smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Brc1ccc([C@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000000712745 560554504 /nfs/dbraw/zinc/55/45/04/560554504.db2.gz ZXQVEPXPKIJYQR-HDMKZQKVSA-N 0 0 405.133 6.038 40 10 HKCBRN CCCC(=O)c1c(C)nc2c(c1-c1ccc(OC)c(OC)c1)C(=O)c1ccccc1-2 ZINC000000795128 559279615 /nfs/dbraw/zinc/27/96/15/559279615.db2.gz YZVUVOZALBQLLH-UHFFFAOYSA-N 0 0 401.462 5.268 40 10 HKCBRN COc1ccc(CNc2sc3c(c2C(=O)Nc2ccccc2OC)CCC3)cc1 ZINC000000798212 559279866 /nfs/dbraw/zinc/27/98/66/559279866.db2.gz XQGDVMWYWQHYKH-UHFFFAOYSA-N 0 0 408.523 5.118 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)cc1OC ZINC000000845821 569033014 /nfs/dbraw/zinc/03/30/14/569033014.db2.gz CIHLXFLGWWGIDV-XMHGGMMESA-N 0 0 400.430 5.477 40 10 HKCBRN Cc1ccc(C2=NC(=O)/C(=C/c3ccc(-c4ccc(Br)cc4)o3)S2)cc1 ZINC000000864703 557105242 /nfs/dbraw/zinc/10/52/42/557105242.db2.gz AVNZYBWEJRXBBO-UNOMPAQXSA-N 0 0 424.319 6.079 40 10 HKCBRN CCOC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc(OC3CSC3)c1)N2 ZINC000000871772 560554540 /nfs/dbraw/zinc/55/45/40/560554540.db2.gz DHDYXANJRQUVLF-MZKRTTBSSA-N 0 0 407.535 5.184 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@H]32)cc(OC)c1OC ZINC000000871792 560536336 /nfs/dbraw/zinc/53/63/36/560536336.db2.gz PXIYOTCBALVQRI-QUJCMNEKSA-N 0 0 406.309 5.846 40 10 HKCBRN CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cc3c(cc1Br)OCO3)N2 ZINC000000871837 341977375 /nfs/dbraw/zinc/97/73/75/341977375.db2.gz VHSVKVWHYFBIFJ-YPENRWOSSA-N 0 0 412.283 5.207 40 10 HKCBRN CCN(CC)c1ccc(NC(=O)CSc2nc3cc(Cl)ccc3[nH]2)c(C)c1 ZINC000000883014 560540066 /nfs/dbraw/zinc/54/00/66/560540066.db2.gz AGPLEHHSHUXJNN-UHFFFAOYSA-N 0 0 402.951 5.102 40 10 HKCBRN CCn1c(-c2ccccc2)cnc1SCC(=O)N(c1ccccc1)c1ccccc1 ZINC000000892096 560542781 /nfs/dbraw/zinc/54/27/81/560542781.db2.gz PBHQYTLKWDNTTA-UHFFFAOYSA-N 0 0 413.546 6.027 40 10 HKCBRN Cc1ccc([C@@H](c2ccccc2)C2(Br)C(=O)c3ccccc3C2=O)cc1 ZINC000000904892 560544963 /nfs/dbraw/zinc/54/49/63/560544963.db2.gz JALUXOUXIOZBRS-HXUWFJFHSA-N 0 0 405.291 5.340 40 10 HKCBRN Cc1ccc([C@H](c2ccccc2)C2(Br)C(=O)c3ccccc3C2=O)cc1 ZINC000000904894 560544991 /nfs/dbraw/zinc/54/49/91/560544991.db2.gz JALUXOUXIOZBRS-FQEVSTJZSA-N 0 0 405.291 5.340 40 10 HKCBRN COc1ccc(Cl)cc1NC(=O)c1c2c(sc1NCc1ccncc1)CCC2 ZINC000000920878 560555884 /nfs/dbraw/zinc/55/58/84/560555884.db2.gz BXLULGVBMNUVFA-UHFFFAOYSA-N 0 0 413.930 5.158 40 10 HKCBRN Cc1ccc(NC(=O)CSc2ncc(-c3ccc(F)cc3)n2Cc2ccco2)cc1 ZINC000000924768 560556704 /nfs/dbraw/zinc/55/67/04/560556704.db2.gz YQSNKBHIBFEIDS-UHFFFAOYSA-N 0 0 421.497 5.370 40 10 HKCBRN Cc1cccc(NC(=O)CSc2ncc(-c3ccc(F)cc3)n2Cc2ccco2)c1 ZINC000000924781 560556697 /nfs/dbraw/zinc/55/66/97/560556697.db2.gz ULMUJLDZMYGHTD-UHFFFAOYSA-N 0 0 421.497 5.370 40 10 HKCBRN Cc1ccc(NC(=O)CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)c(C)c1 ZINC000000924828 560556749 /nfs/dbraw/zinc/55/67/49/560556749.db2.gz JBOOUWHHTSYIRL-HXUWFJFHSA-N 0 0 421.566 5.077 40 10 HKCBRN Cc1ccc(NC(=O)CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)c(C)c1 ZINC000000924829 560556731 /nfs/dbraw/zinc/55/67/31/560556731.db2.gz JBOOUWHHTSYIRL-FQEVSTJZSA-N 0 0 421.566 5.077 40 10 HKCBRN Brc1ccc([C@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000001031091 569321914 /nfs/dbraw/zinc/32/19/14/569321914.db2.gz ZXQVEPXPKIJYQR-RVKKMQEKSA-N 0 0 405.133 6.038 40 10 HKCBRN O=C1N=C(Nc2ccc(F)cc2)SC1=Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000001056872 560727037 /nfs/dbraw/zinc/72/70/37/560727037.db2.gz VDNAKSYRIMHPPV-WQRHYEAKSA-N 0 0 409.398 5.076 40 10 HKCBRN CCOc1ccc([C@H](Nc2cccnc2)c2cc(Cl)c3cccnc3c2O)cc1 ZINC000001066512 557166610 /nfs/dbraw/zinc/16/66/10/557166610.db2.gz RDJCCPWITAIICC-NRFANRHFSA-N 0 0 405.885 5.589 40 10 HKCBRN CCOc1ccc([C@@H](Nc2cccnc2)c2cc(Cl)c3cccnc3c2O)cc1 ZINC000001066515 557166651 /nfs/dbraw/zinc/16/66/51/557166651.db2.gz RDJCCPWITAIICC-OAQYLSRUSA-N 0 0 405.885 5.589 40 10 HKCBRN Cc1csc(-c2cc3ccc([O-])c(C[N@@H+]4C[C@@]5(C)C[C@@H]4CC(C)(C)C5)c3oc2=O)n1 ZINC000001095647 557178151 /nfs/dbraw/zinc/17/81/51/557178151.db2.gz CXKGWHPDVPYYKH-FYSMJZIKSA-N 0 0 424.566 5.331 40 10 HKCBRN Cc1cc(N[C@@H](c2ccc(Cl)cc2)c2cc(Cl)c3cccnc3c2O)no1 ZINC000001098205 557178474 /nfs/dbraw/zinc/17/84/74/557178474.db2.gz QDXYZNJWYYPKMK-SFHVURJKSA-N 0 0 400.265 5.745 40 10 HKCBRN Cc1cc(N[C@H](c2ccc(Cl)cc2)c2cc(Cl)c3cccnc3c2O)no1 ZINC000001098206 557178435 /nfs/dbraw/zinc/17/84/35/557178435.db2.gz QDXYZNJWYYPKMK-GOSISDBHSA-N 0 0 400.265 5.745 40 10 HKCBRN CCOc1ccc(Cl)cc1/C=C1/SC(=S)N(c2ccccc2OC)C1=O ZINC000001136143 560727248 /nfs/dbraw/zinc/72/72/48/560727248.db2.gz KQEDQWQDXJWYNX-GZTJUZNOSA-N 0 0 405.928 5.153 40 10 HKCBRN COc1ccc(Cl)cc1-n1c(C)cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c1C ZINC000001153018 557212197 /nfs/dbraw/zinc/21/21/97/557212197.db2.gz NQPSIHADTOPIAH-FYJGNVAPSA-N 0 0 419.912 5.562 40 10 HKCBRN CCOc1cc(C=C2SC(=S)NC2=O)cc(Cl)c1OCc1cccc(C)c1 ZINC000001179571 568821451 /nfs/dbraw/zinc/82/14/51/568821451.db2.gz MJXOHVARUYJWBD-YVLHZVERSA-N 0 0 419.955 5.115 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(C)C2=O)cc(Cl)c1OCc1ccccc1C ZINC000001180027 568821509 /nfs/dbraw/zinc/82/15/09/568821509.db2.gz SBLMAVIZEQEHSF-YVLHZVERSA-N 0 0 419.955 5.067 40 10 HKCBRN Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccc(C)c(C)c3)C2=O)cc1 ZINC000001180071 557229894 /nfs/dbraw/zinc/22/98/94/557229894.db2.gz JPKSXEIDUBFMME-XSFVSMFZSA-N 0 0 424.591 5.232 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(CC)C2=O)ccc1OCc1ccccc1C ZINC000001180615 568822029 /nfs/dbraw/zinc/82/20/29/568822029.db2.gz YOBPZKYVVUEBMD-MOSHPQCFSA-N 0 0 413.564 5.194 40 10 HKCBRN CN1C(=O)/C(=C/c2cccc(OCc3c(Cl)cccc3Cl)c2)SC1=S ZINC000001181039 568822082 /nfs/dbraw/zinc/82/20/82/568822082.db2.gz IFBQRPBMUMZTHM-SXGWCWSVSA-N 0 0 410.347 5.403 40 10 HKCBRN CN1C(=O)/C(=C/c2cc(Cl)ccc2OCc2ccc(Cl)cc2)SC1=S ZINC000001181685 568822361 /nfs/dbraw/zinc/82/23/61/568822361.db2.gz VGRHPEBBSYBJRH-SXGWCWSVSA-N 0 0 410.347 5.403 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(CC)C2=O)ccc1OCc1ccc(C)cc1 ZINC000001182514 568822346 /nfs/dbraw/zinc/82/23/46/568822346.db2.gz IIPBGWHNLHSWLF-MOSHPQCFSA-N 0 0 413.564 5.194 40 10 HKCBRN CN1C(=O)/C(=C/c2ccc(OCc3c(Cl)cccc3Cl)cc2)SC1=S ZINC000001183143 568822056 /nfs/dbraw/zinc/82/20/56/568822056.db2.gz KQAGOAXFVFUWHS-SXGWCWSVSA-N 0 0 410.347 5.403 40 10 HKCBRN Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3cccc(C)c3C)C2=O)cc1 ZINC000001183417 557232316 /nfs/dbraw/zinc/23/23/16/557232316.db2.gz CCLVWVRDQNHXTA-XSFVSMFZSA-N 0 0 424.591 5.232 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(CC)C2=O)ccc1OCc1cccc(C)c1 ZINC000001183446 568822095 /nfs/dbraw/zinc/82/20/95/568822095.db2.gz IVCYNEUKAQKXMW-MOSHPQCFSA-N 0 0 413.564 5.194 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(C)C2=O)ccc1OCc1cccc2ccccc21 ZINC000001194348 568822846 /nfs/dbraw/zinc/82/28/46/568822846.db2.gz ZAHILMKREZFVAI-BKUYFWCQSA-N 0 0 421.543 5.258 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(Cl)c(OCc3ccccc3)c(OC)c2)SC1=S ZINC000001209256 568823974 /nfs/dbraw/zinc/82/39/74/568823974.db2.gz ABSHFEOTFIVUPI-BOPFTXTBSA-N 0 0 419.955 5.149 40 10 HKCBRN COc1ccc(OC)c(/C=C2/SC(=S)N(c3ccc4ccccc4c3)C2=O)c1 ZINC000001240149 557250656 /nfs/dbraw/zinc/25/06/56/557250656.db2.gz LSGICXVKWKNVSI-DEDYPNTBSA-N 0 0 407.516 5.263 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)ccc1O ZINC000001242984 557250677 /nfs/dbraw/zinc/25/06/77/557250677.db2.gz JAVUGGZZMJYRPP-VIZOYTHASA-N 0 0 412.319 5.113 40 10 HKCBRN COc1cccc(/C=C2/SC(=S)N(c3ccc4ccccc4c3)C2=O)c1OC ZINC000001243735 557250808 /nfs/dbraw/zinc/25/08/08/557250808.db2.gz DXHAAXPSRYKPLP-CPNJWEJPSA-N 0 0 407.516 5.263 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3cc(Cl)cc(Cl)c3)C2=O)ccc1O ZINC000001246967 557251427 /nfs/dbraw/zinc/25/14/27/557251427.db2.gz CBQKRGNQVRROSO-PJQLUOCWSA-N 0 0 412.319 5.113 40 10 HKCBRN O=C1/C(=C\c2c[nH]c3ccccc23)SC(=S)N1c1cccc(Br)c1 ZINC000001254565 560727977 /nfs/dbraw/zinc/72/79/77/560727977.db2.gz RCIYRKIGLAIKMP-LZYBPNLTSA-N 0 0 415.337 5.336 40 10 HKCBRN CC(=C\c1ccccc1)/C=C1\SC(=S)N(CC(=O)Nc2ccc(C)cc2C)C1=O ZINC000001256236 569320354 /nfs/dbraw/zinc/32/03/54/569320354.db2.gz FJVKYPWTOXCWME-UVBZOIGOSA-N 0 0 422.575 5.090 40 10 HKCBRN CCOc1ccc(C=C2SC(Nc3cccc(C(F)(F)F)c3)=NC2=O)cc1OC ZINC000001261049 557252201 /nfs/dbraw/zinc/25/22/01/557252201.db2.gz NSVXMZCZRULHQD-LICLKQGHSA-N 0 0 422.428 5.195 40 10 HKCBRN CC(=C\c1ccccc1)/C=C1\SC(=S)N(CC(=O)Nc2cccc(C)c2C)C1=O ZINC000001263288 569320386 /nfs/dbraw/zinc/32/03/86/569320386.db2.gz YJPFURNVXOAARB-QIROLCGISA-N 0 0 422.575 5.090 40 10 HKCBRN O=C(CCCN1C(=O)/C(=C/c2cccs2)SC1=S)Nc1ccccc1Cl ZINC000001265317 560572762 /nfs/dbraw/zinc/57/27/62/560572762.db2.gz KSPANLMQVCFGIU-PTNGSMBKSA-N 0 0 422.984 5.022 40 10 HKCBRN Cc1cccc(NC(=O)CCCN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)c1 ZINC000001266441 569320381 /nfs/dbraw/zinc/32/03/81/569320381.db2.gz YSQOHPFAMZIPFB-KRWXNTFSSA-N 0 0 422.575 5.171 40 10 HKCBRN CCc1ccccc1NC(=O)CN1C(=O)/C(=C/C(C)=C/c2ccccc2)SC1=S ZINC000001266711 569320362 /nfs/dbraw/zinc/32/03/62/569320362.db2.gz PQWRXHZYAODHML-SDEVTQOVSA-N 0 0 422.575 5.035 40 10 HKCBRN Cc1cc(C)c(NC(=O)CN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)c(C)c1 ZINC000001312361 569320401 /nfs/dbraw/zinc/32/04/01/569320401.db2.gz VMFOIRPYRKNHDD-QBWRGEQUSA-N 0 0 422.575 5.008 40 10 HKCBRN CC(=C\c1ccccc1)/C=C1\SC(=S)N(CC(=O)Nc2ccc(C)c(C)c2)C1=O ZINC000001313995 569320412 /nfs/dbraw/zinc/32/04/12/569320412.db2.gz MTLCPBWFZQXXBU-VONWDDPXSA-N 0 0 422.575 5.090 40 10 HKCBRN CCn1c(-c2ccc(OC)cc2)cnc1SCC(=O)Nc1cccc2ccccc21 ZINC000001328815 560573685 /nfs/dbraw/zinc/57/36/85/560573685.db2.gz TVYVJLNUNLTTHM-UHFFFAOYSA-N 0 0 417.534 5.463 40 10 HKCBRN CN(C)C(=O)CSc1ncc(-c2ccc(Cl)cc2)n1CCC1=CCCCC1 ZINC000001339987 560575384 /nfs/dbraw/zinc/57/53/84/560575384.db2.gz SMOGPAKWQJODJE-UHFFFAOYSA-N 0 0 403.979 5.274 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N1CCCC[C@@H]1C ZINC000001340042 560575430 /nfs/dbraw/zinc/57/54/30/560575430.db2.gz GJYPVKVCSARXHE-INIZCTEOSA-N 0 0 405.995 5.353 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N1CCCC[C@H]1C ZINC000001340046 560575375 /nfs/dbraw/zinc/57/53/75/560575375.db2.gz GJYPVKVCSARXHE-MRXNPFEDSA-N 0 0 405.995 5.353 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N1CCC[C@H](C)C1 ZINC000001340053 560575428 /nfs/dbraw/zinc/57/54/28/560575428.db2.gz QACNWQHIJLJTLS-INIZCTEOSA-N 0 0 405.995 5.210 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N1CCC[C@@H](C)C1 ZINC000001340054 560575424 /nfs/dbraw/zinc/57/54/24/560575424.db2.gz QACNWQHIJLJTLS-MRXNPFEDSA-N 0 0 405.995 5.210 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N1CCC(C)CC1 ZINC000001340072 560575426 /nfs/dbraw/zinc/57/54/26/560575426.db2.gz XJHCIUPMGYKLDR-UHFFFAOYSA-N 0 0 405.995 5.210 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N[C@@H]1CCCC[C@@H]1C ZINC000001340112 560575401 /nfs/dbraw/zinc/57/54/01/560575401.db2.gz FRIKYVRWJAWAEI-QFBILLFUSA-N 0 0 420.022 5.647 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N[C@@H]1CCCC[C@H]1C ZINC000001340118 560575380 /nfs/dbraw/zinc/57/53/80/560575380.db2.gz FRIKYVRWJAWAEI-VQIMIIECSA-N 0 0 420.022 5.647 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N[C@H]1CCCC[C@@H]1C ZINC000001340122 560575386 /nfs/dbraw/zinc/57/53/86/560575386.db2.gz FRIKYVRWJAWAEI-LPHOPBHVSA-N 0 0 420.022 5.647 40 10 HKCBRN CC(C)Cn1c(-c2ccc(Cl)cc2)cnc1SCC(=O)N[C@H]1CCCC[C@H]1C ZINC000001340126 560575474 /nfs/dbraw/zinc/57/54/74/560575474.db2.gz FRIKYVRWJAWAEI-APWZRJJASA-N 0 0 420.022 5.647 40 10 HKCBRN CC[C@H]1CCCCN1C(=O)CSc1ncc(-c2ccc(Cl)cc2)n1CC(C)C ZINC000001340131 560575453 /nfs/dbraw/zinc/57/54/53/560575453.db2.gz QRVULCMRKWTQSC-IBGZPJMESA-N 0 0 420.022 5.743 40 10 HKCBRN CC[C@@H]1CCCCN1C(=O)CSc1ncc(-c2ccc(Cl)cc2)n1CC(C)C ZINC000001340135 560575460 /nfs/dbraw/zinc/57/54/60/560575460.db2.gz QRVULCMRKWTQSC-LJQANCHMSA-N 0 0 420.022 5.743 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3ccc(C)c(Cl)c3)C2=O)c(OC)c1 ZINC000001438726 557263585 /nfs/dbraw/zinc/26/35/85/557263585.db2.gz QITZBBZXFQWJMY-IUXPMGMMSA-N 0 0 405.928 5.071 40 10 HKCBRN O=C1S/C(=C\c2ccc(-c3ccccc3Cl)o2)C(=S)N1Cc1ccccc1 ZINC000001440504 557263883 /nfs/dbraw/zinc/26/38/83/557263883.db2.gz GSLMWNIFRMCNKX-UNOMPAQXSA-N 0 0 411.935 6.637 40 10 HKCBRN CCn1c(-c2ccc(Br)cc2)csc1=Nc1cccc([N+](=O)[O-])c1 ZINC000001455067 557267509 /nfs/dbraw/zinc/26/75/09/557267509.db2.gz XJTFUILVSDKVKR-UHFFFAOYSA-O 0 0 405.297 5.137 40 10 HKCBRN Clc1ccc(-c2csc(=Nc3ccccc3)n2Cc2ccco2)c(Cl)c1 ZINC000001455085 560583272 /nfs/dbraw/zinc/58/32/72/560583272.db2.gz YVNOWAPCUVCGEL-UHFFFAOYSA-O 0 0 402.326 6.394 40 10 HKCBRN COc1ccc([C@@H](Nc2ccccn2)c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)cc1 ZINC000001572794 557273124 /nfs/dbraw/zinc/27/31/24/557273124.db2.gz QQHYEOPHRYYZCV-XMMPIXPASA-N 0 0 418.581 6.592 40 10 in-vitro HKCBRN O=C1/C(=C\c2ccc3c(c2)OCO3)SC(=S)N1c1ccc(Cl)c(Cl)c1 ZINC000001578236 557273575 /nfs/dbraw/zinc/27/35/75/557273575.db2.gz KRAQMRWFTJNNIL-GIDUJCDVSA-N 0 0 410.303 5.128 40 10 HKCBRN O=C1/C(=C/c2ccc3c(c2)OCO3)SC(=S)N1c1ccc(Cl)c(Cl)c1 ZINC000001578237 557273794 /nfs/dbraw/zinc/27/37/94/557273794.db2.gz KRAQMRWFTJNNIL-UUASQNMZSA-N 0 0 410.303 5.128 40 10 HKCBRN CC(C)=CCc1c(=O)c2c(O)c(-c3ccc(O)c(O)c3)coc-2c2c1OC(C)(C)CC2 ZINC000001583706 569074145 /nfs/dbraw/zinc/07/41/45/569074145.db2.gz AFXRALVWINXBHQ-UHFFFAOYSA-N 0 0 422.477 5.189 40 10 HKCBRN O=C(c1ccccc1)c1cc(Cl)ccc1NC[C@@H](O)COc1ccc(Cl)cc1 ZINC000001585936 557274359 /nfs/dbraw/zinc/27/43/59/557274359.db2.gz ZVZBGRKGPQPQNH-GOSISDBHSA-N 0 0 416.304 5.076 40 10 HKCBRN CN(C)c1ccc(/C(=C(/c2ccccc2)c2ccc(N(C)C)cc2)c2ccccc2)cc1 ZINC000001621284 557276533 /nfs/dbraw/zinc/27/65/33/557276533.db2.gz SEHHQLKIKCAWFC-FLWNBWAVSA-N 0 0 418.584 6.826 40 10 HKCBRN O=C1c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)[C@]2(Cl)CC=CC[C@@]12Cl ZINC000001665055 557279451 /nfs/dbraw/zinc/27/94/51/557279451.db2.gz BATMELCQLQGSTJ-ZIAGYGMSSA-N 0 0 418.918 5.984 40 10 HKCBRN O=C1c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)[C@@]2(Cl)CC=CC[C@]12Cl ZINC000001665058 557279510 /nfs/dbraw/zinc/27/95/10/557279510.db2.gz BATMELCQLQGSTJ-KBPBESRZSA-N 0 0 418.918 5.984 40 10 HKCBRN CCN(CC)c1cc(N)c(Cc2c(N)cc(N(CC)CC)cc2Cl)c(Cl)c1 ZINC000001665694 557279423 /nfs/dbraw/zinc/27/94/23/557279423.db2.gz SKWLQLQXKHSCIM-UHFFFAOYSA-N 0 0 409.405 5.441 40 10 HKCBRN CCN(CC)c1ccc(Cc2ccc(N(CC)CC)c3cccnc23)c2ncccc12 ZINC000001667083 569143963 /nfs/dbraw/zinc/14/39/63/569143963.db2.gz VRBIUVFLDNRKFX-UHFFFAOYSA-N 0 0 412.581 6.066 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@H]2N1C(=O)/C(=C/c2cccs2)SC1=S ZINC000001669941 557279837 /nfs/dbraw/zinc/27/98/37/557279837.db2.gz IARZUOKHXXVXTN-XLXASQRYSA-N 0 0 421.568 6.153 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@@H]2N1C(=O)/C(=C/c2cccs2)SC1=S ZINC000001669943 557279726 /nfs/dbraw/zinc/27/97/26/557279726.db2.gz IARZUOKHXXVXTN-OVCORXIESA-N 0 0 421.568 6.153 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@H]2N1C(=O)/C(=C/c2ccccc2)SC1=S ZINC000001669962 557279742 /nfs/dbraw/zinc/27/97/42/557279742.db2.gz KTRAWKDBDIDDDZ-OKPNHQCWSA-N 0 0 415.539 6.092 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@@H]2N1C(=O)/C(=C/c2ccccc2)SC1=S ZINC000001669964 557279776 /nfs/dbraw/zinc/27/97/76/557279776.db2.gz KTRAWKDBDIDDDZ-URBQWANRSA-N 0 0 415.539 6.092 40 10 HKCBRN CC(C)(C)c1ccc(O)c(CN(Cc2cc(C(C)(C)C)ccc2O)c2ccccc2)c1 ZINC000001680976 557280380 /nfs/dbraw/zinc/28/03/80/557280380.db2.gz PNAKTKQCGUAXKF-UHFFFAOYSA-N 0 0 417.593 6.900 40 10 in-vitro HKCBRN Cc1ccc(N(Cc2c(O)ccc3ccccc32)Cc2c(O)ccc3ccccc32)cc1 ZINC000001681081 557280478 /nfs/dbraw/zinc/28/04/78/557280478.db2.gz ROGYLTUEXXMTSG-UHFFFAOYSA-N 0 0 419.524 6.919 40 10 HKCBRN O=[N+]([O-])c1ccc([O-])c(C[N@@H+](Cc2ccccc2)Cc2c(O)ccc3ccccc32)c1 ZINC000001686485 557280830 /nfs/dbraw/zinc/28/08/30/557280830.db2.gz QWDBURTULXBASO-UHFFFAOYSA-N 0 0 414.461 5.362 40 10 HKCBRN CN(C)c1ccc(/C(=C(\c2ccccc2)c2ccc(N(C)C)cc2)c2ccccc2)cc1 ZINC000001696499 557281396 /nfs/dbraw/zinc/28/13/96/557281396.db2.gz SEHHQLKIKCAWFC-QVIHXGFCSA-N 0 0 418.584 6.826 40 10 HKCBRN CCCCN(C[C@H](O)c1cc2c(c3ccccc31)CCCC2)c1ccc(OC)cc1 ZINC000001700113 557281377 /nfs/dbraw/zinc/28/13/77/557281377.db2.gz ZLSRXRFZFXMABN-MHZLTWQESA-N 0 0 403.566 6.067 40 10 HKCBRN CN(C)c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccc(N(C)C)cc2)cc1 ZINC000001708326 557282228 /nfs/dbraw/zinc/28/22/28/557282228.db2.gz DRQOAICHSPZZQO-UHFFFAOYSA-N 0 0 418.584 6.826 40 10 in-vitro HKCBRN COc1ccc(N2CCN(c3ccc(OC)cc3)C2CCc2ccc(Cl)cc2)cc1 ZINC000001717328 557282427 /nfs/dbraw/zinc/28/24/27/557282427.db2.gz IICFOLUWRSRDNW-UHFFFAOYSA-N 0 0 422.956 5.643 40 10 HKCBRN Cc1nn(-c2ccccc2)c(Cl)c1/C=C1/SC(=S)N(c2ccccc2)C1=O ZINC000001750006 560583511 /nfs/dbraw/zinc/58/35/11/560583511.db2.gz UMKJOXFGQIDJRG-SFQUDFHCSA-N 0 0 411.939 5.240 40 10 HKCBRN CC(=C/c1ccccc1)/C=C1\SC(=S)N(c2cc(Cl)cc(Cl)c2)C1=O ZINC000001761573 569052146 /nfs/dbraw/zinc/05/21/46/569052146.db2.gz BEEVPGDVKXPIBI-UOWJXHAGSA-N 0 0 406.359 6.346 40 10 HKCBRN O=C1/C(=C\c2ccccc2)SC(=S)N1C1c2ccccc2Oc2ccccc21 ZINC000001818415 557290702 /nfs/dbraw/zinc/29/07/02/557290702.db2.gz YARPHPIBFXBZCH-XSFVSMFZSA-N 0 0 401.512 5.783 40 10 HKCBRN CC(/C=C1/SC(=S)N(c2ccc(Br)cc2)C1=O)=C/c1ccccc1 ZINC000001826555 557291040 /nfs/dbraw/zinc/29/10/40/557291040.db2.gz IGLLTOLXOCIACE-RTNVFWHRSA-N 0 0 416.365 5.801 40 10 HKCBRN COc1ccc(C=C2SC(Nc3cccc(Cl)c3Cl)=NC2=O)c(OC)c1 ZINC000001838583 557291513 /nfs/dbraw/zinc/29/15/13/557291513.db2.gz RKYKVURXTLWOHG-OVCLIPMQSA-N 0 0 409.294 5.093 40 10 HKCBRN Cc1ccc(C2=NC(=O)/C(=C/c3ccc(-c4ccc(Cl)cc4Cl)o3)S2)cc1 ZINC000002067427 557306135 /nfs/dbraw/zinc/30/61/35/557306135.db2.gz XOSQLBLGNAMRCF-ODLFYWEKSA-N 0 0 414.313 6.623 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3c4ccccc4cc4ccccc43)C(=O)O2)c(OC)c1 ZINC000002076905 560584409 /nfs/dbraw/zinc/58/44/09/560584409.db2.gz AUCCQSRZBKAOAI-RGEXLXHISA-N 0 0 408.453 5.992 40 10 HKCBRN O=C(OC1CCCCC1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1)N2 ZINC000002220653 560559329 /nfs/dbraw/zinc/55/93/29/560559329.db2.gz HMJZOWULXOKDED-IMSXRSKXSA-N 0 0 407.941 6.656 40 10 HKCBRN Cc1ccc(C2=C/C(=C/c3ccc(-c4cc([N+](=O)[O-])ccc4Cl)o3)C(=O)O2)cc1 ZINC000002236680 557329927 /nfs/dbraw/zinc/32/99/27/557329927.db2.gz MYBWTJZBJQOPIE-GDNBJRDFSA-N 0 0 407.809 5.798 40 10 HKCBRN CC[C@@H](C)c1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(-c4ccccc4)o3)C2=O)cc1 ZINC000002240213 569322188 /nfs/dbraw/zinc/32/21/88/569322188.db2.gz QQIRZVDXWROZPZ-GXPOEHQZSA-N 0 0 414.461 5.127 40 10 HKCBRN CC[C@H](C)c1ccc(N2C(=O)[N-]C(=O)C(=Cc3ccc(-c4ccccc4)o3)C2=O)cc1 ZINC000002240215 569322180 /nfs/dbraw/zinc/32/21/80/569322180.db2.gz QQIRZVDXWROZPZ-WASCAKKMSA-N 0 0 414.461 5.967 40 10 HKCBRN COc1ccc(OC)c(C=C2SC(Nc3cccc(Cl)c3Cl)=NC2=O)c1 ZINC000002246132 557330697 /nfs/dbraw/zinc/33/06/97/557330697.db2.gz BOKHAIWAJFUXFY-OQLLNIDSSA-N 0 0 409.294 5.093 40 10 HKCBRN O=C1/C(=C\c2cccc(Br)c2)SC(=S)N1c1ccc(Cl)cc1 ZINC000002302908 560730986 /nfs/dbraw/zinc/73/09/86/560730986.db2.gz MBLCCNRZQKALMA-NTEUORMPSA-N 0 0 410.745 5.508 40 10 HKCBRN Cc1ccc(/C=C2/SC(=S)N(CCCC(=O)Nc3ccc(C)cc3C)C2=O)cc1 ZINC000002323955 557337224 /nfs/dbraw/zinc/33/72/24/557337224.db2.gz NJNWBYGRQCXUMN-XSFVSMFZSA-N 0 0 424.591 5.232 40 10 HKCBRN Cc1ccc(/C=C2/SC(=S)N(CCC(=O)Nc3c(C)cc(C)cc3C)C2=O)cc1 ZINC000002375016 557341847 /nfs/dbraw/zinc/34/18/47/557341847.db2.gz JREFVTUOPYUWED-CPNJWEJPSA-N 0 0 424.591 5.150 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@H]3CCCC[C@]3(O)CCN2C(=O)c2cccc(F)c2)cc1 ZINC000002402169 557704021 /nfs/dbraw/zinc/70/40/21/557704021.db2.gz BCYLGMCDRWDCON-USZFVNFHSA-N 0 0 424.560 5.180 40 10 HKCBRN COc1ccc([C@H](Nc2cc(C)ccn2)c2ccc3ccc(C)nc3c2O)cc1OC ZINC000002470488 568773613 /nfs/dbraw/zinc/77/36/13/568773613.db2.gz UBRHAQAZBZGGSP-QHCPKHFHSA-N 0 0 415.493 5.171 40 10 HKCBRN COc1ccc([C@@H](Nc2cc(C)ccn2)c2ccc3ccc(C)nc3c2O)cc1OC ZINC000002470492 568773563 /nfs/dbraw/zinc/77/35/63/568773563.db2.gz UBRHAQAZBZGGSP-HSZRJFAPSA-N 0 0 415.493 5.171 40 10 HKCBRN COc1ccc([C@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@@H]32)cc1[N+](=O)[O-] ZINC000002488523 560585500 /nfs/dbraw/zinc/58/55/00/560585500.db2.gz KVGKTBJNHOCAGT-CKFHNAJUSA-N 0 0 401.260 5.192 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)c(Cl)c3)o2)SC1=S ZINC000002507754 569282879 /nfs/dbraw/zinc/28/28/79/569282879.db2.gz SOZCQTNPJIJGBR-PXNMLYILSA-N 0 0 412.363 6.111 40 10 HKCBRN CC(C)c1cc(Cc2cc(C(C)C)c(N(C)C)c(C(C)C)c2)cc(C(C)C)c1N(C)C ZINC000002557044 568783320 /nfs/dbraw/zinc/78/33/20/568783320.db2.gz ZLLKEHZDBYULNW-UHFFFAOYSA-N 0 0 422.701 7.903 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3Cl)cc2)SC1=S ZINC000002571013 560731184 /nfs/dbraw/zinc/73/11/84/560731184.db2.gz VWMYBPDTPQQFEC-MFOYZWKCSA-N 0 0 424.374 5.794 40 10 HKCBRN CCCCCCn1c(-c2ccc(Cl)cc2Cl)csc1=Nc1ccccc1 ZINC000002677036 557366922 /nfs/dbraw/zinc/36/69/22/557366922.db2.gz OIVYMCRURHNYKF-UHFFFAOYSA-O 0 0 406.402 7.333 40 10 HKCBRN Cc1ccc(-c2c(Br)sc(=Nc3ccccc3)n2-c2ccccc2)cc1 ZINC000002677170 557366974 /nfs/dbraw/zinc/36/69/74/557366974.db2.gz UXDZCUQVXHLWLV-UHFFFAOYSA-O 0 0 422.371 6.506 40 10 HKCBRN Cc1cc(C(=O)CSc2ccc(Cl)cc2)c(C)n1-c1ccc(F)c(Cl)c1 ZINC000002679435 557367153 /nfs/dbraw/zinc/36/71/53/557367153.db2.gz KDBHXXAGPGCDHE-UHFFFAOYSA-N 0 0 408.325 6.515 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(N(CC)CC)cc3)SC2=S)cc1 ZINC000002770514 560732074 /nfs/dbraw/zinc/73/20/74/560732074.db2.gz XBGAYQCVTLVFGI-HMMYKYKNSA-N 0 0 412.580 5.337 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N([C@@H](C)c3ccccc3)C2=O)ccc1OC(C)C ZINC000002798518 568932288 /nfs/dbraw/zinc/93/22/88/568932288.db2.gz RBQHFYUTMLDOCD-NPRIEWAGSA-N 0 0 413.564 5.445 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N([C@H](C)c3ccccc3)C2=O)ccc1OC(C)C ZINC000002798520 568932221 /nfs/dbraw/zinc/93/22/21/568932221.db2.gz RBQHFYUTMLDOCD-OOWUWCJESA-N 0 0 413.564 5.445 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCc3c(Cl)cccc3Cl)cc2)SC1=S ZINC000002828366 568812412 /nfs/dbraw/zinc/81/24/12/568812412.db2.gz OXCOTGCSTPIAKY-YVLHZVERSA-N 0 0 424.374 5.794 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)SC1=S ZINC000002852074 568813235 /nfs/dbraw/zinc/81/32/35/568813235.db2.gz XBNZRKXPQGURRP-YVLHZVERSA-N 0 0 424.374 5.794 40 10 HKCBRN CCN1C(=O)/C(=C/c2cccc(OCc3c(Cl)cccc3Cl)c2)SC1=S ZINC000002852144 568813288 /nfs/dbraw/zinc/81/32/88/568813288.db2.gz SVGGOLDGOQMYPO-YVLHZVERSA-N 0 0 424.374 5.794 40 10 HKCBRN CN1C(=O)/C(=C/c2cccc(OCCCOc3ccccc3Cl)c2)SC1=S ZINC000002878533 568814218 /nfs/dbraw/zinc/81/42/18/568814218.db2.gz SGHKRQNIWLNLAX-AQTBWJFISA-N 0 0 419.955 5.019 40 10 HKCBRN CN1C(=O)/C(=C/c2ccc(OCCCOc3ccccc3Cl)cc2)SC1=S ZINC000002878549 568814156 /nfs/dbraw/zinc/81/41/56/568814156.db2.gz SPWQBTSIGJIXLM-AQTBWJFISA-N 0 0 419.955 5.019 40 10 HKCBRN CN1C(=O)/C(=C/c2ccccc2OCCCOc2ccccc2Cl)SC1=S ZINC000002882433 568814377 /nfs/dbraw/zinc/81/43/77/568814377.db2.gz FMWHSMLDWUGMCW-AQTBWJFISA-N 0 0 419.955 5.019 40 10 HKCBRN O=C1/C(=C/c2cccc(OCc3ccccc3)c2)SC(=S)N1c1ccccc1 ZINC000002897079 557424360 /nfs/dbraw/zinc/42/43/60/557424360.db2.gz QCELZIIPNBYDOT-QNGOZBTKSA-N 0 0 403.528 5.671 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccccc2OCc2cccc3ccccc32)SC1=S ZINC000002961617 568830397 /nfs/dbraw/zinc/83/03/97/568830397.db2.gz ZPHOFOIMECOLEM-STZFKDTASA-N 0 0 405.544 5.640 40 10 HKCBRN CCN1C(=O)/C(=C/c2cccc(OCc3ccc(Cl)cc3Cl)c2)SC1=S ZINC000002962069 568830631 /nfs/dbraw/zinc/83/06/31/568830631.db2.gz YHHZEBWNPXIUEW-MFOYZWKCSA-N 0 0 424.374 5.794 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(C)C2=O)ccc1OCc1ccccc1Cl ZINC000002964950 568830843 /nfs/dbraw/zinc/83/08/43/568830843.db2.gz DBTNUNYVQSVOBU-WQRHYEAKSA-N 0 0 419.955 5.149 40 10 HKCBRN CN1C(=O)/C(=C/c2ccccc2OCCSc2ccc(Cl)cc2)SC1=S ZINC000002966032 568830885 /nfs/dbraw/zinc/83/08/85/568830885.db2.gz WJZWPSOUHGTICP-ATVHPVEESA-N 0 0 421.996 5.342 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(-c2nnc(-c3ccc(-n4c(C)ccc4C)cc3)o2)cc1 ZINC000003014133 560732892 /nfs/dbraw/zinc/73/28/92/560732892.db2.gz NURFDEUKHKPAKY-UHFFFAOYSA-N 0 0 408.505 6.219 40 10 HKCBRN O=C1C(=Cc2ccccc2Cl)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 ZINC000003018048 132261535 /nfs/dbraw/zinc/26/15/35/132261535.db2.gz WGLOXSSPBVIIBN-UHFFFAOYSA-N 0 0 418.905 5.088 40 10 HKCBRN O=C1/C(=C\c2ccccc2)SC(=S)N1CNc1ccc(Oc2ccccc2)cc1 ZINC000003024682 568841087 /nfs/dbraw/zinc/84/10/87/568841087.db2.gz YLNSVOUMIGVBAO-RCCKNPSSSA-N 0 0 418.543 5.750 40 10 HKCBRN Cc1ccc(-c2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)o2)cc1Cl ZINC000003035924 568845731 /nfs/dbraw/zinc/84/57/31/568845731.db2.gz ZCCIKUSNQIEWEY-UNOMPAQXSA-N 0 0 411.935 6.314 40 10 HKCBRN O=C1/C(=C/c2ccc(OCc3ccccc3)cc2)SC(=S)N1c1ccccc1 ZINC000003035987 557442994 /nfs/dbraw/zinc/44/29/94/557442994.db2.gz VSGIKDVLMIYLKP-QNGOZBTKSA-N 0 0 403.528 5.671 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(CNc3ccc(C)cc3C)C2=O)cc1 ZINC000003044062 568848441 /nfs/dbraw/zinc/84/84/41/568848441.db2.gz BMAIHVAOOMAPIP-KGENOOAVSA-N 0 0 409.555 5.256 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(-c4cccc([N+](=O)[O-])c4)o3)SC2=S)cc1 ZINC000003066821 568853446 /nfs/dbraw/zinc/85/34/46/568853446.db2.gz PAVWUZMWFPAXJX-UNOMPAQXSA-N 0 0 422.487 5.569 40 10 HKCBRN CCc1ccccc1N1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S ZINC000003069351 557444673 /nfs/dbraw/zinc/44/46/73/557444673.db2.gz FCQXFURHNGNFCI-WJDWOHSUSA-N 0 0 404.354 5.417 40 10 HKCBRN CCc1ccccc1N1C(=O)/C(=C/c2cccc(Br)c2)SC1=S ZINC000003069353 557444727 /nfs/dbraw/zinc/44/47/27/557444727.db2.gz ZSOUGMAOZJDJGP-WJDWOHSUSA-N 0 0 404.354 5.417 40 10 HKCBRN CC(=O)c1ccc(N2C(=O)C(=Cc3ccc(Br)cc3)SC2=S)cc1 ZINC000003069363 557444641 /nfs/dbraw/zinc/44/46/41/557444641.db2.gz CQVGMIGUSTWPAQ-YBEGLDIGSA-N 0 0 418.337 5.058 40 10 HKCBRN CC(=O)c1ccc(N2C(=O)C(=Cc3cccc(Br)c3)SC2=S)cc1 ZINC000003069365 557444734 /nfs/dbraw/zinc/44/47/34/557444734.db2.gz COOZYIIOCNQSIF-YBEGLDIGSA-N 0 0 418.337 5.058 40 10 HKCBRN O=C1C(=Cc2cccc3ccccc23)C(=O)N(c2ccccc2)C(=O)N1c1ccccc1 ZINC000003072357 560732974 /nfs/dbraw/zinc/73/29/74/560732974.db2.gz GQNSLEBCAKZSEM-UHFFFAOYSA-N 0 0 418.452 5.423 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(CNc3cccc(C)c3C)C2=O)cc1 ZINC000003074904 568853901 /nfs/dbraw/zinc/85/39/01/568853901.db2.gz IZKQCWADKOWRFD-KGENOOAVSA-N 0 0 409.555 5.256 40 10 HKCBRN CC(C)c1cc(NS(=O)(=O)c2ccc(Br)cc2)cc(C(C)C)c1O ZINC000003075837 557445064 /nfs/dbraw/zinc/44/50/64/557445064.db2.gz LGCCTGSVGMMREZ-UHFFFAOYSA-N 0 0 412.349 5.202 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(Br)cc3)c2C)SC1=S ZINC000003170405 569359779 /nfs/dbraw/zinc/35/97/79/569359779.db2.gz ATSQEZVCHAKUOA-YBEGLDIGSA-N 0 0 421.385 5.078 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=S)N(CNc3ccc(C)cc3)C2=O)cc1 ZINC000003177140 568859914 /nfs/dbraw/zinc/85/99/14/568859914.db2.gz TZJWOWNGZNAGDG-XSFVSMFZSA-N 0 0 411.596 5.112 40 10 HKCBRN O=S(=O)(Nc1c(Cl)c(Cl)c([O-])c2ccccc21)c1ccc(Cl)cc1 ZINC000003185001 568860294 /nfs/dbraw/zinc/86/02/94/568860294.db2.gz CCEZSXBRDIPRKY-UHFFFAOYSA-N 0 0 402.686 5.306 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccccc3)o2)SC(=S)N1c1ccc(F)c(Cl)c1 ZINC000003764460 560734251 /nfs/dbraw/zinc/73/42/51/560734251.db2.gz ZWYCBNKVEHZDHK-WQRHYEAKSA-N 0 0 415.898 6.145 40 10 HKCBRN CCOc1ccc(/C=C2/SC(=S)N(c3ccc(Br)cc3)C2=O)cc1 ZINC000003768756 568868052 /nfs/dbraw/zinc/86/80/52/568868052.db2.gz KOWYIBFYWMUHOQ-LFIBNONCSA-N 0 0 420.353 5.254 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccccc2C)C1=O ZINC000003769053 568926144 /nfs/dbraw/zinc/92/61/44/568926144.db2.gz CUUTUILDMVKXKJ-PXLXIMEGSA-N 0 0 419.571 6.343 40 10 HKCBRN CN(C)c1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)SC2=S)cc1 ZINC000003769093 557498359 /nfs/dbraw/zinc/49/83/59/557498359.db2.gz IUYYIXGNVRAYOI-SXGWCWSVSA-N 0 0 409.363 5.465 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=S)N(c3ccc(N(C)C)cc3)C2=O)cc1 ZINC000003769152 568926103 /nfs/dbraw/zinc/92/61/03/568926103.db2.gz SXOQUQXQPMBLJN-HMMYKYKNSA-N 0 0 411.596 5.005 40 10 HKCBRN O=C1S/C(=C\c2ccc(N3CCCC3)cc2)C(=O)N1Cc1c(F)cccc1Cl ZINC000003769386 569359707 /nfs/dbraw/zinc/35/97/07/569359707.db2.gz AAMJDNZODVYEQH-UNOMPAQXSA-N 0 0 416.905 5.316 40 10 HKCBRN Cc1ccc2c(c1[N+](=O)[O-])C(=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C2=O ZINC000003844570 557500048 /nfs/dbraw/zinc/50/00/48/557500048.db2.gz HANBGEPXBGFQRO-UHFFFAOYSA-N 0 0 405.020 5.292 40 10 HKCBRN Cc1cc(C(F)(F)F)n2nc(N)c(/N=N/c3c(Cl)cc(Cl)cc3Cl)c2n1 ZINC000003848777 557500479 /nfs/dbraw/zinc/50/04/79/557500479.db2.gz CEEMRAZWWVTHPI-WCWDXBQESA-N 0 0 423.613 6.014 40 10 HKCBRN Cc1cc(C(F)(F)F)n2nc(N)c(/N=N/c3cc(Cl)c(Cl)cc3Cl)c2n1 ZINC000003849094 557500850 /nfs/dbraw/zinc/50/08/50/557500850.db2.gz RRDSKWJIILVGCJ-WCWDXBQESA-N 0 0 423.613 6.014 40 10 HKCBRN Nc1nn2c(nc(-c3cccs3)cc2C(F)(F)F)c1/N=N/c1ccc(F)cc1 ZINC000003849195 557500858 /nfs/dbraw/zinc/50/08/58/557500858.db2.gz XYQDJNUEGVBZLE-OCOZRVBESA-N 0 0 406.368 5.613 40 10 HKCBRN O=C(OCC12CC3CC(CC(C3)C1)C2)c1ccc(NCc2cc(O)ccc2O)cc1 ZINC000003941699 557503435 /nfs/dbraw/zinc/50/34/35/557503435.db2.gz MXKHJVTZHIIIMQ-UHFFFAOYSA-N 0 0 407.510 5.083 40 10 HKCBRN FC(F)(F)Oc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000004081970 560892740 /nfs/dbraw/zinc/89/27/40/560892740.db2.gz JKZXWJQNMSFOGV-ZJNRKIDTSA-N 0 0 400.227 6.719 40 10 HKCBRN FC(F)(F)Oc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000004081972 560892801 /nfs/dbraw/zinc/89/28/01/560892801.db2.gz JKZXWJQNMSFOGV-VEVIJQCQSA-N 0 0 400.227 6.719 40 10 HKCBRN Cc1cc(N2CCCC2)ccc1/C=C1/SC(=O)N(Cc2ccccc2Cl)C1=O ZINC000004106803 557513936 /nfs/dbraw/zinc/51/39/36/557513936.db2.gz UWYBUEVXJVDWBG-DEDYPNTBSA-N 0 0 412.942 5.485 40 10 HKCBRN Cc1cc(N2CCCC2)ccc1/C=C1/SC(=O)N(Cc2ccc(Cl)cc2)C1=O ZINC000004106806 557513997 /nfs/dbraw/zinc/51/39/97/557513997.db2.gz VZTFCSSENSQTJK-DEDYPNTBSA-N 0 0 412.942 5.485 40 10 HKCBRN CCc1ccccc1-n1c(C)cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c1C ZINC000004106991 557513965 /nfs/dbraw/zinc/51/39/65/557513965.db2.gz WIZNZDCVUOEUKH-PXLXIMEGSA-N 0 0 418.587 6.062 40 10 HKCBRN O=C(CSc1ncc(-c2ccc(F)cc2)n1Cc1ccco1)Nc1ccccc1 ZINC000004131078 560599645 /nfs/dbraw/zinc/59/96/45/560599645.db2.gz MJVZRKDQIZPBEU-UHFFFAOYSA-N 0 0 407.470 5.061 40 10 HKCBRN CC(=O)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N3C[C@H]1CC=C[C@H]21 ZINC000004132055 132272157 /nfs/dbraw/zinc/27/21/57/132272157.db2.gz DDEKIEWNLHPDSL-BVMUCEKZSA-N 0 0 412.489 5.692 40 10 HKCBRN CC(=O)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1CN3[C@@H](c1cccc([N+](=O)[O-])c1)[C@@H]1CC=C[C@@H]21 ZINC000004132058 132272104 /nfs/dbraw/zinc/27/21/04/132272104.db2.gz DDEKIEWNLHPDSL-NEMUNFNQSA-N 0 0 412.489 5.692 40 10 HKCBRN CC(=O)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1CN3[C@@H](c1cccc([N+](=O)[O-])c1)[C@@H]1CC=C[C@H]21 ZINC000004132060 132272130 /nfs/dbraw/zinc/27/21/30/132272130.db2.gz DDEKIEWNLHPDSL-AIQNWGLSSA-N 0 0 412.489 5.692 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@H]21 ZINC000004151434 560735323 /nfs/dbraw/zinc/73/53/23/560735323.db2.gz MZPRADALSUCTGP-RLFYNMQTSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@H]21 ZINC000004151436 560735355 /nfs/dbraw/zinc/73/53/55/560735355.db2.gz MZPRADALSUCTGP-HDMKZQKVSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@@H](c1cccc(Br)c1)[C@@H]1CC=C[C@H]21 ZINC000004151437 557520839 /nfs/dbraw/zinc/52/08/39/557520839.db2.gz MZPRADALSUCTGP-DAYGRLMNSA-N 0 0 401.260 5.192 40 10 HKCBRN COCCn1c(-c2ccccc2)cnc1SCC(=O)Nc1cccc2ccccc21 ZINC000004161546 560601829 /nfs/dbraw/zinc/60/18/29/560601829.db2.gz KTYIINQSXNULDR-UHFFFAOYSA-N 0 0 417.534 5.081 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c(OCc3ccccc3)ccc(OCc3ccccc3)c21 ZINC000004257673 560735402 /nfs/dbraw/zinc/73/54/02/560735402.db2.gz ZYJBQWBYBPKSSD-UHFFFAOYSA-N 0 0 420.464 5.620 40 10 HKCBRN Cc1cc(N2Cc3ccccc3C2)c(C)cc1/N=N\c1ccc(Br)cc1 ZINC000004300912 557537750 /nfs/dbraw/zinc/53/77/50/557537750.db2.gz KBULNKMQFMAJLM-IZHYLOQSSA-N 0 0 406.327 7.002 40 10 HKCBRN Brc1ccc([C@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000004320323 560895822 /nfs/dbraw/zinc/89/58/22/560895822.db2.gz ZXQVEPXPKIJYQR-RLFYNMQTSA-N 0 0 405.133 6.038 40 10 HKCBRN Cc1ccc(Nc2cccc3c2C(=O)c2cccc(Nc4ccc(C)cc4)c2C3=O)cc1 ZINC000004366766 557547476 /nfs/dbraw/zinc/54/74/76/557547476.db2.gz ZKIVUFFTMWIBCO-UHFFFAOYSA-N 0 0 418.496 6.566 40 10 HKCBRN O=C(Nc1ccc(Cl)cc1)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1CN3C[C@H]1CC=C[C@H]21 ZINC000004498201 132277720 /nfs/dbraw/zinc/27/77/20/132277720.db2.gz GABJEMYOCSTNBS-RFZJPIJTSA-N 0 0 402.925 5.745 40 10 HKCBRN O=C(c1ccccc1)c1cc(Cl)cc2c1N[C@@H](c1ccccc1F)[C@H]1CC=C[C@H]21 ZINC000004502242 560897016 /nfs/dbraw/zinc/89/70/16/560897016.db2.gz PLBLHQIQVLEBNH-IUKKYPGJSA-N 0 0 403.884 6.537 40 10 HKCBRN O=C(c1ccccc1)c1cc(Cl)cc2c1N[C@@H](c1ccccc1F)[C@@H]1CC=C[C@H]21 ZINC000004502270 560897040 /nfs/dbraw/zinc/89/70/40/560897040.db2.gz PLBLHQIQVLEBNH-YZZKKUAISA-N 0 0 403.884 6.537 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)Nc2ccc(Cl)cc2Cl)cc1 ZINC000004541622 569328302 /nfs/dbraw/zinc/32/83/02/569328302.db2.gz ADRDJKQLZKGRFI-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc4c5ccccc5n(C)c4c3)SC2=S)cc1 ZINC000004543824 557565230 /nfs/dbraw/zinc/56/52/30/557565230.db2.gz LETSMGZJAYZKQI-HYARGMPZSA-N 0 0 414.555 6.046 40 10 HKCBRN CCCCC1=NN2C(=NC(=O)/C(=C/c3ccc(-c4ccc(Cl)cc4)o3)C2=N)S1 ZINC000004550710 558681016 /nfs/dbraw/zinc/68/10/16/558681016.db2.gz HZJCQTNFEBYEGX-AZAZKDLZSA-N 0 0 412.902 5.409 40 10 HKCBRN CCOc1cc(/C=C2/C=C(c3ccc(F)cc3)OC2=O)ccc1OCc1ccccc1 ZINC000004575773 568934323 /nfs/dbraw/zinc/93/43/23/568934323.db2.gz WRSVLNHFMYAGKR-STZFKDTASA-N 0 0 416.448 5.785 40 10 HKCBRN CC(C)CC1=NN2C(=NC(=O)/C(=C/c3ccc(-c4ccc(Cl)cc4)o3)C2=N)S1 ZINC000004598722 558834871 /nfs/dbraw/zinc/83/48/71/558834871.db2.gz ICVYCSIMZMETLU-BXODQFHZSA-N 0 0 412.902 5.265 40 10 HKCBRN CC(C)(C)c1cc(Nc2ccccc2C(=O)c2ccccc2)c(O)c(C(C)(C)C)c1 ZINC000004614847 557572752 /nfs/dbraw/zinc/57/27/52/557572752.db2.gz KAIMBBFFMGWBSD-UHFFFAOYSA-N 0 0 401.550 6.962 40 10 HKCBRN O=C1OC(c2ccc(F)cc2)=C/C1=C/c1ccc(OCc2ccc(Cl)cc2)cc1 ZINC000004662670 557578008 /nfs/dbraw/zinc/57/80/08/557578008.db2.gz RLJAVNUTMIAJFQ-UYRXBGFRSA-N 0 0 406.840 6.039 40 10 HKCBRN CCOc1ccc2c(c1)-c1c(ss/c1=N\c1cc(Cl)ccc1O)C(C)(C)N2 ZINC000004696746 560735925 /nfs/dbraw/zinc/73/59/25/560735925.db2.gz YWCPOXBJOWPTDW-QOCHGBHMSA-N 0 0 418.971 6.127 40 10 HKCBRN CC(C)N(C(=O)c1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)C(C)C ZINC000004697727 560610867 /nfs/dbraw/zinc/61/08/67/560610867.db2.gz XLEPURHSHRWTKY-UHFFFAOYSA-N 0 0 407.517 6.348 40 10 HKCBRN CN(C(=O)c1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)c1ccccc1 ZINC000004697730 560610880 /nfs/dbraw/zinc/61/08/80/560610880.db2.gz YAXKNZIYXNMILL-UHFFFAOYSA-N 0 0 413.480 6.366 40 10 HKCBRN Cc1cccc(OC(=O)c2ccc3nc4c5ccccc5c5ccccc5c4nc3c2)c1 ZINC000004697732 569359774 /nfs/dbraw/zinc/35/97/74/569359774.db2.gz DBIPIMBRRLCVAV-UHFFFAOYSA-N 0 0 414.464 6.617 40 10 HKCBRN O=C(NCc1ccccc1)c1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000004713404 560610969 /nfs/dbraw/zinc/61/09/69/560610969.db2.gz HIAAHIIPZFQLIZ-UHFFFAOYSA-N 0 0 413.480 6.019 40 10 HKCBRN O=C(Oc1ccccc1)c1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000004713408 560610989 /nfs/dbraw/zinc/61/09/89/560610989.db2.gz PEHKJWRCAABCNX-UHFFFAOYSA-N 0 0 400.437 6.309 40 10 HKCBRN CCN1C(=O)/C(=C\C=C2/Sc3sc4ccccc4c3N2CC)SC1=S ZINC000004713705 560611000 /nfs/dbraw/zinc/61/10/00/560611000.db2.gz LJZQPAITQHHMFH-ITAGJCAXSA-N 0 0 404.607 5.439 40 10 HKCBRN CCCCN1C(=O)/C(=C/C=C2/Sc3ccc4ccccc4c3N2C)SC1=S ZINC000004714753 560610991 /nfs/dbraw/zinc/61/09/91/560610991.db2.gz KJORLTNDWDUGIJ-MJZABRMRSA-N 0 0 412.605 5.767 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@H]1C=CC[C@@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000004721982 557586527 /nfs/dbraw/zinc/58/65/27/557586527.db2.gz NRDYEOBJMGFFQC-PZROIBLQSA-N 0 0 407.819 5.972 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@H]1C=CC[C@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000004721984 557586532 /nfs/dbraw/zinc/58/65/32/557586532.db2.gz NRDYEOBJMGFFQC-IUUKEHGRSA-N 0 0 407.819 5.972 40 10 HKCBRN O=C1/C(=C/C=C/c2ccccc2)SC(=S)N1c1cccc(Br)c1 ZINC000004746276 559046621 /nfs/dbraw/zinc/04/66/21/559046621.db2.gz HAXRGSMHNHYHBK-MAHQCVNESA-N 0 0 402.338 5.411 40 10 HKCBRN COc1cc([C@H]2Nc3c(C)cccc3[C@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000004757572 560736323 /nfs/dbraw/zinc/73/63/23/560736323.db2.gz XBJNOLZWBKIZPE-PTSWNOGYSA-N 0 0 400.316 5.601 40 10 HKCBRN COc1cc([C@H]2Nc3c(C)cccc3[C@H]3C=CC[C@H]32)cc(Br)c1OC ZINC000004757574 560736361 /nfs/dbraw/zinc/73/63/61/560736361.db2.gz XBJNOLZWBKIZPE-AKCHCHLHSA-N 0 0 400.316 5.601 40 10 HKCBRN COc1ccc([C@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@H]32)cc1[N+](=O)[O-] ZINC000004758063 560608545 /nfs/dbraw/zinc/60/85/45/560608545.db2.gz KVGKTBJNHOCAGT-IQUTYRLHSA-N 0 0 401.260 5.192 40 10 HKCBRN O=C1/C(=C/c2cccs2)SC(=S)N1C1c2ccccc2Oc2ccccc21 ZINC000004769084 557596187 /nfs/dbraw/zinc/59/61/87/557596187.db2.gz ZTTLKTRQVAGUBZ-PDGQHHTCSA-N 0 0 407.541 5.845 40 10 HKCBRN COc1cc(/N=N/c2ccc(Br)cc2)ccc1N1Cc2ccccc2C1 ZINC000004774669 557596744 /nfs/dbraw/zinc/59/67/44/557596744.db2.gz TWVFFLHSAFHEBJ-WCWDXBQESA-N 0 0 408.299 6.393 40 10 HKCBRN CCOc1cc2c(c([N+](=O)[O-])c1)N[C@@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@H]21 ZINC000004817283 557601441 /nfs/dbraw/zinc/60/14/41/557601441.db2.gz LFJRRMWGJUWZMX-WTOJCKNJSA-N 0 0 405.281 6.127 40 10 HKCBRN CCOc1cc2c(c([N+](=O)[O-])c1)N[C@@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@H]21 ZINC000004817285 557601512 /nfs/dbraw/zinc/60/15/12/557601512.db2.gz LFJRRMWGJUWZMX-XEKQOVJPSA-N 0 0 405.281 6.127 40 10 HKCBRN CCCCn1c(-c2ccccc2)cnc1SCC(=O)Nc1ccc(NC(C)=O)cc1 ZINC000004850405 560608584 /nfs/dbraw/zinc/60/85/84/560608584.db2.gz MKLZSCFGXZKANP-UHFFFAOYSA-N 0 0 422.554 5.039 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3c4ccccc4cc4ccccc43)C(=O)O2)cc1OC ZINC000004852788 560611631 /nfs/dbraw/zinc/61/16/31/560611631.db2.gz AVGGPOZIIHWXKV-XSFVSMFZSA-N 0 0 408.453 5.992 40 10 HKCBRN CCOc1cc2c(c([N+](=O)[O-])c1)N[C@@H](c1ccc(Br)cc1)[C@H]1CC=C[C@H]21 ZINC000004852956 557606653 /nfs/dbraw/zinc/60/66/53/557606653.db2.gz FFCHPLAHVHEEJE-BXWFABGCSA-N 0 0 415.287 5.583 40 10 HKCBRN CCOc1cc2c(c([N+](=O)[O-])c1)N[C@@H](c1ccc(Br)cc1)[C@@H]1CC=C[C@H]21 ZINC000004852960 557606647 /nfs/dbraw/zinc/60/66/47/557606647.db2.gz FFCHPLAHVHEEJE-FCEWJHQRSA-N 0 0 415.287 5.583 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@@H](c1ccc(Br)cc1)[C@H]1CC=C[C@H]21 ZINC000004852972 557606576 /nfs/dbraw/zinc/60/65/76/557606576.db2.gz RAURYULKSQUDIB-MPGHIAIKSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@@H](c1ccc(Br)cc1)[C@@H]1CC=C[C@H]21 ZINC000004852975 557606668 /nfs/dbraw/zinc/60/66/68/557606668.db2.gz RAURYULKSQUDIB-DAYGRLMNSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc(OC)c(C2=C/C(=C/c3c4ccccc4cc4ccccc43)C(=O)O2)c1 ZINC000004854482 560611748 /nfs/dbraw/zinc/61/17/48/560611748.db2.gz KOUFYWOQSIEVHH-RGEXLXHISA-N 0 0 408.453 5.992 40 10 HKCBRN COc1ccc(Nc2ccc3ccccc3c2/N=N/c2nc3ccccc3n2C)cc1 ZINC000004855342 560611969 /nfs/dbraw/zinc/61/19/69/560611969.db2.gz SRHHDSIUCHZZMQ-ZQHSETAFSA-N 0 0 407.477 6.894 40 10 HKCBRN CCCN1C(=O)/C(=C\C=C2/Sc3c(ccc4c3CCCC4)N2CC)SC1=S ZINC000004859543 560613074 /nfs/dbraw/zinc/61/30/74/560613074.db2.gz PZGHEIYOCYMTCE-HMQSQOOHSA-N 0 0 416.637 5.493 40 10 HKCBRN CCCN1C(=O)/C(=C\C=C2/Sc3c(ccc4ccccc34)N2CC)SC1=S ZINC000004859544 560613073 /nfs/dbraw/zinc/61/30/73/560613073.db2.gz JTFHAWPSZIGVMA-HMQSQOOHSA-N 0 0 412.605 5.767 40 10 HKCBRN C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 ZINC000004873252 557608806 /nfs/dbraw/zinc/60/88/06/557608806.db2.gz KOLACZLVBICEFL-VXUOGJGISA-N 0 0 417.509 5.436 40 10 HKCBRN C[C@@H]1CCCCN1C(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 ZINC000004873253 557608801 /nfs/dbraw/zinc/60/88/01/557608801.db2.gz KOLACZLVBICEFL-ZWBFNDLWSA-N 0 0 417.509 5.436 40 10 HKCBRN C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 ZINC000004873254 557609050 /nfs/dbraw/zinc/60/90/50/557609050.db2.gz KOLACZLVBICEFL-LXGSUHORSA-N 0 0 417.509 5.436 40 10 HKCBRN CCN1C(=O)/C(=C\C=C2/Sc3ccc(-c4ccccc4)cc3N2C)SC1=S ZINC000004892088 560615420 /nfs/dbraw/zinc/61/54/20/560615420.db2.gz VMLHOBQOQQSXSZ-MZTKBTAGSA-N 0 0 410.589 5.501 40 10 HKCBRN CCOc1c(Br)cc(/C=C2/C=C(c3ccc(C)cc3)OC2=O)cc1OC ZINC000004893412 560615372 /nfs/dbraw/zinc/61/53/72/560615372.db2.gz DHMXTJYYOBQBHT-SXGWCWSVSA-N 0 0 415.283 5.146 40 10 HKCBRN CCOc1cc(/C=C2/C=C(c3ccc(C)cc3)OC2=O)cc(Br)c1OC ZINC000004893419 560615518 /nfs/dbraw/zinc/61/55/18/560615518.db2.gz LMWCZTKXYHHMJQ-SXGWCWSVSA-N 0 0 415.283 5.146 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(OCc4ccccc4)c(OC)c3)C(=O)O2)cc1 ZINC000004893420 560615488 /nfs/dbraw/zinc/61/54/88/560615488.db2.gz UDGAMNDDXYSQRS-STZFKDTASA-N 0 0 414.457 5.264 40 10 HKCBRN COc1ccc([N+](=O)[O-])cc1-c1[nH]c(-c2ccc(N(C)C)cc2)nc1-c1ccccc1 ZINC000004954582 560617283 /nfs/dbraw/zinc/61/72/83/560617283.db2.gz ARBAMTYDGDKGNI-UHFFFAOYSA-N 0 0 414.465 5.394 40 10 HKCBRN CCCCC(=O)N[C@@H](c1ccc(Cl)cc1Cl)c1c(O)ccc2ccccc21 ZINC000004957196 560617418 /nfs/dbraw/zinc/61/74/18/560617418.db2.gz FEVZWMYOBYGFSJ-QFIPXVFZSA-N 0 0 402.321 6.248 40 10 HKCBRN CCCCC(=O)N[C@H](c1ccc(Cl)cc1Cl)c1c(O)ccc2ccccc21 ZINC000004957197 560617454 /nfs/dbraw/zinc/61/74/54/560617454.db2.gz FEVZWMYOBYGFSJ-JOCHJYFZSA-N 0 0 402.321 6.248 40 10 HKCBRN COc1ccc(Br)cc1[C@H]1Nc2ccc([N+](=O)[O-])cc2[C@H]2C=CC[C@H]21 ZINC000004959412 560618348 /nfs/dbraw/zinc/61/83/48/560618348.db2.gz FVAPGMNLQMHFFK-KSMMKXTCSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2ccc([N+](=O)[O-])cc2[C@H]2C=CC[C@H]21 ZINC000004959414 560618507 /nfs/dbraw/zinc/61/85/07/560618507.db2.gz FVAPGMNLQMHFFK-IQUTYRLHSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc(Br)cc1[C@H]1Nc2ccc([N+](=O)[O-])cc2[C@H]2C=CC[C@@H]21 ZINC000004959415 560618525 /nfs/dbraw/zinc/61/85/25/560618525.db2.gz FVAPGMNLQMHFFK-NJSLBKSFSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2ccc([N+](=O)[O-])cc2[C@H]2C=CC[C@@H]21 ZINC000004959416 560618524 /nfs/dbraw/zinc/61/85/24/560618524.db2.gz FVAPGMNLQMHFFK-CKFHNAJUSA-N 0 0 401.260 5.192 40 10 HKCBRN CCOC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc(OC3CSC3)c1)N2 ZINC000004959457 568427389 /nfs/dbraw/zinc/42/73/89/568427389.db2.gz DHDYXANJRQUVLF-JTAQYXEDSA-N 0 0 407.535 5.184 40 10 HKCBRN COc1ccccc1[C@H]1Nc2ccc(I)cc2[C@H]2C=CC[C@H]21 ZINC000004959484 560620892 /nfs/dbraw/zinc/62/08/92/560620892.db2.gz NUAVAFAHUHNVNE-KSMMKXTCSA-N 0 0 403.263 5.126 40 10 HKCBRN COc1ccccc1[C@@H]1Nc2ccc(I)cc2[C@H]2C=CC[C@H]21 ZINC000004959485 560620921 /nfs/dbraw/zinc/62/09/21/560620921.db2.gz NUAVAFAHUHNVNE-IQUTYRLHSA-N 0 0 403.263 5.126 40 10 HKCBRN COc1ccccc1[C@H]1Nc2ccc(I)cc2[C@H]2C=CC[C@@H]21 ZINC000004959486 560620904 /nfs/dbraw/zinc/62/09/04/560620904.db2.gz NUAVAFAHUHNVNE-NJSLBKSFSA-N 0 0 403.263 5.126 40 10 HKCBRN COc1ccccc1[C@@H]1Nc2ccc(I)cc2[C@H]2C=CC[C@@H]21 ZINC000004959487 560620897 /nfs/dbraw/zinc/62/08/97/560620897.db2.gz NUAVAFAHUHNVNE-CKFHNAJUSA-N 0 0 403.263 5.126 40 10 HKCBRN COc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc3c(cc1Br)OCO3)N2 ZINC000004959598 568427485 /nfs/dbraw/zinc/42/74/85/568427485.db2.gz JOKJMQHCVVMSMH-KQHSUYLTSA-N 0 0 400.272 5.013 40 10 HKCBRN COc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc3c(cc1Br)OCO3)N2 ZINC000004959600 568427508 /nfs/dbraw/zinc/42/75/08/568427508.db2.gz JOKJMQHCVVMSMH-MRRFBWAASA-N 0 0 400.272 5.013 40 10 HKCBRN CC(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cc3c(cc1Br)OCO3)N2 ZINC000004959601 341977377 /nfs/dbraw/zinc/97/73/77/341977377.db2.gz VHSVKVWHYFBIFJ-DGCWBMGLSA-N 0 0 412.283 5.207 40 10 in-vitro HKCBRN CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cc3c(cc1Br)OCO3)N2 ZINC000004959602 341977378 /nfs/dbraw/zinc/97/73/78/341977378.db2.gz VHSVKVWHYFBIFJ-ZMOMAAQPSA-N 0 0 412.283 5.207 40 10 in-vitro HKCBRN CC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cc3c(cc1Br)OCO3)N2 ZINC000004959603 341977379 /nfs/dbraw/zinc/97/73/79/341977379.db2.gz VHSVKVWHYFBIFJ-PXIJXODZSA-N 0 0 412.283 5.207 40 10 in-vitro HKCBRN CC(C)c1ccc([C@H](NC(=O)CCc2ccccc2)c2ccc3cccnc3c2O)cc1 ZINC000004959830 560620936 /nfs/dbraw/zinc/62/09/36/560620936.db2.gz DCPIBHNVFMFQIT-SANMLTNESA-N 0 0 424.544 5.902 40 10 HKCBRN CC(C)c1ccc([C@@H](NC(=O)CCc2ccccc2)c2ccc3cccnc3c2O)cc1 ZINC000004959831 560620899 /nfs/dbraw/zinc/62/08/99/560620899.db2.gz DCPIBHNVFMFQIT-AREMUKBSSA-N 0 0 424.544 5.902 40 10 HKCBRN CCCCC(=O)N[C@@H](c1ccc(C(C)C)cc1)c1cc(Cl)c2cccnc2c1O ZINC000004959843 560620870 /nfs/dbraw/zinc/62/08/70/560620870.db2.gz XJSFZNOPOYMXLH-QFIPXVFZSA-N 0 0 410.945 6.113 40 10 HKCBRN CCCCC(=O)N[C@H](c1ccc(C(C)C)cc1)c1cc(Cl)c2cccnc2c1O ZINC000004959844 560620908 /nfs/dbraw/zinc/62/09/08/560620908.db2.gz XJSFZNOPOYMXLH-JOCHJYFZSA-N 0 0 410.945 6.113 40 10 HKCBRN Clc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc3c(cc1Br)OCO3)N2 ZINC000004975146 560736692 /nfs/dbraw/zinc/73/66/92/560736692.db2.gz ZFMVEDMTPKHEJC-UYSIFFEZSA-N 0 0 404.691 5.658 40 10 HKCBRN COc1cc([C@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@H]32)cc(OC)c1OC ZINC000004975152 560622702 /nfs/dbraw/zinc/62/27/02/560622702.db2.gz VSSFMNHIUGMXMU-IQUTYRLHSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@H]32)cc(OC)c1OC ZINC000004975153 560622701 /nfs/dbraw/zinc/62/27/01/560622701.db2.gz VSSFMNHIUGMXMU-KSMMKXTCSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000004975154 560622660 /nfs/dbraw/zinc/62/26/60/560622660.db2.gz VSSFMNHIUGMXMU-CKFHNAJUSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000004975155 560622687 /nfs/dbraw/zinc/62/26/87/560622687.db2.gz VSSFMNHIUGMXMU-NJSLBKSFSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@H]32)cc(OC)c1OC ZINC000004975174 560622683 /nfs/dbraw/zinc/62/26/83/560622683.db2.gz PXIYOTCBALVQRI-XEKQOVJPSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000004975176 560622658 /nfs/dbraw/zinc/62/26/58/560622658.db2.gz PXIYOTCBALVQRI-WTOJCKNJSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000004975177 560622656 /nfs/dbraw/zinc/62/26/56/560622656.db2.gz PXIYOTCBALVQRI-JMERFSKESA-N 0 0 406.309 5.846 40 10 HKCBRN CC(C)c1ccc([C@H](NC(=O)CCc2ccccc2)c2c(O)ccc3ccccc32)cc1 ZINC000004977228 560622802 /nfs/dbraw/zinc/62/28/02/560622802.db2.gz FJWJYLJUSISHOQ-LJAQVGFWSA-N 0 0 423.556 6.507 40 10 HKCBRN CC(C)c1ccc([C@@H](NC(=O)CCc2ccccc2)c2c(O)ccc3ccccc32)cc1 ZINC000004977229 560622833 /nfs/dbraw/zinc/62/28/33/560622833.db2.gz FJWJYLJUSISHOQ-GDLZYMKVSA-N 0 0 423.556 6.507 40 10 HKCBRN Cc1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)c2c1C(=O)c1ccccc1C2=O ZINC000005002815 560620466 /nfs/dbraw/zinc/62/04/66/560620466.db2.gz VLGWTJRTLJBWAZ-UHFFFAOYSA-N 0 0 417.464 5.690 40 10 HKCBRN Cc1ccc(Nc2cccc3c2C(=O)c2c(Nc4ccc(C)cc4)cccc2C3=O)cc1 ZINC000005002964 560620447 /nfs/dbraw/zinc/62/04/47/560620447.db2.gz YNPQDABMOAMHNC-UHFFFAOYSA-N 0 0 418.496 6.566 40 10 HKCBRN CCCCOc1ccc(C(=O)Oc2ccc(N=Nc3ccc(C(C)=O)cc3)cc2)cc1 ZINC000005003631 560620555 /nfs/dbraw/zinc/62/05/55/560620555.db2.gz RXHUFQGMVXIRNU-CYYJNZCTSA-N 0 0 416.477 6.703 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc(-c4ccc(Cl)cc4)o3)SC2=S)cc1 ZINC000005005415 560620584 /nfs/dbraw/zinc/62/05/84/560620584.db2.gz QANOGKARLIQJCQ-XDHOZWIPSA-N 0 0 411.935 6.314 40 10 HKCBRN O=C(OC1CCCCC1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000005024948 568431447 /nfs/dbraw/zinc/43/14/47/568431447.db2.gz HMJZOWULXOKDED-YZUZCNPQSA-N 0 0 407.941 6.656 40 10 HKCBRN O=C(OC1CCCCC1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000005024949 568431405 /nfs/dbraw/zinc/43/14/05/568431405.db2.gz HMJZOWULXOKDED-AWRGLXIESA-N 0 0 407.941 6.656 40 10 HKCBRN O=C(OC1CCCCC1)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1)N2 ZINC000005024950 568431467 /nfs/dbraw/zinc/43/14/67/568431467.db2.gz HMJZOWULXOKDED-HFMPRLQTSA-N 0 0 407.941 6.656 40 10 HKCBRN Cc1ccc(NC(=O)COC(=O)c2ccccc2NN=C2C=CC(=O)C=C2)c(C)c1 ZINC000005039575 568431661 /nfs/dbraw/zinc/43/16/61/568431661.db2.gz FSNGFZNBGPICTP-OCEACIFDSA-N 0 0 403.438 5.220 40 10 HKCBRN COc1ccccc1NC(=O)c1c(NCc2ccc(N(C)C)cc2)sc2c1CCC2 ZINC000005043972 560623924 /nfs/dbraw/zinc/62/39/24/560623924.db2.gz PRHCGHXVFKDMKM-UHFFFAOYSA-N 0 0 421.566 5.176 40 10 HKCBRN O=C(CSc1nnc(-c2ccco2)c(-c2ccco2)n1)c1ccc2ccccc2c1 ZINC000005059556 560624090 /nfs/dbraw/zinc/62/40/90/560624090.db2.gz LUTGEYFWWUPYLP-UHFFFAOYSA-N 0 0 413.458 5.520 40 10 HKCBRN O=C(CSc1nnc(-c2ccco2)c(-c2ccco2)n1)c1ccc(Cl)s1 ZINC000005059568 560624041 /nfs/dbraw/zinc/62/40/41/560624041.db2.gz LSRVBZCAOAOBRU-UHFFFAOYSA-N 0 0 403.872 5.082 40 10 HKCBRN O=C1c2cccc(Sc3ccccc3)c2C(=O)c2c(Sc3ccccc3)cccc21 ZINC000005124931 557637563 /nfs/dbraw/zinc/63/75/63/557637563.db2.gz CNRPDCKHCGUKDK-UHFFFAOYSA-N 0 0 424.546 6.764 40 10 HKCBRN O=C1/C(=C/c2ccc(Br)cc2)C=C(c2ccccc2)N1c1cccnc1 ZINC000005128135 557637581 /nfs/dbraw/zinc/63/75/81/557637581.db2.gz FIXRKJFLAMFVTB-QGOAFFKASA-N 0 0 403.279 5.315 40 10 HKCBRN CCN(CCC(=O)OC)c1ccc(/N=N/c2snc3ccc([N+](=O)[O-])cc32)cc1 ZINC000005139548 557637798 /nfs/dbraw/zinc/63/77/98/557637798.db2.gz VHLFTCNAACYPDY-QZQOTICOSA-N 0 0 413.459 5.009 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@@H]3CCCC[C@]3(O)CCN2C(=O)c2cccc(F)c2)cc1 ZINC000005148403 568441174 /nfs/dbraw/zinc/44/11/74/568441174.db2.gz BCYLGMCDRWDCON-GNKBHMEESA-N 0 0 424.560 5.180 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@@H]3CCCC[C@]3(O)CCN2C(=O)c2ccc(F)cc2)cc1 ZINC000005164497 568441857 /nfs/dbraw/zinc/44/18/57/568441857.db2.gz AEPPKFNTBVOYFC-GNKBHMEESA-N 0 0 424.560 5.180 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@H]3CCCC[C@]3(O)CCN2C(=O)c2ccc(F)cc2)cc1 ZINC000005164500 568441887 /nfs/dbraw/zinc/44/18/87/568441887.db2.gz AEPPKFNTBVOYFC-USZFVNFHSA-N 0 0 424.560 5.180 40 10 HKCBRN CC(=O)Nc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3)C=C2c2ccccc2)cc1 ZINC000005174086 560737022 /nfs/dbraw/zinc/73/70/22/560737022.db2.gz LPRJQLIUDBUOPH-HMMYKYKNSA-N 0 0 414.892 5.770 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)C1=C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC000005191915 557639379 /nfs/dbraw/zinc/63/93/79/557639379.db2.gz ICWBTGYDDZUCDH-UHFFFAOYSA-N 0 0 424.548 5.043 40 10 HKCBRN CCCCN(CCCC)c1cc(C)c(/N=N/c2cc(Cl)ccc2Cl)c(C)c1 ZINC000005192888 557639543 /nfs/dbraw/zinc/63/95/43/557639543.db2.gz HYCSHQJJZXOJQM-OCEACIFDSA-N 0 0 406.401 8.432 40 10 HKCBRN CCCCCOC(=O)CCCCCN1C(=O)/C(=C/c2ccccc2)SC1=S ZINC000005214256 557640230 /nfs/dbraw/zinc/64/02/30/557640230.db2.gz ZTNUVEXFEXSENV-VLGSPTGOSA-N 0 0 405.585 5.182 40 10 HKCBRN O=C1c2ccccc2C(=O)c2cc3nc4c5ccccc5c5ccccc5c4nc3cc21 ZINC000005218086 557640492 /nfs/dbraw/zinc/64/04/92/557640492.db2.gz VHIGDOFOYLTIIL-UHFFFAOYSA-N 0 0 410.432 5.865 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C\c3nc4ccccc4n3C)SC2=S)cc1 ZINC000005235991 557641045 /nfs/dbraw/zinc/64/10/45/557641045.db2.gz PBUWEFKYNLEDEX-XMHGGMMESA-N 0 0 407.564 5.322 40 10 HKCBRN CCCCCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)cc1 ZINC000005259967 569255655 /nfs/dbraw/zinc/25/56/55/569255655.db2.gz PGDYHUZLMOJXCV-UHFFFAOYSA-N 0 0 423.534 5.287 40 10 HKCBRN CCCCOC(=O)CCCCCN1C(=O)/C(=C/c2ccc(C)cc2)SC1=S ZINC000005370740 557647172 /nfs/dbraw/zinc/64/71/72/557647172.db2.gz HACDIICYANZZJZ-SDXDJHTJSA-N 0 0 405.585 5.100 40 10 HKCBRN CCCCCOC(=O)CCCN1C(=O)/C(=C/C(C)=C/c2ccccc2)SC1=S ZINC000005370979 557647597 /nfs/dbraw/zinc/64/75/97/557647597.db2.gz GSVBYRLAWIJHED-SRKLUXGOSA-N 0 0 417.596 5.348 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3cccc(OC)c3OC)SC2=S)cc1 ZINC000005371339 557647608 /nfs/dbraw/zinc/64/76/08/557647608.db2.gz AKSKAXKIZAPFQZ-RGEXLXHISA-N 0 0 413.564 5.452 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3ccc(OC)cc3OC)SC2=S)cc1 ZINC000005371351 557647613 /nfs/dbraw/zinc/64/76/13/557647613.db2.gz NKIDEAUHOSPGTG-MOSHPQCFSA-N 0 0 413.564 5.452 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3cc(OC)ccc3OC)SC2=S)cc1 ZINC000005371376 557647821 /nfs/dbraw/zinc/64/78/21/557647821.db2.gz ZMDJQUYHFDGNCA-ZHZULCJRSA-N 0 0 413.564 5.452 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3ccc(OC)c(OC)c3)SC2=S)cc1 ZINC000005371400 557647815 /nfs/dbraw/zinc/64/78/15/557647815.db2.gz FHVLHRGXHJUQIV-ZHZULCJRSA-N 0 0 413.564 5.452 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C/c2ccccc2OCc2ccccc2Cl)SC1=S ZINC000005371430 557647738 /nfs/dbraw/zinc/64/77/38/557647738.db2.gz WAGZGCJPYPFZDW-PDGQHHTCSA-N 0 0 417.983 5.919 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C/c2ccccc2OCc2ccc(Cl)cc2)SC1=S ZINC000005371432 557647805 /nfs/dbraw/zinc/64/78/05/557647805.db2.gz BETAKDKHTKPTFF-PDGQHHTCSA-N 0 0 417.983 5.919 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C/c2cccc(OCc3ccc(Cl)cc3)c2)SC1=S ZINC000005371437 557647774 /nfs/dbraw/zinc/64/77/74/557647774.db2.gz QXIDUDHWZUSLFU-PDGQHHTCSA-N 0 0 417.983 5.919 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C/c2ccc(OCc3ccccc3Cl)cc2)SC1=S ZINC000005371474 557647843 /nfs/dbraw/zinc/64/78/43/557647843.db2.gz VCFXJNXMAGFXMB-PDGQHHTCSA-N 0 0 417.983 5.919 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3)cc2)SC1=S ZINC000005371477 557647828 /nfs/dbraw/zinc/64/78/28/557647828.db2.gz BZYMYIOQQIFPNJ-PDGQHHTCSA-N 0 0 417.983 5.919 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C\c2ccc(-c3cc(Cl)ccc3Cl)o2)SC1=S ZINC000005371486 557647743 /nfs/dbraw/zinc/64/77/43/557647743.db2.gz QGUFIWNRNMCJKK-OQLLNIDSSA-N 0 0 412.363 6.253 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C\c2ccc(-c3ccc(Cl)c(Cl)c3)o2)SC1=S ZINC000005371492 557647793 /nfs/dbraw/zinc/64/77/93/557647793.db2.gz LETZTICCEMGVKN-OQLLNIDSSA-N 0 0 412.363 6.253 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3ccc(C(=O)OC)cc3)SC2=S)cc1 ZINC000005371716 557647903 /nfs/dbraw/zinc/64/79/03/557647903.db2.gz RCRMBOMAHLLASM-RGEXLXHISA-N 0 0 411.548 5.222 40 10 HKCBRN CC(=O)c1ccc(N2C(=O)C(=Cc3ccc(Cl)cc3Cl)SC2=S)cc1 ZINC000005371913 557647917 /nfs/dbraw/zinc/64/79/17/557647917.db2.gz SDRTUXRHQLYVQN-PXNMLYILSA-N 0 0 408.331 5.602 40 10 HKCBRN CC(=O)c1cccc(N2C(=O)C(=Cc3ccc(Cl)cc3Cl)SC2=S)c1 ZINC000005371914 557647912 /nfs/dbraw/zinc/64/79/12/557647912.db2.gz PUFMUZNQHAGPOY-PXNMLYILSA-N 0 0 408.331 5.602 40 10 HKCBRN CC(=O)c1ccc(N2C(=O)C(=Cc3c(Cl)cccc3Cl)SC2=S)cc1 ZINC000005371926 557647920 /nfs/dbraw/zinc/64/79/20/557647920.db2.gz HOGNNEGMXISNJB-SXGWCWSVSA-N 0 0 408.331 5.602 40 10 HKCBRN CC(=O)c1cccc(N2C(=O)C(=Cc3c(Cl)cccc3Cl)SC2=S)c1 ZINC000005371929 557647922 /nfs/dbraw/zinc/64/79/22/557647922.db2.gz NIDWBXAVWZDZPH-SXGWCWSVSA-N 0 0 408.331 5.602 40 10 HKCBRN CCc1ccc(N2C(=O)/C(=C/c3cccc(Br)c3)SC2=S)cc1 ZINC000005371934 557647934 /nfs/dbraw/zinc/64/79/34/557647934.db2.gz SAQOQDOERLTGOW-WJDWOHSUSA-N 0 0 404.354 5.417 40 10 HKCBRN Cc1ccc(C)c(N2C(=O)/C(=C/c3cccc(Br)c3)SC2=S)c1 ZINC000005371935 557647926 /nfs/dbraw/zinc/64/79/26/557647926.db2.gz MQAVKRSEVXBOIA-YBEGLDIGSA-N 0 0 404.354 5.472 40 10 HKCBRN CCc1ccc(N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)cc1 ZINC000005371949 557647946 /nfs/dbraw/zinc/64/79/46/557647946.db2.gz CWUFXCKJNYHASP-WJDWOHSUSA-N 0 0 404.354 5.417 40 10 HKCBRN Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)c1 ZINC000005371950 557647965 /nfs/dbraw/zinc/64/79/65/557647965.db2.gz SCFQLKAYUNTLQX-YBEGLDIGSA-N 0 0 404.354 5.472 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3ccc(O)c(OCC)c3)SC2=S)cc1 ZINC000005372068 557648065 /nfs/dbraw/zinc/64/80/65/557648065.db2.gz SBOIYJUWLKFADZ-ZHZULCJRSA-N 0 0 413.564 5.539 40 10 HKCBRN COc1ccc(CCN2C(=O)/C(=C/C(Cl)=C/c3ccccc3)SC2=S)cc1 ZINC000005372220 557648091 /nfs/dbraw/zinc/64/80/91/557648091.db2.gz QNRCGWQNVYSPPI-PHGFRJIASA-N 0 0 415.967 5.262 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C\c2ccc(-c3c(Cl)cccc3Cl)o2)SC1=S ZINC000005372345 557648098 /nfs/dbraw/zinc/64/80/98/557648098.db2.gz CXTFWZWOPZIEIN-NTEUORMPSA-N 0 0 412.363 6.253 40 10 HKCBRN CC(=O)Nc1ccc(NC2=NC(=O)C(=Cc3ccc(Cl)cc3Cl)S2)cc1 ZINC000005373004 557648107 /nfs/dbraw/zinc/64/81/07/557648107.db2.gz FDUXQBMDFKHHKD-PXNMLYILSA-N 0 0 406.294 5.034 40 10 HKCBRN Cn1c(C=C2SC(Nc3cccc(Cl)c3Cl)=NC2=O)cc2ccccc21 ZINC000005374365 557648446 /nfs/dbraw/zinc/64/84/46/557648446.db2.gz BSTHZKXTPHKNPZ-MHWRWJLKSA-N 0 0 402.306 5.568 40 10 HKCBRN Cn1c(C=C2SC(Nc3ccc(Br)cc3)=NC2=O)cc2ccccc21 ZINC000005374369 557648500 /nfs/dbraw/zinc/64/85/00/557648500.db2.gz XOOCESDEHKDLDB-GZTJUZNOSA-N 0 0 412.312 5.023 40 10 HKCBRN Cn1c(C=C2SC(Nc3cccc(Br)c3)=NC2=O)cc2ccccc21 ZINC000005374379 557648463 /nfs/dbraw/zinc/64/84/63/557648463.db2.gz UVXYKYOMKMBENV-GZTJUZNOSA-N 0 0 412.312 5.023 40 10 HKCBRN Cn1c(C=C2SC(Nc3ccccc3Br)=NC2=O)cc2ccccc21 ZINC000005374382 557648478 /nfs/dbraw/zinc/64/84/78/557648478.db2.gz REINAGZGQNLEIB-GZTJUZNOSA-N 0 0 412.312 5.023 40 10 HKCBRN Cn1cccc1/C=C1\SC(=S)N(c2ccc(Cl)c(C(F)(F)F)c2)C1=O ZINC000005374412 557648460 /nfs/dbraw/zinc/64/84/60/557648460.db2.gz WYJCYPFYKGPSJT-JYRVWZFOSA-N 0 0 402.850 5.103 40 10 HKCBRN CCCCCOC(=O)CCCCCN1C(=O)/C(=C/c2ccc(C)cc2)SC1=S ZINC000005376052 557648994 /nfs/dbraw/zinc/64/89/94/557648994.db2.gz OMLFXKSQAVCYBN-MNDPQUGUSA-N 0 0 419.612 5.490 40 10 HKCBRN CC(C)c1ccc(/C=C2/SC(=S)N(CNc3ccccc3Cl)C2=O)cc1 ZINC000005413344 557652197 /nfs/dbraw/zinc/65/21/97/557652197.db2.gz RYPHUVZSNMFGNR-WOJGMQOQSA-N 0 0 402.972 5.734 40 10 HKCBRN CCCCCOc1ccc(C(=O)Oc2ccc(/N=N/c3cccc(C)c3)cc2)cc1 ZINC000005418910 557652602 /nfs/dbraw/zinc/65/26/02/557652602.db2.gz LKTKTYMFVIZISR-CYYJNZCTSA-N 0 0 402.494 7.199 40 10 HKCBRN CC(C)(C)c1ccc(Sc2cccc3c2C(=O)c2c(Cl)cccc2C3=O)cc1 ZINC000005438675 557653531 /nfs/dbraw/zinc/65/35/31/557653531.db2.gz UBRVGEUKXQCCIW-UHFFFAOYSA-N 0 0 406.934 6.564 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3Cl)SC2=S)cc1 ZINC000005465619 560737753 /nfs/dbraw/zinc/73/77/53/560737753.db2.gz GXBWAHSYFKPOPM-CXUHLZMHSA-N 0 0 410.347 5.798 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@@H]3CCCC[C@]3(O)CCN2C(=O)c2cccs2)cc1 ZINC000005478295 568443762 /nfs/dbraw/zinc/44/37/62/568443762.db2.gz XFGYWZZFLOUEQF-SSPYTLHUSA-N 0 0 412.599 5.103 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@H]3CCCC[C@]3(O)CCN2C(=O)c2cccs2)cc1 ZINC000005478297 568443773 /nfs/dbraw/zinc/44/37/73/568443773.db2.gz XFGYWZZFLOUEQF-SFLYRZDNSA-N 0 0 412.599 5.103 40 10 HKCBRN CN(C)c1ccc(C=C(NC(=O)c2ccccc2)c2nc3cc(Cl)ccc3[nH]2)cc1 ZINC000005502586 557658579 /nfs/dbraw/zinc/65/85/79/557658579.db2.gz QIURFMPQSWEFHB-HMAPJEAMSA-N 0 0 416.912 5.210 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3)N(c3cccc(Cl)c3)C2=O)c(OC)c1 ZINC000005513222 557659056 /nfs/dbraw/zinc/65/90/56/557659056.db2.gz ZSHIVLUNYAAERT-FYJGNVAPSA-N 0 0 418.880 5.192 40 10 HKCBRN COc1ccc(/C=C2\N=C(c3ccccc3)N(c3ccc(Cl)cc3)C2=O)c(OC)c1 ZINC000005513230 557659067 /nfs/dbraw/zinc/65/90/67/557659067.db2.gz OPTNTCSAJGTDCB-STZFKDTASA-N 0 0 418.880 5.192 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3cn(C)c4ccccc34)SC2=S)cc1 ZINC000005520138 557659451 /nfs/dbraw/zinc/65/94/51/557659451.db2.gz RMQRUYWFGNXNCK-STZFKDTASA-N 0 0 406.576 5.927 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4ccccc4Cl)o3)S2)cc1 ZINC000005520186 557659386 /nfs/dbraw/zinc/65/93/86/557659386.db2.gz LCKYGXDDHHRMJR-DEDYPNTBSA-N 0 0 408.910 6.245 40 10 HKCBRN CCc1ccccc1NC1=NC(=O)C(=Cc2ccc(-c3ccccc3Cl)o2)S1 ZINC000005520187 557659478 /nfs/dbraw/zinc/65/94/78/557659478.db2.gz KUXRZEBFASVOSZ-DEDYPNTBSA-N 0 0 408.910 6.245 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4cccc(Cl)c4)o3)S2)cc1 ZINC000005520192 557659423 /nfs/dbraw/zinc/65/94/23/557659423.db2.gz CXLRSUWLKOEXGJ-DEDYPNTBSA-N 0 0 408.910 6.245 40 10 HKCBRN CCc1ccccc1NC1=NC(=O)C(=Cc2ccc(-c3cccc(Cl)c3)o2)S1 ZINC000005520193 557659427 /nfs/dbraw/zinc/65/94/27/557659427.db2.gz WAWROSCSARJZGL-DEDYPNTBSA-N 0 0 408.910 6.245 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000005523232 557659529 /nfs/dbraw/zinc/65/95/29/557659529.db2.gz HCCAANAGKSTYIQ-GDNBJRDFSA-N 0 0 406.240 5.010 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3c4ccccc4cc4ccccc43)C(=O)O2)c(OC)c1 ZINC000005526759 557659878 /nfs/dbraw/zinc/65/98/78/557659878.db2.gz AUCCQSRZBKAOAI-XMHGGMMESA-N 0 0 408.453 5.992 40 10 HKCBRN Cc1cc(C)c(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)c(C)c1 ZINC000005538522 560737898 /nfs/dbraw/zinc/73/78/98/560737898.db2.gz ZVFCHSYMRKYHBU-UHFFFAOYSA-N 0 0 413.926 5.297 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)cc1C ZINC000005546884 557660637 /nfs/dbraw/zinc/66/06/37/557660637.db2.gz SJEJJCPGAILLHA-YBEGLDIGSA-N 0 0 404.354 5.472 40 10 HKCBRN CN(C)c1ccc([C@H]2ON=C(c3ccccc3)N2C23CC4CC(CC(C4)C2)C3)cc1 ZINC000005549658 557660912 /nfs/dbraw/zinc/66/09/12/557660912.db2.gz NQVSALXMASODGJ-CTCZGSPCSA-N 0 0 401.554 5.414 40 10 HKCBRN CN(C)c1ccc([C@@H]2ON=C(c3ccccc3)N2C23CC4CC(CC(C4)C2)C3)cc1 ZINC000005549668 557660893 /nfs/dbraw/zinc/66/08/93/557660893.db2.gz NQVSALXMASODGJ-AAQGMKQJSA-N 0 0 401.554 5.414 40 10 HKCBRN COc1ccc(NC2=NC(=O)C(=Cc3ccc(Cl)cc3Cl)S2)c(OC)c1 ZINC000005551090 557660872 /nfs/dbraw/zinc/66/08/72/557660872.db2.gz PDTDIPSHNFWLAP-APSNUPSMSA-N 0 0 409.294 5.093 40 10 HKCBRN Cc1ccc(-c2ccc(/C=C3/SC(=S)N(C(C)(C)C)C3=O)o2)c([N+](=O)[O-])c1 ZINC000005551826 557661078 /nfs/dbraw/zinc/66/10/78/557661078.db2.gz PJWNZLHFWWQHLM-MHWRWJLKSA-N 0 0 402.497 5.163 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/C(Cl)=C/c3ccccc3)SC2=S)cc1 ZINC000005551968 557661018 /nfs/dbraw/zinc/66/10/18/557661018.db2.gz QVUGEFMGYYTFOZ-WNPPYXCZSA-N 0 0 413.995 6.558 40 10 HKCBRN COc1ccc(CCN2C(=O)/C(=C/c3cccc4ccccc34)SC2=S)cc1 ZINC000005551981 557661111 /nfs/dbraw/zinc/66/11/11/557661111.db2.gz JEVGMJQIQBUBIW-QNGOZBTKSA-N 0 0 405.544 5.292 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3cccc4ccccc34)SC2=S)cc1 ZINC000005551989 557661122 /nfs/dbraw/zinc/66/11/22/557661122.db2.gz LSTCCPWYXVOPOZ-JWGURIENSA-N 0 0 403.572 6.588 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3cccc4ccccc34)SC2=S)c(OC)c1 ZINC000005551996 557661057 /nfs/dbraw/zinc/66/10/57/557661057.db2.gz FXFBILRCWBUFIY-NDENLUEZSA-N 0 0 407.516 5.263 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3c(F)cccc3Cl)SC2=S)cc1 ZINC000005552033 557661178 /nfs/dbraw/zinc/66/11/78/557661178.db2.gz XTPWISYJAAWEEY-PDGQHHTCSA-N 0 0 405.947 6.228 40 10 HKCBRN CC(=O)Nc1ccc(NC(=O)[C@H](C)Oc2ccc(/N=N/c3ccccc3)cc2)cc1 ZINC000005559120 560627552 /nfs/dbraw/zinc/62/75/52/560627552.db2.gz BVHQHLNFZDUEJX-FBQNGNFFSA-N 0 0 402.454 5.466 40 10 HKCBRN CC(=O)Nc1ccc(NC(=O)[C@@H](C)Oc2ccc(/N=N/c3ccccc3)cc2)cc1 ZINC000005559122 560627555 /nfs/dbraw/zinc/62/75/55/560627555.db2.gz BVHQHLNFZDUEJX-ZGKJFVQXSA-N 0 0 402.454 5.466 40 10 HKCBRN c1ccc(/N=N/N(CN(/N=N/c2ccccc2)c2ccccc2)c2ccccc2)cc1 ZINC000005600845 557664558 /nfs/dbraw/zinc/66/45/58/557664558.db2.gz BYFZJRCXRILWRR-TUUFZWAFSA-N 0 0 406.493 7.355 40 10 HKCBRN CC(C)=CCc1c2c(c(=O)c3c(O)c(-c4ccc(O)c(O)c4)coc1-3)C=CC(C)(C)O2 ZINC000005601526 291286335 /nfs/dbraw/zinc/28/63/35/291286335.db2.gz PSEBCAMYGWGJMH-UHFFFAOYSA-N 0 0 420.461 5.270 40 10 biogenic,in-vitro HKCBRN CN(C)c1ccc(/N=N/c2ccccc2C(=O)OCCOc2ccccc2F)cc1 ZINC000005656885 560628187 /nfs/dbraw/zinc/62/81/87/560628187.db2.gz UOTQPBWYYWKZCQ-OCEACIFDSA-N 0 0 407.445 5.543 40 10 HKCBRN COc1ccc(C=C2SC(Nc3ccc(Cl)cc3Cl)=NC2=O)cc1OC ZINC000005661840 557667077 /nfs/dbraw/zinc/66/70/77/557667077.db2.gz LCXGECAIXDGBAZ-PXNMLYILSA-N 0 0 409.294 5.093 40 10 HKCBRN COc1ccc(N(Cc2ccccc2O)C(=O)Oc2cc(C)ccc2C(C)C)cc1 ZINC000005698251 568936028 /nfs/dbraw/zinc/93/60/28/568936028.db2.gz GSNYOTDGTCFOQS-UHFFFAOYSA-N 0 0 405.494 6.038 40 10 HKCBRN COc1ccc([C@H](Nc2ccccn2)c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)cc1 ZINC000005714724 557670048 /nfs/dbraw/zinc/67/00/48/557670048.db2.gz QQHYEOPHRYYZCV-DEOSSOPVSA-N 0 0 418.581 6.592 40 10 in-vitro HKCBRN CCCCCOC(=O)CCCN1C(=O)/C(=C\c2ccccc2Cl)SC1=S ZINC000005735194 557671803 /nfs/dbraw/zinc/67/18/03/557671803.db2.gz PAINRSRGPIYXAT-DTQAZKPQSA-N 0 0 411.976 5.055 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/N=C(c3ccccc3)N(Cc3ccccc3)C2=O)cc1 ZINC000005736354 568453854 /nfs/dbraw/zinc/45/38/54/568453854.db2.gz XOFVDFLSIFXAJB-NCELDCMTSA-N 0 0 409.533 5.363 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@@H]21 ZINC000005738351 557672065 /nfs/dbraw/zinc/67/20/65/557672065.db2.gz MZPRADALSUCTGP-RVKKMQEKSA-N 0 0 401.260 5.192 40 10 HKCBRN Cc1ccc([N+](=O)[O-])c2c1N[C@H](c1c3ccccc3cc3ccccc31)[C@H]1CC=C[C@@H]21 ZINC000005740251 557672152 /nfs/dbraw/zinc/67/21/52/557672152.db2.gz HCYIVZMKLCIMFT-VHSZZVNMSA-N 0 0 406.485 7.036 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3)N(c3cccc4ccccc43)C2=O)cc1 ZINC000005744294 568454026 /nfs/dbraw/zinc/45/40/26/568454026.db2.gz WJMBKYHKMWEVMN-HKOYGPOVSA-N 0 0 404.469 5.683 40 10 HKCBRN O=C(COC(=O)c1cccc2ccccc21)Nc1ccc(/N=N/c2ccccc2)cc1 ZINC000005787955 560627558 /nfs/dbraw/zinc/62/75/58/560627558.db2.gz DCVGXXUONMVCRX-BYYHNAKLSA-N 0 0 409.445 6.051 40 10 HKCBRN Cc1c(Cl)cccc1NC1=NC(=O)C(=Cc2ccc(N3CCCC3)c(F)c2)S1 ZINC000005796795 569359741 /nfs/dbraw/zinc/35/97/41/569359741.db2.gz YUWPDQNGBLMMOC-UNOMPAQXSA-N 0 0 415.921 5.470 40 10 HKCBRN Nc1cc(C(=O)OCC(=O)Nc2ccc(/N=N/c3ccccc3)cc2)ccc1Cl ZINC000005834659 560627579 /nfs/dbraw/zinc/62/75/79/560627579.db2.gz VHCLJZXLSNYDQH-OCEACIFDSA-N 0 0 408.845 5.133 40 10 HKCBRN CCCCN(C[C@@H](O)c1cc2c(c3ccccc31)CCCC2)c1ccc(OC)cc1 ZINC000005837943 557676863 /nfs/dbraw/zinc/67/68/63/557676863.db2.gz ZLSRXRFZFXMABN-HHHXNRCGSA-N 0 0 403.566 6.067 40 10 HKCBRN CCCCOc1ccc(/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000005861827 557677883 /nfs/dbraw/zinc/67/78/83/557677883.db2.gz PTTBTRDSQIXELV-AQTBWJFISA-N 0 0 403.956 5.925 40 10 HKCBRN CCCCN1C(=O)/C(=C\c2ccc(OCc3ccccc3)c(OC)c2)SC1=S ZINC000005867864 557678116 /nfs/dbraw/zinc/67/81/16/557678116.db2.gz UJEXIJUHABEMGO-XSFVSMFZSA-N 0 0 413.564 5.276 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc(Cl)c3)N=C2c2ccccc2)cc1 ZINC000005953624 568454435 /nfs/dbraw/zinc/45/44/35/568454435.db2.gz MXEBPLOOHGFBEN-CJLVFECKSA-N 0 0 402.881 5.573 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(-c4ccccc4)o3)SC2=S)cc1 ZINC000005953629 557682371 /nfs/dbraw/zinc/68/23/71/557682371.db2.gz ATXFCCUFSVOWLI-XSFVSMFZSA-N 0 0 407.516 5.751 40 10 HKCBRN CCOc1ccccc1N1C(=O)/C(=C\c2cccc(Cl)c2)N=C1c1ccccc1 ZINC000005953823 568454492 /nfs/dbraw/zinc/45/44/92/568454492.db2.gz BHEOPBKCCLBOBU-CAPFRKAQSA-N 0 0 402.881 5.573 40 10 HKCBRN Cc1nc2ccc(Cl)cn2c1C(=O)/N=N/Cc1ccccc1OCc1ccccc1 ZINC000006025135 569359789 /nfs/dbraw/zinc/35/97/89/569359789.db2.gz UGUGKGJQIBIOMF-IMVLJIQESA-N 0 0 418.884 5.668 40 10 HKCBRN Cc1cc(C)c2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(OCc3ccc(Cl)cc3)cc1)N2 ZINC000006044085 557685003 /nfs/dbraw/zinc/68/50/03/557685003.db2.gz QOEIODXPCHCUMV-XFAFFCHDSA-N 0 0 415.964 7.362 40 10 HKCBRN Cc1ccc(CN2C(=O)S/C(=C\c3cc(F)c(N4CCCC4)cc3C)C2=O)cc1 ZINC000006044349 569359764 /nfs/dbraw/zinc/35/97/64/569359764.db2.gz WWJUQCURWFUYRW-BKUYFWCQSA-N 0 0 410.514 5.279 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)S2)cc1 ZINC000006044377 569359728 /nfs/dbraw/zinc/35/97/28/569359728.db2.gz PCWOQHWIBQUGOF-HMAPJEAMSA-N 0 0 418.493 5.796 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)S2)cc1 ZINC000006044379 569359736 /nfs/dbraw/zinc/35/97/36/569359736.db2.gz AYZHVKXSMQOWTC-HMAPJEAMSA-N 0 0 418.493 5.796 40 10 HKCBRN O=C(c1ccccc1)c1ccccc1NC(=S)Nc1ccc(Cl)cc1Cl ZINC000006045503 557685077 /nfs/dbraw/zinc/68/50/77/557685077.db2.gz NMYHTZINRJYIBS-UHFFFAOYSA-N 0 0 401.318 6.033 40 10 HKCBRN CC(C)N(C(=O)Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)C(C)C ZINC000006049651 569359903 /nfs/dbraw/zinc/35/99/03/569359903.db2.gz SNYUMPUNAWMHAZ-UHFFFAOYSA-N 0 0 422.532 6.740 40 10 HKCBRN Cc1cc(I)cc2c1N[C@@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21 ZINC000006194065 560740111 /nfs/dbraw/zinc/74/01/11/560740111.db2.gz HUJYBDLEDPBIRX-CKFHNAJUSA-N 0 0 421.709 6.080 40 10 HKCBRN Cc1cc(I)cc2c1N[C@@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21 ZINC000006194073 560740164 /nfs/dbraw/zinc/74/01/64/560740164.db2.gz HUJYBDLEDPBIRX-IQUTYRLHSA-N 0 0 421.709 6.080 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4ccc(CC)cc4)c3C)C2=N)S1 ZINC000006203163 569032543 /nfs/dbraw/zinc/03/25/43/569032543.db2.gz UBHDAJDTSGWOHF-YNUQAMOLSA-N 0 0 419.554 5.076 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(Cl)cc3Cl)c2C)SC1=S ZINC000006205497 569359947 /nfs/dbraw/zinc/35/99/47/569359947.db2.gz DMWZKUZOEYCASC-PXNMLYILSA-N 0 0 411.379 5.622 40 10 HKCBRN Clc1ccc(Cl)c2c1N[C@@H](c1ccc(OC3CSC3)cc1)[C@H]1CC=C[C@@H]21 ZINC000006221877 560740416 /nfs/dbraw/zinc/74/04/16/560740416.db2.gz HZKPDOSNAHBFMR-GUXCAODWSA-N 0 0 404.362 6.314 40 10 HKCBRN O=[N+]([O-])c1ccc(COc2ccc([C@@H]3Nc4c(F)cccc4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000006222094 560740450 /nfs/dbraw/zinc/74/04/50/560740450.db2.gz DSKUKJMTMICQRP-DPLHUUCSSA-N 0 0 416.452 6.139 40 10 HKCBRN S=C(Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)N1CCCC1 ZINC000006243952 560740619 /nfs/dbraw/zinc/74/06/19/560740619.db2.gz IKTUQRDNQORGLA-UHFFFAOYSA-N 0 0 408.530 5.882 40 10 HKCBRN CN(C)c1ccc(N=Nc2nnc3[n-][nH+]c(-c4ccccc4)c(-c4ccccc4)c2-3)cc1 ZINC000006247466 559114338 /nfs/dbraw/zinc/11/43/38/559114338.db2.gz TWFSHZIONXGODW-BYCLXTJYSA-N 0 0 419.492 6.168 40 10 HKCBRN Cc1cccc(CN2C(=O)S/C(=C\c3cc(F)c(N4CCCC4)cc3C)C2=O)c1 ZINC000006256568 569359887 /nfs/dbraw/zinc/35/98/87/569359887.db2.gz XOTWQGDZQGCVMA-BKUYFWCQSA-N 0 0 410.514 5.279 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1OCC ZINC000006265122 557696762 /nfs/dbraw/zinc/69/67/62/557696762.db2.gz SSCHALCLZHLRSP-XSFVSMFZSA-N 0 0 413.564 5.276 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3cccc(OCc4cccc(F)c4)c3)S2)cc1 ZINC000006267022 569359884 /nfs/dbraw/zinc/35/98/84/569359884.db2.gz KIAXTMAECKOLOE-HMAPJEAMSA-N 0 0 418.493 5.796 40 10 HKCBRN Cc1ccc(Cl)cc1NC1=NC(=O)C(=Cc2cn(CC#N)c3ccccc23)S1 ZINC000006267414 569359857 /nfs/dbraw/zinc/35/98/57/569359857.db2.gz GNFJBMXSGHPWQW-GRSHGNNSSA-N 0 0 406.898 5.209 40 10 HKCBRN COC(=O)C1=C(C)N(C2CCCC2)C(=O)/C1=C\c1cccc(Oc2ccccc2)c1 ZINC000006272763 569359846 /nfs/dbraw/zinc/35/98/46/569359846.db2.gz AOSYILFHMIJUHO-JWGURIENSA-N 0 0 403.478 5.094 40 10 HKCBRN Cc1ccc(C)c([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000006275917 560740847 /nfs/dbraw/zinc/74/08/47/560740847.db2.gz VRZMSIDLULTMBR-GQIGUUNPSA-N 0 0 401.291 5.735 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)cc2)C(=O)N1Cc1ccc(F)cc1Cl ZINC000006276537 557697593 /nfs/dbraw/zinc/69/75/93/557697593.db2.gz XVXMSPRQKZDLJI-YBFXNURJSA-N 0 0 416.905 5.316 40 10 HKCBRN Clc1ccccc1[C@@H]1Nc2ccc(I)cc2[C@@H]2C=CC[C@@H]21 ZINC000006276772 560740886 /nfs/dbraw/zinc/74/08/86/560740886.db2.gz OATPWHYBWFRJDD-FHSNZYRGSA-N 0 0 407.682 5.771 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc3ccccc32)C(=O)/C1=C\c1ccc(SC)cc1 ZINC000006307886 569359926 /nfs/dbraw/zinc/35/99/26/569359926.db2.gz OFRQWTZPRQPWSF-QNGOZBTKSA-N 0 0 415.514 5.439 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc3ccccc32)C(=O)/C1=C\c1cccc2ccccc12 ZINC000006307906 569359928 /nfs/dbraw/zinc/35/99/28/569359928.db2.gz NHNFMYNCMWQGAB-ULJHMMPZSA-N 0 0 419.480 5.870 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@H]3C=CC[C@H]32)cc1 ZINC000006324041 569330822 /nfs/dbraw/zinc/33/08/22/569330822.db2.gz QOKUQLCFMTXAGU-MDOVXXIYSA-N 0 0 406.784 7.771 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@H]3C=CC[C@H]32)cc1 ZINC000006324053 569330791 /nfs/dbraw/zinc/33/07/91/569330791.db2.gz CJINKZMNJHBIAR-YRNRMSPPSA-N 0 0 405.891 7.483 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(F)cc(Br)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000006324070 569330838 /nfs/dbraw/zinc/33/08/38/569330838.db2.gz VAEWKPNFAOVJIQ-QKLQHJQFSA-N 0 0 400.335 6.712 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@H]3C=CC[C@@H]32)cc1 ZINC000006324109 569330829 /nfs/dbraw/zinc/33/08/29/569330829.db2.gz QOKUQLCFMTXAGU-AVYPCKFXSA-N 0 0 406.784 7.771 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@H]3C=CC[C@@H]32)cc1 ZINC000006324121 569330819 /nfs/dbraw/zinc/33/08/19/569330819.db2.gz CJINKZMNJHBIAR-FTRWYGJKSA-N 0 0 405.891 7.483 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(F)cc(Br)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006324136 569330790 /nfs/dbraw/zinc/33/07/90/569330790.db2.gz VAEWKPNFAOVJIQ-ZWOKBUDYSA-N 0 0 400.335 6.712 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc(OCc4ccccc4)cc3)S2)c(C)c1 ZINC000006331100 569359853 /nfs/dbraw/zinc/35/98/53/569359853.db2.gz LGUHICLPYFRHCF-HZHRSRAPSA-N 0 0 414.530 5.965 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)S2)c(C)c1 ZINC000006331113 557699512 /nfs/dbraw/zinc/69/95/12/557699512.db2.gz GKFPJQYJDYDUEB-HZHRSRAPSA-N 0 0 414.530 5.965 40 10 HKCBRN O=C1/C(=C/c2c3ccccc3cc3ccccc32)SC(=S)N1Cc1ccccc1 ZINC000006344205 557699649 /nfs/dbraw/zinc/69/96/49/557699649.db2.gz WRHQYJLNFBNZJR-HAHDFKILSA-N 0 0 411.551 6.394 40 10 HKCBRN COC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1cccc(Oc2ccccc2)c1 ZINC000006348311 560741172 /nfs/dbraw/zinc/74/11/72/560741172.db2.gz LIFHHFXGBCYWHT-QJOMJCCJSA-N 0 0 417.505 5.484 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1cccc(Oc2ccccc2)c1 ZINC000006348325 560741168 /nfs/dbraw/zinc/74/11/68/560741168.db2.gz JSKBMLBBHBHCAO-QJOMJCCJSA-N 0 0 411.457 5.356 40 10 HKCBRN CCN1C(=O)/C(=C\c2cn(Cc3ccc(Cl)cc3)c3ccccc23)SC1=S ZINC000006353581 560741277 /nfs/dbraw/zinc/74/12/77/560741277.db2.gz UUFVKGYRGYAVSV-YBFXNURJSA-N 0 0 412.967 5.564 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3cccnc3)C2=O)cc1 ZINC000006366165 560741344 /nfs/dbraw/zinc/74/13/44/560741344.db2.gz STCSRCXCNWYCPQ-XMHGGMMESA-N 0 0 402.881 5.605 40 10 HKCBRN CN(C)c1ccc(/N=N/c2ccccc2C(=O)OCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000006367862 569331689 /nfs/dbraw/zinc/33/16/89/569331689.db2.gz ZKVVLGCTXNJVJH-WCWDXBQESA-N 0 0 404.426 5.433 40 10 HKCBRN CN(C)c1ccc(/N=N/c2ccccc2C(=O)OCc2cccc([N+](=O)[O-])c2)cc1 ZINC000006367865 569331716 /nfs/dbraw/zinc/33/17/16/569331716.db2.gz JKROMOOYQVOGDX-WCWDXBQESA-N 0 0 404.426 5.433 40 10 HKCBRN CN(C)c1ccc(/N=N/c2ccccc2C(=O)OCc2ccccc2[N+](=O)[O-])cc1 ZINC000006367868 569331701 /nfs/dbraw/zinc/33/17/01/569331701.db2.gz SLZAKYAWBJBVEP-WCWDXBQESA-N 0 0 404.426 5.433 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3cccc(Cl)c3Cl)c2C)SC1=S ZINC000006387042 569359967 /nfs/dbraw/zinc/35/99/67/569359967.db2.gz SAOYOKJYALECMA-DHDCSXOGSA-N 0 0 411.379 5.622 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(Cl)cc3O)C2=O)cc1 ZINC000006388011 557700904 /nfs/dbraw/zinc/70/09/04/557700904.db2.gz GIFJKBBLIJQFGA-XMHGGMMESA-N 0 0 417.892 5.916 40 10 HKCBRN O=C1N=C(Nc2ccccc2)SC1=Cc1ccc(OCc2cccc(F)c2)cc1 ZINC000006393035 569359959 /nfs/dbraw/zinc/35/99/59/569359959.db2.gz OEWWCBIHUREDMI-STZFKDTASA-N 0 0 404.466 5.487 40 10 HKCBRN COc1ccc(NC2=NC(=O)C(=Cc3ccc(N4CCCCC4)c(C)c3)S2)cc1 ZINC000006399927 132310779 /nfs/dbraw/zinc/31/07/79/132310779.db2.gz IETBNBALSPVLBC-RCCKNPSSSA-N 0 0 407.539 5.076 40 10 HKCBRN CCN(CC)C(=S)Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000006416152 569360007 /nfs/dbraw/zinc/36/00/07/569360007.db2.gz NDUIQCLUTILRRZ-UHFFFAOYSA-N 0 0 411.530 6.095 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3cc(Cl)ccc3Cl)c2C)SC1=S ZINC000006418182 569359979 /nfs/dbraw/zinc/35/99/79/569359979.db2.gz KFRNLXDXVSIXKB-PXNMLYILSA-N 0 0 411.379 5.622 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1/C=C(c2ccc(Br)cc2)OC1=O ZINC000006449838 557703123 /nfs/dbraw/zinc/70/31/23/557703123.db2.gz FNGWTUDYERISJD-VBKFSLOCSA-N 0 0 407.263 5.592 40 10 HKCBRN O=C1S[C@H](Nc2cccc3ccccc32)C(=O)N1c1ccc(Br)cc1 ZINC000006475365 560630812 /nfs/dbraw/zinc/63/08/12/560630812.db2.gz FDPMIJVTHOGNQQ-KRWDZBQOSA-N 0 0 413.296 5.240 40 10 HKCBRN O=C1S[C@@H](Nc2cccc3ccccc32)C(=O)N1c1ccc(Br)cc1 ZINC000006475368 560630814 /nfs/dbraw/zinc/63/08/14/560630814.db2.gz FDPMIJVTHOGNQQ-QGZVFWFLSA-N 0 0 413.296 5.240 40 10 HKCBRN COc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)ccc1OCc1cccc(C)c1 ZINC000006504306 560743833 /nfs/dbraw/zinc/74/38/33/560743833.db2.gz YAROESHJBVEIGA-HZHRSRAPSA-N 0 0 412.489 5.389 40 10 HKCBRN CC(C)(C)N(Cc1ccccc1)C(=O)COc1ccc(/N=N/c2ccccc2)cc1 ZINC000006515379 560632030 /nfs/dbraw/zinc/63/20/30/560632030.db2.gz VJANKSAISSROLW-CYYJNZCTSA-N 0 0 401.510 6.308 40 10 HKCBRN CCOc1ccc(/C=C2\SC(N(C)c3ccc(Cl)cc3)=NC2=O)cc1OCC ZINC000006518168 557706473 /nfs/dbraw/zinc/70/64/73/557706473.db2.gz GLSICHSEFNINCB-UYRXBGFRSA-N 0 0 416.930 5.244 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@@H]2N1C(=O)/C(=C\c2ccccc2)SC1=S ZINC000006523182 557706428 /nfs/dbraw/zinc/70/64/28/557706428.db2.gz KTRAWKDBDIDDDZ-UKQGIEBLSA-N 0 0 415.539 6.092 40 10 HKCBRN Cc1ccc(C)c([C@H]2Nc3ccc(I)cc3[C@H]3C=CC[C@H]32)c1 ZINC000006546269 557707488 /nfs/dbraw/zinc/70/74/88/557707488.db2.gz VRZMSIDLULTMBR-YRNRMSPPSA-N 0 0 401.291 5.735 40 10 HKCBRN Clc1ccccc1[C@H]1Nc2ccc(I)cc2[C@H]2C=CC[C@H]21 ZINC000006548402 557707449 /nfs/dbraw/zinc/70/74/49/557707449.db2.gz OATPWHYBWFRJDD-JCGVRSQUSA-N 0 0 407.682 5.771 40 10 HKCBRN CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(/N=N/c2ccccc2)cc1 ZINC000006563789 569360010 /nfs/dbraw/zinc/36/00/10/569360010.db2.gz BESIZRIYWMJSRB-PBJDEKFSSA-N 0 0 410.518 5.980 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4cccc(Cl)c4)o3)S2)cc1 ZINC000006570421 560744183 /nfs/dbraw/zinc/74/41/83/560744183.db2.gz CXLRSUWLKOEXGJ-MOSHPQCFSA-N 0 0 408.910 6.245 40 10 HKCBRN Cc1cc(C)cc(NC2=NC(=O)C(=Cc3cc(F)c(N4CCCC4)cc3C)S2)c1 ZINC000006571472 569359962 /nfs/dbraw/zinc/35/99/62/569359962.db2.gz OECJAVRUVUEKRA-BKUYFWCQSA-N 0 0 409.530 5.434 40 10 HKCBRN O=C(c1ccccc1)c1cc(Cl)ccc1NC[C@H](O)COc1ccc(Cl)cc1 ZINC000006574831 557708713 /nfs/dbraw/zinc/70/87/13/557708713.db2.gz ZVZBGRKGPQPQNH-SFHVURJKSA-N 0 0 416.304 5.076 40 10 HKCBRN CCCCC(=O)NC(=S)Nc1ccc2oc(-c3ccc(N(CC)CC)cc3)nc2c1 ZINC000006593864 557709540 /nfs/dbraw/zinc/70/95/40/557709540.db2.gz KFJGBOFYTDFVTH-UHFFFAOYSA-N 0 0 424.570 5.344 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)C=C(c2ccccc2)N1c1cccc(O)c1 ZINC000006596256 560745083 /nfs/dbraw/zinc/74/50/83/560745083.db2.gz MGHAQYKOZAJNLX-GZTJUZNOSA-N 0 0 408.284 6.170 40 10 HKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccc([N+](=O)[O-])cc3)cc1)N2 ZINC000006614143 560744401 /nfs/dbraw/zinc/74/44/01/560744401.db2.gz ITDSTRRLZYZZAQ-UMFSSWHCSA-N 0 0 412.489 6.309 40 10 HKCBRN Cc1cc(N2CCCC2)ccc1/C=C1/SC(=S)N(c2ccc(N(C)C)cc2)C1=O ZINC000006626581 557711092 /nfs/dbraw/zinc/71/10/92/557711092.db2.gz CNIUBIODLOPXJE-RCCKNPSSSA-N 0 0 423.607 5.067 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)COc4ccccc4)ccc3o2)cc1 ZINC000006630086 557711156 /nfs/dbraw/zinc/71/11/56/557711156.db2.gz OFAFQYNCZONWLO-UHFFFAOYSA-N 0 0 415.493 5.359 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4cc(C)cc(C)c4)ccc3o2)cc1 ZINC000006630088 557711069 /nfs/dbraw/zinc/71/10/69/557711069.db2.gz QLWIKNVITALPOB-UHFFFAOYSA-N 0 0 413.521 6.210 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4ccc(C)c(C)c4)ccc3o2)cc1 ZINC000006630089 557711250 /nfs/dbraw/zinc/71/12/50/557711250.db2.gz WXMZWBOUBLPGOO-UHFFFAOYSA-N 0 0 413.521 6.210 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4ccc(Cl)cc4)ccc3o2)cc1 ZINC000006630091 557711256 /nfs/dbraw/zinc/71/12/56/557711256.db2.gz RSQGHVSBJNWAQT-UHFFFAOYSA-N 0 0 419.912 6.247 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4ccc(F)cc4)ccc3o2)cc1 ZINC000006630092 557711241 /nfs/dbraw/zinc/71/12/41/557711241.db2.gz ODYKWGBAJOSTIJ-UHFFFAOYSA-N 0 0 403.457 5.732 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4ccc(OC)cc4)ccc3o2)cc1 ZINC000006630093 557711247 /nfs/dbraw/zinc/71/12/47/557711247.db2.gz SBYILCAZGUUYDM-UHFFFAOYSA-N 0 0 415.493 5.602 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4cccc(Cl)c4)ccc3o2)cc1 ZINC000006630095 557711290 /nfs/dbraw/zinc/71/12/90/557711290.db2.gz UFLYJRITRILVGC-UHFFFAOYSA-N 0 0 419.912 6.247 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4cccc(F)c4)ccc3o2)cc1 ZINC000006630096 557711222 /nfs/dbraw/zinc/71/12/22/557711222.db2.gz KGGWICVSKVXWNY-UHFFFAOYSA-N 0 0 403.457 5.732 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4cccc(OC)c4)ccc3o2)cc1 ZINC000006630097 557711288 /nfs/dbraw/zinc/71/12/88/557711288.db2.gz RSBJYVSSSCSQSK-UHFFFAOYSA-N 0 0 415.493 5.602 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4ccccc4Cl)ccc3o2)cc1 ZINC000006630100 557711231 /nfs/dbraw/zinc/71/12/31/557711231.db2.gz UXEIZGGUYHAJLG-UHFFFAOYSA-N 0 0 419.912 6.247 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4ccccc4F)ccc3o2)cc1 ZINC000006630101 557711297 /nfs/dbraw/zinc/71/12/97/557711297.db2.gz CICSZTQJNSSQCP-UHFFFAOYSA-N 0 0 403.457 5.732 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4cccnc4Cl)ccc3o2)cc1 ZINC000006630102 557711226 /nfs/dbraw/zinc/71/12/26/557711226.db2.gz MGITWUBXSNFCEW-UHFFFAOYSA-N 0 0 420.900 5.642 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=S)NC(=O)C(C)(C)C)ccc3o2)cc1 ZINC000006630105 557711258 /nfs/dbraw/zinc/71/12/58/557711258.db2.gz NFVCXVLQVRKOGH-UHFFFAOYSA-N 0 0 424.570 5.200 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=S)NC(=O)CC(C)C)ccc3o2)cc1 ZINC000006630106 557711277 /nfs/dbraw/zinc/71/12/77/557711277.db2.gz PYWNCOCTIMWBSX-UHFFFAOYSA-N 0 0 424.570 5.200 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc3ccccc32)C(=O)/C1=C\c1ccc(C(C)C)cc1 ZINC000006634335 569360043 /nfs/dbraw/zinc/36/00/43/569360043.db2.gz WBIFHUSPUFPPGJ-KQWNVCNZSA-N 0 0 411.501 5.840 40 10 HKCBRN CCCCCCOc1c(Cl)cc(/C=C2/SC(NC(C)=O)=NC2=O)cc1Cl ZINC000006635168 569360023 /nfs/dbraw/zinc/36/00/23/569360023.db2.gz PZHIZPXMMMDHSZ-XNTDXEJSSA-N 0 0 415.342 5.059 40 10 HKCBRN CN(C)c1ccc(-c2nc3cc(NC(=O)C45CC6CC(CC(C6)C4)C5)ccc3[nH]2)cc1 ZINC000006693948 557715473 /nfs/dbraw/zinc/71/54/73/557715473.db2.gz NIFCURPNTWPXTC-UHFFFAOYSA-N 0 0 414.553 5.451 40 10 HKCBRN CCC(CC)C1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4ccccc4)c3C)C2=N)S1 ZINC000006709547 569095607 /nfs/dbraw/zinc/09/56/07/569095607.db2.gz SCVIWQUASSJENJ-RYEIUNSYSA-N 0 0 419.554 5.150 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000006740926 560746594 /nfs/dbraw/zinc/74/65/94/560746594.db2.gz AFLVJSJCGOFTTI-CTDBOCAGSA-N 0 0 407.642 6.540 40 10 HKCBRN CC(C)(C)NC(=S)Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000006761740 569360034 /nfs/dbraw/zinc/36/00/34/569360034.db2.gz PRLTZIHRFPAFTJ-UHFFFAOYSA-N 0 0 410.546 6.174 40 10 HKCBRN Cc1c(Cl)cccc1NC1=NC(=O)C(=Cc2ccc(O)c(Br)c2)S1 ZINC000006767326 560746725 /nfs/dbraw/zinc/74/67/25/560746725.db2.gz RWLKYPLLPZEYOG-OVCLIPMQSA-N 0 0 423.719 5.199 40 10 HKCBRN Cc1c(Cl)cccc1NC1=NC(=O)C(=Cc2ccccc2Br)S1 ZINC000006767354 560746718 /nfs/dbraw/zinc/74/67/18/560746718.db2.gz RYKSZZOJTCMUDN-OQLLNIDSSA-N 0 0 407.720 5.493 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(Cl)cc3)C2=O)c(OC)c1 ZINC000006793394 560746431 /nfs/dbraw/zinc/74/64/31/560746431.db2.gz OPTNTCSAJGTDCB-KGENOOAVSA-N 0 0 418.880 5.192 40 10 HKCBRN Cc1cccc(NC2=NC(=O)C(=Cc3cc(F)c(N4CCCC4)cc3C)S2)c1C ZINC000006814940 569359999 /nfs/dbraw/zinc/35/99/99/569359999.db2.gz WOBNIDXNCOZLQX-BKUYFWCQSA-N 0 0 409.530 5.434 40 10 HKCBRN O=C1/C(=C\c2ccc(OCc3ccccc3)cc2)SC(=S)N1Cc1ccccc1 ZINC000006829503 560747470 /nfs/dbraw/zinc/74/74/70/560747470.db2.gz MINHTYCGLDVOQA-PXLXIMEGSA-N 0 0 417.555 5.667 40 10 HKCBRN Cc1ccc(COc2ccc(/C=C3\SC(N4CCCCCC4)=NC3=O)cc2)cc1 ZINC000006841153 557726399 /nfs/dbraw/zinc/72/63/99/557726399.db2.gz JDHVUCAQXPYVQO-JWGURIENSA-N 0 0 406.551 5.420 40 10 HKCBRN Cc1ccc(COc2ccc(/C=C3\SC(N4CCC[C@H](C)C4)=NC3=O)cc2)cc1 ZINC000006841157 557726395 /nfs/dbraw/zinc/72/63/95/557726395.db2.gz RDVFVOKXKQLYDR-GFHXCNCHSA-N 0 0 406.551 5.276 40 10 HKCBRN Cc1ccc(COc2ccc(/C=C3\SC(N4CCC[C@@H](C)C4)=NC3=O)cc2)cc1 ZINC000006841160 557726454 /nfs/dbraw/zinc/72/64/54/557726454.db2.gz RDVFVOKXKQLYDR-QWQBBLJPSA-N 0 0 406.551 5.276 40 10 HKCBRN COc1cc(/C=C2\SC(N3CCCCC3)=NC2=O)ccc1OCc1ccc(C)cc1 ZINC000006841189 557726468 /nfs/dbraw/zinc/72/64/68/557726468.db2.gz XPOOQJRHXDJXJG-JCMHNJIXSA-N 0 0 422.550 5.039 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2\SC(N3CCC[C@H](C)C3)=NC2=O)cc1 ZINC000006841216 557726476 /nfs/dbraw/zinc/72/64/76/557726476.db2.gz ZWGLKHVKWZYTMK-GFHXCNCHSA-N 0 0 406.551 5.276 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2\SC(N3CCC[C@@H](C)C3)=NC2=O)cc1 ZINC000006841220 557726418 /nfs/dbraw/zinc/72/64/18/557726418.db2.gz ZWGLKHVKWZYTMK-QWQBBLJPSA-N 0 0 406.551 5.276 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccccc2OC)C1=O ZINC000006849208 557726923 /nfs/dbraw/zinc/72/69/23/557726923.db2.gz LRVAHMYZNBFURA-DEDYPNTBSA-N 0 0 407.516 5.263 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)Nc2cc(Cl)ccc2Cl)cc1 ZINC000006865657 569334819 /nfs/dbraw/zinc/33/48/19/569334819.db2.gz KAGGHGJMIZQKHK-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000006865659 569334851 /nfs/dbraw/zinc/33/48/51/569334851.db2.gz ZEPVIENVLVVLIO-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)Nc2cccc(Cl)c2Cl)cc1 ZINC000006865668 569334776 /nfs/dbraw/zinc/33/47/76/569334776.db2.gz ZMPJLLODSLGNME-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C\c2c3ccccc3cc3ccccc32)SC1=S ZINC000006925107 557730380 /nfs/dbraw/zinc/73/03/80/557730380.db2.gz DAZSZRBFIVCNAX-HZHRSRAPSA-N 0 0 411.551 6.707 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C\c2ccccc2Oc2ccccc2)SC1=S ZINC000006925109 568936871 /nfs/dbraw/zinc/93/68/71/568936871.db2.gz VLRQGCBYESJHCS-RCCKNPSSSA-N 0 0 403.528 6.193 40 10 HKCBRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccc(N(CC)CC)cc4)nc3c2)cc1 ZINC000006941119 557730821 /nfs/dbraw/zinc/73/08/21/557730821.db2.gz HMZYONFZFLMRBQ-UHFFFAOYSA-N 0 0 413.521 6.156 40 10 HKCBRN CCc1ccc([C@@H]2Nc3ccc(I)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000006943523 569335286 /nfs/dbraw/zinc/33/52/86/569335286.db2.gz JVZNDOIMJDHZHN-QKLQHJQFSA-N 0 0 401.291 5.680 40 10 HKCBRN CCc1ccc([C@@H]2Nc3ccc(I)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006943636 559224460 /nfs/dbraw/zinc/22/44/60/559224460.db2.gz JVZNDOIMJDHZHN-ZWOKBUDYSA-N 0 0 401.291 5.680 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@H]21 ZINC000006951553 569335495 /nfs/dbraw/zinc/33/54/95/569335495.db2.gz LUAHFXPNLUDLMM-LXIYXOSZSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@H]21 ZINC000006951572 569335475 /nfs/dbraw/zinc/33/54/75/569335475.db2.gz LUAHFXPNLUDLMM-JCGVRSQUSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccc(Br)cc1)[C@H]1CC=C[C@H]21 ZINC000006952798 560747086 /nfs/dbraw/zinc/74/70/86/560747086.db2.gz SOELNBRTBGOSRU-SUNYJGFJSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@H]21 ZINC000006952838 569335604 /nfs/dbraw/zinc/33/56/04/569335604.db2.gz TXLHJKMDAZCUPT-SUNYJGFJSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@H]21 ZINC000006952872 569335591 /nfs/dbraw/zinc/33/55/91/569335591.db2.gz RUNARRDHWQJIEK-PZROIBLQSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccc(Br)cc1)[C@@H]1CC=C[C@H]21 ZINC000006952908 560747102 /nfs/dbraw/zinc/74/71/02/560747102.db2.gz SOELNBRTBGOSRU-PMUMKWKESA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@H]21 ZINC000006952927 569335603 /nfs/dbraw/zinc/33/56/03/569335603.db2.gz TXLHJKMDAZCUPT-PMUMKWKESA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@H]21 ZINC000006952947 559229071 /nfs/dbraw/zinc/22/90/71/559229071.db2.gz RUNARRDHWQJIEK-IUUKEHGRSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2[N+](=O)[O-])[C@H]2C=CC[C@H]21 ZINC000006954173 559229792 /nfs/dbraw/zinc/22/97/92/559229792.db2.gz WFJUBQUSIGATNH-VEVIJQCQSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2[N+](=O)[O-])[C@H]2C=CC[C@@H]21 ZINC000006954175 559229928 /nfs/dbraw/zinc/22/99/28/559229928.db2.gz WFJUBQUSIGATNH-ZJNRKIDTSA-N 0 0 401.260 5.192 40 10 HKCBRN CCOc1cc(C)c(C[C@H]2SC(=S)N(Cc3ccco3)C2=O)cc1C(C)C ZINC000006958357 569335832 /nfs/dbraw/zinc/33/58/32/569335832.db2.gz OKJLVDWZLVXFNI-LJQANCHMSA-N 0 0 403.569 5.082 40 10 HKCBRN CCOc1cc(C)c(C[C@@H]2SC(=S)N(Cc3ccco3)C2=O)cc1C(C)C ZINC000006958373 569335873 /nfs/dbraw/zinc/33/58/73/569335873.db2.gz OKJLVDWZLVXFNI-IBGZPJMESA-N 0 0 403.569 5.082 40 10 HKCBRN CCOc1cc(C[C@H]2SC(=S)N(CCC3CCCCC3)C2=O)c(C)cc1OC ZINC000006958478 569335811 /nfs/dbraw/zinc/33/58/11/569335811.db2.gz DPWKQTOHCSGBRE-HXUWFJFHSA-N 0 0 421.628 5.144 40 10 HKCBRN CCOc1cc(C[C@@H]2SC(=S)N(CCC3CCCCC3)C2=O)c(C)cc1OC ZINC000006958482 569335850 /nfs/dbraw/zinc/33/58/50/569335850.db2.gz DPWKQTOHCSGBRE-FQEVSTJZSA-N 0 0 421.628 5.144 40 10 HKCBRN Cc1cc([C@@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(Cl)c(Cl)c1 ZINC000006961506 569336189 /nfs/dbraw/zinc/33/61/89/569336189.db2.gz NYHXJEFRFLNSKM-HXUWFJFHSA-N 0 0 402.350 6.098 40 10 HKCBRN Cc1cc([C@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(Cl)c(Cl)c1 ZINC000006961509 569336166 /nfs/dbraw/zinc/33/61/66/569336166.db2.gz NYHXJEFRFLNSKM-FQEVSTJZSA-N 0 0 402.350 6.098 40 10 HKCBRN Cc1cc([C@@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(Br)cc1 ZINC000006961528 569336154 /nfs/dbraw/zinc/33/61/54/569336154.db2.gz LWIBYYSFVAIFDQ-HXUWFJFHSA-N 0 0 412.356 5.553 40 10 HKCBRN Cc1cc([C@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(Br)cc1 ZINC000006961529 569336174 /nfs/dbraw/zinc/33/61/74/569336174.db2.gz LWIBYYSFVAIFDQ-FQEVSTJZSA-N 0 0 412.356 5.553 40 10 HKCBRN Cc1cc([C@@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(-c2ccccc2)cc1 ZINC000006961892 569336258 /nfs/dbraw/zinc/33/62/58/569336258.db2.gz BVHWCEUBFQVLDM-AREMUKBSSA-N 0 0 409.558 6.458 40 10 HKCBRN Cc1cc([C@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(-c2ccccc2)cc1 ZINC000006961895 569336297 /nfs/dbraw/zinc/33/62/97/569336297.db2.gz BVHWCEUBFQVLDM-SANMLTNESA-N 0 0 409.558 6.458 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@H]21 ZINC000006963479 569336409 /nfs/dbraw/zinc/33/64/09/569336409.db2.gz QLXNZCCFGOZVSM-JCYRPKCISA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@H]21 ZINC000006963481 569336413 /nfs/dbraw/zinc/33/64/13/569336413.db2.gz PZQJZNKBJDNAGV-JCYRPKCISA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000006963485 569336393 /nfs/dbraw/zinc/33/63/93/569336393.db2.gz OQCGFTDIWBNWSH-JCYRPKCISA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@H]21 ZINC000006963487 569336366 /nfs/dbraw/zinc/33/63/66/569336366.db2.gz FUEKARHAJWFDSS-JCYRPKCISA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21 ZINC000006963498 569336418 /nfs/dbraw/zinc/33/64/18/569336418.db2.gz DWWQBBDHPWUBIR-WOVHNISZSA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1F)[C@H]1CC=C[C@H]21 ZINC000006963500 569336397 /nfs/dbraw/zinc/33/63/97/569336397.db2.gz PZLDAQINPUZQOK-WOVHNISZSA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CC=C[C@H]21 ZINC000006963513 569336437 /nfs/dbraw/zinc/33/64/37/569336437.db2.gz QLXNZCCFGOZVSM-PPJWLVRDSA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@H]21 ZINC000006963515 569336432 /nfs/dbraw/zinc/33/64/32/569336432.db2.gz PZQJZNKBJDNAGV-PPJWLVRDSA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@H]21 ZINC000006963519 569336389 /nfs/dbraw/zinc/33/63/89/569336389.db2.gz OQCGFTDIWBNWSH-PPJWLVRDSA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@H]21 ZINC000006963521 569336379 /nfs/dbraw/zinc/33/63/79/569336379.db2.gz FUEKARHAJWFDSS-PPJWLVRDSA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21 ZINC000006963532 569336410 /nfs/dbraw/zinc/33/64/10/569336410.db2.gz DWWQBBDHPWUBIR-UZINWLIJSA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1F)[C@@H]1CC=C[C@H]21 ZINC000006963534 569336408 /nfs/dbraw/zinc/33/64/08/569336408.db2.gz PZLDAQINPUZQOK-UZINWLIJSA-N 0 0 401.550 7.253 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc([N+](=O)[O-])cc2[C@H]2C=CC[C@@H]21 ZINC000006963541 569336417 /nfs/dbraw/zinc/33/64/17/569336417.db2.gz LWOWFXJOFQMROI-AUSJPIAWSA-N 0 0 415.287 5.501 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc([N+](=O)[O-])cc2[C@H]2C=CC[C@H]21 ZINC000006963575 569336391 /nfs/dbraw/zinc/33/63/91/569336391.db2.gz LWOWFXJOFQMROI-BXTJHSDWSA-N 0 0 415.287 5.501 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@H]32)ccc1Cl ZINC000006969845 560748936 /nfs/dbraw/zinc/74/89/36/560748936.db2.gz NAHWCBGHNHDIFX-JCGVRSQUSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@@H]32)ccc1Cl ZINC000006969854 560748929 /nfs/dbraw/zinc/74/89/29/560748929.db2.gz NAHWCBGHNHDIFX-LXIYXOSZSA-N 0 0 405.679 5.837 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000006969923 569336711 /nfs/dbraw/zinc/33/67/11/569336711.db2.gz PYYFMPCABSJYKK-VBQJREDUSA-N 0 0 405.133 6.038 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@@H]32)c1 ZINC000006969926 569336745 /nfs/dbraw/zinc/33/67/45/569336745.db2.gz PYYFMPCABSJYKK-ZQIUZPCESA-N 0 0 405.133 6.038 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@@H]32)c1 ZINC000006971317 560748943 /nfs/dbraw/zinc/74/89/43/560748943.db2.gz TVJLOTKNPXJXGH-NVGCLXPQSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@@H]32)ccc1Cl ZINC000006971322 560749001 /nfs/dbraw/zinc/74/90/01/560749001.db2.gz WEVPXBSNJYPFKD-PRXAMGSTSA-N 0 0 405.679 5.837 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006971324 560749003 /nfs/dbraw/zinc/74/90/03/560749003.db2.gz KLYFCRCTRIKBNK-ZQIUZPCESA-N 0 0 405.133 6.038 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000006971341 560749020 /nfs/dbraw/zinc/74/90/20/560749020.db2.gz TVJLOTKNPXJXGH-XWCIJXRUSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@H]32)ccc1Cl ZINC000006971346 560748988 /nfs/dbraw/zinc/74/89/88/560748988.db2.gz WEVPXBSNJYPFKD-JKDFXYPNSA-N 0 0 405.679 5.837 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@H]32)cc1 ZINC000006971348 560749008 /nfs/dbraw/zinc/74/90/08/560749008.db2.gz KLYFCRCTRIKBNK-VBQJREDUSA-N 0 0 405.133 6.038 40 10 HKCBRN c1ccc(-c2nc3ccccc3n2/N=N/n2c3ccccc3nc2-c2ccccc2)cc1 ZINC000006982290 568466255 /nfs/dbraw/zinc/46/62/55/568466255.db2.gz PFYYQYPIMPREIC-QVIHXGFCSA-N 0 0 414.472 6.399 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@H]2C=CC[C@H]21 ZINC000007092806 560749744 /nfs/dbraw/zinc/74/97/44/560749744.db2.gz JGTGNIASKOASRP-XWCIJXRUSA-N 0 0 405.133 6.038 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@H]2C=CC[C@@H]21 ZINC000007093098 559246430 /nfs/dbraw/zinc/24/64/30/559246430.db2.gz JGTGNIASKOASRP-NVGCLXPQSA-N 0 0 405.133 6.038 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000007095993 569336775 /nfs/dbraw/zinc/33/67/75/569336775.db2.gz PSBDHIZEENHVBL-SLSDLSHTSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000007095998 569336786 /nfs/dbraw/zinc/33/67/86/569336786.db2.gz HYLMNKPWEILMND-SLSDLSHTSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000007096003 569336768 /nfs/dbraw/zinc/33/67/68/569336768.db2.gz SAEJRPUSFSFSHE-SLSDLSHTSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000007096014 569336791 /nfs/dbraw/zinc/33/67/91/569336791.db2.gz QETBCIRRLMCIDF-SLSDLSHTSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@@H]2C=CC[C@@H]21 ZINC000007096025 569336802 /nfs/dbraw/zinc/33/68/02/569336802.db2.gz OLJYNICISKGTFQ-OHUGHZGNSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@@H]2C=CC[C@@H]21 ZINC000007096034 569336783 /nfs/dbraw/zinc/33/67/83/569336783.db2.gz RNSCSHGUBZRHLT-OHUGHZGNSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000007096038 569336771 /nfs/dbraw/zinc/33/67/71/569336771.db2.gz PSBDHIZEENHVBL-RQTOMXEWSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000007096043 569336814 /nfs/dbraw/zinc/33/68/14/569336814.db2.gz HYLMNKPWEILMND-RQTOMXEWSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000007096048 569336769 /nfs/dbraw/zinc/33/67/69/569336769.db2.gz SAEJRPUSFSFSHE-RQTOMXEWSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000007096055 569336805 /nfs/dbraw/zinc/33/68/05/569336805.db2.gz QETBCIRRLMCIDF-RQTOMXEWSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@@H]2C=CC[C@H]21 ZINC000007096064 569336810 /nfs/dbraw/zinc/33/68/10/569336810.db2.gz OLJYNICISKGTFQ-UMEGOILYSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@@H]2C=CC[C@H]21 ZINC000007096075 569336770 /nfs/dbraw/zinc/33/67/70/569336770.db2.gz RNSCSHGUBZRHLT-UMEGOILYSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000007096078 569336787 /nfs/dbraw/zinc/33/67/87/569336787.db2.gz PSBDHIZEENHVBL-HWBMXIPRSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000007096080 569336797 /nfs/dbraw/zinc/33/67/97/569336797.db2.gz HYLMNKPWEILMND-HWBMXIPRSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000007096084 569336762 /nfs/dbraw/zinc/33/67/62/569336762.db2.gz SAEJRPUSFSFSHE-HWBMXIPRSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000007096093 569336863 /nfs/dbraw/zinc/33/68/63/569336863.db2.gz QETBCIRRLMCIDF-HWBMXIPRSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@H]2C=CC[C@@H]21 ZINC000007096102 569336845 /nfs/dbraw/zinc/33/68/45/569336845.db2.gz OLJYNICISKGTFQ-ZYLNGJIFSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@H]2C=CC[C@@H]21 ZINC000007096108 569336837 /nfs/dbraw/zinc/33/68/37/569336837.db2.gz RNSCSHGUBZRHLT-ZYLNGJIFSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000007096112 569336860 /nfs/dbraw/zinc/33/68/60/569336860.db2.gz PSBDHIZEENHVBL-FBLLAGFSSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000007096119 569336833 /nfs/dbraw/zinc/33/68/33/569336833.db2.gz HYLMNKPWEILMND-FBLLAGFSSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@H]32)c1 ZINC000007096127 569336842 /nfs/dbraw/zinc/33/68/42/569336842.db2.gz SAEJRPUSFSFSHE-FBLLAGFSSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(CSc4ccccc4)cc3[C@H]3C=CC[C@H]32)c1 ZINC000007096138 569336821 /nfs/dbraw/zinc/33/68/21/569336821.db2.gz QETBCIRRLMCIDF-FBLLAGFSSA-N 0 0 414.530 6.714 40 10 HKCBRN Clc1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@H]2C=CC[C@H]21 ZINC000007096149 569336864 /nfs/dbraw/zinc/33/68/64/569336864.db2.gz OLJYNICISKGTFQ-WZOHSFFVSA-N 0 0 403.978 7.459 40 10 HKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2ccc(CSc3ccccc3)cc2[C@H]2C=CC[C@H]21 ZINC000007096158 557735046 /nfs/dbraw/zinc/73/50/46/557735046.db2.gz RNSCSHGUBZRHLT-WZOHSFFVSA-N 0 0 414.530 6.714 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000007096670 560749757 /nfs/dbraw/zinc/74/97/57/560749757.db2.gz UTSYBTNUMCOWEQ-YDIMBITNSA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000007096686 569336824 /nfs/dbraw/zinc/33/68/24/569336824.db2.gz VGZHEOKJWIRQQQ-IMWIBFENSA-N 0 0 402.881 6.742 40 10 HKCBRN Brc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000007096691 560749767 /nfs/dbraw/zinc/74/97/67/560749767.db2.gz WQHYDXHDMTWESQ-DPLHUUCSSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000007096727 560749752 /nfs/dbraw/zinc/74/97/52/560749752.db2.gz KLQBNLNRIHAPJP-DPLHUUCSSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@@H]2C=CC[C@@H]21 ZINC000007096790 569336834 /nfs/dbraw/zinc/33/68/34/569336834.db2.gz OFURWXPYPOORIS-YDIMBITNSA-N 0 0 402.335 6.943 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000007096850 569336868 /nfs/dbraw/zinc/33/68/68/569336868.db2.gz UTSYBTNUMCOWEQ-KHCICDEESA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000007096864 569336825 /nfs/dbraw/zinc/33/68/25/569336825.db2.gz VGZHEOKJWIRQQQ-IECBHUPTSA-N 0 0 402.881 6.742 40 10 HKCBRN Brc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000007096868 569336843 /nfs/dbraw/zinc/33/68/43/569336843.db2.gz WQHYDXHDMTWESQ-LGVFNWMJSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000007096916 569336867 /nfs/dbraw/zinc/33/68/67/569336867.db2.gz KLQBNLNRIHAPJP-LGVFNWMJSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@@H]2C=CC[C@H]21 ZINC000007096965 569336828 /nfs/dbraw/zinc/33/68/28/569336828.db2.gz OFURWXPYPOORIS-KHCICDEESA-N 0 0 402.335 6.943 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000007097025 569336859 /nfs/dbraw/zinc/33/68/59/569336859.db2.gz UTSYBTNUMCOWEQ-AXHZCLLHSA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@@H]32)ccc1Cl ZINC000007097040 560749769 /nfs/dbraw/zinc/74/97/69/560749769.db2.gz VGZHEOKJWIRQQQ-JXQFQVJHSA-N 0 0 402.881 6.742 40 10 HKCBRN Brc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000007097048 569336850 /nfs/dbraw/zinc/33/68/50/569336850.db2.gz WQHYDXHDMTWESQ-HFMPRLQTSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000007097084 569336847 /nfs/dbraw/zinc/33/68/47/569336847.db2.gz KLQBNLNRIHAPJP-HFMPRLQTSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@H]2C=CC[C@@H]21 ZINC000007097125 569336844 /nfs/dbraw/zinc/33/68/44/569336844.db2.gz OFURWXPYPOORIS-AXHZCLLHSA-N 0 0 402.335 6.943 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@H]32)c1 ZINC000007097183 569336846 /nfs/dbraw/zinc/33/68/46/569336846.db2.gz UTSYBTNUMCOWEQ-XLNZFTOWSA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@H]32)ccc1Cl ZINC000007097201 569336823 /nfs/dbraw/zinc/33/68/23/569336823.db2.gz VGZHEOKJWIRQQQ-GLDPYIMESA-N 0 0 402.881 6.742 40 10 HKCBRN Brc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000007097208 569336849 /nfs/dbraw/zinc/33/68/49/569336849.db2.gz WQHYDXHDMTWESQ-IMSXRSKXSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@H]32)c1 ZINC000007097241 569336829 /nfs/dbraw/zinc/33/68/29/569336829.db2.gz KLQBNLNRIHAPJP-IMSXRSKXSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@H]2C=CC[C@H]21 ZINC000007097287 569336835 /nfs/dbraw/zinc/33/68/35/569336835.db2.gz OFURWXPYPOORIS-XLNZFTOWSA-N 0 0 402.335 6.943 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@@H]32)c1 ZINC000007097618 569336861 /nfs/dbraw/zinc/33/68/61/569336861.db2.gz ZGACXMVNYWOSNO-LJFZDNNRSA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@@H]32)ccc1Cl ZINC000007097628 557735052 /nfs/dbraw/zinc/73/50/52/557735052.db2.gz QYQDBLQEXUUZBO-YDHSSHFGSA-N 0 0 402.881 6.742 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000007097633 569336855 /nfs/dbraw/zinc/33/68/55/569336855.db2.gz LOHXGVJBQOWZHN-FUDKSRODSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@@H]32)c1 ZINC000007097648 569336851 /nfs/dbraw/zinc/33/68/51/569336851.db2.gz RJMQTSXJQCSXGU-FUDKSRODSA-N 0 0 402.335 6.943 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000007097698 569336820 /nfs/dbraw/zinc/33/68/20/569336820.db2.gz ZGACXMVNYWOSNO-DRMXPCRNSA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@H]32)ccc1Cl ZINC000007097709 569336826 /nfs/dbraw/zinc/33/68/26/569336826.db2.gz QYQDBLQEXUUZBO-YYDVJCTNSA-N 0 0 402.881 6.742 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@H]32)cc1 ZINC000007097713 569336866 /nfs/dbraw/zinc/33/68/66/569336866.db2.gz LOHXGVJBQOWZHN-XJUOHMSHSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000007097740 569336838 /nfs/dbraw/zinc/33/68/38/569336838.db2.gz RJMQTSXJQCSXGU-XJUOHMSHSA-N 0 0 402.335 6.943 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)ccc1OC(F)F ZINC000007166048 560749387 /nfs/dbraw/zinc/74/93/87/560749387.db2.gz PRMRPUHEPNMBSU-WJDWOHSUSA-N 0 0 407.463 5.093 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1OC ZINC000007261899 560750055 /nfs/dbraw/zinc/75/00/55/560750055.db2.gz YFADZGAIGMXWSJ-XMHGGMMESA-N 0 0 405.585 5.408 40 10 HKCBRN COc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4cccc(Cl)c4)o3)S2)cc1 ZINC000007275647 560750234 /nfs/dbraw/zinc/75/02/34/560750234.db2.gz DPUZUDFDNMSMOM-UNOMPAQXSA-N 0 0 410.882 5.691 40 10 HKCBRN CCc1cccc(CC)c1NC(=O)COC(=O)c1ccc(-n2c(C)ccc2C)cc1 ZINC000007378325 569337550 /nfs/dbraw/zinc/33/75/50/569337550.db2.gz VOCQIUQLYPVELU-UHFFFAOYSA-N 0 0 404.510 5.014 40 10 HKCBRN Cc1ccc(C)n1-c1cccc(C(=O)OCC(=O)Nc2ccc(Cl)c(Cl)c2)c1 ZINC000007378446 557740073 /nfs/dbraw/zinc/74/00/73/557740073.db2.gz LHOUNAPKOADEQG-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN Cc1ccc(C)n1-c1cccc(C(=O)OCC(=O)Nc2cc(Cl)ccc2Cl)c1 ZINC000007378523 569337534 /nfs/dbraw/zinc/33/75/34/569337534.db2.gz GWLVNDWWMBSNBU-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN Cc1ccc(C)n1-c1cccc(C(=O)OCC(=O)Nc2cccc(Cl)c2Cl)c1 ZINC000007378725 569337513 /nfs/dbraw/zinc/33/75/13/569337513.db2.gz FXXVTUZDDYRRJX-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN CCc1cccc(CC)c1NC(=O)COC(=O)c1cccc(-n2c(C)ccc2C)c1 ZINC000007378993 557740115 /nfs/dbraw/zinc/74/01/15/557740115.db2.gz FDNWQPNOCLOBMS-UHFFFAOYSA-N 0 0 404.510 5.014 40 10 HKCBRN Cc1ccc(C)n1-c1cccc(C(=O)OCC(=O)Nc2ccc(Cl)cc2Cl)c1 ZINC000007467967 569337613 /nfs/dbraw/zinc/33/76/13/569337613.db2.gz HRIMENCNXCROIY-UHFFFAOYSA-N 0 0 417.292 5.196 40 10 HKCBRN Nc1ccc(NC(=O)c2ccccc2C(=O)N(c2ccccc2)c2ccccc2)cc1 ZINC000007468406 569337558 /nfs/dbraw/zinc/33/75/58/569337558.db2.gz ITLUPHDESDYEHB-UHFFFAOYSA-N 0 0 407.473 5.500 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000008092237 569339545 /nfs/dbraw/zinc/33/95/45/569339545.db2.gz CEWQOAQJWBYQCX-SOZUMNATSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000008092242 569339563 /nfs/dbraw/zinc/33/95/63/569339563.db2.gz CNVZCLZYBYIMIE-FTLABTOESA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000008092245 569339538 /nfs/dbraw/zinc/33/95/38/569339538.db2.gz XOQFLVXELCSIFR-LIBAHTEVSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000008092250 569339541 /nfs/dbraw/zinc/33/95/41/569339541.db2.gz CEWQOAQJWBYQCX-FMTVUPSXSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000008092255 569339547 /nfs/dbraw/zinc/33/95/47/569339547.db2.gz CNVZCLZYBYIMIE-SEDUGSJDSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000008092258 569339514 /nfs/dbraw/zinc/33/95/14/569339514.db2.gz XOQFLVXELCSIFR-PJYBLOJUSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@H]3C=CC[C@H]32)cc1 ZINC000008101588 569339528 /nfs/dbraw/zinc/33/95/28/569339528.db2.gz OEGUCIMKOUDTTM-IYOUNJFTSA-N 0 0 407.819 5.972 40 10 HKCBRN COC(=O)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@H]3C=CC[C@@H]32)cc1 ZINC000008101633 569339521 /nfs/dbraw/zinc/33/95/21/569339521.db2.gz OEGUCIMKOUDTTM-DEYYWGMASA-N 0 0 407.819 5.972 40 10 HKCBRN COc1cccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@H]3C=CC[C@H]32)c1OC ZINC000008168980 569339833 /nfs/dbraw/zinc/33/98/33/569339833.db2.gz QFPSIJRLMMMUTL-VNBZBWLYSA-N 0 0 409.835 6.203 40 10 HKCBRN COc1cccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@H]3C=CC[C@@H]32)c1OC ZINC000008168993 569339806 /nfs/dbraw/zinc/33/98/06/569339806.db2.gz QFPSIJRLMMMUTL-OAVHHTNSSA-N 0 0 409.835 6.203 40 10 HKCBRN CCOc1cc(C=C2SC(Nc3ccc(Cl)c(Cl)c3)=NC2=O)ccc1O ZINC000008254218 560753537 /nfs/dbraw/zinc/75/35/37/560753537.db2.gz FBVASBANZXUSPD-LZYBPNLTSA-N 0 0 409.294 5.180 40 10 HKCBRN COc1cc(C)c(C[C@H]2SC(=S)N(CCc3ccccc3)C2=O)cc1C(C)C ZINC000008333861 569340108 /nfs/dbraw/zinc/34/01/08/569340108.db2.gz OAFQGIBYPZYFAW-OAQYLSRUSA-N 0 0 413.608 5.141 40 10 HKCBRN COc1cc(C)c(C[C@@H]2SC(=S)N(CCc3ccccc3)C2=O)cc1C(C)C ZINC000008333890 569340074 /nfs/dbraw/zinc/34/00/74/569340074.db2.gz OAFQGIBYPZYFAW-NRFANRHFSA-N 0 0 413.608 5.141 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc(Cl)cc2[C@H]2C=CC[C@@H]21 ZINC000008336109 569340098 /nfs/dbraw/zinc/34/00/98/569340098.db2.gz RSKCYQDLZYNWOI-AUSJPIAWSA-N 0 0 404.735 6.246 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc(Cl)cc2[C@H]2C=CC[C@H]21 ZINC000008336139 569340103 /nfs/dbraw/zinc/34/01/03/569340103.db2.gz RSKCYQDLZYNWOI-BXTJHSDWSA-N 0 0 404.735 6.246 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)S2)cc1 ZINC000008411969 560754728 /nfs/dbraw/zinc/75/47/28/560754728.db2.gz JYALXDNFLVPKDI-UNOMPAQXSA-N 0 0 405.435 5.246 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)S2)cc1 ZINC000008411970 560754716 /nfs/dbraw/zinc/75/47/16/560754716.db2.gz OXNQODDWVLGEPU-UNOMPAQXSA-N 0 0 405.435 5.246 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)S2)cc1 ZINC000008411975 560754755 /nfs/dbraw/zinc/75/47/55/560754755.db2.gz DWCIXVOCOPEFOL-UNOMPAQXSA-N 0 0 405.435 5.246 40 10 HKCBRN O=C1N=C(Nc2ccc3ccccc3c2)SC1=Cc1ccc(Br)cc1 ZINC000008436706 557789175 /nfs/dbraw/zinc/78/91/75/557789175.db2.gz SWXGDAFIZJZHTA-WQRHYEAKSA-N 0 0 409.308 5.685 40 10 HKCBRN COc1ccc(OC)c(C=C2SC(Nc3ccc(Cl)c(Cl)c3)=NC2=O)c1 ZINC000008472727 560754730 /nfs/dbraw/zinc/75/47/30/560754730.db2.gz YXJFVGLRRUTVNC-LZYBPNLTSA-N 0 0 409.294 5.093 40 10 HKCBRN COc1ccc(C=C2SC(Nc3ccc(Cl)c(Cl)c3)=NC2=O)c(OC)c1 ZINC000008473014 560754766 /nfs/dbraw/zinc/75/47/66/560754766.db2.gz RVXAXIZSVJPPAY-FRKPEAEDSA-N 0 0 409.294 5.093 40 10 HKCBRN COc1ccc(C=C2SC(Nc3ccc(Cl)c(Cl)c3)=NC2=O)cc1OC ZINC000008493336 560754960 /nfs/dbraw/zinc/75/49/60/560754960.db2.gz QNFRPZPQQUZREU-LZYBPNLTSA-N 0 0 409.294 5.093 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@@H]2N1C(=O)/C(=C\c2cccs2)SC1=S ZINC000008615405 557796806 /nfs/dbraw/zinc/79/68/06/557796806.db2.gz IARZUOKHXXVXTN-GQEMFKIVSA-N 0 0 421.568 6.153 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@H]2N1C(=O)/C(=C\c2cccs2)SC1=S ZINC000008615406 557796933 /nfs/dbraw/zinc/79/69/33/557796933.db2.gz IARZUOKHXXVXTN-TVNWYLLRSA-N 0 0 421.568 6.153 40 10 HKCBRN Oc1c([C@H](Nc2ccccc2Br)c2ccccc2)ccc2cccnc21 ZINC000008617643 557797184 /nfs/dbraw/zinc/79/71/84/557797184.db2.gz ZTTCRWKPIONBEL-HXUWFJFHSA-N 0 0 405.295 5.904 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C\c1ccc(-c2ccc(Br)cc2)o1 ZINC000008656760 560755447 /nfs/dbraw/zinc/75/54/47/560755447.db2.gz LBLLUWUAVXFAHH-UYRXBGFRSA-N 0 0 407.267 5.515 40 10 HKCBRN O=C1N=C(Nc2ccc(Cl)cc2)SC1=Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000008819071 557810065 /nfs/dbraw/zinc/81/00/65/557810065.db2.gz RALVMAHGWLWXTJ-WOJGMQOQSA-N 0 0 415.301 6.336 40 10 HKCBRN Cc1ccccc1NC(=O)CCCCCN1C(=O)/C(=C/c2ccccc2)SC1=S ZINC000008819657 557810068 /nfs/dbraw/zinc/81/00/68/557810068.db2.gz GYAKGUFZPVHACU-SILNSSARSA-N 0 0 424.591 5.395 40 10 HKCBRN Cc1cccc(NC(=O)CCCCCN2C(=O)/C(=C/c3ccccc3)SC2=S)c1 ZINC000008819658 557810046 /nfs/dbraw/zinc/81/00/46/557810046.db2.gz NXTSYCULKHNSGV-SILNSSARSA-N 0 0 424.591 5.395 40 10 HKCBRN Cc1ccc(NC(=O)CCCCCN2C(=O)/C(=C/c3ccccc3)SC2=S)cc1 ZINC000008819659 557810070 /nfs/dbraw/zinc/81/00/70/557810070.db2.gz SINURXZOTUUIJM-SILNSSARSA-N 0 0 424.591 5.395 40 10 HKCBRN Cc1ccc(/C=C2\SC(=S)N(CCCCCC(=O)Nc3ccccc3)C2=O)cc1 ZINC000008819739 557810105 /nfs/dbraw/zinc/81/01/05/557810105.db2.gz PKYWXHHJRUGYJD-SILNSSARSA-N 0 0 424.591 5.395 40 10 HKCBRN Cc1cccc(NC(=O)CCN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)c1C ZINC000008820418 557810056 /nfs/dbraw/zinc/81/00/56/557810056.db2.gz DWIITMRJPYEVGR-KZBAPLJJSA-N 0 0 422.575 5.090 40 10 HKCBRN Cc1ccc(NC(=O)CCN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)c(C)c1 ZINC000008820419 557810060 /nfs/dbraw/zinc/81/00/60/557810060.db2.gz ZOVZPRJPSNXYBW-CRVGVPJFSA-N 0 0 422.575 5.090 40 10 HKCBRN CCN(CC)c1ccc(NC2=NC(=O)C(=Cc3ccc(Cl)cc3Cl)S2)cc1 ZINC000008821152 557810554 /nfs/dbraw/zinc/81/05/54/557810554.db2.gz HIYPHVQRTIHUAV-WQRHYEAKSA-N 0 0 420.365 5.922 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2\SC(=S)N(Cc3ccco3)C2=O)cc1 ZINC000008821261 557810541 /nfs/dbraw/zinc/81/05/41/557810541.db2.gz QVTZIEURXMPWOE-BKUYFWCQSA-N 0 0 421.543 5.568 40 10 HKCBRN Cc1ccc(COc2ccc(/C=C3\SC(=S)N(Cc4ccco4)C3=O)cc2)cc1 ZINC000008821341 557810519 /nfs/dbraw/zinc/81/05/19/557810519.db2.gz CBDHMDWGTDVMNZ-BKUYFWCQSA-N 0 0 421.543 5.568 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C\c2ccc(-c3ccc(Br)cc3)o2)SC1=S ZINC000008821463 557810547 /nfs/dbraw/zinc/81/05/47/557810547.db2.gz JJIPICZJWCZVGV-XNTDXEJSSA-N 0 0 422.369 5.709 40 10 HKCBRN CC(C)(C)N1C(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S ZINC000008821522 557810545 /nfs/dbraw/zinc/81/05/45/557810545.db2.gz HTBQTWZFPVXWPY-OQLLNIDSSA-N 0 0 422.915 5.508 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C\c3ccc(Br)o3)SC2=S)cc1 ZINC000008821555 557810508 /nfs/dbraw/zinc/81/05/08/557810508.db2.gz PPHTVBFHAMBYJL-RVDMUPIBSA-N 0 0 422.369 5.791 40 10 HKCBRN COc1ccc(CCN2C(=O)/C(=C/c3ccc(Cl)cc3Cl)SC2=S)cc1 ZINC000008821563 557810791 /nfs/dbraw/zinc/81/07/91/557810791.db2.gz OWUMARGMZIPTGH-YVLHZVERSA-N 0 0 424.374 5.446 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)SC2=S)cc1 ZINC000008821564 557810676 /nfs/dbraw/zinc/81/06/76/557810676.db2.gz IGBKJGMTRNUDLW-WQRHYEAKSA-N 0 0 422.402 6.742 40 10 HKCBRN COc1ccc(CCN2C(=O)/C(=C/c3c(Cl)cccc3Cl)SC2=S)cc1 ZINC000008821568 557810727 /nfs/dbraw/zinc/81/07/27/557810727.db2.gz WCMSVWWYTGBMAJ-BOPFTXTBSA-N 0 0 424.374 5.446 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3c(Cl)cccc3Cl)SC2=S)cc1 ZINC000008821569 557810701 /nfs/dbraw/zinc/81/07/01/557810701.db2.gz PVVLALHPZJHUCE-PDGQHHTCSA-N 0 0 422.402 6.742 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)S2)cc1 ZINC000008821846 557810781 /nfs/dbraw/zinc/81/07/81/557810781.db2.gz UKOHJLBYNHHOHV-DEDYPNTBSA-N 0 0 419.462 5.500 40 10 HKCBRN CCc1ccccc1NC1=NC(=O)C(=Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)S1 ZINC000008821848 557810778 /nfs/dbraw/zinc/81/07/78/557810778.db2.gz RXUBNQTZZGUQIE-DEDYPNTBSA-N 0 0 419.462 5.500 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)S2)cc1 ZINC000008821855 557810787 /nfs/dbraw/zinc/81/07/87/557810787.db2.gz AOZOJDFWRNOBAU-DEDYPNTBSA-N 0 0 419.462 5.500 40 10 HKCBRN CCc1ccccc1NC1=NC(=O)C(=Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)S1 ZINC000008821857 557810763 /nfs/dbraw/zinc/81/07/63/557810763.db2.gz IOYQFYLDXMXYJW-DEDYPNTBSA-N 0 0 419.462 5.500 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)S2)cc1 ZINC000008821864 557810743 /nfs/dbraw/zinc/81/07/43/557810743.db2.gz OKDGZJIOEMOLTP-DEDYPNTBSA-N 0 0 419.462 5.500 40 10 HKCBRN CCc1ccccc1NC1=NC(=O)C(=Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)S1 ZINC000008821866 557810681 /nfs/dbraw/zinc/81/06/81/557810681.db2.gz MKWLPHBFIDMLGV-DEDYPNTBSA-N 0 0 419.462 5.500 40 10 HKCBRN CC(=O)c1cccc(N2C(=O)C(=Cc3cccc(Br)c3)SC2=S)c1 ZINC000008828319 557811036 /nfs/dbraw/zinc/81/10/36/557811036.db2.gz GBNYHPNAVWLDKO-SXGWCWSVSA-N 0 0 418.337 5.058 40 10 HKCBRN CN1C(=O)/C(=C\c2ccc(C(=O)Nc3cccc(Cl)c3Cl)cc2)SC1=S ZINC000008870004 557812584 /nfs/dbraw/zinc/81/25/84/557812584.db2.gz FNIIDELHNIEDOI-NTEUORMPSA-N 0 0 423.346 5.077 40 10 HKCBRN CN1C(=O)/C(=C\c2ccc(C(=O)Nc3ccc(Cl)cc3Cl)cc2)SC1=S ZINC000008870005 557812535 /nfs/dbraw/zinc/81/25/35/557812535.db2.gz ZYMLWWMICRIUKP-OVCLIPMQSA-N 0 0 423.346 5.077 40 10 HKCBRN O=C1/C(=C/c2ccccc2)N=C(c2ccccc2)N1c1nc2cc(Cl)ccc2s1 ZINC000008894542 569390799 /nfs/dbraw/zinc/39/07/99/569390799.db2.gz TTYXTXIWLVPUHB-UYRXBGFRSA-N 0 0 415.905 5.784 40 10 HKCBRN O=C1/C(=C/c2ccco2)N=C(c2ccccc2)N1c1nc2cc(Cl)c(F)cc2s1 ZINC000008894567 557813440 /nfs/dbraw/zinc/81/34/40/557813440.db2.gz PXZCBLYMBGOZQM-MFOYZWKCSA-N 0 0 423.856 5.516 40 10 HKCBRN CN(C)c1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)cc3)SC2=S)cc1 ZINC000009188372 557825803 /nfs/dbraw/zinc/82/58/03/557825803.db2.gz RNQXJXKUOVQJPF-JWGURIENSA-N 0 0 416.571 5.825 40 10 HKCBRN CCCCN1C(=O)/C(=C\c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)SC1=S ZINC000009188384 557825823 /nfs/dbraw/zinc/82/58/23/557825823.db2.gz KVOKYFABKOHYCV-GHRIWEEISA-N 0 0 405.629 5.989 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2\SC(=S)N(c3ccccc3)C2=O)cc1 ZINC000009188431 557825871 /nfs/dbraw/zinc/82/58/71/557825871.db2.gz MRACKSYNTQBOBV-JCMHNJIXSA-N 0 0 417.555 5.980 40 10 HKCBRN O=C1/C(=C/c2ccccc2OCc2ccccc2)SC(=S)N1Cc1ccco1 ZINC000009188441 557825861 /nfs/dbraw/zinc/82/58/61/557825861.db2.gz ZYTLVYMBSUJXDW-MOSHPQCFSA-N 0 0 407.516 5.260 40 10 HKCBRN O=C1/C(=C/c2cccc(OCc3ccccc3)c2)SC(=S)N1Cc1ccco1 ZINC000009188443 557825853 /nfs/dbraw/zinc/82/58/53/557825853.db2.gz JPUXRIZNRLWZCR-MOSHPQCFSA-N 0 0 407.516 5.260 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C/c3ccccc3OCc3ccccc3)SC2=S)c1 ZINC000009188474 557825881 /nfs/dbraw/zinc/82/58/81/557825881.db2.gz BXFPRTLLLKJAJH-JCMHNJIXSA-N 0 0 417.555 5.980 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)cc3)SC2=S)cc1 ZINC000009188486 557825792 /nfs/dbraw/zinc/82/57/92/557825792.db2.gz XQJPSMMFTOHQEN-QNGOZBTKSA-N 0 0 403.528 5.768 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3ccccc3Br)SC2=S)cc1 ZINC000009188495 557826107 /nfs/dbraw/zinc/82/61/07/557826107.db2.gz KCZVAVGGECVRPK-WJDWOHSUSA-N 0 0 420.353 5.254 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)cc3)SC2=S)cc1 ZINC000009188500 557826046 /nfs/dbraw/zinc/82/60/46/557826046.db2.gz ILIPXJBRFMOYPM-JWGURIENSA-N 0 0 417.555 6.158 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3ccc(Cl)c(Cl)c3)SC2=S)cc1 ZINC000009188501 557826035 /nfs/dbraw/zinc/82/60/35/557826035.db2.gz JKBIPGBTOOELLV-YBEGLDIGSA-N 0 0 410.347 5.798 40 10 HKCBRN O=C1/C(=C/c2ccccc2Br)SC(=S)N1c1ccc(Cl)cc1 ZINC000009188512 557826105 /nfs/dbraw/zinc/82/61/05/557826105.db2.gz NVBOXAIKGJHWOO-ZROIWOOFSA-N 0 0 410.745 5.508 40 10 HKCBRN CCN(CC)c1ccc(/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000009188519 557826048 /nfs/dbraw/zinc/82/60/48/557826048.db2.gz JJAWWRCDTXNNKA-AQTBWJFISA-N 0 0 402.972 5.592 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccccc3)cc2)SC(=S)N1c1ccc(Cl)cc1 ZINC000009188520 557826099 /nfs/dbraw/zinc/82/60/99/557826099.db2.gz QANPYZZPSATKJH-ZHZULCJRSA-N 0 0 407.947 6.413 40 10 HKCBRN O=C1/C(=C/c2ccccc2OCc2ccccc2)SC(=S)N1c1ccc(F)cc1 ZINC000009188524 557826068 /nfs/dbraw/zinc/82/60/68/557826068.db2.gz MDNSGGYJNJJLOK-STZFKDTASA-N 0 0 421.518 5.811 40 10 HKCBRN O=C1/C(=C/c2ccc(OCc3ccccc3)cc2)SC(=S)N1c1ccc(F)cc1 ZINC000009188527 557826051 /nfs/dbraw/zinc/82/60/51/557826051.db2.gz WWLUKHNGOWMPGF-STZFKDTASA-N 0 0 421.518 5.811 40 10 HKCBRN O=C1/C(=C/c2cccc(OCc3ccccc3)c2)SC(=S)N1c1ccc(F)cc1 ZINC000009188536 557826041 /nfs/dbraw/zinc/82/60/41/557826041.db2.gz JGBYYALRORCQHZ-STZFKDTASA-N 0 0 421.518 5.811 40 10 HKCBRN CCOc1ccccc1/C=C1\SC(=S)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000009188537 557826085 /nfs/dbraw/zinc/82/60/85/557826085.db2.gz VVHJEBYQBAHFJB-SXGWCWSVSA-N 0 0 410.347 5.798 40 10 HKCBRN O=C1/C(=C/c2c(F)cccc2Cl)SC(=S)N1c1ccc(Cl)c(Cl)c1 ZINC000009188543 557826071 /nfs/dbraw/zinc/82/60/71/557826071.db2.gz FJWOLZUWKXIJOC-AUWJEWJLSA-N 0 0 418.729 6.192 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2)SC(=S)N1c1ccc(Cl)c(Cl)c1 ZINC000009188546 557826096 /nfs/dbraw/zinc/82/60/96/557826096.db2.gz ABTCBTWNPGXSHC-AUWJEWJLSA-N 0 0 400.739 6.053 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000009188549 557826039 /nfs/dbraw/zinc/82/60/39/557826039.db2.gz LQUZVUCYHBIPKN-SXGWCWSVSA-N 0 0 410.347 5.798 40 10 HKCBRN CC(C)c1ccc(/C=C2\SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000009188560 557826102 /nfs/dbraw/zinc/82/61/02/557826102.db2.gz OQRXYGQAIYRNPO-MFOYZWKCSA-N 0 0 408.375 6.523 40 10 HKCBRN CC(C)(C)c1ccc(/C=C2\SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000009188561 557826088 /nfs/dbraw/zinc/82/60/88/557826088.db2.gz SZCWWAROZPZNGB-YVLHZVERSA-N 0 0 422.402 6.697 40 10 HKCBRN CN(C)c1ccc(/C=C2\SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000009188562 557826033 /nfs/dbraw/zinc/82/60/33/557826033.db2.gz UHIBEQIXPRJIBR-SXGWCWSVSA-N 0 0 409.363 5.465 40 10 HKCBRN CC(C)c1ccc(/C=C2\SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000009188565 557826109 /nfs/dbraw/zinc/82/61/09/557826109.db2.gz YDFUVKZYVYXKKK-YVLHZVERSA-N 0 0 407.482 6.235 40 10 HKCBRN O=C1/C(=C/c2c(F)cccc2Cl)SC(=S)N1c1cccc(C(F)(F)F)c1 ZINC000009188567 557826079 /nfs/dbraw/zinc/82/60/79/557826079.db2.gz WJKHGMRDKMDDSB-ZSOIEALJSA-N 0 0 417.836 5.904 40 10 HKCBRN CCOc1ccccc1/C=C1\SC(=S)N(c2cccc(C(F)(F)F)c2)C1=O ZINC000009188577 557826059 /nfs/dbraw/zinc/82/60/59/557826059.db2.gz KZXCIDSAAFHPAT-YBEGLDIGSA-N 0 0 409.454 5.510 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)cc3)SC2=S)cc1C ZINC000009188590 557826028 /nfs/dbraw/zinc/82/60/28/557826028.db2.gz WEHBGHYCSLOLFZ-JCMHNJIXSA-N 0 0 401.556 6.376 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccccc3Br)SC2=S)c(C)c1 ZINC000009188602 557826091 /nfs/dbraw/zinc/82/60/91/557826091.db2.gz ZCMRUOHZPDYVBR-YBEGLDIGSA-N 0 0 404.354 5.472 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)cc3)SC2=S)c(C)c1 ZINC000009188611 557826062 /nfs/dbraw/zinc/82/60/62/557826062.db2.gz VOOGFRFTJSDWES-JCMHNJIXSA-N 0 0 401.556 6.376 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccccc3Br)SC2=S)cc1Cl ZINC000009188622 557826082 /nfs/dbraw/zinc/82/60/82/557826082.db2.gz JZQQQVIVGFCKDT-NVNXTCNLSA-N 0 0 424.772 5.817 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)SC2=S)cc1Cl ZINC000009188624 557826251 /nfs/dbraw/zinc/82/62/51/557826251.db2.gz VYACPEJVZBZXGR-UUASQNMZSA-N 0 0 414.766 6.361 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)c(Cl)c3)SC2=S)cc1Cl ZINC000009188625 557826296 /nfs/dbraw/zinc/82/62/96/557826296.db2.gz MOIPKKKZHBDDAE-CHHVJCJISA-N 0 0 414.766 6.361 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Br)cc3)SC2=S)cc1Cl ZINC000009188627 557826253 /nfs/dbraw/zinc/82/62/53/557826253.db2.gz KKNBRPKPILGDHZ-NVNXTCNLSA-N 0 0 424.772 5.817 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3ccc(C)c(Cl)c3)C2=O)cc1OC ZINC000009188631 557826282 /nfs/dbraw/zinc/82/62/82/557826282.db2.gz MGKAVKZDWYNJEH-ZDLGFXPLSA-N 0 0 419.955 5.462 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3ccc(C)c(Cl)c3)C2=O)cc1OC ZINC000009188634 557826260 /nfs/dbraw/zinc/82/62/60/557826260.db2.gz JRQIOAPNXXNQKU-MFOYZWKCSA-N 0 0 405.928 5.071 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3cccc(Br)c3)SC2=S)cc1Cl ZINC000009188637 557826262 /nfs/dbraw/zinc/82/62/62/557826262.db2.gz AFBAIWAGFOAEQN-NVNXTCNLSA-N 0 0 424.772 5.817 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(C(C)(C)C)cc3)SC2=S)cc1Cl ZINC000009188641 557826293 /nfs/dbraw/zinc/82/62/93/557826293.db2.gz RQKZEOWYHFOLLS-WQRHYEAKSA-N 0 0 401.984 6.352 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)cc3)SC2=S)cc1Cl ZINC000009188651 557826270 /nfs/dbraw/zinc/82/62/70/557826270.db2.gz BUWASFSOUGSTSF-BKUYFWCQSA-N 0 0 421.974 6.721 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccccc3)cc2)SC(=S)N1CCc1ccccc1 ZINC000009188663 557826299 /nfs/dbraw/zinc/82/62/99/557826299.db2.gz MBFXQKGFENOMNP-XLNRJJMWSA-N 0 0 401.556 5.798 40 10 HKCBRN C[C@@H](c1ccccc1)N1C(=O)/C(=C/c2ccccc2Br)SC1=S ZINC000009188696 557826240 /nfs/dbraw/zinc/82/62/40/557826240.db2.gz XCMSNWWXEISGMX-IEMQHYRPSA-N 0 0 404.354 5.412 40 10 HKCBRN C[C@H](c1ccccc1)N1C(=O)/C(=C/c2ccccc2Br)SC1=S ZINC000009188697 557826266 /nfs/dbraw/zinc/82/62/66/557826266.db2.gz XCMSNWWXEISGMX-COOUDCDJSA-N 0 0 404.354 5.412 40 10 HKCBRN CCc1ccc(N2C(=O)/C(=C/c3ccccc3Br)SC2=S)cc1 ZINC000009188785 557826430 /nfs/dbraw/zinc/82/64/30/557826430.db2.gz MHHPULHNZBZNDQ-WJDWOHSUSA-N 0 0 404.354 5.417 40 10 HKCBRN CCc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)cc3)SC2=S)cc1 ZINC000009188797 557826432 /nfs/dbraw/zinc/82/64/32/557826432.db2.gz ZZWCATBBGYGUOO-JWGURIENSA-N 0 0 401.556 6.322 40 10 HKCBRN Cc1ccc(/C=C2\SC(=S)N(c3ccc(Oc4ccccc4)cc3)C2=O)cc1 ZINC000009188807 557826442 /nfs/dbraw/zinc/82/64/42/557826442.db2.gz NVPSTIDDJNJBQJ-QNGOZBTKSA-N 0 0 403.528 6.193 40 10 HKCBRN CCc1ccc(/C=C2\SC(=S)N(c3ccc(Oc4ccccc4)cc3)C2=O)cc1 ZINC000009188808 557826421 /nfs/dbraw/zinc/82/64/21/557826421.db2.gz SBJNJLWASIZHJU-JWGURIENSA-N 0 0 417.555 6.447 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3ccc(Oc4ccccc4)cc3)C2=O)cc1 ZINC000009188811 557826428 /nfs/dbraw/zinc/82/64/28/557826428.db2.gz VMCSTSXOIOUTTR-QNGOZBTKSA-N 0 0 419.527 5.893 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2)SC(=S)N1c1ccc(Oc2ccccc2)cc1 ZINC000009188813 557826444 /nfs/dbraw/zinc/82/64/44/557826444.db2.gz QYDKTANITVNOLD-ZHZULCJRSA-N 0 0 423.946 6.538 40 10 HKCBRN O=C1/C(=C/c2ccc(F)cc2)SC(=S)N1c1ccc(Oc2ccccc2)cc1 ZINC000009188816 557826419 /nfs/dbraw/zinc/82/64/19/557826419.db2.gz QFJQKALCMWZHTO-ZHZULCJRSA-N 0 0 407.491 6.024 40 10 HKCBRN Cc1cccc(/C=C2\SC(=S)N(c3ccc(Oc4ccccc4)cc3)C2=O)c1 ZINC000009188817 557826422 /nfs/dbraw/zinc/82/64/22/557826422.db2.gz LIHQNXIKNOMVLO-QNGOZBTKSA-N 0 0 403.528 6.193 40 10 HKCBRN COc1ccccc1/C=C1\SC(=S)N(c2ccc(Oc3ccccc3)cc2)C1=O ZINC000009188826 557826413 /nfs/dbraw/zinc/82/64/13/557826413.db2.gz XFECHPHXYMADSQ-QNGOZBTKSA-N 0 0 419.527 5.893 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2\SC(N3CCCCCC3)=NC2=O)cc1 ZINC000009188857 557826459 /nfs/dbraw/zinc/82/64/59/557826459.db2.gz VNIVAMMMPJAQKG-JWGURIENSA-N 0 0 406.551 5.420 40 10 HKCBRN Cc1ccc(COc2cccc(/C=C3\SC(N4CCCCCC4)=NC3=O)c2)cc1 ZINC000009188860 557826440 /nfs/dbraw/zinc/82/64/40/557826440.db2.gz IGKJQFNBXBWDJN-JWGURIENSA-N 0 0 406.551 5.420 40 10 HKCBRN CC(C)(C)c1cc(/C=C2\SC(N3CCCCCC3)=NC2=O)cc(C(C)(C)C)c1O ZINC000009188865 557826438 /nfs/dbraw/zinc/82/64/38/557826438.db2.gz JEJXUMRVBOJZNY-CYVLTUHYSA-N 0 0 414.615 5.834 40 10 HKCBRN Cc1ccc(COc2cccc(/C=C3\SC(N4CCC(C)CC4)=NC3=O)c2)cc1 ZINC000009188870 557826426 /nfs/dbraw/zinc/82/64/26/557826426.db2.gz XZSNWOUAXVBGNO-JCMHNJIXSA-N 0 0 406.551 5.276 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2\SC(N3CCC(C)CC3)=NC2=O)cc1 ZINC000009188871 557826415 /nfs/dbraw/zinc/82/64/15/557826415.db2.gz RUQJFERYWWIURP-JCMHNJIXSA-N 0 0 406.551 5.276 40 10 HKCBRN CC1CCN(C2=NC(=O)/C(=C/c3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)S2)CC1 ZINC000009188878 557826424 /nfs/dbraw/zinc/82/64/24/557826424.db2.gz VFRUELPZDZZNAO-RGEXLXHISA-N 0 0 414.615 5.689 40 10 HKCBRN Cc1ccc(COc2ccc(/C=C3\SC(N4CCC(C)CC4)=NC3=O)cc2)cc1 ZINC000009188882 557826451 /nfs/dbraw/zinc/82/64/51/557826451.db2.gz DVGPCFVMJFMNDX-JCMHNJIXSA-N 0 0 406.551 5.276 40 10 HKCBRN CCOc1ccccc1/C=C1\SC(N2CCC(Cc3ccccc3)CC2)=NC1=O ZINC000009188919 557826462 /nfs/dbraw/zinc/82/64/62/557826462.db2.gz ONQDELDIZCWZLO-XLNRJJMWSA-N 0 0 406.551 5.010 40 10 HKCBRN CSc1ccc(/C=C2\SC(N3CCC(Cc4ccccc4)CC3)=NC2=O)cc1 ZINC000009188929 557826630 /nfs/dbraw/zinc/82/66/30/557826630.db2.gz SKJPHZVCSCAASQ-PGMHBOJBSA-N 0 0 408.592 5.334 40 10 HKCBRN O=C1/C(=C/c2cccc(OCc3ccccc3)c2)SC(=S)N1C1CCCCC1 ZINC000009189193 557826664 /nfs/dbraw/zinc/82/66/64/557826664.db2.gz ZKOAYNQAVSYRPU-QNGOZBTKSA-N 0 0 409.576 5.800 40 10 HKCBRN Cc1ccc(COc2cccc(/C=C3\SC(=S)N(C4CCCCC4)C3=O)c2)cc1 ZINC000009189194 557826622 /nfs/dbraw/zinc/82/66/22/557826622.db2.gz QKZZHUOKRIRKHQ-JCMHNJIXSA-N 0 0 423.603 6.108 40 10 HKCBRN O=C1/C(=C/c2ccccc2OCc2ccccc2)SC(=S)N1C1CCCCC1 ZINC000009189195 557826662 /nfs/dbraw/zinc/82/66/62/557826662.db2.gz HVPJFGFESLVWQP-QNGOZBTKSA-N 0 0 409.576 5.800 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2\SC(=S)N(C3CCCCC3)C2=O)cc1 ZINC000009189196 557826674 /nfs/dbraw/zinc/82/66/74/557826674.db2.gz XXJGKBMTHIZFGL-JCMHNJIXSA-N 0 0 423.603 6.108 40 10 HKCBRN Cc1ccc(COc2ccc(/C=C3\SC(=S)N(C4CCCCC4)C3=O)cc2)cc1 ZINC000009189202 557826632 /nfs/dbraw/zinc/82/66/32/557826632.db2.gz MACFGOOEJUKOMA-JCMHNJIXSA-N 0 0 423.603 6.108 40 10 HKCBRN COCCCN1C(=O)/C(=C/c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)SC1=S ZINC000009189312 557826668 /nfs/dbraw/zinc/82/66/68/557826668.db2.gz MVJPOIQSPSAPOE-LGMDPLHJSA-N 0 0 421.628 5.225 40 10 HKCBRN O=C1/C(=C\c2c(Cl)cccc2Cl)SC(=S)N1c1ccc(F)c(Cl)c1 ZINC000009232307 557830769 /nfs/dbraw/zinc/83/07/69/557830769.db2.gz ATKBNSXCEOASEW-VGOFMYFVSA-N 0 0 418.729 6.192 40 10 HKCBRN O=C1/C(=C\c2c(F)cccc2Cl)SC(=S)N1c1ccc(F)c(Cl)c1 ZINC000009232312 557830822 /nfs/dbraw/zinc/83/08/22/557830822.db2.gz YNHNMHUESAPDDS-VGOFMYFVSA-N 0 0 402.274 5.677 40 10 HKCBRN CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCc1ccc2ccccc2c1 ZINC000009233791 557831014 /nfs/dbraw/zinc/83/10/14/557831014.db2.gz VPPQLHSLMLPODN-FYJGNVAPSA-N 0 0 421.543 5.306 40 10 HKCBRN Cc1ccc(C2=C/C(=C/c3cn(Cc4cccc(C)c4)c4ccccc34)C(=O)O2)cc1 ZINC000009262202 557833361 /nfs/dbraw/zinc/83/33/61/557833361.db2.gz QKRXJSWJXAPIRP-HAHDFKILSA-N 0 0 405.497 6.288 40 10 HKCBRN COc1ccc(CN2C(=O)/C(=C\c3ccc(C(F)(F)F)cc3)SC2=S)cc1 ZINC000009295636 560757955 /nfs/dbraw/zinc/75/79/55/560757955.db2.gz ADPTWMYNJFNRSE-MHWRWJLKSA-N 0 0 409.454 5.115 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(C)C2=O)ccc1OCc1ccc(Cl)cc1 ZINC000009296468 560757974 /nfs/dbraw/zinc/75/79/74/560757974.db2.gz WEQRHRNSFZGUOI-WOJGMQOQSA-N 0 0 419.955 5.149 40 10 HKCBRN CC(C)(C)c1ccc(/C=C2/SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000009310294 557836141 /nfs/dbraw/zinc/83/61/41/557836141.db2.gz QJUJXTUBSYXZJY-GZTJUZNOSA-N 0 0 421.509 6.409 40 10 HKCBRN O=C1/C(=C\c2c3ccccc3cc3ccccc32)SC(=S)N1c1ccc(F)cc1 ZINC000009310323 560758501 /nfs/dbraw/zinc/75/85/01/560758501.db2.gz AHRPISANOLAELU-HYARGMPZSA-N 0 0 415.514 6.538 40 10 HKCBRN O=C1NC(=S)S/C1=C/c1cn(Cc2c(Cl)cccc2Cl)c2ccccc12 ZINC000009310474 557836175 /nfs/dbraw/zinc/83/61/75/557836175.db2.gz ROHIPGIFRVDPOP-CAOOACKPSA-N 0 0 419.358 5.485 40 10 HKCBRN CN1C(=O)/C(=C/c2ccc(OCCCOc3ccc(Cl)cc3)cc2)SC1=S ZINC000009762303 557849543 /nfs/dbraw/zinc/84/95/43/557849543.db2.gz MOYICVYUXKIOML-AQTBWJFISA-N 0 0 419.955 5.019 40 10 HKCBRN COc1cc([C@H]2Nc3c(F)cc(F)cc3[C@H]3C=CC[C@H]32)cc(Br)c1OC ZINC000009763612 569394059 /nfs/dbraw/zinc/39/40/59/569394059.db2.gz FTQLDMVTJMBLFI-VEVIJQCQSA-N 0 0 422.269 5.571 40 10 HKCBRN O=C(NCc1ccc(N2CCCCC2)cc1)c1ccc(CSc2ccccc2)cc1 ZINC000010113079 132345207 /nfs/dbraw/zinc/34/52/07/132345207.db2.gz SUCOIFBORQNZTG-UHFFFAOYSA-N 0 0 416.590 5.899 40 10 HKCBRN O=C(CSCc1c(Cl)cccc1Cl)NCc1ccc(N2CCCCC2)cc1 ZINC000010113096 560764284 /nfs/dbraw/zinc/76/42/84/560764284.db2.gz WWPURCVMYADZRH-UHFFFAOYSA-N 0 0 423.409 5.533 40 10 HKCBRN O=C(CSCc1c(F)cccc1Cl)NCc1ccc(N2CCCCC2)cc1 ZINC000010113102 557855874 /nfs/dbraw/zinc/85/58/74/557855874.db2.gz OGIAKAKAGRDUFK-UHFFFAOYSA-N 0 0 406.954 5.019 40 10 HKCBRN O=C(NCc1ccc(N2CCCCC2)cc1)c1ccccc1SCc1ccccc1 ZINC000010113238 560764269 /nfs/dbraw/zinc/76/42/69/560764269.db2.gz RSMDVMBPPLUICS-UHFFFAOYSA-N 0 0 416.590 5.899 40 10 HKCBRN O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(CSc2ccccc2)cc1 ZINC000010113489 560764252 /nfs/dbraw/zinc/76/42/52/560764252.db2.gz IYECDSHSOAZXAF-UHFFFAOYSA-N 0 0 402.563 5.509 40 10 HKCBRN Cc1ccc(SCc2ccc(C(=O)NCc3ccc(N4CCCC4)cc3)cc2)cc1 ZINC000010113511 560764291 /nfs/dbraw/zinc/76/42/91/560764291.db2.gz AEGMEZQMDQMULJ-UHFFFAOYSA-N 0 0 416.590 5.818 40 10 HKCBRN CCN(CC)C(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000011859520 560775358 /nfs/dbraw/zinc/77/53/58/560775358.db2.gz SSWHUEHHYRFWSO-JKSBSHDWSA-N 0 0 415.364 6.302 40 10 HKCBRN CCN(CC)C(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000011859521 560775301 /nfs/dbraw/zinc/77/53/01/560775301.db2.gz SSWHUEHHYRFWSO-HOIFWPIMSA-N 0 0 415.364 6.302 40 10 HKCBRN CC1=NN(c2cc(Cl)ccc2Cl)C(=O)/C1=C/c1cccc(Oc2ccccc2)c1 ZINC000012042501 569399396 /nfs/dbraw/zinc/39/93/96/569399396.db2.gz YLSVGZIWBLYTHI-DEDYPNTBSA-N 0 0 423.299 6.592 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/C(Cl)=C/c3ccc([N+](=O)[O-])cc3)SC2=S)cc1 ZINC000012123073 558331014 /nfs/dbraw/zinc/33/10/14/558331014.db2.gz UMPZWLRZMXVDBQ-HRBPJWPPSA-N 0 0 416.911 5.432 40 10 HKCBRN CC(=O)c1cccc(N2C(=O)C(=Cc3ccc(Br)cc3)SC2=S)c1 ZINC000012273941 558363412 /nfs/dbraw/zinc/36/34/12/558363412.db2.gz WFURBDZEXHXVAO-SXGWCWSVSA-N 0 0 418.337 5.058 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/C(Cl)=C/c3ccccc3)SC2=S)c(OC)c1 ZINC000012273942 558363483 /nfs/dbraw/zinc/36/34/83/558363483.db2.gz IOYMYLBMECPPHH-LQHTZKGQSA-N 0 0 417.939 5.232 40 10 HKCBRN O=C1/C(=C/C=C/c2ccco2)SC(=S)N1c1ccc(Cl)c(C(F)(F)F)c1 ZINC000012273954 558363485 /nfs/dbraw/zinc/36/34/85/558363485.db2.gz CIEINYONZLXQMN-NQDFZQDQSA-N 0 0 415.845 5.914 40 10 HKCBRN Cc1ccc(NC(=O)CCN2C(=O)/C(=C/C=C/c3ccccc3)SC2=S)cc1C ZINC000012278485 558364720 /nfs/dbraw/zinc/36/47/20/558364720.db2.gz VHKNZBVUSJMOIE-CRVGVPJFSA-N 0 0 422.575 5.090 40 10 HKCBRN CCc1ccccc1NC(=O)CCN1C(=O)/C(=C/C=C/c2ccccc2)SC1=S ZINC000012278487 558364678 /nfs/dbraw/zinc/36/46/78/558364678.db2.gz HHJJABMEGROKMS-LXBAEQJTSA-N 0 0 422.575 5.035 40 10 HKCBRN O=C(Nc1ccc(Cl)cc1)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1CN3C[C@@H]1CC=C[C@H]21 ZINC000012374594 132359235 /nfs/dbraw/zinc/35/92/35/132359235.db2.gz GABJEMYOCSTNBS-GQSCTRQFSA-N 0 0 402.925 5.745 40 10 HKCBRN C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000012385128 558393962 /nfs/dbraw/zinc/39/39/62/558393962.db2.gz DQXWFOCJQYKYMF-OEZJKNOUSA-N 0 0 406.957 6.181 40 10 HKCBRN C[C@@H]1CCCCN1C(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000012385129 558393938 /nfs/dbraw/zinc/39/39/38/558393938.db2.gz DQXWFOCJQYKYMF-ARKGGFPYSA-N 0 0 406.957 6.181 40 10 HKCBRN C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 ZINC000012385131 560780051 /nfs/dbraw/zinc/78/00/51/560780051.db2.gz KOLACZLVBICEFL-GGWAELBDSA-N 0 0 417.509 5.436 40 10 HKCBRN C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc([N+](=O)[O-])c1)N2 ZINC000012385133 558394192 /nfs/dbraw/zinc/39/41/92/558394192.db2.gz KOLACZLVBICEFL-WPIDTTEISA-N 0 0 417.509 5.436 40 10 HKCBRN COc1cc([C@H]2Nc3c(F)cc(F)cc3[C@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000012418439 569401114 /nfs/dbraw/zinc/40/11/14/569401114.db2.gz FTQLDMVTJMBLFI-ZJNRKIDTSA-N 0 0 422.269 5.571 40 10 HKCBRN COc1cc([C@H]2Nc3c(F)cc(F)cc3[C@@H]3C=CC[C@H]32)cc(Br)c1OC ZINC000012418442 560780578 /nfs/dbraw/zinc/78/05/78/560780578.db2.gz FTQLDMVTJMBLFI-SNUQEOBHSA-N 0 0 422.269 5.571 40 10 HKCBRN COc1cc([C@H]2Nc3c(F)cc(F)cc3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000012418444 558402753 /nfs/dbraw/zinc/40/27/53/558402753.db2.gz FTQLDMVTJMBLFI-FHSNZYRGSA-N 0 0 422.269 5.571 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C(=O)O2)cc1 ZINC000012420478 560780525 /nfs/dbraw/zinc/78/05/25/560780525.db2.gz UYZWLWSQCVGJEF-GXDHUFHOSA-N 0 0 423.808 5.498 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@H]3CCCC[C@@]3(O)CCN2C(=O)c2cccs2)cc1 ZINC000013140421 560802419 /nfs/dbraw/zinc/80/24/19/560802419.db2.gz XFGYWZZFLOUEQF-JCTONOIOSA-N 0 0 412.599 5.103 40 10 HKCBRN Oc1c([C@@H](Nc2ccccc2Br)c2ccccc2)ccc2cccnc21 ZINC000013207208 558525443 /nfs/dbraw/zinc/52/54/43/558525443.db2.gz ZTTCRWKPIONBEL-FQEVSTJZSA-N 0 0 405.295 5.904 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cccn3-c3ccc4ccccc4c3)C2=N)S1 ZINC000013280942 569254688 /nfs/dbraw/zinc/25/46/88/569254688.db2.gz HZHAZMCNVLHOPF-ANDFITQPSA-N 0 0 413.506 5.050 40 10 HKCBRN CCCCC1=NN2C(=NC(=O)/C(=C\c3cccn3-c3ccc(C(C)C)cc3)C2=N)S1 ZINC000013280970 569254676 /nfs/dbraw/zinc/25/46/76/569254676.db2.gz JOGKUJPGYJMYOV-ANDFITQPSA-N 0 0 419.554 5.410 40 10 HKCBRN CCCCCC1=NN2C(=NC(=O)/C(=C\c3cccn3-c3ccc(C)c(C)c3)C2=N)S1 ZINC000013280976 569254645 /nfs/dbraw/zinc/25/46/45/569254645.db2.gz RZSUFLJHBGBBCJ-ANDFITQPSA-N 0 0 419.554 5.294 40 10 HKCBRN CCOc1cc(/C=C2/C=C(c3ccc(C)cc3)OC2=O)ccc1OCc1ccccc1 ZINC000013371322 560806058 /nfs/dbraw/zinc/80/60/58/560806058.db2.gz CWGNKHXVQMCURJ-HAHDFKILSA-N 0 0 412.485 5.954 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2ccc([N+](=O)[O-])cc2[C@@H]2C=CC[C@H]21 ZINC000013389146 560806215 /nfs/dbraw/zinc/80/62/15/560806215.db2.gz FVAPGMNLQMHFFK-PJIJBLCYSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@H]32)cc(OC)c1OC ZINC000013389217 560806158 /nfs/dbraw/zinc/80/61/58/560806158.db2.gz VSSFMNHIUGMXMU-LPMFXHHGSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@H]32)cc(OC)c1OC ZINC000013389279 560806203 /nfs/dbraw/zinc/80/62/03/560806203.db2.gz PXIYOTCBALVQRI-VPZZIHKRSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1ccccc1[C@@H]1Nc2ccc(I)cc2[C@@H]2C=CC[C@H]21 ZINC000013389312 560806182 /nfs/dbraw/zinc/80/61/82/560806182.db2.gz NUAVAFAHUHNVNE-PJIJBLCYSA-N 0 0 403.263 5.126 40 10 HKCBRN O=C(Nc1cccc(/N=N/c2cccc(NC(=O)c3ccccc3)c2)c1)c1ccccc1 ZINC000013403719 558531717 /nfs/dbraw/zinc/53/17/17/558531717.db2.gz WZUYESRIGAZGNI-QVIHXGFCSA-N 0 0 420.472 6.607 40 10 HKCBRN O=C(Oc1cccc(/N=N/c2cccc(OC(=O)c3ccccc3)c2)c1)c1ccccc1 ZINC000013403751 558531727 /nfs/dbraw/zinc/53/17/27/558531727.db2.gz FCTSSWFCZGVIME-BYYHNAKLSA-N 0 0 422.440 6.540 40 10 HKCBRN O=C1C=CC(=NNc2ccccc2)C(N=NC2=CC(=O)C=CC2=NNc2ccccc2)=C1 ZINC000013403781 558531703 /nfs/dbraw/zinc/53/17/03/558531703.db2.gz VASNUSURBQADNP-COROVXQKSA-N 0 0 422.448 8.344 40 10 HKCBRN O=C1/C(=C\c2ccc(Br)cc2)C=C(c2ccccc2)N1c1cccnc1 ZINC000013546856 558538099 /nfs/dbraw/zinc/53/80/99/558538099.db2.gz FIXRKJFLAMFVTB-AQTBWJFISA-N 0 0 403.279 5.315 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccccc3)cc2)SC(=S)N1CCOc1ccccc1 ZINC000013547160 558538082 /nfs/dbraw/zinc/53/80/82/558538082.db2.gz QBEKRKZVKCXRGR-XLNRJJMWSA-N 0 0 417.555 5.634 40 10 HKCBRN O=C1/C(=C/c2ccc(OCc3ccc(F)cc3)cc2)SC(=S)N1c1ccccc1 ZINC000013547354 558538320 /nfs/dbraw/zinc/53/83/20/558538320.db2.gz QCMRSOZFOXIOES-STZFKDTASA-N 0 0 421.518 5.811 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)c(Cl)c2)SC(=S)N1CCOc1ccccc1 ZINC000013547376 558538301 /nfs/dbraw/zinc/53/83/01/558538301.db2.gz FLKFFYXBGBRIAO-WJDWOHSUSA-N 0 0 410.347 5.274 40 10 HKCBRN CC(C)(C)c1cc(/C=C2\SC(N3CCCCC3)=NC2=O)cc(C(C)(C)C)c1O ZINC000013547661 558538329 /nfs/dbraw/zinc/53/83/29/558538329.db2.gz YKSSUSQTCFWAOM-JXAWBTAJSA-N 0 0 400.588 5.443 40 10 HKCBRN Cc1[nH]c2ccccc2c1C(=O)CSc1nnc(-c2ccco2)c(-c2ccco2)n1 ZINC000013566434 560813662 /nfs/dbraw/zinc/81/36/62/560813662.db2.gz RKJBFRHBUWEPET-UHFFFAOYSA-N 0 0 416.462 5.156 40 10 HKCBRN CCOc1cc(C=C2SC(=S)NC2=O)ccc1OCc1cccc2ccccc21 ZINC000013566887 560813738 /nfs/dbraw/zinc/81/37/38/560813738.db2.gz ZSIZYNPBTIBLMU-BKUYFWCQSA-N 0 0 421.543 5.306 40 10 HKCBRN Cc1cn(-c2ccccc2)c(C)c1/C=C1\SC(=S)N(c2cccc(Cl)c2)C1=O ZINC000013602847 560824952 /nfs/dbraw/zinc/82/49/52/560824952.db2.gz GCLMPTSOBYBQIW-NDENLUEZSA-N 0 0 424.978 6.153 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3c(C)cn(-c4ccccc4)c3C)SC2=S)cc1 ZINC000013602850 560824950 /nfs/dbraw/zinc/82/49/50/560824950.db2.gz FMOSXAPEUBHLRB-BKUYFWCQSA-N 0 0 420.559 5.509 40 10 HKCBRN CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000013603060 560824910 /nfs/dbraw/zinc/82/49/10/560824910.db2.gz OHUZZFOJPKXNCG-UNOMPAQXSA-N 0 0 407.813 5.314 40 10 HKCBRN O=[N+]([O-])c1ccc([C@H]2Nc3c(I)cccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000013615552 558549461 /nfs/dbraw/zinc/54/94/61/558549461.db2.gz CYIWVPWUCPMPAJ-GRDNDAEWSA-N 0 0 418.234 5.026 40 10 HKCBRN O=[N+]([O-])c1ccc([C@H]2Nc3c(I)cccc3[C@H]3C=CC[C@H]32)cc1 ZINC000013615558 558549410 /nfs/dbraw/zinc/54/94/10/558549410.db2.gz CYIWVPWUCPMPAJ-JJRVBVJISA-N 0 0 418.234 5.026 40 10 HKCBRN O=[N+]([O-])c1ccc([C@H]2Nc3ccc(I)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000013632882 527378989 /nfs/dbraw/zinc/37/89/89/527378989.db2.gz IASYTKQGFQJPHK-HDMKZQKVSA-N 0 0 418.234 5.026 40 10 HKCBRN O=[N+]([O-])c1ccc([C@H]2Nc3ccc(I)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000013632888 527378455 /nfs/dbraw/zinc/37/84/55/527378455.db2.gz IASYTKQGFQJPHK-RLFYNMQTSA-N 0 0 418.234 5.026 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)cc1OC ZINC000013633451 560825857 /nfs/dbraw/zinc/82/58/57/560825857.db2.gz CIHLXFLGWWGIDV-RGEXLXHISA-N 0 0 400.430 5.477 40 10 HKCBRN Brc1ccc([C@@H]2Nc3ccc(Oc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000013638494 560825964 /nfs/dbraw/zinc/82/59/64/560825964.db2.gz HYMZOKIHSBSHSX-DPLHUUCSSA-N 0 0 418.334 7.068 40 10 HKCBRN CCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000013639448 560826088 /nfs/dbraw/zinc/82/60/88/560826088.db2.gz WZXLIOXLIPNFBD-LQWHRVPQSA-N 0 0 411.343 5.415 40 10 HKCBRN CCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000013639451 560826080 /nfs/dbraw/zinc/82/60/80/560826080.db2.gz WZXLIOXLIPNFBD-OPYAIIAOSA-N 0 0 411.343 5.415 40 10 HKCBRN O=C(NCc1ccc(N2CCCC2)cc1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000013648984 558557711 /nfs/dbraw/zinc/55/77/11/558557711.db2.gz OYGOZZWCLXEWLU-HKOYGPOVSA-N 0 0 416.952 5.797 40 10 HKCBRN O=C(CSCc1c(Cl)cccc1Cl)NCc1ccc(N2CCCC2)cc1 ZINC000013669242 558560917 /nfs/dbraw/zinc/56/09/17/558560917.db2.gz CCXAKMSHTYFFER-UHFFFAOYSA-N 0 0 409.382 5.143 40 10 HKCBRN COc1ccc(/C=C(/C(=O)NCc2ccc(N3CCCC3)cc2)c2ccccc2)cc1 ZINC000013669879 558561642 /nfs/dbraw/zinc/56/16/42/558561642.db2.gz DSFKTKLCHRFMEJ-LGUFXXKBSA-N 0 0 412.533 5.152 40 10 HKCBRN O=C(NCc1ccc(N2CCCC2)cc1)c1ccccc1SCc1ccccc1 ZINC000013671756 558562821 /nfs/dbraw/zinc/56/28/21/558562821.db2.gz SIMVOCQXLCGSOM-UHFFFAOYSA-N 0 0 402.563 5.509 40 10 HKCBRN Cc1cc(O[C@H](C)C(=O)NCc2ccc(N3CCCCC3)cc2)cc(C)c1Cl ZINC000013675910 558564497 /nfs/dbraw/zinc/56/44/97/558564497.db2.gz CWJXIPQIHUAPNQ-GOSISDBHSA-N 0 0 400.950 5.031 40 10 HKCBRN Cc1cc(O[C@@H](C)C(=O)NCc2ccc(N3CCCCC3)cc2)cc(C)c1Cl ZINC000013675912 132458760 /nfs/dbraw/zinc/45/87/60/132458760.db2.gz CWJXIPQIHUAPNQ-SFHVURJKSA-N 0 0 400.950 5.031 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@H]3CCCC[C@@]3(O)CCN2C(=O)c2cccc(F)c2)cc1 ZINC000013758486 560827717 /nfs/dbraw/zinc/82/77/17/560827717.db2.gz BCYLGMCDRWDCON-RMTZWNOUSA-N 0 0 424.560 5.180 40 10 HKCBRN CCN(CC)c1ccc([C@H]2[C@H]3CCCC[C@@]3(O)CCN2C(=O)c2ccc(F)cc2)cc1 ZINC000013777379 560827838 /nfs/dbraw/zinc/82/78/38/560827838.db2.gz AEPPKFNTBVOYFC-RMTZWNOUSA-N 0 0 424.560 5.180 40 10 HKCBRN CCOc1cc(Cl)c(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1OCC ZINC000013915136 558832727 /nfs/dbraw/zinc/83/27/27/558832727.db2.gz JNIVHHOGQXXABL-WOJGMQOQSA-N 0 0 419.955 5.543 40 10 HKCBRN CCOc1cc(Cl)c(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc1OC ZINC000013915340 558832538 /nfs/dbraw/zinc/83/25/38/558832538.db2.gz DXWXZHXGRXYYLH-VCHYOVAHSA-N 0 0 419.955 5.462 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(Cc3cccc4ccccc43)C2=O)cc1 ZINC000014132007 560838654 /nfs/dbraw/zinc/83/86/54/560838654.db2.gz GPXRZCOVZTVCBU-XQNSMLJCSA-N 0 0 416.546 5.923 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)cc2)C(=O)N1Cc1cccc2ccccc21 ZINC000014132507 560838617 /nfs/dbraw/zinc/83/86/17/560838617.db2.gz WTGTWELUTFYSPP-XQNSMLJCSA-N 0 0 414.530 5.677 40 10 HKCBRN Ic1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc3ccccc31)N2 ZINC000014165812 560839736 /nfs/dbraw/zinc/83/97/36/560839736.db2.gz NASZQGNHZHSODS-LZNRXBQRSA-N 0 0 423.297 6.271 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(F)c(Cl)c2)C(=O)/C1=C\c1ccc(SC)cc1 ZINC000014413813 560845843 /nfs/dbraw/zinc/84/58/43/560845843.db2.gz TYVRNXLAWFGYOR-YBEGLDIGSA-N 0 0 417.889 5.078 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(F)c(Cl)c2)C(=O)/C1=C\c1c(F)cccc1Cl ZINC000014413816 560845875 /nfs/dbraw/zinc/84/58/75/560845875.db2.gz ZQRRASZEUBAYKB-LCYFTJDESA-N 0 0 424.230 5.149 40 10 HKCBRN CCOC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccc(C(C)C)cc1 ZINC000014414947 560845858 /nfs/dbraw/zinc/84/58/58/560845858.db2.gz CJBBXZOBBFKZHA-QJOMJCCJSA-N 0 0 403.522 5.115 40 10 HKCBRN CCOC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000014415077 560846350 /nfs/dbraw/zinc/84/63/50/560846350.db2.gz OTDXPIVSXFKUTQ-MOHJPFBDSA-N 0 0 411.501 5.145 40 10 HKCBRN CCOC(=O)C1=C(C)N(CCc2ccccc2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000014415105 560846296 /nfs/dbraw/zinc/84/62/96/560846296.db2.gz YJEWTAPXBJOHFS-NKFKGCMQSA-N 0 0 417.549 5.290 40 10 HKCBRN Cc1ccc([C@H]2Nc3ccc(S(=O)(=O)Nc4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000014458250 560846505 /nfs/dbraw/zinc/84/65/05/560846505.db2.gz IXBLDLZFOBVUGO-SGIRGMQISA-N 0 0 416.546 5.622 40 10 HKCBRN Ic1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cccc3ccccc31)N2 ZINC000014463758 558654877 /nfs/dbraw/zinc/65/48/77/558654877.db2.gz NASZQGNHZHSODS-LRXVAGHRSA-N 0 0 423.297 6.271 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3ccc(Oc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000014472615 560846460 /nfs/dbraw/zinc/84/64/60/560846460.db2.gz QDXAXZGKCRNMEP-YDIMBITNSA-N 0 0 418.880 6.867 40 10 HKCBRN Clc1cccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@H]3C=CC[C@H]32)c1Cl ZINC000014476982 560846470 /nfs/dbraw/zinc/84/64/70/560846470.db2.gz RYFNMXBLKQIFDF-MRAOVIAESA-N 0 0 419.566 7.780 40 10 HKCBRN Clc1cccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@H]3C=CC[C@@H]32)c1Cl ZINC000014476984 560846515 /nfs/dbraw/zinc/84/65/15/560846515.db2.gz RYFNMXBLKQIFDF-IRWWLHRVSA-N 0 0 419.566 7.780 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(Oc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c(Cl)c1 ZINC000014477445 560846516 /nfs/dbraw/zinc/84/65/16/560846516.db2.gz AEHIWJPWPWSWJW-YDIMBITNSA-N 0 0 408.328 7.612 40 10 HKCBRN O=[N+]([O-])c1ccccc1[C@H]1Nc2ccc(I)cc2[C@H]2C=CC[C@H]21 ZINC000014477974 560846463 /nfs/dbraw/zinc/84/64/63/560846463.db2.gz OESCYOPBCJNBJJ-JCGVRSQUSA-N 0 0 418.234 5.026 40 10 HKCBRN Clc1cccc(Cl)c1[C@@H]1Nc2ccc(Oc3ccccc3)cc2[C@@H]2C=CC[C@@H]21 ZINC000014546558 560846190 /nfs/dbraw/zinc/84/61/90/560846190.db2.gz SBNYZTMDXKDWIM-NXMSCROESA-N 0 0 408.328 7.612 40 10 HKCBRN CCOC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1c3ccccc3cc3ccccc31)N2 ZINC000014549133 560846206 /nfs/dbraw/zinc/84/62/06/560846206.db2.gz QTQCNKDVWXTWFP-FMGHJNRGSA-N 0 0 419.524 6.996 40 10 HKCBRN COc1ccc(OC)c2c1N[C@@H](c1c3ccccc3cc3ccccc31)[C@H]1CC=C[C@@H]21 ZINC000014549156 560846253 /nfs/dbraw/zinc/84/62/53/560846253.db2.gz KCTFBQCMQXJCDK-UMTXDNHDSA-N 0 0 407.513 6.837 40 10 HKCBRN O=S(=O)(Nc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2 ZINC000014551171 560846279 /nfs/dbraw/zinc/84/62/79/560846279.db2.gz CIBZGPSMXNRKIV-YZUZCNPQSA-N 0 0 402.519 5.314 40 10 HKCBRN O=C(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccc(S(=O)(=O)C(F)F)cc1 ZINC000014862345 560850461 /nfs/dbraw/zinc/85/04/61/560850461.db2.gz BTHRRDAKWVVXRI-OCOZRVBESA-N 0 0 415.421 5.351 40 10 HKCBRN CS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(/N=N/c3ccccc3)cc2)c1 ZINC000014862388 569044233 /nfs/dbraw/zinc/04/42/33/569044233.db2.gz AFYPAPLMOSFYSG-WCWDXBQESA-N 0 0 413.886 5.411 40 10 HKCBRN COc1ccc(/C=C2/SC(=S)N(c3ccccc3C)C2=O)cc1Br ZINC000015008605 558699531 /nfs/dbraw/zinc/69/95/31/558699531.db2.gz VCKYHMRACUWEET-MHWRWJLKSA-N 0 0 420.353 5.172 40 10 HKCBRN COc1ccc(Br)cc1/C=C1/SC(=S)N(c2ccccc2C)C1=O ZINC000015008608 558699517 /nfs/dbraw/zinc/69/95/17/558699517.db2.gz HFZHAFQCNXBDHL-MHWRWJLKSA-N 0 0 420.353 5.172 40 10 HKCBRN COC(=O)c1ccc(Cl)c(-c2ccc(/C=C3\C(=O)N(c4ccccc4)N=C3C)o2)c1 ZINC000015009055 560851993 /nfs/dbraw/zinc/85/19/93/560851993.db2.gz OPGSUMAUQBJQEG-AQTBWJFISA-N 0 0 420.852 5.193 40 10 HKCBRN CCN(CC)c1ccc(/C=C/c2onc(C)c2[N+](=O)[O-])c(OCc2ccccc2)c1 ZINC000015009415 558699794 /nfs/dbraw/zinc/69/97/94/558699794.db2.gz JLZNBPYQISLRQT-WYMLVPIESA-N 0 0 407.470 5.487 40 10 HKCBRN CSc1ccc(/C=C2/SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000015011648 560851982 /nfs/dbraw/zinc/85/19/82/560851982.db2.gz ZIVFQGDXVIXGHL-OQLLNIDSSA-N 0 0 411.495 5.833 40 10 HKCBRN O=C1/C(=C\c2c3ccccc3cc3ccccc32)SC(=S)N1c1ccccc1F ZINC000015011938 560851920 /nfs/dbraw/zinc/85/19/20/560851920.db2.gz KYZHZCBSURDUNW-HYARGMPZSA-N 0 0 415.514 6.538 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(C3CCCCC3)C2=O)cc1 ZINC000015012853 558701066 /nfs/dbraw/zinc/70/10/66/558701066.db2.gz MOZUHRURYYUFFI-CAPFRKAQSA-N 0 0 407.941 6.338 40 10 HKCBRN COc1cc(Cl)cc(/C=C2\SC(N(C)c3ccc(Cl)cc3)=NC2=O)c1OC ZINC000015016197 558702021 /nfs/dbraw/zinc/70/20/21/558702021.db2.gz AJWGMJOUWQPKBM-SXGWCWSVSA-N 0 0 423.321 5.117 40 10 HKCBRN Oc1ccc(/C=C/c2ccc3cccc(OCc4ccc(Cl)cc4)c3n2)cc1O ZINC000015017278 558702702 /nfs/dbraw/zinc/70/27/02/558702702.db2.gz CLAMLALJIZIHNG-IZZDOVSWSA-N 0 0 403.865 6.049 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C/c3ccc(Sc4ccc(C)cc4)o3)C2=N)S1 ZINC000015224880 558728494 /nfs/dbraw/zinc/72/84/94/558728494.db2.gz VLOQLHGYVXNTJN-XGXACIPPSA-N 0 0 410.524 5.158 40 10 HKCBRN O=C1/C(=C\c2ccc(Br)cc2)N=C(c2ccc(F)cc2)N1c1ccccc1 ZINC000015227419 560854302 /nfs/dbraw/zinc/85/43/02/560854302.db2.gz DHZZTGGCNLIZDM-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(C3CCCCC3)C2=O)cc1OC ZINC000015231214 560853916 /nfs/dbraw/zinc/85/39/16/560853916.db2.gz QHKRNTNTOBKPPY-XMHGGMMESA-N 0 0 423.940 5.957 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)SC(=S)N1Cc1ccccc1Cl ZINC000015305917 558731392 /nfs/dbraw/zinc/73/13/92/558731392.db2.gz REKKZSRVXIAXCM-CHHVJCJISA-N 0 0 414.766 6.048 40 10 HKCBRN CCOc1cc(/C=C2/C(=O)N(c3cccc(C(F)(F)F)c3)N=C2C)cc(Cl)c1O ZINC000015930218 558992848 /nfs/dbraw/zinc/99/28/48/558992848.db2.gz MKXUBQJWZFRVPX-VIZOYTHASA-N 0 0 424.806 5.269 40 10 HKCBRN CC1=NN(c2c(Cl)cc(Cl)cc2Cl)C(=O)/C1=C\c1c[nH]c2ccccc12 ZINC000016160858 558774399 /nfs/dbraw/zinc/77/43/99/558774399.db2.gz UFCPRBFAIIUOAY-NSIKDUERSA-N 0 0 404.684 5.934 40 10 HKCBRN CC1=NN(c2c(Cl)cc(Cl)cc2Cl)C(=O)/C1=C\c1ccc(N(C)C)cc1 ZINC000016160914 558774395 /nfs/dbraw/zinc/77/43/95/558774395.db2.gz ACQLRDCABUWKSN-NVNXTCNLSA-N 0 0 408.716 5.519 40 10 HKCBRN CCc1ccc(NCN2C(=O)S/C(=C/c3ccc(N(CC)CC)cc3)C2=O)cc1 ZINC000016161960 558774795 /nfs/dbraw/zinc/77/47/95/558774795.db2.gz JPZCVPMWJPUDQL-RCCKNPSSSA-N 0 0 409.555 5.201 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc4cc(C)ccc4c3)OC2=O)cc(OC)c1OC ZINC000016184228 558775994 /nfs/dbraw/zinc/77/59/94/558775994.db2.gz PRBHSELHBJUJMW-KEBDBYFISA-N 0 0 402.446 5.155 40 10 HKCBRN CN(C)c1ccc([C@@H]2CC(c3ccccc3)=NN2c2ccc(Br)cc2)cc1 ZINC000016186468 558776145 /nfs/dbraw/zinc/77/61/45/558776145.db2.gz QROLSNONOIKISV-QHCPKHFHSA-N 0 0 420.354 5.871 40 10 HKCBRN CN(C)c1ccc([C@H]2CC(c3ccccc3)=NN2c2ccc(Br)cc2)cc1 ZINC000016186470 558776094 /nfs/dbraw/zinc/77/60/94/558776094.db2.gz QROLSNONOIKISV-HSZRJFAPSA-N 0 0 420.354 5.871 40 10 HKCBRN CN(c1ccc(C(=S)c2ccc(N(C)c3ccccc3)s2)s1)c1ccccc1 ZINC000016188822 558776985 /nfs/dbraw/zinc/77/69/85/558776985.db2.gz KKNSFZFDNCZYGR-UHFFFAOYSA-N 0 0 420.628 7.112 40 10 HKCBRN COc1ccc(C(=O)N2C(=O)/C(=C\c3ccc(Cl)cc3Cl)SC2=S)cc1 ZINC000016216276 558779220 /nfs/dbraw/zinc/77/92/20/558779220.db2.gz NNOKUDVNXTVZGY-OVCLIPMQSA-N 0 0 424.330 5.044 40 10 HKCBRN COc1ccc(C=C2SC(=S)NC2=O)cc1Oc1ccc(Cl)cc1Cl ZINC000016227620 558779796 /nfs/dbraw/zinc/77/97/96/558779796.db2.gz LLNQLRMARNZZRH-VIZOYTHASA-N 0 0 412.319 5.283 40 10 HKCBRN Cc1nc2ccccc2nc1CNc1ccccc1NCc1nc2ccccc2nc1C ZINC000016265275 558781976 /nfs/dbraw/zinc/78/19/76/558781976.db2.gz IBRCUZHSBCJQRA-UHFFFAOYSA-N 0 0 420.520 5.414 40 10 HKCBRN CC1=NN(c2c(Cl)cc(Cl)cc2Cl)C(=O)/C1=C\c1c(C)cc(C)cc1C ZINC000016267159 558782350 /nfs/dbraw/zinc/78/23/50/558782350.db2.gz WHHXGAPKNXQXNQ-SXGWCWSVSA-N 0 0 407.728 6.378 40 10 HKCBRN Cc1ccc(NCN2C(=O)/C(=C\c3c(Cl)cccc3Cl)SC2=S)c(C)c1 ZINC000016284970 558783798 /nfs/dbraw/zinc/78/37/98/558783798.db2.gz BUSPRDFHKPQMGT-RQZCQDPDSA-N 0 0 423.390 5.881 40 10 HKCBRN COc1cc(C)ccc1/C=C1\C(=O)N(c2c(Cl)cc(Cl)cc2Cl)N=C1C ZINC000016291078 558783886 /nfs/dbraw/zinc/78/38/86/558783886.db2.gz QIRZNORPPSLGLL-AUWJEWJLSA-N 0 0 409.700 5.770 40 10 HKCBRN COc1ccc(/N=N/c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)s2)cc1 ZINC000016292605 558784215 /nfs/dbraw/zinc/78/42/15/558784215.db2.gz JGVRCCHXSMEWEO-CYYJNZCTSA-N 0 0 413.546 8.259 40 10 HKCBRN Cc1ccc(N(c2ccc(/N=N/c3ccc([N+](=O)[O-])cc3)s2)c2ccccc2)cc1 ZINC000016292622 558784149 /nfs/dbraw/zinc/78/41/49/558784149.db2.gz FNBMQJJFYXEDCU-OCOZRVBESA-N 0 0 414.490 7.850 40 10 HKCBRN Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)o1 ZINC000016347948 558787300 /nfs/dbraw/zinc/78/73/00/558787300.db2.gz IJSWWSLGIAUJPY-XDHOZWIPSA-N 0 0 422.487 5.569 40 10 HKCBRN Cc1ccc2ccccc2c1CC1(c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O ZINC000016348894 560860094 /nfs/dbraw/zinc/86/00/94/560860094.db2.gz AAEYGUSWOJLTAW-UHFFFAOYSA-N 0 0 410.900 6.361 40 10 HKCBRN Cc1cccc(C)c1NC(=O)CCNc1ccc(Cl)cc1C(=O)c1ccccc1 ZINC000016362226 558787965 /nfs/dbraw/zinc/78/79/65/558787965.db2.gz IPFMURYSIIPZKI-UHFFFAOYSA-N 0 0 406.913 5.629 40 10 HKCBRN O=C1/C(=C\c2c(Cl)cccc2Cl)SC(=S)N1CNc1cccc(F)c1 ZINC000016399171 558789734 /nfs/dbraw/zinc/78/97/34/558789734.db2.gz ZTGQCKOGJKPMNX-OVCLIPMQSA-N 0 0 413.326 5.403 40 10 HKCBRN O=[N+]([O-])c1ccc(/N=N/c2sc(N3CCCCC3)nc2N2CCCCC2)cc1 ZINC000016400508 558789874 /nfs/dbraw/zinc/78/98/74/558789874.db2.gz SPPQAUWFLMQMDK-QURGRASLSA-N 0 0 400.508 5.447 40 10 HKCBRN O=C1OC(c2ccc(Cl)cc2)=C/C1=C\c1ccccc1NCc1ccc(F)cc1 ZINC000016448938 558792001 /nfs/dbraw/zinc/79/20/01/558792001.db2.gz DRJJFEYJFALXPP-CPNJWEJPSA-N 0 0 405.856 6.073 40 10 HKCBRN O=C(c1cc(/N=N/c2ccc([N+](=O)[O-])cc2)c(N2CCOCC2)s1)c1ccccc1 ZINC000016476900 558793306 /nfs/dbraw/zinc/79/33/06/558793306.db2.gz QXMRHIVMGOJXRT-GHVJWSGMSA-N 0 0 422.466 5.139 40 10 HKCBRN O=C1N=C(c2ccccc2)S/C1=C/c1ccc(-c2ccc(Br)cc2)o1 ZINC000016477989 558793771 /nfs/dbraw/zinc/79/37/71/558793771.db2.gz XSRVODSZKSKUKT-LDADJPATSA-N 0 0 410.292 5.770 40 10 HKCBRN CC1(C)Cc2nc3sc(C(=O)OCc4ccc(Cl)cc4)c(N)c3cc2C(=O)C1 ZINC000016605248 558796679 /nfs/dbraw/zinc/79/66/79/558796679.db2.gz WZWWZJMBZYIYQQ-UHFFFAOYSA-N 0 0 414.914 5.044 40 10 HKCBRN O=C1/C(=C\c2ccc(-c3cccc(Cl)c3)o2)SC(=S)N1Cc1ccco1 ZINC000016669673 558798483 /nfs/dbraw/zinc/79/84/83/558798483.db2.gz SWPVUAYSHKITRJ-LICLKQGHSA-N 0 0 401.896 5.594 40 10 HKCBRN CCN(CC)c1ccc(-c2nc3cc(NC(=O)c4ccc([N+](=O)[O-])o4)ccc3o2)cc1 ZINC000016678603 558799202 /nfs/dbraw/zinc/79/92/02/558799202.db2.gz SYNWOZXBRRRMHU-UHFFFAOYSA-N 0 0 420.425 5.095 40 10 HKCBRN CCOC(=O)c1sc2nc(C3CC3)cc(-c3ccc(Br)cc3)c2c1N ZINC000016683009 558799716 /nfs/dbraw/zinc/79/97/16/558799716.db2.gz ZJFLJCWQQWACBS-UHFFFAOYSA-N 0 0 417.328 5.362 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(Cc3ccc(C)cc3)C2=O)cc1OCC ZINC000016692873 558800465 /nfs/dbraw/zinc/80/04/65/558800465.db2.gz UZIKEUJAFYGVJY-MOSHPQCFSA-N 0 0 413.564 5.194 40 10 HKCBRN COc1cccc(C=C2SC(Nc3cccc(Cl)c3Cl)=NC2=O)c1OC ZINC000016695915 558801164 /nfs/dbraw/zinc/80/11/64/558801164.db2.gz WNYBLRRPXXIZRB-NTEUORMPSA-N 0 0 409.294 5.093 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N([C@@H](C)c3ccccc3)C2=O)ccc1OC(F)F ZINC000016740829 559079158 /nfs/dbraw/zinc/07/91/58/559079158.db2.gz XVJTZKBRECHVOR-OOIIIRTPSA-N 0 0 421.490 5.259 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N([C@H](C)c3ccccc3)C2=O)ccc1OC(F)F ZINC000016740830 559079159 /nfs/dbraw/zinc/07/91/59/559079159.db2.gz XVJTZKBRECHVOR-PBSOMRJOSA-N 0 0 421.490 5.259 40 10 HKCBRN CCN1C(=O)/C(=C/c2c3ccccc3c3n(C)c4c(cccc4C)n23)SC1=S ZINC000016756653 558805787 /nfs/dbraw/zinc/80/57/87/558805787.db2.gz JUMBFMACVXPSJV-PDGQHHTCSA-N 0 0 405.548 5.114 40 10 HKCBRN Cc1c(C)n(-c2cc(NS(=O)(=O)c3ccccc3)c(C)c(C)c2O)c2ccccc12 ZINC000016779650 558806682 /nfs/dbraw/zinc/80/66/82/558806682.db2.gz BIARYEXHXPRHEE-UHFFFAOYSA-N 0 0 420.534 5.371 40 10 HKCBRN Cc1c(C)n(-c2cc(NS(=O)(=O)c3ccc(F)cc3)c(C)cc2O)c2ccccc12 ZINC000016779653 558806604 /nfs/dbraw/zinc/80/66/04/558806604.db2.gz GDQWRZBMSVVXHA-UHFFFAOYSA-N 0 0 424.497 5.201 40 10 HKCBRN Cc1c(C)n(-c2cc(NS(=O)(=O)c3ccc(C)cc3)cc(C)c2O)c2ccccc12 ZINC000016779658 558806825 /nfs/dbraw/zinc/80/68/25/558806825.db2.gz VSZOHEWUYFUOCD-UHFFFAOYSA-N 0 0 420.534 5.371 40 10 HKCBRN Cc1c(C)n(-c2cc(NS(=O)(=O)c3ccccc3)cc(C)c2O)c2ccccc12 ZINC000016779660 558806748 /nfs/dbraw/zinc/80/67/48/558806748.db2.gz IYVICFDEYUYBSV-UHFFFAOYSA-N 0 0 406.507 5.062 40 10 HKCBRN Cc1c(C)n(-c2cc(NS(=O)(=O)c3ccc(F)cc3)cc(C)c2O)c2ccccc12 ZINC000016779666 558806798 /nfs/dbraw/zinc/80/67/98/558806798.db2.gz RGAZSQAONFLJGV-UHFFFAOYSA-N 0 0 424.497 5.201 40 10 HKCBRN Cc1c(C)n(-c2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2O)c2ccccc12 ZINC000016779672 558806828 /nfs/dbraw/zinc/80/68/28/558806828.db2.gz CXMMEULBGGCWIM-UHFFFAOYSA-N 0 0 406.507 5.062 40 10 HKCBRN CC(=C\c1ccccc1)/C=C1\SC(=S)N(CCCC(=O)Nc2ccccc2)C1=O ZINC000016805076 569046417 /nfs/dbraw/zinc/04/64/17/569046417.db2.gz ZAAAUNSWOYDONU-KBWOEQRPSA-N 0 0 422.575 5.253 40 10 HKCBRN Cc1c(C)n(-c2cc(NS(=O)(=O)c3ccc(C)cc3)c(C)cc2O)c2ccccc12 ZINC000016807685 558807812 /nfs/dbraw/zinc/80/78/12/558807812.db2.gz NRBQNEYWEOXWFV-UHFFFAOYSA-N 0 0 420.534 5.371 40 10 HKCBRN COc1ccccc1/N=N/c1c(-c2ccccc2)nn(C(N)=S)c1-c1ccccc1 ZINC000016930166 558809396 /nfs/dbraw/zinc/80/93/96/558809396.db2.gz AEQJWPYADAYAEW-OCEACIFDSA-N 0 0 413.506 5.733 40 10 HKCBRN COc1ccc(/N=N/c2c(-c3ccccc3)nn(C(N)=S)c2-c2ccccc2)cc1 ZINC000016930170 558809344 /nfs/dbraw/zinc/80/93/44/558809344.db2.gz FFNFNYLTWGACFJ-OCEACIFDSA-N 0 0 413.506 5.733 40 10 HKCBRN Nc1nc(-c2cccc([N+](=O)[O-])c2)c(/N=N/c2ccc(Br)cc2)s1 ZINC000016956146 571310839 /nfs/dbraw/zinc/31/08/39/571310839.db2.gz KNHASUMTWGUIKZ-FMQUCBEESA-N 0 0 404.249 5.478 40 10 HKCBRN CN(C)c1ccc(C=C(NC(=O)c2ccccc2)c2nc3cc(Cl)ccc3[nH]2)cc1 ZINC000016957412 558810217 /nfs/dbraw/zinc/81/02/17/558810217.db2.gz QIURFMPQSWEFHB-HYARGMPZSA-N 0 0 416.912 5.210 40 10 HKCBRN c1ccc(CN(Cc2ccccc2)/N=N/N(Cc2ccccc2)Cc2ccccc2)cc1 ZINC000017005660 558811550 /nfs/dbraw/zinc/81/15/50/558811550.db2.gz NQOAYYLTRTXFRH-QVIHXGFCSA-N 0 0 420.560 6.673 40 10 HKCBRN CC(Nc1cccc2ccccc21)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000017082673 560862318 /nfs/dbraw/zinc/86/23/18/560862318.db2.gz SDQOTJITRLXKLH-PLRJNAJWSA-N 0 0 403.485 5.977 40 10 HKCBRN COc1ccc(C2=NN(c3ccccc3)C(=O)C2=C(C)NC2CCCCCC2)cc1 ZINC000017082723 560862293 /nfs/dbraw/zinc/86/22/93/560862293.db2.gz PUYDVNRODDEJET-NKFKGCMQSA-N 0 0 403.526 5.033 40 10 HKCBRN COc1ccc(N2N=C(c3ccccc3)C(=C(C)NC3CCCCCC3)C2=O)cc1 ZINC000017082724 560862268 /nfs/dbraw/zinc/86/22/68/560862268.db2.gz JDLSOAXBSCCJEN-NKFKGCMQSA-N 0 0 403.526 5.033 40 10 HKCBRN CCCCCNC(C)=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 ZINC000017083004 560862313 /nfs/dbraw/zinc/86/23/13/560862313.db2.gz NRAUJIPPXLYIKO-SILNSSARSA-N 0 0 404.539 5.101 40 10 HKCBRN CC(Nc1ccc(Cl)cc1)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 ZINC000017083274 560862367 /nfs/dbraw/zinc/86/23/67/560862367.db2.gz KKDIXHZAFGSBSL-QNGOZBTKSA-N 0 0 405.860 5.616 40 10 HKCBRN COc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)ccc1OCc1ccc(C)cc1 ZINC000017086119 560862492 /nfs/dbraw/zinc/86/24/92/560862492.db2.gz SAZGGOPOSNXANQ-HZHRSRAPSA-N 0 0 412.489 5.389 40 10 HKCBRN CC(Nc1ccccc1)=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 ZINC000017088549 560863454 /nfs/dbraw/zinc/86/34/54/560863454.db2.gz HBYPJXKTSJWSHJ-PGMHBOJBSA-N 0 0 410.502 5.433 40 10 HKCBRN CCc1ccc(NC(C)=C2C(=O)N(c3ccccc3)N=C2c2ccc(OC)cc2)cc1 ZINC000017088918 560863831 /nfs/dbraw/zinc/86/38/31/560863831.db2.gz IRSLFLUZHLWWQR-MOHJPFBDSA-N 0 0 411.505 5.395 40 10 HKCBRN COc1ccc(C2=NN(c3ccccc3)C(=O)C2=C(C)Nc2ccc(C)cc2C)cc1 ZINC000017088923 560863911 /nfs/dbraw/zinc/86/39/11/560863911.db2.gz RIBQJUFDIXNQSJ-CLCOLTQESA-N 0 0 411.505 5.449 40 10 HKCBRN COc1ccc(N2N=C(c3ccccc3)C(=C(C)Nc3ccc(C)cc3C)C2=O)cc1 ZINC000017088924 560863929 /nfs/dbraw/zinc/86/39/29/560863929.db2.gz ZEPLAYJYZYYYNP-CLCOLTQESA-N 0 0 411.505 5.449 40 10 HKCBRN CCc1ccccc1NC(C)=C1C(=O)N(c2ccc(OC)cc2)N=C1c1ccccc1 ZINC000017088926 560863880 /nfs/dbraw/zinc/86/38/80/560863880.db2.gz WPBWGXAJBQBERK-MOHJPFBDSA-N 0 0 411.505 5.395 40 10 HKCBRN CCc1ccccc1NC(C)=C1C(=O)N(c2ccccc2)N=C1c1ccc(OC)cc1 ZINC000017088927 560863933 /nfs/dbraw/zinc/86/39/33/560863933.db2.gz AKQGNJKPZRIDFD-MOHJPFBDSA-N 0 0 411.505 5.395 40 10 HKCBRN CCc1ccc(NC(C)=C2C(=O)N(c3ccc(OC)cc3)N=C2c2ccccc2)cc1 ZINC000017088933 560863867 /nfs/dbraw/zinc/86/38/67/560863867.db2.gz MMUXHCUQOYTMPL-MOHJPFBDSA-N 0 0 411.505 5.395 40 10 HKCBRN CCOc1ccc(NC(C)=C2C(=O)N(c3ccc(F)cc3)N=C2c2ccccc2)cc1 ZINC000017090281 560865037 /nfs/dbraw/zinc/86/50/37/560865037.db2.gz HNNMDYVPQQDOIE-QJOMJCCJSA-N 0 0 415.468 5.361 40 10 HKCBRN CC(NCCc1ccc(Cl)cc1)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000017090446 560865278 /nfs/dbraw/zinc/86/52/78/560865278.db2.gz VQJIEVUPVNAKBF-NKFKGCMQSA-N 0 0 415.924 5.197 40 10 HKCBRN CC(NC1CCCCC1)=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 ZINC000017090828 560865487 /nfs/dbraw/zinc/86/54/87/560865487.db2.gz RWCCYVRNACGMAE-PGMHBOJBSA-N 0 0 416.550 5.244 40 10 HKCBRN COc1ccc(N2N=C(c3ccccc3)C(=C(C)Nc3ccccc3Cl)C2=O)cc1 ZINC000017091251 560866004 /nfs/dbraw/zinc/86/60/04/560866004.db2.gz HOIHQQZMPPLNEH-JWGURIENSA-N 0 0 417.896 5.486 40 10 HKCBRN COc1ccc(C2=NN(c3ccccc3)C(=O)C2=C(C)Nc2ccccc2Cl)cc1 ZINC000017091253 560866010 /nfs/dbraw/zinc/86/60/10/560866010.db2.gz JUZJRPAMFNHACQ-JWGURIENSA-N 0 0 417.896 5.486 40 10 HKCBRN CC(Nc1ccc(Cl)cc1C)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 ZINC000017092021 560866713 /nfs/dbraw/zinc/86/67/13/560866713.db2.gz MRIJPWOWNYPDOT-JWGURIENSA-N 0 0 419.887 5.925 40 10 HKCBRN CC(Nc1cccc(Cl)c1C)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 ZINC000017092024 560866765 /nfs/dbraw/zinc/86/67/65/560866765.db2.gz VVRDSYZVMVTGSF-JWGURIENSA-N 0 0 419.887 5.925 40 10 HKCBRN CC(NCCc1c[nH]c2ccccc12)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000017092272 560866938 /nfs/dbraw/zinc/86/69/38/560866938.db2.gz QEQPSUYIBXCBLW-PLRJNAJWSA-N 0 0 420.516 5.025 40 10 HKCBRN CC(Nc1cccc2ccccc21)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 ZINC000017092677 560867242 /nfs/dbraw/zinc/86/72/42/560867242.db2.gz LZEWQMNDWAILEJ-BWAHOGKJSA-N 0 0 421.475 6.116 40 10 HKCBRN COc1ccc(C2=NN(c3ccc(F)cc3)C(=O)C2=C(C)NC2CCCCCC2)cc1 ZINC000017092726 560867234 /nfs/dbraw/zinc/86/72/34/560867234.db2.gz BYMVOILBCITKRB-QJOMJCCJSA-N 0 0 421.516 5.172 40 10 HKCBRN CC(Nc1ccc(Cl)c(Cl)c1)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000017092905 560867466 /nfs/dbraw/zinc/86/74/66/560867466.db2.gz RZZPIBDVKRYIGB-QNGOZBTKSA-N 0 0 422.315 6.130 40 10 HKCBRN Cc1ccc(C(=O)NC(=S)Nc2ccc(Cl)cc2C(=O)c2ccccc2)c(C)c1 ZINC000017093389 558821797 /nfs/dbraw/zinc/82/17/97/558821797.db2.gz ALDMHBQACUPAQZ-UHFFFAOYSA-N 0 0 422.937 5.315 40 10 HKCBRN Cc1cc(C)cc(C(=O)NC(=S)Nc2ccc(Cl)cc2C(=O)c2ccccc2)c1 ZINC000017093391 560867930 /nfs/dbraw/zinc/86/79/30/560867930.db2.gz SGBUEPAXQBTPGK-UHFFFAOYSA-N 0 0 422.937 5.315 40 10 HKCBRN CCc1ccc(C(=O)NC(=S)Nc2ccc(Cl)cc2C(=O)c2ccccc2)cc1 ZINC000017093403 560868082 /nfs/dbraw/zinc/86/80/82/560868082.db2.gz GZPLIYRBHOVIDW-UHFFFAOYSA-N 0 0 422.937 5.260 40 10 HKCBRN COc1ccc(CCNC(=S)Nc2ccc(Cl)cc2C(=O)c2ccccc2)cc1 ZINC000017094179 560868736 /nfs/dbraw/zinc/86/87/36/560868736.db2.gz AQWZOXNQIVDXMU-UHFFFAOYSA-N 0 0 424.953 5.109 40 10 HKCBRN NC(=S)n1nc(-c2ccccc2)c(/N=N\c2ccccc2Cl)c1-c1ccccc1 ZINC000017129828 558823478 /nfs/dbraw/zinc/82/34/78/558823478.db2.gz HKMFTEZOWQIZMO-QPLCGJKRSA-N 0 0 417.925 6.378 40 10 HKCBRN Fc1cccc(/N=N/c2c(-c3ccccc3)nn(C(=S)S)c2-c2ccccc2)c1 ZINC000017129837 558823372 /nfs/dbraw/zinc/82/33/72/558823372.db2.gz QXKRKBKXHDUJQJ-OCOZRVBESA-N 0 0 418.522 6.834 40 10 HKCBRN Cc1c(/N=N/c2ccc(Br)cc2)c(-c2ccccc2)nn1C(N)=S ZINC000017129908 525522383 /nfs/dbraw/zinc/52/23/83/525522383.db2.gz KCRHOLITEGEVND-QZQOTICOSA-N 0 0 400.305 5.128 40 10 HKCBRN Cc1c(/N=N/c2ccc(Br)cc2)c(-c2ccccc2)nn1C(=S)S ZINC000017129918 525522628 /nfs/dbraw/zinc/52/26/28/525522628.db2.gz DXPAKKRVOCZXIJ-FMQUCBEESA-N 0 0 417.357 6.099 40 10 HKCBRN Cc1ccc(/N=N/c2c(-c3ccccc3)nn(C(=S)S)c2-c2ccccc2)cc1 ZINC000017129925 558823444 /nfs/dbraw/zinc/82/34/44/558823444.db2.gz DFJXJVKXCJTBSY-OCOZRVBESA-N 0 0 414.559 7.004 40 10 HKCBRN Cc1c(/N=N/c2cccc(Cl)c2Cl)c(-c2ccccc2)nn1C(=S)S ZINC000017130516 558823476 /nfs/dbraw/zinc/82/34/76/558823476.db2.gz KTQLMCUTPVVWOT-QZQOTICOSA-N 0 0 407.351 6.644 40 10 HKCBRN CCOc1c(/N=N/c2ccccc2Cl)c(-c2ccccc2)nn1C(=S)S ZINC000017140008 558823796 /nfs/dbraw/zinc/82/37/96/558823796.db2.gz ITALQPCUIJXJAA-QZQOTICOSA-N 0 0 402.932 6.080 40 10 HKCBRN CCOc1c(/N=N/c2cccc(Cl)c2)c(-c2ccccc2)nn1C(=S)S ZINC000017140010 558823717 /nfs/dbraw/zinc/82/37/17/558823717.db2.gz LQZROICRXYVSHK-QZQOTICOSA-N 0 0 402.932 6.080 40 10 HKCBRN CCOc1c(/N=N/c2ccc(Cl)cc2)c(-c2ccccc2)nn1C(=S)S ZINC000017140012 558823805 /nfs/dbraw/zinc/82/38/05/558823805.db2.gz JUGUFCFAXATHCK-QZQOTICOSA-N 0 0 402.932 6.080 40 10 HKCBRN CSC(=S)n1nc(-c2cccs2)c(/N=N/c2ccccc2)c1C(F)(F)F ZINC000017141402 558823746 /nfs/dbraw/zinc/82/37/46/558823746.db2.gz BRBCEOLWXNFELI-QZQOTICOSA-N 0 0 412.487 6.542 40 10 HKCBRN O=C(O/C(=C(\N=N\c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1 ZINC000017191672 558825211 /nfs/dbraw/zinc/82/52/11/558825211.db2.gz CRYAIAGXVMJABY-JODJXZMCSA-N 0 0 404.469 7.153 40 10 HKCBRN O=C1/C(=C\c2cccs2)SC(=S)N1C1c2ccccc2Oc2ccccc21 ZINC000017288257 558826566 /nfs/dbraw/zinc/82/65/66/558826566.db2.gz ZTTLKTRQVAGUBZ-LDADJPATSA-N 0 0 407.541 5.845 40 10 HKCBRN Cc1cccc2c1Oc1ccccc1[C@H]2N1C(=O)/C(=C\c2ccccc2)SC1=S ZINC000017300228 558826715 /nfs/dbraw/zinc/82/67/15/558826715.db2.gz KTRAWKDBDIDDDZ-JCZXDDDQSA-N 0 0 415.539 6.092 40 10 HKCBRN O=C(Nc1ccccc1)C1=Cc2ccccc2C(=NNc2cccc([N+](=O)[O-])c2)C1=O ZINC000017303183 558826710 /nfs/dbraw/zinc/82/67/10/558826710.db2.gz QSFJILOAMVJLLT-QPLCGJKRSA-N 0 0 412.405 6.121 40 10 HKCBRN O=C(Nc1ccccc1)C1=Cc2ccccc2C(=NNc2ccc([N+](=O)[O-])cc2)C1=O ZINC000017303185 558826718 /nfs/dbraw/zinc/82/67/18/558826718.db2.gz VZEZEKXEFKSTBJ-OCEACIFDSA-N 0 0 412.405 6.121 40 10 HKCBRN Clc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cc3c(cc1Br)OCO3)N2 ZINC000017332250 558827036 /nfs/dbraw/zinc/82/70/36/558827036.db2.gz ZFMVEDMTPKHEJC-CRTZDJKQSA-N 0 0 404.691 5.658 40 10 HKCBRN O=C1/C(=C\c2c[nH]c3ccc(Br)cc23)SC(=S)N1c1ccccc1 ZINC000017353811 560868773 /nfs/dbraw/zinc/86/87/73/560868773.db2.gz QKDGGRSEZDTZFJ-LZYBPNLTSA-N 0 0 415.337 5.336 40 10 HKCBRN CC(=C\c1ccccc1)/C=C1/SC(=S)N(c2cc(Cl)cc(Cl)c2)C1=O ZINC000017373697 558827297 /nfs/dbraw/zinc/82/72/97/558827297.db2.gz BEEVPGDVKXPIBI-RZKYTRJLSA-N 0 0 406.359 6.346 40 10 HKCBRN O=C(Oc1ccc(/N=N/c2ccc(OC(=O)c3ccccc3)cc2)cc1)c1ccccc1 ZINC000017542593 559124174 /nfs/dbraw/zinc/12/41/74/559124174.db2.gz LSNKJMMPJRNFOF-BYYHNAKLSA-N 0 0 422.440 6.540 40 10 HKCBRN CCn1c2ccccc2c2cc(/N=N/c3cc4cc5ccccc5cc4cc3N)ccc21 ZINC000017722426 558827772 /nfs/dbraw/zinc/82/77/72/558827772.db2.gz LVWOHEWJKIJNAB-NVQSTNCTSA-N 0 0 414.512 8.118 40 10 HKCBRN COc1ccc(/N=N/c2ccc3oc(=O)c(C(=O)Nc4ccccc4C)cc3c2)cc1 ZINC000017778432 558827970 /nfs/dbraw/zinc/82/79/70/558827970.db2.gz ZJVMYWTYUAFFOA-CYYJNZCTSA-N 0 0 413.433 5.778 40 10 HKCBRN CCCCC1=NN2C(=NC(=O)/C(=C/c3ccc(-c4cccc(Cl)c4)o3)C2=N)S1 ZINC000017862151 559123242 /nfs/dbraw/zinc/12/32/42/559123242.db2.gz UWRLFEPMDATXAR-AZAZKDLZSA-N 0 0 412.902 5.409 40 10 HKCBRN CCn1c2ccccc2c2cc(/N=N/c3ccc4c(c3)c3ccccc3n4CC)ccc21 ZINC000017887401 558828569 /nfs/dbraw/zinc/82/85/69/558828569.db2.gz GGSYFBKGHLGGBL-QVIHXGFCSA-N 0 0 416.528 8.358 40 10 HKCBRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1/N=N/c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000018038512 558829877 /nfs/dbraw/zinc/82/98/77/558829877.db2.gz DGGOIOMXJOCAKL-QURGRASLSA-N 0 0 408.214 5.956 40 10 HKCBRN O=C1C=CC(=NNc2c(Br)cc([N+](=O)[O-])cc2Br)C=C1 ZINC000018058604 558830232 /nfs/dbraw/zinc/83/02/32/558830232.db2.gz NLDRBKFCMSXIMY-FOCLMDBBSA-N 0 0 401.014 5.241 40 10 HKCBRN O=c1ccc(=NNc2ccc([N+](=O)[O-])cc2Cl)c2c(=O)c3ccccc3c(=O)c1=2 ZINC000018098634 558831089 /nfs/dbraw/zinc/83/10/89/558831089.db2.gz IEXCCPKNYHWLNG-GHVJWSGMSA-N 0 0 407.769 5.145 40 10 HKCBRN O=C(Nc1ccc(Cl)cc1)c1cc2c3c(c1)[C@H]1C=CC[C@@H]1CN3C[C@@H]1CC=C[C@@H]21 ZINC000018100775 569383684 /nfs/dbraw/zinc/38/36/84/569383684.db2.gz GABJEMYOCSTNBS-IFCLKOLQSA-N 0 0 402.925 5.745 40 10 HKCBRN Cc1cccc(NC(=O)c2cc3cc(/N=N/c4ccccc4Cl)ccc3oc2=O)c1 ZINC000018143431 558832148 /nfs/dbraw/zinc/83/21/48/558832148.db2.gz HYENGBBCWLYETF-CYYJNZCTSA-N 0 0 417.852 6.423 40 10 HKCBRN COc1cc(/N=N/c2ccc(N)nc2N)c(OC)cc1/N=N/c1ccc([N+](=O)[O-])cc1 ZINC000018156451 558832386 /nfs/dbraw/zinc/83/23/86/558832386.db2.gz IFUWHSTUYLHHCN-OGGGYYITSA-N 0 0 422.405 5.002 40 10 HKCBRN COc1cc(/N=N\c2ccc(N)nc2N)c(OC)cc1/N=N/c1ccc([N+](=O)[O-])cc1 ZINC000018156453 558832361 /nfs/dbraw/zinc/83/23/61/558832361.db2.gz IFUWHSTUYLHHCN-MRAZZECGSA-N 0 0 422.405 5.002 40 10 HKCBRN COc1cc(-c2ccc(/N=N/c3ccccc3)c(OC)c2)ccc1/N=N/c1ccccc1 ZINC000018169206 558832585 /nfs/dbraw/zinc/83/25/85/558832585.db2.gz MMOYRWFODWJWKM-QAVVBOBSSA-N 0 0 422.488 8.202 40 10 HKCBRN O=C(O/C(=C(/N=N/c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1 ZINC000018178653 558832746 /nfs/dbraw/zinc/83/27/46/558832746.db2.gz CRYAIAGXVMJABY-NKOIKLBZSA-N 0 0 404.469 7.153 40 10 HKCBRN c1c2ccccc2[nH]c1/N=N/c1cccc2c(/N=N/c3cc4ccccc4[nH]3)cccc12 ZINC000018181051 558832777 /nfs/dbraw/zinc/83/27/77/558832777.db2.gz OPYYZEZGTXAJEB-JWTBXLROSA-N 0 0 414.472 8.633 40 10 HKCBRN COc1ccc(/N=N/c2nc3cc(Br)c(Br)cc3n2C)cc1 ZINC000018183222 560870955 /nfs/dbraw/zinc/87/09/55/560870955.db2.gz GCAISBKBIUBBJN-FMQUCBEESA-N 0 0 424.096 5.522 40 10 HKCBRN O=C1c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)[C@@]2(Cl)CC=CC[C@@]12Cl ZINC000018188126 558832891 /nfs/dbraw/zinc/83/28/91/558832891.db2.gz BATMELCQLQGSTJ-OKILXGFUSA-N 0 0 418.918 5.984 40 10 HKCBRN CC(=O)Nc1ccc(/N=N/c2ccc(/N=N/c3ccc(NC(C)=O)cc3)cc2)cc1 ZINC000018206754 558833430 /nfs/dbraw/zinc/83/34/30/558833430.db2.gz MOHHIDUYBMLZAV-NBHCHVEOSA-N 0 0 400.442 6.434 40 10 HKCBRN COc1cc(CN[C@@H](Cc2ccsc2)c2nc(C)cs2)ccc1N1CCCC1 ZINC000019240223 558858888 /nfs/dbraw/zinc/85/88/88/558858888.db2.gz BOYKEAGFVCLLEO-IBGZPJMESA-N 0 0 413.612 5.195 40 10 HKCBRN COc1cc(CN[C@H](Cc2ccsc2)c2nc(C)cs2)ccc1N1CCCC1 ZINC000019240224 558858856 /nfs/dbraw/zinc/85/88/56/558858856.db2.gz BOYKEAGFVCLLEO-LJQANCHMSA-N 0 0 413.612 5.195 40 10 HKCBRN Oc1ccccc1C1N(Cc2ccc(Cl)cc2)CCN1Cc1ccc(Cl)cc1 ZINC000019319445 558867299 /nfs/dbraw/zinc/86/72/99/558867299.db2.gz RHMQAAFHGZAFPU-UHFFFAOYSA-N 0 0 413.348 5.716 40 10 HKCBRN CC(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cc3c(cc1Br)OCO3)N2 ZINC000020033506 341977374 /nfs/dbraw/zinc/97/73/74/341977374.db2.gz VHSVKVWHYFBIFJ-QTCYRWPVSA-N 0 0 412.283 5.207 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@@H]21 ZINC000020058206 560880230 /nfs/dbraw/zinc/88/02/30/560880230.db2.gz MZPRADALSUCTGP-IIDMSEBBSA-N 0 0 401.260 5.192 40 10 HKCBRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000020106358 558333478 /nfs/dbraw/zinc/33/34/78/558333478.db2.gz XHCAOHGFXURKPV-RUZDIDTESA-N 0 0 402.538 5.304 40 10 HKCBRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000020106360 558333420 /nfs/dbraw/zinc/33/34/20/558333420.db2.gz XHCAOHGFXURKPV-VWLOTQADSA-N 0 0 402.538 5.304 40 10 HKCBRN CC[C@@H](Oc1cccc2ccccc21)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000020107349 558333890 /nfs/dbraw/zinc/33/38/90/558333890.db2.gz VCKSIVXZDNXHPV-XMMPIXPASA-N 0 0 402.538 5.304 40 10 HKCBRN CC[C@H](Oc1cccc2ccccc21)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000020107351 558333844 /nfs/dbraw/zinc/33/38/44/558333844.db2.gz VCKSIVXZDNXHPV-DEOSSOPVSA-N 0 0 402.538 5.304 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2ccc3ccccc3c2)cc1 ZINC000020244071 560883374 /nfs/dbraw/zinc/88/33/74/560883374.db2.gz USTVAUXVDPVHMZ-OVVQPSECSA-N 0 0 418.496 6.225 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1sccc1C ZINC000020426794 558362479 /nfs/dbraw/zinc/36/24/79/558362479.db2.gz QXBIHQLLLXDQFJ-LCYFTJDESA-N 0 0 408.306 5.241 40 10 HKCBRN O=C(CSCc1ccc(Cl)c(Cl)c1)NCc1ccc(N2CCCCC2)cc1 ZINC000020493663 558379196 /nfs/dbraw/zinc/37/91/96/558379196.db2.gz FBWFEQYVQLBNEC-UHFFFAOYSA-N 0 0 423.409 5.533 40 10 HKCBRN O=C1/C(=C\c2ccc(OCc3ccc(F)cc3)cc2)SC(=S)N1c1ccccc1 ZINC000020523057 568443040 /nfs/dbraw/zinc/44/30/40/568443040.db2.gz QCMRSOZFOXIOES-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccc(Br)cc1)[C@H]1CC=C[C@@H]21 ZINC000020680581 568457760 /nfs/dbraw/zinc/45/77/60/568457760.db2.gz SOELNBRTBGOSRU-QWQRMKEZSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccc(Br)cc1)[C@@H]1CC=C[C@@H]21 ZINC000020680584 568457804 /nfs/dbraw/zinc/45/78/04/568457804.db2.gz SOELNBRTBGOSRU-HBUWYVDXSA-N 0 0 401.260 5.192 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000020680700 568457796 /nfs/dbraw/zinc/45/77/96/568457796.db2.gz KLYFCRCTRIKBNK-CPUCHLNUSA-N 0 0 405.133 6.038 40 10 HKCBRN O=C(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Br)cc1)N2)N1CCCC1 ZINC000020681229 569349698 /nfs/dbraw/zinc/34/96/98/569349698.db2.gz MTWZOMYMUFGQCP-KNKQGSTJSA-N 0 0 423.354 5.512 40 10 HKCBRN O=C(c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Br)cc1)N2)N1CCCC1 ZINC000020681232 568457820 /nfs/dbraw/zinc/45/78/20/568457820.db2.gz MTWZOMYMUFGQCP-WOIUINJBSA-N 0 0 423.354 5.512 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000020704020 569349691 /nfs/dbraw/zinc/34/96/91/569349691.db2.gz NAHWCBGHNHDIFX-VFVRVIDISA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000020704266 569349657 /nfs/dbraw/zinc/34/96/57/569349657.db2.gz WEVPXBSNJYPFKD-QFSBIZTOSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@H]32)c1 ZINC000020705926 569349681 /nfs/dbraw/zinc/34/96/81/569349681.db2.gz TVJLOTKNPXJXGH-PSTGCABASA-N 0 0 405.679 5.837 40 10 HKCBRN Clc1cccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@H]32)c1Cl ZINC000020711450 568457868 /nfs/dbraw/zinc/45/78/68/568457868.db2.gz RYFNMXBLKQIFDF-CGMALJKESA-N 0 0 419.566 7.780 40 10 HKCBRN CCc1ccc(NC(=O)C2=C(C)Nc3nc4ccccc4n3[C@@H]2c2ccccc2O)cc1 ZINC000020970139 558425076 /nfs/dbraw/zinc/42/50/76/558425076.db2.gz XEFLDUFFXBOMEB-XMMPIXPASA-N 0 0 424.504 5.232 40 10 HKCBRN CCc1ccc(NC(=O)C2=C(C)Nc3nc4ccccc4n3[C@H]2c2ccccc2O)cc1 ZINC000020970143 558425088 /nfs/dbraw/zinc/42/50/88/558425088.db2.gz XEFLDUFFXBOMEB-DEOSSOPVSA-N 0 0 424.504 5.232 40 10 HKCBRN CCOc1ccc2nc(Sc3ccccc3)c(C=C3SC(=S)NC3=O)cc2c1 ZINC000022079705 558462995 /nfs/dbraw/zinc/46/29/95/558462995.db2.gz RCEHIUCVDQBGOH-LDADJPATSA-N 0 0 424.572 5.274 40 10 HKCBRN CC(C)N1CCCc2cc([C@H]3c4ccccc4C=CN3C(=O)c3ccccc3)ccc21 ZINC000022114863 558463589 /nfs/dbraw/zinc/46/35/89/558463589.db2.gz UGYNXIJYLXBRHS-MHZLTWQESA-N 0 0 408.545 6.064 40 10 HKCBRN CC(C)N1CCCc2cc([C@@H]3c4ccccc4C=CN3C(=O)c3ccccc3)ccc21 ZINC000022114866 535180434 /nfs/dbraw/zinc/18/04/34/535180434.db2.gz UGYNXIJYLXBRHS-HHHXNRCGSA-N 0 0 408.545 6.064 40 10 HKCBRN COc1ccccc1N1C(=O)/C(=C\c2ccc(F)c(Br)c2)SC1=S ZINC000022226052 568477185 /nfs/dbraw/zinc/47/71/85/568477185.db2.gz IEDNBIXKFDJHHH-OQLLNIDSSA-N 0 0 424.316 5.003 40 10 HKCBRN O=C(Oc1ccc(/N=N/c2ccc(C(=O)Oc3ccccc3)cc2)cc1)c1ccccc1 ZINC000024605390 569024912 /nfs/dbraw/zinc/02/49/12/569024912.db2.gz CZTGAUOTWSCOJW-BYYHNAKLSA-N 0 0 422.440 6.540 40 10 HKCBRN CCN(CCOc1ccc(OC)cc1)c1ccc(/N=N/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000025763589 559013026 /nfs/dbraw/zinc/01/30/26/559013026.db2.gz JRGMBLADXKQLLB-OCOZRVBESA-N 0 0 420.469 5.924 40 10 HKCBRN CCn1c(-c2ccc(Cl)cc2Cl)csc1=Nc1ccc(NC(C)=O)cc1 ZINC000026570052 558663177 /nfs/dbraw/zinc/66/31/77/558663177.db2.gz VYEGHGGBZOKLCH-UHFFFAOYSA-O 0 0 407.346 5.731 40 10 HKCBRN O=[N+]([O-])c1ccc([C@@H](O)Cn2c(-c3ccccc3)csc2=Nc2ccccc2)cc1 ZINC000026570084 558663161 /nfs/dbraw/zinc/66/31/61/558663161.db2.gz LIEFKALAPHUTRD-QFIPXVFZSA-O 0 0 418.498 5.088 40 10 HKCBRN O=[N+]([O-])c1ccc([C@H](O)Cn2c(-c3ccccc3)csc2=Nc2ccccc2)cc1 ZINC000026570087 558663197 /nfs/dbraw/zinc/66/31/97/558663197.db2.gz LIEFKALAPHUTRD-JOCHJYFZSA-O 0 0 418.498 5.088 40 10 HKCBRN C[C@@H](Oc1ccc(/C=C2\SC(=S)N(c3ccccc3)C2=O)cc1)c1ccccc1 ZINC000026675859 569025668 /nfs/dbraw/zinc/02/56/68/569025668.db2.gz INTNPLASRNNQKM-VULIGXMUSA-N 0 0 417.555 6.232 40 10 HKCBRN C[C@H](Oc1ccc(/C=C2\SC(=S)N(c3ccccc3)C2=O)cc1)c1ccccc1 ZINC000026675861 569025672 /nfs/dbraw/zinc/02/56/72/569025672.db2.gz INTNPLASRNNQKM-DBZAVIBRSA-N 0 0 417.555 6.232 40 10 HKCBRN O=C1/C(=C\C=C\c2ccco2)SC(=S)N1c1ccc(Cl)c(C(F)(F)F)c1 ZINC000027230099 569289614 /nfs/dbraw/zinc/28/96/14/569289614.db2.gz CIEINYONZLXQMN-GSPDUGTFSA-N 0 0 415.845 5.914 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000027345307 568567949 /nfs/dbraw/zinc/56/79/49/568567949.db2.gz AFLVJSJCGOFTTI-SCBVSMRHSA-N 0 0 407.642 6.540 40 10 HKCBRN CN(C)c1ccc(/C=C2\CCc3c2nc(-c2ccccc2)cc3-c2ccccc2)cc1 ZINC000027515394 558673890 /nfs/dbraw/zinc/67/38/90/558673890.db2.gz ATJIZPXGDIVKOJ-LYBHJNIJSA-N 0 0 402.541 6.968 40 10 HKCBRN Nc1ccc(Oc2ccc3c(c2)Oc2cc(O)ccc2[C@@]32OC(=O)c3ccccc32)cc1 ZINC000027638816 569385592 /nfs/dbraw/zinc/38/55/92/569385592.db2.gz SKRNNOWWEXPZBB-AREMUKBSSA-N 0 0 423.424 5.335 40 10 in-vitro HKCBRN Nc1ccc(Oc2ccc3c(c2)Oc2cc(O)ccc2[C@]32OC(=O)c3ccccc32)cc1 ZINC000027638822 569385596 /nfs/dbraw/zinc/38/55/96/569385596.db2.gz SKRNNOWWEXPZBB-SANMLTNESA-N 0 0 423.424 5.335 40 10 in-vitro HKCBRN CCOC(=O)c1cccc(N[C@@H](c2cccs2)c2ccc3cccnc3c2O)c1 ZINC000027644769 569026311 /nfs/dbraw/zinc/02/63/11/569026311.db2.gz YYFZAMAFLGVYRR-OAQYLSRUSA-N 0 0 404.491 5.380 40 10 HKCBRN CCOC(=O)c1cccc(N[C@H](c2cccs2)c2ccc3cccnc3c2O)c1 ZINC000027644776 569026281 /nfs/dbraw/zinc/02/62/81/569026281.db2.gz YYFZAMAFLGVYRR-NRFANRHFSA-N 0 0 404.491 5.380 40 10 HKCBRN COc1ccc(-c2nn(-c3ccccc3)cc2N=Nc2c(O)ccc3ccccc32)cc1 ZINC000027750678 568939845 /nfs/dbraw/zinc/93/98/45/568939845.db2.gz OEJQQYACTBMIRJ-BYYHNAKLSA-N 0 0 420.472 6.822 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(CC)C3=O)cn(Cc3ccc(F)cc3)c21 ZINC000027906268 569360020 /nfs/dbraw/zinc/36/00/20/569360020.db2.gz QHFQZHRQXLNXHL-NDENLUEZSA-N 0 0 424.566 5.612 40 10 HKCBRN Nc1ccc(NC(=O)c2ccc3nc(-c4ccccc4)c(-c4ccccc4)nc3c2)cc1 ZINC000028539624 569026583 /nfs/dbraw/zinc/02/65/83/569026583.db2.gz CNBYDVFOKBAJID-UHFFFAOYSA-N 0 0 416.484 5.798 40 10 HKCBRN O=C(CCc1nnc(-c2ccsc2)o1)Nc1ccc(/N=N/c2ccccc2)cc1 ZINC000030810100 568892474 /nfs/dbraw/zinc/89/24/74/568892474.db2.gz HUYXICQOWGPNTP-WCWDXBQESA-N 0 0 403.467 5.785 40 10 HKCBRN O=C(CSCc1ccc(Cl)c(Cl)c1)NCc1ccc(N2CCCC2)cc1 ZINC000030861104 558741627 /nfs/dbraw/zinc/74/16/27/558741627.db2.gz YIJQBVBJVYCIRQ-UHFFFAOYSA-N 0 0 409.382 5.143 40 10 HKCBRN C[N@H+](Cc1c[nH]c2ccccc12)Cc1cc(Br)cc(Br)c1[O-] ZINC000031666708 558751960 /nfs/dbraw/zinc/75/19/60/558751960.db2.gz CYZVKNLQWCNKFE-UHFFFAOYSA-N 0 0 424.136 5.031 40 10 HKCBRN N=C1/C(=C\c2ccc(-c3ccccc3)o2)C(=O)N=C2SC(C3CCCCC3)=NN21 ZINC000032109444 526838035 /nfs/dbraw/zinc/83/80/35/526838035.db2.gz KLEPPNCKIRCKCV-SLWLXCFBSA-N 0 0 404.495 5.146 40 10 HKCBRN N=C1/C(=C\c2ccc(-c3ccc(F)cc3)o2)C(=O)N=C2SC(C3CCCCC3)=NN21 ZINC000032109445 526838597 /nfs/dbraw/zinc/83/85/97/526838597.db2.gz VABADDBYLINLQW-HGPWHKJCSA-N 0 0 422.485 5.285 40 10 HKCBRN CCN1C(=O)/C(=C/c2cccc(OCc3ccc(Cl)c(Cl)c3)c2)SC1=S ZINC000032109496 521513294 /nfs/dbraw/zinc/51/32/94/521513294.db2.gz CDKZVYFSPBMGNY-YVLHZVERSA-N 0 0 424.374 5.794 40 10 HKCBRN CCN(CC)c1ccc(-n2c(C)cc(/C=C3\SC(=O)N(C(C)C)C3=O)c2C)cc1 ZINC000032115796 520879452 /nfs/dbraw/zinc/87/94/52/520879452.db2.gz OJLLINVMFWAORT-STZFKDTASA-N 0 0 411.571 5.385 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)SC1=S ZINC000032124805 521516696 /nfs/dbraw/zinc/51/66/96/521516696.db2.gz JJCXUNVUGYSOLJ-GZTJUZNOSA-N 0 0 416.549 5.276 40 10 HKCBRN Cc1cc(C=C2SC(=O)NC2=O)c(C)n1-c1ccc(OCc2ccccc2F)cc1 ZINC000032189095 526093799 /nfs/dbraw/zinc/09/37/99/526093799.db2.gz VVFYXVULBIVTPW-MTJSOVHGSA-N 0 0 422.481 5.136 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(N(C)C)cc3)S[C@H]2c2ccccc2)cc1 ZINC000032594774 524915780 /nfs/dbraw/zinc/91/57/80/524915780.db2.gz YUIIIMDNCKMUOD-PBMMVTTKSA-N 0 0 400.547 5.881 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(N(C)C)cc3)S[C@@H]2c2ccccc2)cc1 ZINC000032594775 524916389 /nfs/dbraw/zinc/91/63/89/524916389.db2.gz YUIIIMDNCKMUOD-IVNHJSRESA-N 0 0 400.547 5.881 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2)S[C@@H](c2ccccc2O)N1c1ccccc1F ZINC000032598128 526940573 /nfs/dbraw/zinc/94/05/73/526940573.db2.gz KSRZBLULSDLWFW-WLJFKGHSSA-N 0 0 411.885 6.004 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2)S[C@H](c2ccccc2O)N1c1ccccc1F ZINC000032598131 526940545 /nfs/dbraw/zinc/94/05/45/526940545.db2.gz KSRZBLULSDLWFW-VLOXRPPESA-N 0 0 411.885 6.004 40 10 HKCBRN COC(=O)c1ccc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000033313209 568696559 /nfs/dbraw/zinc/69/65/59/568696559.db2.gz RJOYWGGREJVLSN-UYRXBGFRSA-N 0 0 405.500 5.032 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)SC1=S ZINC000033315561 568696706 /nfs/dbraw/zinc/69/67/06/568696706.db2.gz LGCABZHJFQIZDK-XDHOZWIPSA-N 0 0 422.487 5.569 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3ccc(OCc4ccccc4)c(OC)c3)C(=O)O2)cc1 ZINC000033343232 568696701 /nfs/dbraw/zinc/69/67/01/568696701.db2.gz UDGAMNDDXYSQRS-KGENOOAVSA-N 0 0 414.457 5.264 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccccc1Cl ZINC000033376118 568696771 /nfs/dbraw/zinc/69/67/71/568696771.db2.gz LSJYPAXOTKJBBQ-MOSHPQCFSA-N 0 0 408.910 5.988 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCCCOc3ccccc3C)cc2)SC1=S ZINC000033430058 559192252 /nfs/dbraw/zinc/19/22/52/559192252.db2.gz COZKVTFDYBSBKV-HKWRFOASSA-N 0 0 413.564 5.064 40 10 HKCBRN CCN1C(=O)/C(=C/c2cccc(OCCCOc3ccccc3C)c2)SC1=S ZINC000033430119 559192262 /nfs/dbraw/zinc/19/22/62/559192262.db2.gz ZHQGPGSZEPBAMF-HKWRFOASSA-N 0 0 413.564 5.064 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccccc2OCCCOc2ccccc2C)SC1=S ZINC000033430175 559192242 /nfs/dbraw/zinc/19/22/42/559192242.db2.gz IOISSBINTOPYLK-HKWRFOASSA-N 0 0 413.564 5.064 40 10 HKCBRN O=C1/C(=C\c2cc(Cl)c([O-])c(Cl)c2)SC(=S)N1c1ccc(Cl)cc1 ZINC000033458436 568697483 /nfs/dbraw/zinc/69/74/83/568697483.db2.gz AWKUVVVQMJLMAI-NTUHNPAUSA-N 0 0 416.738 5.758 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1cc(Cl)ccc1Cl ZINC000033479296 569360238 /nfs/dbraw/zinc/36/02/38/569360238.db2.gz ZNMMTFARKQYUPK-UDWIEESQSA-N 0 0 424.331 6.207 40 10 HKCBRN O=C1N=C(Nc2ccccc2)SC1=Cc1ccccc1OCc1ccc(Cl)cc1 ZINC000033540839 568697129 /nfs/dbraw/zinc/69/71/29/568697129.db2.gz KXQNVTKBXHECPJ-STZFKDTASA-N 0 0 420.921 6.001 40 10 HKCBRN Cc1cc(N2CCCC2)c(F)cc1/C=C1\SC(=O)N(Cc2ccccc2F)C1=O ZINC000033595502 569360206 /nfs/dbraw/zinc/36/02/06/569360206.db2.gz FMUUSUFOQNLUOA-NDENLUEZSA-N 0 0 414.477 5.110 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccn3-c3cccc([N+](=O)[O-])c3)SC2=S)c1 ZINC000033626046 568697796 /nfs/dbraw/zinc/69/77/96/568697796.db2.gz HZPSEEYRPUQTQC-CPNJWEJPSA-N 0 0 421.503 5.100 40 10 HKCBRN COc1cc(C)c(C=C2SC(Nc3cc(Cl)ccc3C)=NC2=O)cc1OC ZINC000033642653 569360215 /nfs/dbraw/zinc/36/02/15/569360215.db2.gz UWLQHJLTAFZGNN-NVMNQCDNSA-N 0 0 402.903 5.056 40 10 HKCBRN CCCOc1ccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1OC ZINC000033644532 569360180 /nfs/dbraw/zinc/36/01/80/569360180.db2.gz NZAAFTUKNUHGJI-PDGQHHTCSA-N 0 0 402.903 5.220 40 10 HKCBRN CCOc1c(Cl)cc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1OC ZINC000033651190 569360262 /nfs/dbraw/zinc/36/02/62/569360262.db2.gz NYLCANQCWREMBD-YBEGLDIGSA-N 0 0 423.321 5.483 40 10 HKCBRN CCN(CC)C(=S)Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000033655417 569360308 /nfs/dbraw/zinc/36/03/08/569360308.db2.gz VAZDNGIVSBSREL-UHFFFAOYSA-N 0 0 410.546 6.128 40 10 HKCBRN O=C1/C(=C\c2cccc(OCc3ccccc3F)c2)SC(=S)N1c1ccccc1 ZINC000033660042 568697988 /nfs/dbraw/zinc/69/79/88/568697988.db2.gz TZJGFJCPUKXSJY-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cn(Cc3ccc(F)cc3)c3ccccc23)SC1=S ZINC000033706993 568697654 /nfs/dbraw/zinc/69/76/54/568697654.db2.gz RJURKBGWZURWAP-UDWIEESQSA-N 0 0 410.539 5.440 40 10 HKCBRN CCCOc1ccc(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1 ZINC000033707479 568697706 /nfs/dbraw/zinc/69/77/06/568697706.db2.gz WLFFEOZEOAPTFC-YVLHZVERSA-N 0 0 407.919 5.674 40 10 HKCBRN CCN(CC)c1ccc(-n2c(C)cc(/C=C3\SC(=S)N(CC)C3=O)c2C)cc1 ZINC000033707795 569360329 /nfs/dbraw/zinc/36/03/29/569360329.db2.gz ZGXJLDBJGNYRHL-ZHZULCJRSA-N 0 0 413.612 5.161 40 10 HKCBRN CC1(C)Cc2c(cc(-c3ccccc3)n2-c2ccc(Oc3ccccc3)cc2)C(=O)C1 ZINC000033714730 569351052 /nfs/dbraw/zinc/35/10/52/569351052.db2.gz HUFANLUZRBNIAU-UHFFFAOYSA-N 0 0 407.513 7.092 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3cc(F)c(N4CCCC4)cc3C)S2)cc1 ZINC000033721994 569360334 /nfs/dbraw/zinc/36/03/34/569360334.db2.gz NKDVSEBIDLQHSC-STZFKDTASA-N 0 0 409.530 5.379 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cn(Cc3ccc(C)cc3)c3ccccc23)SC1=S ZINC000033730932 568697643 /nfs/dbraw/zinc/69/76/43/568697643.db2.gz JCUKXCDWINCFPW-FYJGNVAPSA-N 0 0 406.576 5.609 40 10 HKCBRN Cc1cc(N2CCCC2)c(F)cc1C=C1SC(Nc2cccc(Cl)c2)=NC1=O ZINC000033732268 569360309 /nfs/dbraw/zinc/36/03/09/569360309.db2.gz NYNAJZSVRBNZHU-ODLFYWEKSA-N 0 0 415.921 5.470 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)S2)cc1 ZINC000033739026 569360464 /nfs/dbraw/zinc/36/04/64/569360464.db2.gz VFWOXVTXCCGGIQ-JCMHNJIXSA-N 0 0 400.503 5.656 40 10 HKCBRN O=C1[C@H]2[C@@H](C(=O)N1c1ccc(N=Nc3ccccc3)cc1)[C@@H]1C(=O)C[C@H]2c2ccccc21 ZINC000033743716 558771194 /nfs/dbraw/zinc/77/11/94/558771194.db2.gz DCRGAADTEDREEN-VWZDACTLSA-N 0 0 421.456 5.061 40 10 HKCBRN O=C1[C@@H]2[C@@H](C(=O)N1c1ccc(N=Nc3ccccc3)cc1)[C@@H]1C(=O)C[C@H]2c2ccccc21 ZINC000033743717 558771282 /nfs/dbraw/zinc/77/12/82/558771282.db2.gz DCRGAADTEDREEN-ISQIARDLSA-N 0 0 421.456 5.061 40 10 HKCBRN CCCCCC[C@@H](C)Oc1ccc(Cl)cc1/C=C1\SC(NC(C)=O)=NC1=O ZINC000033752526 568698701 /nfs/dbraw/zinc/69/87/01/568698701.db2.gz YBKLMUHJYNRZJX-FDIDITGRSA-N 0 0 408.951 5.184 40 10 HKCBRN CCCCCC[C@H](C)Oc1ccc(Cl)cc1/C=C1\SC(NC(C)=O)=NC1=O ZINC000033752528 568698584 /nfs/dbraw/zinc/69/85/84/568698584.db2.gz YBKLMUHJYNRZJX-CYUIRQCWSA-N 0 0 408.951 5.184 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)S2)cc1 ZINC000033759725 569360489 /nfs/dbraw/zinc/36/04/89/569360489.db2.gz VCWDJVOUFCKQQF-HMAPJEAMSA-N 0 0 402.519 6.018 40 10 HKCBRN CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C\N(Cc1ccccc1)c1ccccc1 ZINC000033765297 558771277 /nfs/dbraw/zinc/77/12/77/558771277.db2.gz SRMQIJFZUMQRFE-QJOMJCCJSA-N 0 0 401.897 5.653 40 10 HKCBRN Cc1cc(N2CCCC2)c(F)cc1/C=C1\SC(=O)N(Cc2ccc(F)cc2)C1=O ZINC000033767570 569360504 /nfs/dbraw/zinc/36/05/04/569360504.db2.gz DTUQMVFJLNNWRQ-NDENLUEZSA-N 0 0 414.477 5.110 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3cc(F)c(N4CCCC4)cc3C)S2)cc1C ZINC000033776332 569360436 /nfs/dbraw/zinc/36/04/36/569360436.db2.gz NMMSEBNOOLNTFX-BKUYFWCQSA-N 0 0 409.530 5.434 40 10 HKCBRN CN(CCCNC(=S)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 ZINC000033776407 558771357 /nfs/dbraw/zinc/77/13/57/558771357.db2.gz VRAWRGPBYLKWNW-UHFFFAOYSA-N 0 0 401.885 5.172 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4cccc(C)c4C)c3C)C2=N)S1 ZINC000033782295 559244960 /nfs/dbraw/zinc/24/49/60/559244960.db2.gz YANTUGXYKYQUBK-YIFJCWOOSA-N 0 0 419.554 5.130 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000033787640 568697978 /nfs/dbraw/zinc/69/79/78/568697978.db2.gz PTTBTRDSQIXELV-QGOAFFKASA-N 0 0 403.956 5.925 40 10 HKCBRN O=C1OC(c2ccc(Oc3ccccc3)cc2)=C/C1=C\c1ccc(Cl)cc1Cl ZINC000033818226 569360534 /nfs/dbraw/zinc/36/05/34/569360534.db2.gz BIDOUTOVNJLCCA-SFQUDFHCSA-N 0 0 409.268 6.767 40 10 HKCBRN O=C1OC(c2ccc(Oc3ccccc3)cc2)=C/C1=C\c1c(Cl)cccc1Cl ZINC000033818227 569360487 /nfs/dbraw/zinc/36/04/87/569360487.db2.gz XAQLFAVDGOCUEF-DTQAZKPQSA-N 0 0 409.268 6.767 40 10 HKCBRN CCOc1c(Cl)cc(C=C2SC(Nc3ccc(C)cc3)=NC2=O)cc1Cl ZINC000033860418 569360458 /nfs/dbraw/zinc/36/04/58/569360458.db2.gz PQOHQLBIHSYWMK-YBEGLDIGSA-N 0 0 407.322 5.783 40 10 HKCBRN CCOc1c(Cl)cc(C=C2SC(Nc3ccc(C)cc3)=NC2=O)cc1Cl ZINC000033860419 569360542 /nfs/dbraw/zinc/36/05/42/569360542.db2.gz PQOHQLBIHSYWMK-MHWRWJLKSA-N 0 0 407.322 5.783 40 10 HKCBRN O=C1/C(=C/c2ccccc2OCc2ccccc2)SC(=S)N1Cc1ccccc1 ZINC000033869143 568698427 /nfs/dbraw/zinc/69/84/27/568698427.db2.gz BSAGUZDIUOBWEV-JCMHNJIXSA-N 0 0 417.555 5.667 40 10 HKCBRN CCOc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)c(OCC)c1 ZINC000033912684 568698332 /nfs/dbraw/zinc/69/83/32/568698332.db2.gz WFNDSMKQYGJFEI-WOJGMQOQSA-N 0 0 419.955 5.543 40 10 HKCBRN COc1ccc(OC)c(C2=C/C(=C\c3c4ccccc4cc4ccccc43)C(=O)O2)c1 ZINC000033926531 568698286 /nfs/dbraw/zinc/69/82/86/568698286.db2.gz KOUFYWOQSIEVHH-XMHGGMMESA-N 0 0 408.453 5.992 40 10 HKCBRN CCOc1c(Br)cc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)cc1OC ZINC000033927634 568698374 /nfs/dbraw/zinc/69/83/74/568698374.db2.gz DHMXTJYYOBQBHT-CXUHLZMHSA-N 0 0 415.283 5.146 40 10 HKCBRN CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2cc([N+](=O)[O-])ccc2Cl)cc1 ZINC000033969274 560551335 /nfs/dbraw/zinc/55/13/35/560551335.db2.gz IPICUXHYPAMJNC-UHFFFAOYSA-N 0 0 409.917 5.560 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccccc3)C2=O)cc1OC ZINC000034139188 568698933 /nfs/dbraw/zinc/69/89/33/568698933.db2.gz MMVXJAWVEAGMBO-XSFVSMFZSA-N 0 0 418.880 5.192 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3c[nH]c4ccccc34)SC2=S)cc1Cl ZINC000034234481 568698909 /nfs/dbraw/zinc/69/89/09/568698909.db2.gz PMVXASAEKYFEQW-CAOOACKPSA-N 0 0 400.912 5.236 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4ccc(C)c(C)c4)c3C)C2=N)S1 ZINC000034260123 560597079 /nfs/dbraw/zinc/59/70/79/560597079.db2.gz ZJKYODSNTYKPGS-MPZUNYIRSA-N 0 0 419.554 5.130 40 10 HKCBRN CCCCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4ccccc4)c3C)C2=N)S1 ZINC000034387961 568537043 /nfs/dbraw/zinc/53/70/43/568537043.db2.gz SDDHBGUOBPWXPC-ANDFITQPSA-N 0 0 419.554 5.294 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc(C)c1C ZINC000034688967 557015984 /nfs/dbraw/zinc/01/59/84/557015984.db2.gz CZHVRZKCEQHIMJ-HMAPJEAMSA-N 0 0 402.519 5.952 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(Cl)c(OCc3ccccc3)c(Cl)c2)SC1=S ZINC000034703292 569360589 /nfs/dbraw/zinc/36/05/89/569360589.db2.gz VAWFDIUQQHUOCO-YBEGLDIGSA-N 0 0 424.374 5.794 40 10 HKCBRN O=C1/C(=C/c2cccc(Cl)c2Cl)SC(=S)N1c1ccc(Cl)cc1 ZINC000034703708 569360692 /nfs/dbraw/zinc/36/06/92/569360692.db2.gz QFCAIQAFYRADHO-JYRVWZFOSA-N 0 0 400.739 6.053 40 10 HKCBRN C=CCOc1c(Cl)cc(C=C2SC(Nc3ccccc3)=NC2=O)cc1Cl ZINC000034718836 569360657 /nfs/dbraw/zinc/36/06/57/569360657.db2.gz GCALSQQXTLYIJX-WJDWOHSUSA-N 0 0 405.306 5.641 40 10 HKCBRN CCCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4ccc(F)cc4)c3C)C2=N)S1 ZINC000034720750 557424080 /nfs/dbraw/zinc/42/40/80/557424080.db2.gz ONBXXLYKKFFHCE-FZAWDKCWSA-N 0 0 423.517 5.043 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)S2)cc1 ZINC000035043014 557270165 /nfs/dbraw/zinc/27/01/65/557270165.db2.gz AOZOJDFWRNOBAU-MOSHPQCFSA-N 0 0 419.462 5.500 40 10 HKCBRN COc1c(Cl)cc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1Cl ZINC000035045586 569360844 /nfs/dbraw/zinc/36/08/44/569360844.db2.gz QNEQKOVGPJCZAG-ZSOIEALJSA-N 0 0 413.713 5.738 40 10 HKCBRN O=C1/C(=C\c2c(F)cccc2Cl)SC(=S)N1c1cccc(C(F)(F)F)c1 ZINC000035077782 557294326 /nfs/dbraw/zinc/29/43/26/557294326.db2.gz WJKHGMRDKMDDSB-RIYZIHGNSA-N 0 0 417.836 5.904 40 10 HKCBRN CC[C@@H](C)Oc1c(Cl)cc(C=C2SC(Nc3ccccc3)=NC2=O)cc1OC ZINC000035145298 557455435 /nfs/dbraw/zinc/45/54/35/557455435.db2.gz DSYIVEXHZYVNOC-FDIDITGRSA-N 0 0 416.930 5.608 40 10 HKCBRN CC[C@H](C)Oc1c(Cl)cc(C=C2SC(Nc3ccccc3)=NC2=O)cc1OC ZINC000035145300 557455542 /nfs/dbraw/zinc/45/55/42/557455542.db2.gz DSYIVEXHZYVNOC-CYUIRQCWSA-N 0 0 416.930 5.608 40 10 HKCBRN CCCOc1c(Cl)cc(C=C2SC(Nc3ccc(C)cc3)=NC2=O)cc1Cl ZINC000035213755 557573400 /nfs/dbraw/zinc/57/34/00/557573400.db2.gz KEJLTUWRKRKGMI-BOPFTXTBSA-N 0 0 421.349 6.173 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cn(Cc3ccccc3F)c3ccccc23)SC1=S ZINC000035401617 557708317 /nfs/dbraw/zinc/70/83/17/557708317.db2.gz XCKKCKXNDYRWNZ-UDWIEESQSA-N 0 0 410.539 5.440 40 10 HKCBRN COc1ccc(Br)cc1C=C1SC(Nc2ccc(C)cc2C)=NC1=O ZINC000035419543 557712146 /nfs/dbraw/zinc/71/21/46/557712146.db2.gz YLGQQCMUESHSJL-YVLHZVERSA-N 0 0 417.328 5.157 40 10 HKCBRN O=C1N=C(Nc2ccc(Cl)cc2)SC1=Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000035624712 557787193 /nfs/dbraw/zinc/78/71/93/557787193.db2.gz RALVMAHGWLWXTJ-WQRHYEAKSA-N 0 0 415.301 6.336 40 10 HKCBRN CCOc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4cccc(Cl)c4)o3)S2)cc1 ZINC000035646050 557802764 /nfs/dbraw/zinc/80/27/64/557802764.db2.gz XFBDHXJSMUIBLV-MOSHPQCFSA-N 0 0 424.909 6.081 40 10 HKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccc(Cl)cc3)cc1)N2 ZINC000036080599 557834324 /nfs/dbraw/zinc/83/43/24/557834324.db2.gz ZWLNQQLOBFVLFF-UMFSSWHCSA-N 0 0 401.937 7.054 40 10 HKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccc(Cl)cc3)cc1)N2 ZINC000036080621 557834337 /nfs/dbraw/zinc/83/43/37/557834337.db2.gz VYQOJGJEBDTYSM-UMFSSWHCSA-N 0 0 417.936 6.754 40 10 HKCBRN Cc1ccc(C)c2c1N[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000036080653 557834250 /nfs/dbraw/zinc/83/42/50/557834250.db2.gz PDEOXFTXBFQUCI-DXBVXKBHSA-N 0 0 415.964 7.362 40 10 HKCBRN CC(C)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC(=O)c3ccccc3)cc1)N2 ZINC000036081017 569351702 /nfs/dbraw/zinc/35/17/02/569351702.db2.gz REXGCXZTIOEQMA-DXBVXKBHSA-N 0 0 409.529 6.856 40 10 HKCBRN CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC(=O)c3ccccc3)cc1)N2 ZINC000036082270 569351703 /nfs/dbraw/zinc/35/17/03/569351703.db2.gz UUACWNPNBIQLOG-UMFSSWHCSA-N 0 0 409.485 5.935 40 10 HKCBRN COc1ccccc1[C@@H]1Nc2ccc(I)cc2[C@@H]2C=CC[C@@H]21 ZINC000036229968 557841790 /nfs/dbraw/zinc/84/17/90/557841790.db2.gz NUAVAFAHUHNVNE-BIENJYKASA-N 0 0 403.263 5.126 40 10 HKCBRN O=C1/C(=C\c2ccccc2OCc2ccccc2Cl)SC(=S)N1C1CC1 ZINC000036613109 558726343 /nfs/dbraw/zinc/72/63/43/558726343.db2.gz OWNCBMANUFNHER-WOJGMQOQSA-N 0 0 401.940 5.283 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(C3CC3)C2=O)ccc1OCc1ccccc1 ZINC000036613115 558726349 /nfs/dbraw/zinc/72/63/49/558726349.db2.gz VLQOVMQNMAKHID-MOSHPQCFSA-N 0 0 411.548 5.028 40 10 HKCBRN FC(F)(F)c1[nH]nc(-c2ccc(-n3cccc3)cc2)c1C12CC3CC(CC(C3)C1)C2 ZINC000036620406 558741586 /nfs/dbraw/zinc/74/15/86/558741586.db2.gz FEQXSAMXQYOSQA-UHFFFAOYSA-N 0 0 411.471 6.354 40 10 HKCBRN COc1cc([C@@H]2Nc3ccc(C)cc3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000037170881 569351718 /nfs/dbraw/zinc/35/17/18/569351718.db2.gz JBXVRVRKPUWPJU-SIFCLUCFSA-N 0 0 400.316 5.601 40 10 HKCBRN COc1cc([C@@H]2Nc3c(C)cc(C)cc3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000037170897 569351679 /nfs/dbraw/zinc/35/16/79/569351679.db2.gz GBFLRZKHOOTPQC-XFQAVAEZSA-N 0 0 414.343 5.910 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1c(O)ccc2ccccc21 ZINC000038177468 569360778 /nfs/dbraw/zinc/36/07/78/569360778.db2.gz GGIMIUIFMXHWSS-MOSHPQCFSA-N 0 0 419.864 5.076 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc3ccccc32)C(=O)/C1=C\c1c(F)cccc1Cl ZINC000038205183 569360808 /nfs/dbraw/zinc/36/08/08/569360808.db2.gz TUSQYJAUVNADSR-AQTBWJFISA-N 0 0 421.855 5.510 40 10 HKCBRN O=C1OC(c2ccc(-c3ccccc3)cc2)=C/C1=C\c1c2ccccc2cc2ccccc21 ZINC000038232080 569360846 /nfs/dbraw/zinc/36/08/46/569360846.db2.gz MEGRPEKIKXYLHA-LGUFXXKBSA-N 0 0 424.499 7.641 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3OC)N(c3ccc(F)cc3)C2=O)cc1 ZINC000039132426 569360722 /nfs/dbraw/zinc/36/07/22/569360722.db2.gz CTOFYEJSXHHBNV-CJLVFECKSA-N 0 0 416.452 5.068 40 10 HKCBRN CN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3Cl)cc2)SC1=S ZINC000040005892 558692740 /nfs/dbraw/zinc/69/27/40/558692740.db2.gz VPUOKDBIEBMMPU-PXNMLYILSA-N 0 0 410.347 5.403 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3)c(OC)c2)SC1=S ZINC000040005899 569360720 /nfs/dbraw/zinc/36/07/20/569360720.db2.gz MGASTAWSXOYKRS-WQRHYEAKSA-N 0 0 419.955 5.149 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(CC)C2=O)ccc1OCc1ccccc1F ZINC000040005901 558692699 /nfs/dbraw/zinc/69/26/99/558692699.db2.gz MDZQHJOJMKMZDM-XDHOZWIPSA-N 0 0 417.527 5.025 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(CC)C2=O)ccc1OCc1ccc(F)cc1 ZINC000040005902 558692672 /nfs/dbraw/zinc/69/26/72/558692672.db2.gz VVAZAAFWRKOEOH-XDHOZWIPSA-N 0 0 417.527 5.025 40 10 HKCBRN CCCN1C(=O)/C(=C/c2cccc(OCc3ccccc3Cl)c2)SC1=S ZINC000040005914 569360703 /nfs/dbraw/zinc/36/07/03/569360703.db2.gz SVUSNQKFDAEEKZ-PDGQHHTCSA-N 0 0 403.956 5.530 40 10 HKCBRN CCCN1C(=O)/C(=C/c2cccc(OCc3ccc(Cl)cc3)c2)SC1=S ZINC000040005916 569360728 /nfs/dbraw/zinc/36/07/28/569360728.db2.gz GQLQDBBJHOGHMS-PDGQHHTCSA-N 0 0 403.956 5.530 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(OCc3ccc(C)cc3)c(OC)c2)SC1=S ZINC000040005921 569360696 /nfs/dbraw/zinc/36/06/96/569360696.db2.gz FGUNWGOLWHCOPP-MOSHPQCFSA-N 0 0 413.564 5.194 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccc(OCc3ccccc3Cl)cc2)SC1=S ZINC000040006103 569360730 /nfs/dbraw/zinc/36/07/30/569360730.db2.gz TYKSIURIUQYVJE-ODLFYWEKSA-N 0 0 417.983 5.776 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3)cc2)SC1=S ZINC000040006104 569360743 /nfs/dbraw/zinc/36/07/43/569360743.db2.gz SCOZOTWICWFNBL-ODLFYWEKSA-N 0 0 417.983 5.776 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccc(OCc3ccc(F)cc3)cc2)SC1=S ZINC000040006105 569360814 /nfs/dbraw/zinc/36/08/14/569360814.db2.gz XFHSWXUXOYQZSD-ODLFYWEKSA-N 0 0 401.528 5.262 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cccc(OCc2ccccc2Cl)c1 ZINC000040007069 558692963 /nfs/dbraw/zinc/69/29/63/558692963.db2.gz QWUFWHCTMMIXCY-PXLXIMEGSA-N 0 0 402.881 5.725 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc(OCc4ccccc4Cl)cc3)C(=O)O2)cc1 ZINC000040864837 559129771 /nfs/dbraw/zinc/12/97/71/559129771.db2.gz RTNMHPOCUPSESZ-KGENOOAVSA-N 0 0 402.877 6.209 40 10 HKCBRN C[C@H](COc1ccccc1)Cn1cc(/C=C2\SC(=S)N(C)C2=O)c2ccccc21 ZINC000041077647 524593749 /nfs/dbraw/zinc/59/37/49/524593749.db2.gz QDAQXLCPSKNFBO-IXGURIBZSA-N 0 0 422.575 5.187 40 10 HKCBRN C[C@@H](COc1ccccc1)Cn1cc(/C=C2\SC(=S)N(C)C2=O)c2ccccc21 ZINC000041077648 524825830 /nfs/dbraw/zinc/82/58/30/524825830.db2.gz QDAQXLCPSKNFBO-YQODDJSKSA-N 0 0 422.575 5.187 40 10 HKCBRN O=C1/C(=C/c2ccc(SC3CCCCC3)o2)SC(=S)N1c1ccccc1 ZINC000041078006 526941104 /nfs/dbraw/zinc/94/11/04/526941104.db2.gz HUOZGZVCAPDSSX-LGMDPLHJSA-N 0 0 401.578 6.110 40 10 HKCBRN CCCCC1=NN2C(=NC(=O)/C(=C\c3ccc(SC4CCCCC4)o3)C2=N)S1 ZINC000041082901 519917413 /nfs/dbraw/zinc/91/74/13/519917413.db2.gz NEXDEZLUDNQHDY-FVLYSNIGSA-N 0 0 416.572 5.514 40 10 HKCBRN CCCCCC1=NN2C(=NC(=O)/C(=C\c3cccn3-c3c(C)cccc3C)C2=N)S1 ZINC000041083010 519946557 /nfs/dbraw/zinc/94/65/57/519946557.db2.gz QOCOCMKIRIRBKR-ZUGBYVCQSA-N 0 0 419.554 5.294 40 10 HKCBRN CCCCCC1=NN2C(=NC(=O)/C(=C\c3cccn3-c3ccc(C)cc3C)C2=N)S1 ZINC000041083028 519947227 /nfs/dbraw/zinc/94/72/27/519947227.db2.gz RDOKYKFZFITETM-ZUGBYVCQSA-N 0 0 419.554 5.294 40 10 HKCBRN CCCCCC1=NN2C(=NC(=O)/C(=C\c3ccc(Sc4ccccc4)o3)C2=N)S1 ZINC000041083111 519946428 /nfs/dbraw/zinc/94/64/28/519946428.db2.gz QXDRDTYVKCOQAI-ZXPXUXNTSA-N 0 0 424.551 5.630 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4cc(C)ccc4C)c3C)C2=N)S1 ZINC000041083379 519894639 /nfs/dbraw/zinc/89/46/39/519894639.db2.gz ZWMDWEQEVDLIAG-YIFJCWOOSA-N 0 0 419.554 5.130 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4ccccc4CC)c3C)C2=N)S1 ZINC000041083383 519894512 /nfs/dbraw/zinc/89/45/12/519894512.db2.gz YDNOJNHXVVRUNA-SDWZUDADSA-N 0 0 419.554 5.076 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2=N)S1 ZINC000041083387 519894916 /nfs/dbraw/zinc/89/49/16/519894916.db2.gz PSCLSVBTCQGINB-MPZUNYIRSA-N 0 0 419.554 5.130 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3cc(C)n(-c4c(C)cccc4C)c3C)C2=N)S1 ZINC000041083393 519894688 /nfs/dbraw/zinc/89/46/88/519894688.db2.gz GLSJVLWAAXTOEK-YIFJCWOOSA-N 0 0 419.554 5.130 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3ccc(-c4ccc(F)c(Cl)c4)o3)C2=N)S1 ZINC000041083407 519894723 /nfs/dbraw/zinc/89/47/23/519894723.db2.gz MDFIRIVARLFKGE-FSKGJUTHSA-N 0 0 416.865 5.158 40 10 HKCBRN CCCC1=NN2C(=NC(=O)/C(=C\c3ccc(SC4CCCCC4)o3)C2=N)S1 ZINC000041083416 519894477 /nfs/dbraw/zinc/89/44/77/519894477.db2.gz HJNKKEKFLVLVMM-NPAPQTCNSA-N 0 0 402.545 5.124 40 10 HKCBRN Cc1[nH]c2ccc(C)cc2c1/C=C1/C(=N)N2C(c3ccc(F)cc3)=CSC2=NC1=O ZINC000041083596 525424335 /nfs/dbraw/zinc/42/43/35/525424335.db2.gz BMIGRDZGFMQMRY-XSHSNWJLSA-N 0 0 416.481 5.228 40 10 HKCBRN CC1=NN2C(=NC(=O)/C(=C\c3ccc(Sc4cccc5ccccc54)o3)C2=N)S1 ZINC000041108165 520901537 /nfs/dbraw/zinc/90/15/37/520901537.db2.gz HKTAJJFZQMEYGV-JTKJEDPUSA-N 0 0 418.503 5.223 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C=CSC3=NC2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 ZINC000041108256 526082875 /nfs/dbraw/zinc/08/28/75/526082875.db2.gz MUNNEBSRRLZLGD-ROQGJMCKSA-N 0 0 417.321 5.178 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C/C(Br)=C/c2ccccc2)SC1=S ZINC000041108525 525219595 /nfs/dbraw/zinc/21/95/95/525219595.db2.gz MTJHEOOFEWVQTG-OZFCMSLCSA-N 0 0 416.365 5.680 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(N(C)C)c(Cl)c3)SC2=S)c(C)c1 ZINC000041108543 524915701 /nfs/dbraw/zinc/91/57/01/524915701.db2.gz MMAMIJUTEYPLNX-WQRHYEAKSA-N 0 0 402.972 5.429 40 10 HKCBRN Cc1cc(C(=O)C(=O)Nc2ccc(Cl)c(C)c2)c(C)n1-c1ccc(Cl)cc1 ZINC000041108649 526199640 /nfs/dbraw/zinc/19/96/40/526199640.db2.gz DVMRQXBEFWSCCK-UHFFFAOYSA-N 0 0 401.293 5.531 40 10 HKCBRN Cc1cc(C(=O)C(=O)Nc2cccc(Cl)c2Cl)c(C)n1-c1ccc(C)cc1 ZINC000041108652 526199901 /nfs/dbraw/zinc/19/99/01/526199901.db2.gz LNQUJAAYVCLWSI-UHFFFAOYSA-N 0 0 401.293 5.531 40 10 HKCBRN Cc1nn(-c2ccccc2)c2nc3c(c(-c4ccc(Cl)cc4)c12)C(=O)c1ccccc1-3 ZINC000044137965 527556249 /nfs/dbraw/zinc/55/62/49/527556249.db2.gz JMHITUQKRXDPQS-UHFFFAOYSA-N 0 0 421.887 6.261 40 10 HKCBRN Cc1nn(-c2ccccc2)c2nc3c(c(-c4ccc(O)cc4)c12)C(=O)c1ccccc1-3 ZINC000044138472 527556600 /nfs/dbraw/zinc/55/66/00/527556600.db2.gz GJHUVZHVGZXFFA-UHFFFAOYSA-N 0 0 403.441 5.313 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)c(Cl)c2)SC(=S)N1c1ccc(Cl)cc1 ZINC000048520810 558845846 /nfs/dbraw/zinc/84/58/46/558845846.db2.gz PKLDUVNLCLKDAJ-RIYZIHGNSA-N 0 0 400.739 6.053 40 10 HKCBRN O=C1N(Cc2ccccc2Cl)c2ccccc2C12Nc1cccc3cccc(c31)N2 ZINC000049947084 569038851 /nfs/dbraw/zinc/03/88/51/569038851.db2.gz CNYFLPRNPJHWKW-UHFFFAOYSA-N 0 0 411.892 5.730 40 10 HKCBRN O=C1N(Cc2ccc(Cl)cc2)c2ccccc2C12Nc1cccc3cccc(c31)N2 ZINC000049947086 569038907 /nfs/dbraw/zinc/03/89/07/569038907.db2.gz QGWUJYDMJLBPCO-UHFFFAOYSA-N 0 0 411.892 5.730 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S ZINC000054360639 569072244 /nfs/dbraw/zinc/07/22/44/569072244.db2.gz AMQIBAIMEVMJDT-DHDCSXOGSA-N 0 0 408.888 5.119 40 10 HKCBRN COc1ccc([C@H]2N=C(c3ccccc3)C[C@@H](c3cc(Cl)ccc3O)N2)cc1OC ZINC000057509307 568493581 /nfs/dbraw/zinc/49/35/81/568493581.db2.gz KXYJXPGCVWVSOA-RDPSFJRHSA-N 0 0 422.912 5.285 40 10 HKCBRN COc1ccc([C@@H]2N=C(c3ccccc3)C[C@@H](c3cc(Cl)ccc3O)N2)cc1OC ZINC000057509311 568493574 /nfs/dbraw/zinc/49/35/74/568493574.db2.gz KXYJXPGCVWVSOA-GBXCKJPGSA-N 0 0 422.912 5.285 40 10 HKCBRN COc1ccc([C@H]2N=C(c3ccccc3)C[C@H](c3cc(Cl)ccc3O)N2)cc1OC ZINC000057509315 568493607 /nfs/dbraw/zinc/49/36/07/568493607.db2.gz KXYJXPGCVWVSOA-YKSBVNFPSA-N 0 0 422.912 5.285 40 10 HKCBRN COc1ccc([C@@H]2N=C(c3ccccc3)C[C@H](c3cc(Cl)ccc3O)N2)cc1OC ZINC000057509318 568493495 /nfs/dbraw/zinc/49/34/95/568493495.db2.gz KXYJXPGCVWVSOA-HYBUGGRVSA-N 0 0 422.912 5.285 40 10 HKCBRN CCOc1ccc(N(Cc2ccccc2)Cc2cc3ccc(OC)cc3[nH]c2=O)cc1 ZINC000057719754 568496146 /nfs/dbraw/zinc/49/61/46/568496146.db2.gz BETDJTKKYVEZSV-UHFFFAOYSA-N 0 0 414.505 5.142 40 10 HKCBRN Cc1cc(CN(Cc2cccnc2)Cc2ccccc2F)c(C)n1-c1ccccn1 ZINC000057796901 558890502 /nfs/dbraw/zinc/89/05/02/558890502.db2.gz UCZHXHWRXKDCAJ-UHFFFAOYSA-N 0 0 400.501 5.226 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(Cc2ccccc2F)c2ccccc12 ZINC000058821985 568699721 /nfs/dbraw/zinc/69/97/21/568699721.db2.gz OPQVOYAFFSNZDM-HZHRSRAPSA-N 0 0 409.464 5.635 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(Cc2ccc(F)cc2)c2ccccc12 ZINC000058821988 568699724 /nfs/dbraw/zinc/69/97/24/568699724.db2.gz UYMJSWFPHOYAKG-BUVRLJJBSA-N 0 0 409.464 5.635 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cccc(OCc2cccc3ccccc32)c1 ZINC000058821995 568699686 /nfs/dbraw/zinc/69/96/86/568699686.db2.gz NTSBOKLRQAIIEF-OVVQPSECSA-N 0 0 418.496 6.225 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1cccc2ccccc21 ZINC000058821998 568699906 /nfs/dbraw/zinc/69/99/06/568699906.db2.gz USGXCFTVGVEHDD-NLRVBDNBSA-N 0 0 418.496 6.225 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(C)C2=O)cc(Cl)c1OCc1ccccc1 ZINC000058822002 568699742 /nfs/dbraw/zinc/69/97/42/568699742.db2.gz GTNRXXBHMLYRQN-GZTJUZNOSA-N 0 0 419.955 5.149 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(Cl)ccc1OCc1ccccc1F ZINC000058822004 568699707 /nfs/dbraw/zinc/69/97/07/568699707.db2.gz WHPRCMWOVAPSGB-KGENOOAVSA-N 0 0 420.871 5.864 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(Cl)ccc1OCc1ccc(F)cc1 ZINC000058822006 568699812 /nfs/dbraw/zinc/69/98/12/568699812.db2.gz HLQBKMMEKREVLL-HYARGMPZSA-N 0 0 420.871 5.864 40 10 HKCBRN Cc1ccccc1NS(=O)(=O)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2 ZINC000058845659 568699977 /nfs/dbraw/zinc/69/99/77/568699977.db2.gz YPYHXDHDTXCQCP-BPYKYCOYSA-N 0 0 416.546 5.622 40 10 HKCBRN Cc1cccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2ccccc2)N3)c1 ZINC000058845783 568700009 /nfs/dbraw/zinc/70/00/09/568700009.db2.gz JSMYVYVMKQDOIP-SGIRGMQISA-N 0 0 416.546 5.622 40 10 HKCBRN Cc1ccc(NS(=O)(=O)c2ccc3c(c2)[C@H]2C=CC[C@H]2[C@@H](c2ccccc2)N3)cc1 ZINC000058845897 568700029 /nfs/dbraw/zinc/70/00/29/568700029.db2.gz MBRAVYVLPHFVCQ-SGIRGMQISA-N 0 0 416.546 5.622 40 10 HKCBRN O=S(=O)(Nc1ccccc1F)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2 ZINC000058846928 568700024 /nfs/dbraw/zinc/70/00/24/568700024.db2.gz RLCLRZHSXZXPRF-XLNZFTOWSA-N 0 0 420.509 5.453 40 10 HKCBRN O=S(=O)(Nc1ccc(F)cc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2 ZINC000058847051 568699233 /nfs/dbraw/zinc/69/92/33/568699233.db2.gz GMKPHGZNTUPASB-YZUZCNPQSA-N 0 0 420.509 5.453 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(S(=O)(=O)Nc2ccc(-c3ccccc3)cc2)cc1 ZINC000058850409 568699263 /nfs/dbraw/zinc/69/92/63/568699263.db2.gz MXAKYYIOSXDZNY-UHFFFAOYSA-N 0 0 402.519 5.562 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 ZINC000058850524 568699206 /nfs/dbraw/zinc/69/92/06/568699206.db2.gz YLTSOTUQNGEOHW-UHFFFAOYSA-N 0 0 418.518 5.687 40 10 HKCBRN Brc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1Br)N2 ZINC000058850693 568699154 /nfs/dbraw/zinc/69/91/54/568699154.db2.gz GPAPNQZESWFQSC-FHSNZYRGSA-N 0 0 405.133 6.038 40 10 HKCBRN CSc1ccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058850938 568699251 /nfs/dbraw/zinc/69/92/51/568699251.db2.gz FKVZBUKHEZHWCR-GJYPPUQNSA-N 0 0 419.331 5.840 40 10 HKCBRN Cc1ccc([C@@H]2Nc3ccc(-c4nc5ccc(C)cc5s4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058851096 568699260 /nfs/dbraw/zinc/69/92/60/568699260.db2.gz FCXTVYKICTZRSV-SWYRRKHMSA-N 0 0 408.570 7.407 40 10 HKCBRN Cc1ccc2nc(-c3ccc4c(c3)[C@@H]3C=CC[C@@H]3[C@H](c3ccccc3F)N4)sc2c1 ZINC000058851108 568699179 /nfs/dbraw/zinc/69/91/79/568699179.db2.gz UMPDLJICPKGYLB-FUMQJTLXSA-N 0 0 412.533 7.237 40 10 HKCBRN Cc1ccc2nc(-c3ccc4c(c3)[C@@H]3C=CC[C@@H]3[C@H](c3ccc(F)cc3)N4)sc2c1 ZINC000058851114 568699255 /nfs/dbraw/zinc/69/92/55/568699255.db2.gz HTAAQJXKHVGYPQ-RNHFSVANSA-N 0 0 412.533 7.237 40 10 HKCBRN Clc1cc(Cl)c2c(c1Cl)[C@@H]1C=CC[C@@H]1[C@H](c1cccc3ccccc31)N2 ZINC000058851253 568699242 /nfs/dbraw/zinc/69/92/42/568699242.db2.gz ORXMYWYUEWQJHG-ZJTDPSCFSA-N 0 0 400.736 7.627 40 10 HKCBRN Clc1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)cc1Cl ZINC000058851281 568699193 /nfs/dbraw/zinc/69/91/93/568699193.db2.gz WAMPGXPETARLOK-KEYDSSBGSA-N 0 0 419.566 7.780 40 10 HKCBRN Clc1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)c(Cl)c1 ZINC000058851286 568699225 /nfs/dbraw/zinc/69/92/25/568699225.db2.gz QLBZQAYJSMLLPR-GPHJXTMHSA-N 0 0 419.566 7.780 40 10 HKCBRN Clc1cc(Cl)c2c(c1Cl)[C@@H]1C=CC[C@@H]1[C@H](c1c(Cl)cccc1Cl)N2 ZINC000058851306 568699136 /nfs/dbraw/zinc/69/91/36/568699136.db2.gz AXJRHCUUMGSYQE-KSRUKNBBSA-N 0 0 419.566 7.780 40 10 HKCBRN COc1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)cc1OC ZINC000058851324 568699227 /nfs/dbraw/zinc/69/92/27/568699227.db2.gz DXDDPOLUNLBEBR-UFYHVXEKSA-N 0 0 410.728 6.491 40 10 HKCBRN COc1cccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)c1OC ZINC000058851332 568699215 /nfs/dbraw/zinc/69/92/15/568699215.db2.gz JXUJDWKFHYYZAZ-LIBAHTEVSA-N 0 0 410.728 6.491 40 10 HKCBRN COC(=O)c1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058851338 568699115 /nfs/dbraw/zinc/69/91/15/568699115.db2.gz SAQDJMFCSRHESP-VBHSOAQHSA-N 0 0 408.712 6.260 40 10 HKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)cc(Cl)c(Cl)c2[C@@H]2C=CC[C@@H]21 ZINC000058851357 568699231 /nfs/dbraw/zinc/69/92/31/568699231.db2.gz DHUKSBILPJCIJD-GPHJXTMHSA-N 0 0 418.673 7.492 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2cccc3ccccc32)cc1 ZINC000058854818 568699220 /nfs/dbraw/zinc/69/92/20/568699220.db2.gz KFUUBFAATHLZHU-OVVQPSECSA-N 0 0 418.496 6.225 40 10 HKCBRN O=C1OC2(CCCCC2)OC(=O)C1=Cc1cccc(OCc2ccccc2Cl)c1 ZINC000058856260 568699140 /nfs/dbraw/zinc/69/91/40/568699140.db2.gz MNRUQGJGPOKZSU-UHFFFAOYSA-N 0 0 412.869 5.063 40 10 HKCBRN O=C1OC2(CCCCC2)OC(=O)C1=Cc1cccc(OCc2ccc(Cl)cc2)c1 ZINC000058865614 568699204 /nfs/dbraw/zinc/69/92/04/568699204.db2.gz IKNDQOIAMFNZRI-UHFFFAOYSA-N 0 0 412.869 5.063 40 10 HKCBRN O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccccc1OCc1ccc(Cl)cc1 ZINC000058865618 568699411 /nfs/dbraw/zinc/69/94/11/568699411.db2.gz UTAVHGUNXBVZNZ-UHFFFAOYSA-N 0 0 412.869 5.063 40 10 HKCBRN O=C1OC2(CCCC2)OC(=O)C1=Cc1cccc(OCc2cccc3ccccc32)c1 ZINC000058865997 568699514 /nfs/dbraw/zinc/69/95/14/568699514.db2.gz LTVXJLVNYMMASC-UHFFFAOYSA-N 0 0 414.457 5.173 40 10 HKCBRN O=C1OC2(CCCC2)OC(=O)C1=Cc1ccccc1OCc1cccc2ccccc21 ZINC000058866000 568699536 /nfs/dbraw/zinc/69/95/36/568699536.db2.gz YJVQAGLZTXDXFB-UHFFFAOYSA-N 0 0 414.457 5.173 40 10 HKCBRN O=C1OC2(CCCC2)OC(=O)C1=Cc1cn(Cc2ccccc2Cl)c2ccccc12 ZINC000058866095 568699383 /nfs/dbraw/zinc/69/93/83/568699383.db2.gz WNRWZMNTVPSNKQ-UHFFFAOYSA-N 0 0 421.880 5.097 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C(C)C)cc2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000058883541 568700891 /nfs/dbraw/zinc/70/08/91/568700891.db2.gz OXPGXHJSOFCNRZ-KQWNVCNZSA-N 0 0 417.549 5.985 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(C(C)(C)C)cc3)C(C(=O)OC)=C2C)cc1 ZINC000058883586 568700878 /nfs/dbraw/zinc/70/08/78/568700878.db2.gz FTRBEMHFMKJDBF-JWGURIENSA-N 0 0 419.521 5.260 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000058883910 568700888 /nfs/dbraw/zinc/70/08/88/568700888.db2.gz HTTUYPGGJXGIHX-PXNMLYILSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000058883913 568700902 /nfs/dbraw/zinc/70/09/02/568700902.db2.gz PRVRKWYQRZEEGB-NVNXTCNLSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000058883966 568700866 /nfs/dbraw/zinc/70/08/66/568700866.db2.gz QDWWFJYEWOIUHD-YBEGLDIGSA-N 0 0 421.802 5.236 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000058883974 568700747 /nfs/dbraw/zinc/70/07/47/568700747.db2.gz LQURHWVPOPCCQL-DHDCSXOGSA-N 0 0 422.695 5.524 40 10 HKCBRN CCOc1ccccc1/C=C1\C(=O)N(c2ccc(C(C)C)cc2)C(C)=C1C(=O)OC ZINC000058884044 568700753 /nfs/dbraw/zinc/70/07/53/568700753.db2.gz ZTTGRWKTYWQHPU-QNGOZBTKSA-N 0 0 405.494 5.086 40 10 HKCBRN CCOc1ccc(/C=C2\C(=O)N(c3ccc(C(C)C)cc3)C(C)=C2C(=O)OC)cc1 ZINC000058884048 568700855 /nfs/dbraw/zinc/70/08/55/568700855.db2.gz MCQJHSNHPLBEAG-JCMHNJIXSA-N 0 0 405.494 5.086 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C(C)C)cc2)C(=O)/C1=C\c1ccc(SC)cc1 ZINC000058884072 568700860 /nfs/dbraw/zinc/70/08/60/568700860.db2.gz HFPZIAYGDICLMZ-STZFKDTASA-N 0 0 407.535 5.409 40 10 HKCBRN Cc1cccc2c1N[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000058928528 568700002 /nfs/dbraw/zinc/70/00/02/568700002.db2.gz ROWMFMWETKOAFY-GVUKDKGQSA-N 0 0 401.937 7.054 40 10 HKCBRN Cc1ccc2c(c1C)N[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000058928541 568700153 /nfs/dbraw/zinc/70/01/53/568700153.db2.gz FJXBRHYRCJAMKI-DXBVXKBHSA-N 0 0 415.964 7.362 40 10 HKCBRN Cc1cc(C)c2c(c1)N[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000058928556 568700046 /nfs/dbraw/zinc/70/00/46/568700046.db2.gz LZPURHIAVWYMPW-DXBVXKBHSA-N 0 0 415.964 7.362 40 10 HKCBRN COc1cccc2c1N[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000058928564 568700080 /nfs/dbraw/zinc/70/00/80/568700080.db2.gz VVIGWOLHCUNOSB-SLSDLSHTSA-N 0 0 417.936 6.754 40 10 HKCBRN Fc1cccc2c1N[C@@H](c1ccc(OCc3ccc(Cl)cc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000058928599 568700122 /nfs/dbraw/zinc/70/01/22/568700122.db2.gz RXVVFCXBJLAVFR-DPLHUUCSSA-N 0 0 405.900 6.885 40 10 HKCBRN COc1ccc(C)c2c1N[C@@H](c1ccc(OCc3ccc(C)cc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000058928609 568700151 /nfs/dbraw/zinc/70/01/51/568700151.db2.gz POODVRWHWMZDRQ-DXBVXKBHSA-N 0 0 411.545 6.718 40 10 HKCBRN Cc1ccc(COc2ccc([C@@H]3Nc4c(C)ccc(Cl)c4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000058928618 568700140 /nfs/dbraw/zinc/70/01/40/568700140.db2.gz IFSQANOTAQSYCJ-KHVXQDHOSA-N 0 0 415.964 7.362 40 10 HKCBRN CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccc(C)cc3)cc1)N2 ZINC000058928671 568700148 /nfs/dbraw/zinc/70/01/48/568700148.db2.gz ODMPGFBLEJZRCM-QQNWGBJXSA-N 0 0 409.529 6.603 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@@H]3C=CC[C@@H]32)c1 ZINC000058929067 568700146 /nfs/dbraw/zinc/70/01/46/568700146.db2.gz GNJQTNSUXBTVGQ-VGTOOOLASA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Br)c1)N2 ZINC000058929074 568700142 /nfs/dbraw/zinc/70/01/42/568700142.db2.gz CDTFPHKUXBFPHE-IIYDPXPESA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Br)c1)N2 ZINC000058929076 568700044 /nfs/dbraw/zinc/70/00/44/568700044.db2.gz CDTFPHKUXBFPHE-IGCXYCKISA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Br)cc1)N2 ZINC000058929079 568700143 /nfs/dbraw/zinc/70/01/43/568700143.db2.gz YFKQICZOLVNGRJ-IIYDPXPESA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000058929084 568699970 /nfs/dbraw/zinc/69/99/70/568699970.db2.gz YFKQICZOLVNGRJ-IGCXYCKISA-N 0 0 405.679 5.837 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2[N+](=O)[O-])[C@@H]2C=CC[C@@H]21 ZINC000058929375 568700075 /nfs/dbraw/zinc/70/00/75/568700075.db2.gz WFJUBQUSIGATNH-FHSNZYRGSA-N 0 0 401.260 5.192 40 10 HKCBRN CCN1C(=O)/C(=C/c2cccc(OC)c2OCc2ccc(Cl)cc2)SC1=S ZINC000059167715 568701840 /nfs/dbraw/zinc/70/18/40/568701840.db2.gz HZLBUQQZURVEOT-BOPFTXTBSA-N 0 0 419.955 5.149 40 10 HKCBRN Cc1cc(/C=C2\C(=O)Nc3cc(C(F)(F)F)ccc32)c(C)n1-c1ccc(Cl)cc1 ZINC000059186130 568702222 /nfs/dbraw/zinc/70/22/22/568702222.db2.gz KUZZJIPHZHOKAR-GRSHGNNSSA-N 0 0 416.830 6.259 40 10 HKCBRN CCN1C(=O)/C(=C\c2ccc(OCc3c(F)cccc3Cl)cc2)SC1=S ZINC000059192227 568702321 /nfs/dbraw/zinc/70/23/21/568702321.db2.gz BFTABQWLRZURAV-LICLKQGHSA-N 0 0 407.919 5.279 40 10 HKCBRN CCN1C(=O)/C(=C/c2cccc(OCc3c(F)cccc3Cl)c2)SC1=S ZINC000059192229 568702582 /nfs/dbraw/zinc/70/25/82/568702582.db2.gz KBIOOXMKDMLMGU-YVLHZVERSA-N 0 0 407.919 5.279 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccco3)N=C2c2ccc(Br)cc2)cc1 ZINC000059229240 568702868 /nfs/dbraw/zinc/70/28/68/568702868.db2.gz ZPMLBCADUQBFKS-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccco3)N=C2c2ccccc2Br)cc1 ZINC000059229919 568702961 /nfs/dbraw/zinc/70/29/61/568702961.db2.gz WKORJCXAQGQWFC-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2c2ccccc2Cl)cc1 ZINC000059230213 568703018 /nfs/dbraw/zinc/70/30/18/568703018.db2.gz LTTHWDJEOSITIP-UDWIEESQSA-N 0 0 416.864 5.212 40 10 HKCBRN Cc1ccc(C)c([C@@H]2Nc3ccc4c(c3[C@@H]3C=CC[C@@H]32)C(=O)c2ccccc2C4=O)c1 ZINC000059401517 568705534 /nfs/dbraw/zinc/70/55/34/568705534.db2.gz SODSXKKRXZJQQW-FIAZIHOUSA-N 0 0 405.497 5.905 40 10 HKCBRN CC1=NN(c2ccc(C)c(Cl)c2)C(=O)/C1=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000059416951 568705808 /nfs/dbraw/zinc/70/58/08/568705808.db2.gz FJEROMIUFNUDQK-XDHOZWIPSA-N 0 0 421.840 5.623 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(-c3ccc(C)cc3Br)o2)SC1=S ZINC000059417898 568705684 /nfs/dbraw/zinc/70/56/84/568705684.db2.gz YCSBLYPFMNKIRU-MHWRWJLKSA-N 0 0 422.369 5.629 40 10 HKCBRN O=C1/C(=C\c2cc(Cc3ccccc3)ccc2O)SC(=S)N1C1CCCCC1 ZINC000059417909 568705711 /nfs/dbraw/zinc/70/57/11/568705711.db2.gz IAZPCHILLMXJPX-RCCKNPSSSA-N 0 0 409.576 5.517 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(CNc3ccc(C)c(C)c3)C2=O)cc1 ZINC000059417939 568705945 /nfs/dbraw/zinc/70/59/45/568705945.db2.gz PKEVCXRJCOXSCD-KGENOOAVSA-N 0 0 409.555 5.256 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)SC1=S ZINC000059417948 568705922 /nfs/dbraw/zinc/70/59/22/568705922.db2.gz AMQIBAIMEVMJDT-OQLLNIDSSA-N 0 0 408.888 5.119 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)SC(=S)N1c1cccc([N+](=O)[O-])c1 ZINC000059417963 568706041 /nfs/dbraw/zinc/70/60/41/568706041.db2.gz XABBJUWOSNVSPI-NSIKDUERSA-N 0 0 411.291 5.307 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1\SC(=S)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000059417982 568705978 /nfs/dbraw/zinc/70/59/78/568705978.db2.gz DSEMANJPWRIFBC-UNOMPAQXSA-N 0 0 422.487 5.162 40 10 HKCBRN COc1ccc(Br)cc1/C=C1/SC(=S)N(c2cccc(F)c2)C1=O ZINC000059417990 568706090 /nfs/dbraw/zinc/70/60/90/568706090.db2.gz UPMPZSULEMMYKM-OVCLIPMQSA-N 0 0 424.316 5.003 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3cccc(Oc4ccccc4)c3)SC2=S)cc1 ZINC000059418001 568705927 /nfs/dbraw/zinc/70/59/27/568705927.db2.gz IHOCDZPPZYNHDG-QNGOZBTKSA-N 0 0 419.527 5.893 40 10 HKCBRN O=C1/C(=C\c2ccccc2OCc2ccccc2F)SC(=S)N1c1ccccc1 ZINC000059418064 568705929 /nfs/dbraw/zinc/70/59/29/568705929.db2.gz VAAIAXSRPAOSEQ-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN O=C1/C(=C\c2ccccc2OCc2ccc(F)cc2)SC(=S)N1c1ccccc1 ZINC000059418065 568705958 /nfs/dbraw/zinc/70/59/58/568705958.db2.gz QBBKOHGSYALEFF-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN O=C1/C(=C\c2cccc(OCc3ccc(F)cc3)c2)SC(=S)N1c1ccccc1 ZINC000059418066 568706066 /nfs/dbraw/zinc/70/60/66/568706066.db2.gz NLZSTJFWMNBCPR-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN O=C1/C(=C\c2ccc(OCc3ccccc3F)cc2)SC(=S)N1c1ccccc1 ZINC000059418067 568706077 /nfs/dbraw/zinc/70/60/77/568706077.db2.gz VKKODRGIBXGBMX-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN CCN1C(=O)/C(=C\c2ccc(OC)c(OCc3ccc(Cl)cc3)c2)SC1=S ZINC000059418109 568706084 /nfs/dbraw/zinc/70/60/84/568706084.db2.gz YRNPNQJWEWBUNV-WOJGMQOQSA-N 0 0 419.955 5.149 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(OCc3ccccc3F)c(OC)c2)SC1=S ZINC000059418258 568706080 /nfs/dbraw/zinc/70/60/80/568706080.db2.gz VGTOJSKBLFSWEL-XDHOZWIPSA-N 0 0 417.527 5.025 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(OCc3ccc(F)cc3)c(OC)c2)SC1=S ZINC000059418259 568705936 /nfs/dbraw/zinc/70/59/36/568705936.db2.gz RQUJGPWHLSLSBI-XDHOZWIPSA-N 0 0 417.527 5.025 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(-c3cc([N+](=O)[O-])ccc3Cl)o2)SC1=S ZINC000059418261 568706309 /nfs/dbraw/zinc/70/63/09/568706309.db2.gz JHJBOQUMBQNRGY-OQLLNIDSSA-N 0 0 408.888 5.119 40 10 HKCBRN CCOc1ccc(C2=C/C(=C/c3cc(C)n(-c4ccc(Cl)cc4)c3C)C(=O)O2)cc1 ZINC000059425792 568706335 /nfs/dbraw/zinc/70/63/35/568706335.db2.gz ZLLYCUKQEZCARA-ZHZULCJRSA-N 0 0 419.908 6.128 40 10 HKCBRN CCOc1ccc(C2=C/C(=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C(=O)O2)cc1 ZINC000059425804 568706327 /nfs/dbraw/zinc/70/63/27/568706327.db2.gz NTQSFXLRYMEKEI-LGMDPLHJSA-N 0 0 403.390 5.235 40 10 HKCBRN Cc1ccc(C2=C/C(=C/c3ccc(-c4ccc(Br)cc4)o3)C(=O)O2)cc1 ZINC000059425874 568706269 /nfs/dbraw/zinc/70/62/69/568706269.db2.gz LSGZTDRKDPGBOP-ATVHPVEESA-N 0 0 407.263 5.999 40 10 HKCBRN Cc1ccc(C2=C/C(=C/c3ccc(-c4ccc(C)cc4Br)o3)C(=O)O2)cc1 ZINC000059425885 568706204 /nfs/dbraw/zinc/70/62/04/568706204.db2.gz WJYVESLOOZGZQT-ATVHPVEESA-N 0 0 421.290 6.307 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(-c4ccc(Br)cc4)o3)C(=O)O2)cc1 ZINC000059425967 568706331 /nfs/dbraw/zinc/70/63/31/568706331.db2.gz NRGGLDRUYTZPCZ-VBKFSLOCSA-N 0 0 423.262 5.699 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(-c4ccc(Cl)c(Cl)c4)o3)C(=O)O2)cc1 ZINC000059425973 568706293 /nfs/dbraw/zinc/70/62/93/568706293.db2.gz OGRVBRXQMUDSLT-GDNBJRDFSA-N 0 0 413.256 6.243 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(-c4ccc(Cl)cc4Cl)o3)C(=O)O2)cc1 ZINC000059425976 568706299 /nfs/dbraw/zinc/70/62/99/568706299.db2.gz QMFCKMGDCNIFGI-UVTDQMKNSA-N 0 0 413.256 6.243 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(-c4ccc([N+](=O)[O-])cc4C)o3)C(=O)O2)cc1 ZINC000059425979 568706304 /nfs/dbraw/zinc/70/63/04/568706304.db2.gz UZFHFWJGMIFHJS-VBKFSLOCSA-N 0 0 403.390 5.153 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(-c4ccc(Cl)c([N+](=O)[O-])c4)o3)C(=O)O2)cc1 ZINC000059425981 568706296 /nfs/dbraw/zinc/70/62/96/568706296.db2.gz DOPUENRSJBXZJZ-GDNBJRDFSA-N 0 0 423.808 5.498 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(-c4cccc(Cl)c4Cl)o3)C(=O)O2)cc1 ZINC000059425986 568706193 /nfs/dbraw/zinc/70/61/93/568706193.db2.gz SVTVAGKKKBPSNH-KAMYIIQDSA-N 0 0 413.256 6.243 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000059435706 568703861 /nfs/dbraw/zinc/70/38/61/568703861.db2.gz JAICEWIVPVBKLS-SXGWCWSVSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1c(O)ccc2ccccc21 ZINC000059435721 568704069 /nfs/dbraw/zinc/70/40/69/568704069.db2.gz DEKFTRUJBDXUFC-MOSHPQCFSA-N 0 0 419.864 5.076 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccc(C)cc1 ZINC000059435723 568704049 /nfs/dbraw/zinc/70/40/49/568704049.db2.gz YSFZTFJGUUCOAO-YBEGLDIGSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccccc1Cl ZINC000059435724 568704137 /nfs/dbraw/zinc/70/41/37/568704137.db2.gz CMIHQYYHJPOBKB-ZROIWOOFSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1cccc(Cl)c1 ZINC000059435725 568704100 /nfs/dbraw/zinc/70/41/00/568704100.db2.gz RZZBMOKJHDDZQA-DHDCSXOGSA-N 0 0 422.695 5.524 40 10 HKCBRN COc1cc([C@@H]2Nc3c(C)c(C)ccc3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000059437061 568704056 /nfs/dbraw/zinc/70/40/56/568704056.db2.gz UGOBBVDPXFBXDS-XFQAVAEZSA-N 0 0 414.343 5.910 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)SC(=S)N1c1ccc([N+](=O)[O-])cc1 ZINC000059459805 568704727 /nfs/dbraw/zinc/70/47/27/568704727.db2.gz HFIBHFVUFYZAHC-AUWJEWJLSA-N 0 0 411.291 5.307 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)c(Cl)c2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 ZINC000059459813 568704553 /nfs/dbraw/zinc/70/45/53/568704553.db2.gz LBISAVOEKWFBGO-ZSOIEALJSA-N 0 0 411.291 5.307 40 10 HKCBRN O=C1/C(=C/c2c3ccccc3cc3ccccc32)SC(=S)N1C1CCCCC1 ZINC000059459822 568704663 /nfs/dbraw/zinc/70/46/63/568704663.db2.gz CAMQXNRJIKBBEO-JCMHNJIXSA-N 0 0 403.572 6.527 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3cccc(Br)c3)SC2=S)c(C)c1 ZINC000059459826 568704628 /nfs/dbraw/zinc/70/46/28/568704628.db2.gz FDUSZKQFUUNXIT-YBEGLDIGSA-N 0 0 404.354 5.472 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c(C)c1 ZINC000059459829 568704577 /nfs/dbraw/zinc/70/45/77/568704577.db2.gz YIBNAKSHHABBGO-SXGWCWSVSA-N 0 0 404.900 5.271 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000059462519 568704649 /nfs/dbraw/zinc/70/46/49/568704649.db2.gz KPPXXRMLQPTCAB-LDADJPATSA-N 0 0 402.972 5.592 40 10 HKCBRN CC(C)c1ccc(/C=C2/C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2)cc1 ZINC000059463847 568704903 /nfs/dbraw/zinc/70/49/03/568704903.db2.gz RUUUQPJYZRNBRS-XQNSMLJCSA-N 0 0 411.461 5.553 40 10 HKCBRN Cc1ccc2cc(C3=C/C(=C\c4c5ccccc5cc5ccccc45)C(=O)O3)ccc2c1 ZINC000059472381 568704860 /nfs/dbraw/zinc/70/48/60/568704860.db2.gz YKPTUPSVCTXHFM-KOEQRZSOSA-N 0 0 412.488 7.436 40 10 HKCBRN CCCCCOc1ccc(/C=C2/C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1 ZINC000059474881 568706919 /nfs/dbraw/zinc/70/69/19/568706919.db2.gz IEHTZDWSOLKPKE-LKUDQCMESA-N 0 0 410.517 6.090 40 10 HKCBRN Cc1ccc(C=C2C(=O)N(c3ccccc3C)C(=O)N(c3ccccc3C)C2=O)cc1 ZINC000059484125 568707604 /nfs/dbraw/zinc/70/76/04/568707604.db2.gz JIBNGQCVUKVGCB-UHFFFAOYSA-N 0 0 410.473 5.195 40 10 HKCBRN Cc1ccccc1C=C1C(=O)N(c2ccccc2C)C(=O)N(c2ccccc2C)C1=O ZINC000059484127 568707624 /nfs/dbraw/zinc/70/76/24/568707624.db2.gz HMROOKOMEHHLBE-UHFFFAOYSA-N 0 0 410.473 5.195 40 10 HKCBRN O=C1c2ccccc2C(=O)C1(Nc1ccc(OCc2ccccc2)cc1)c1ccccc1 ZINC000059484663 568707891 /nfs/dbraw/zinc/70/78/91/568707891.db2.gz LZPNJMZBOVQCSI-UHFFFAOYSA-N 0 0 419.480 5.652 40 10 HKCBRN COc1ccc2c(c1)-c1c(ss/c1=N\c1cc(Cl)ccc1O)C(C)(C)N2 ZINC000059501093 568708397 /nfs/dbraw/zinc/70/83/97/568708397.db2.gz HUTMCZOSXSMDQP-UZYVYHOESA-N 0 0 404.944 5.737 40 10 HKCBRN O=C1/C(=C\C=C\c2cccc([N+](=O)[O-])c2)SC(=S)N1c1cccc(Cl)c1 ZINC000059514497 568708711 /nfs/dbraw/zinc/70/87/11/568708711.db2.gz HFKGZBKHFPLQCU-ZRQJSYPSSA-N 0 0 402.884 5.210 40 10 HKCBRN O=C1/C(=C\C=C\c2ccccc2[N+](=O)[O-])SC(=S)N1c1cccc(Cl)c1 ZINC000059514498 568708654 /nfs/dbraw/zinc/70/86/54/568708654.db2.gz NAVRUXPDWCLSKU-BOPDVPAVSA-N 0 0 402.884 5.210 40 10 HKCBRN O=C1/C(=C/c2c(Cl)cccc2Cl)SC(=S)N1c1cccc(Cl)c1 ZINC000059514499 568708734 /nfs/dbraw/zinc/70/87/34/568708734.db2.gz IKZMEXFUPRTOOY-ZSOIEALJSA-N 0 0 400.739 6.053 40 10 HKCBRN O=C1/C(=C\c2ccccc2OCc2ccccc2)SC(=S)N1c1ccccc1 ZINC000059514536 568709033 /nfs/dbraw/zinc/70/90/33/568709033.db2.gz WBYLQUJPROQJAX-RCCKNPSSSA-N 0 0 403.528 5.671 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cc(Cl)ccc3OCC)SC2=S)cc1 ZINC000059535586 568709044 /nfs/dbraw/zinc/70/90/44/568709044.db2.gz GXPKACBGQQBVOA-LDADJPATSA-N 0 0 419.955 5.543 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3cc([N+](=O)[O-])ccc3Cl)SC2=S)cc1 ZINC000059535631 568709328 /nfs/dbraw/zinc/70/93/28/568709328.db2.gz BGTSOVWACZBHIC-YBEGLDIGSA-N 0 0 420.899 5.053 40 10 HKCBRN COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000059566415 568706775 /nfs/dbraw/zinc/70/67/75/568706775.db2.gz CXKQTFKSDVIOLJ-BOPFTXTBSA-N 0 0 416.304 5.175 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000059959136 568709654 /nfs/dbraw/zinc/70/96/54/568709654.db2.gz OWIBJPIMXHQGPC-GDNBJRDFSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000059959167 568709643 /nfs/dbraw/zinc/70/96/43/568709643.db2.gz MKYPCSMAFNRNOO-BKUYFWCQSA-N 0 0 403.865 5.370 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C(C)C)cc2)C(=O)/C1=C\c1ccc(C(C)C)cc1 ZINC000059959231 568709620 /nfs/dbraw/zinc/70/96/20/568709620.db2.gz JVLVPZQMLWAIIJ-HAHDFKILSA-N 0 0 403.522 5.811 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C(C)C)cc2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000059959264 568709598 /nfs/dbraw/zinc/70/95/98/568709598.db2.gz DMLZVCOCYQFYKN-JLPGSUDCSA-N 0 0 411.501 5.840 40 10 HKCBRN COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000059959354 568709584 /nfs/dbraw/zinc/70/95/84/568709584.db2.gz NCKLVTVCOWRFFD-YVLHZVERSA-N 0 0 416.304 5.175 40 10 HKCBRN COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000059959356 568709659 /nfs/dbraw/zinc/70/96/59/568709659.db2.gz WBELNRAQJCQHFM-BOPFTXTBSA-N 0 0 416.304 5.175 40 10 HKCBRN O=S(=O)(Nc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccccc1F)N2 ZINC000059961074 568709950 /nfs/dbraw/zinc/70/99/50/568709950.db2.gz RPHZKIXVHCXGGJ-GLDPYIMESA-N 0 0 420.509 5.453 40 10 HKCBRN O=S(=O)(Nc1ccccc1)c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2 ZINC000059961080 568709876 /nfs/dbraw/zinc/70/98/76/568709876.db2.gz MVIHFJPKVULNCX-YZUZCNPQSA-N 0 0 420.509 5.453 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3ccccc3F)C2=O)cc1OCC ZINC000060510593 569352388 /nfs/dbraw/zinc/35/23/88/569352388.db2.gz CUQGXBUCWTXKOO-PDGQHHTCSA-N 0 0 403.500 5.029 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)ccc1O ZINC000060512481 569352432 /nfs/dbraw/zinc/35/24/32/569352432.db2.gz UQUXOZDNZKBOCO-MOSHPQCFSA-N 0 0 407.516 5.350 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3cccc(Cl)c3)C2=O)ccc1OC ZINC000060512736 569352457 /nfs/dbraw/zinc/35/24/57/569352457.db2.gz VHTSZVVTAZKSDB-YVLHZVERSA-N 0 0 405.928 5.153 40 10 HKCBRN COc1cccc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)c1OC ZINC000060512738 569352466 /nfs/dbraw/zinc/35/24/66/569352466.db2.gz SHCMSDUFGJVTLI-UYRXBGFRSA-N 0 0 407.516 5.263 40 10 HKCBRN O=[N+]([O-])c1ccccc1NCCn1c(-c2ccccc2)csc1=Nc1ccccc1 ZINC000065090448 558970091 /nfs/dbraw/zinc/97/00/91/558970091.db2.gz OHWRWINJYKKNQZ-UHFFFAOYSA-O 0 0 417.514 5.467 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c(NCc3ccccc3)cc3sc4ccccc4c3c21 ZINC000066089244 568940777 /nfs/dbraw/zinc/94/07/77/568940777.db2.gz CBXKUCHHJDYQJI-UHFFFAOYSA-N 0 0 419.505 6.442 40 10 HKCBRN COC(=O)c1ccc(COc2ccc(C3Nc4cccc5cccc(c54)N3)cc2)cc1 ZINC000070453903 559281822 /nfs/dbraw/zinc/28/18/22/559281822.db2.gz VILBBJSGZNCTNH-UHFFFAOYSA-N 0 0 410.473 5.742 40 10 HKCBRN Clc1ccc(COc2ccc(C3Nc4cccc5cccc(c54)N3)cc2)cc1Cl ZINC000070453904 559281858 /nfs/dbraw/zinc/28/18/58/559281858.db2.gz IXDUXJLHVYXANM-UHFFFAOYSA-N 0 0 421.327 7.262 40 10 HKCBRN Cc1cccn2cc(COc3ccc(C4Nc5cccc6cccc(c65)N4)cc3)nc12 ZINC000070453907 559281873 /nfs/dbraw/zinc/28/18/73/559281873.db2.gz ZWZTYZMUSVUZDW-UHFFFAOYSA-N 0 0 406.489 5.911 40 10 HKCBRN COc1cc(C2Nc3cccc4cccc(c43)N2)ccc1OCc1c(C)noc1C ZINC000070453915 559281890 /nfs/dbraw/zinc/28/18/90/559281890.db2.gz VDEQHYDOMMRTBM-UHFFFAOYSA-N 0 0 401.466 5.568 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C2Nc3cccc4cccc(c43)N2)cc1 ZINC000070453922 559281597 /nfs/dbraw/zinc/28/15/97/559281597.db2.gz SAUUOLRLRKJDMR-UHFFFAOYSA-N 0 0 417.852 6.730 40 10 HKCBRN Cc1cc(C2Nc3cccc4cccc(c43)N2)c(C)n1-c1ccc(OC(F)F)cc1 ZINC000070453948 569410552 /nfs/dbraw/zinc/41/05/52/569410552.db2.gz MWQPMFGCJGNQPF-UHFFFAOYSA-N 0 0 405.448 6.385 40 10 HKCBRN COc1cc(C2Nc3cccc4cccc(c43)N2)cc(Br)c1OC(F)F ZINC000070453955 569410545 /nfs/dbraw/zinc/41/05/45/569410545.db2.gz ZNYQWTOGKNBIDJ-UHFFFAOYSA-N 0 0 421.241 5.749 40 10 HKCBRN c1c(C2Nc3cccc4cccc(c43)N2)c(-c2cccnc2)nn1Cc1ccccc1 ZINC000070453968 569410557 /nfs/dbraw/zinc/41/05/57/569410557.db2.gz RWSRVJOUHFEGNL-UHFFFAOYSA-N 0 0 403.489 5.683 40 10 HKCBRN Cc1ccccc1-c1nn(-c2ccccc2)cc1C1Nc2cccc3cccc(c32)N1 ZINC000070453970 569410551 /nfs/dbraw/zinc/41/05/51/569410551.db2.gz RIMUDLZSYRXSBE-UHFFFAOYSA-N 0 0 402.501 6.537 40 10 HKCBRN CCOC(=O)c1ccc(-n2c(C)cc(C3Nc4cccc5cccc(c54)N3)c2C)cc1 ZINC000070453973 569410525 /nfs/dbraw/zinc/41/05/25/569410525.db2.gz STDFLQZTADBMFG-UHFFFAOYSA-N 0 0 411.505 5.960 40 10 HKCBRN Cc1cc(C2Nc3cccc4cccc(c43)N2)c(C)n1-c1cccc(C(F)(F)F)c1 ZINC000070453974 569410503 /nfs/dbraw/zinc/41/05/03/569410503.db2.gz FGVJLAVHINKPGH-UHFFFAOYSA-N 0 0 407.439 6.802 40 10 HKCBRN COc1ccc(-c2nn(-c3ccccc3)cc2C2Nc3cccc4cccc(c43)N2)cc1 ZINC000070453979 569410546 /nfs/dbraw/zinc/41/05/46/569410546.db2.gz UPLLGDWBLJDQAU-UHFFFAOYSA-N 0 0 418.500 6.237 40 10 HKCBRN CC(C)c1ccc(/C=C2/SC(=S)N(NC(=O)c3ccc(Cl)cc3)C2=O)cc1 ZINC000083260076 558833124 /nfs/dbraw/zinc/83/31/24/558833124.db2.gz OAXOEWZDYJLHDO-GZTJUZNOSA-N 0 0 416.955 5.010 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3ccc(-c4cc([N+](=O)[O-])ccc4C)o3)C(=O)O2)cc1 ZINC000083260599 558833151 /nfs/dbraw/zinc/83/31/51/558833151.db2.gz WAAVMDGEYMXWIC-LFIBNONCSA-N 0 0 403.390 5.153 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3ccc(-c4cc([N+](=O)[O-])ccc4Cl)o3)C(=O)O2)cc1 ZINC000083260606 558833116 /nfs/dbraw/zinc/83/31/16/558833116.db2.gz RTCVWIQXKUOMGT-GXDHUFHOSA-N 0 0 423.808 5.498 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3ccc(-c4cc(Cl)ccc4Cl)o3)C(=O)O2)cc1 ZINC000083260607 558833158 /nfs/dbraw/zinc/83/31/58/558833158.db2.gz SLYOCRODQGOODQ-GXDHUFHOSA-N 0 0 413.256 6.243 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccc(F)cc4)o3)SC2=S)cc1 ZINC000083261493 558833148 /nfs/dbraw/zinc/83/31/48/558833148.db2.gz IYFXZCWQCRQBFW-UNOMPAQXSA-N 0 0 411.479 5.500 40 10 HKCBRN CC(C)(C)c1ccc(C2=C/C(=C\c3ccc(I)o3)C(=O)O2)cc1 ZINC000083262025 558833133 /nfs/dbraw/zinc/83/31/33/558833133.db2.gz BLBOXYXXBUMXIZ-JLHYYAGUSA-N 0 0 420.246 5.163 40 10 HKCBRN CC(C)(C)c1ccc(C2=C/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C(=O)O2)cc1 ZINC000083262035 558833161 /nfs/dbraw/zinc/83/31/61/558833161.db2.gz QLDFEIOCSJDWEU-NBVRZTHBSA-N 0 0 415.445 6.134 40 10 HKCBRN CC(C)(C)c1ccc(C2=C/C(=C\c3ccc(-c4ccc(Cl)cc4)o3)C(=O)O2)cc1 ZINC000083262037 558833162 /nfs/dbraw/zinc/83/31/62/558833162.db2.gz YSCGDIPWARTZAQ-NBVRZTHBSA-N 0 0 404.893 6.879 40 10 HKCBRN CCOC(=O)c1ccc(-c2ccc(/C=C3\C=C(c4ccc(C)cc4)OC3=O)o2)cc1 ZINC000083262514 558833140 /nfs/dbraw/zinc/83/31/40/558833140.db2.gz YPDNSYOXDNNYQG-XSFVSMFZSA-N 0 0 400.430 5.413 40 10 HKCBRN CCOC(=O)c1ccc(-c2ccc(/C=C3\C=C(c4ccc(OC)cc4)OC3=O)o2)cc1 ZINC000083262520 558833144 /nfs/dbraw/zinc/83/31/44/558833144.db2.gz ZUXIUEUISHCZPB-XMHGGMMESA-N 0 0 416.429 5.113 40 10 HKCBRN O=C(NN1C(=O)/C(=C\c2cccc3ccccc23)SC1=S)c1ccc(Cl)cc1 ZINC000083306051 558833235 /nfs/dbraw/zinc/83/32/35/558833235.db2.gz FGRYMPXYACGZIU-LDADJPATSA-N 0 0 424.934 5.039 40 10 HKCBRN Cc1cc(/C=C2\C=C(c3ccc(C(C)(C)C)cc3)OC2=O)c(C)n1-c1ccc(C)cc1 ZINC000083309591 558833379 /nfs/dbraw/zinc/83/33/79/558833379.db2.gz DOWHSSWYWLICMY-XQNSMLJCSA-N 0 0 411.545 6.681 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C(=O)O2)cc1 ZINC000083317646 558833557 /nfs/dbraw/zinc/83/35/57/558833557.db2.gz LJESMKXGSCVGDD-XNTDXEJSSA-N 0 0 407.809 5.798 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000083318693 558833599 /nfs/dbraw/zinc/83/35/99/558833599.db2.gz DWEZFDXHORNCGQ-MOSHPQCFSA-N 0 0 409.913 5.515 40 10 HKCBRN COC(=O)C1=C(C)N(Cc2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000083318704 558833742 /nfs/dbraw/zinc/83/37/42/558833742.db2.gz LGBMOMLHFYWXMX-JCMHNJIXSA-N 0 0 403.522 5.165 40 10 HKCBRN C[C@]12C[C@H](CC(C)(C)C1)[N@H+](Cc1c([O-])ccc3c(-c4ccccc4)cc(=O)oc31)C2 ZINC000085875599 558851449 /nfs/dbraw/zinc/85/14/49/558851449.db2.gz JMBKSMPFEYYJKB-QYBDOPJKSA-N 0 0 403.522 5.566 40 10 HKCBRN C[C@@]12C[C@@H](CC(C)(C)C1)[N@H+](Cc1c([O-])ccc3c(-c4ccccc4)cc(=O)oc31)C2 ZINC000085875604 558851522 /nfs/dbraw/zinc/85/15/22/558851522.db2.gz JMBKSMPFEYYJKB-WXTAPIANSA-N 0 0 403.522 5.566 40 10 HKCBRN CCOC(=O)[C@@H](Cc1ccccc1)n1c(C)ccc1-c1ccc(Br)cc1 ZINC000095951482 559089380 /nfs/dbraw/zinc/08/93/80/559089380.db2.gz ZJSOQGZENKTEFP-OAQYLSRUSA-N 0 0 412.327 5.573 40 10 HKCBRN CCOC(=O)[C@H](Cc1ccccc1)n1c(C)ccc1-c1ccc(Br)cc1 ZINC000095951483 559089426 /nfs/dbraw/zinc/08/94/26/559089426.db2.gz ZJSOQGZENKTEFP-NRFANRHFSA-N 0 0 412.327 5.573 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@@H](c1cccc(Br)c1)[C@@H]1CC=C[C@@H]21 ZINC000096006219 559089672 /nfs/dbraw/zinc/08/96/72/559089672.db2.gz MZPRADALSUCTGP-RKVPGOIHSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1\C=C(c2ccc(Br)cc2)OC1=O ZINC000096483267 568721580 /nfs/dbraw/zinc/72/15/80/568721580.db2.gz FNGWTUDYERISJD-FOWTUZBSSA-N 0 0 407.263 5.592 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1cc(Cl)ccc1C ZINC000096499255 568722095 /nfs/dbraw/zinc/72/20/95/568722095.db2.gz IAFXABXGDQSUGV-LPYMAVHISA-N 0 0 403.913 5.862 40 10 HKCBRN Cc1ccc(COc2ccccc2/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1 ZINC000096505040 569361005 /nfs/dbraw/zinc/36/10/05/569361005.db2.gz MRACKSYNTQBOBV-PXLXIMEGSA-N 0 0 417.555 5.980 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000096505116 568722068 /nfs/dbraw/zinc/72/20/68/568722068.db2.gz JJAWWRCDTXNNKA-QGOAFFKASA-N 0 0 402.972 5.592 40 10 HKCBRN O=C1/C(=C\c2c(F)cccc2Cl)SC(=S)N1c1ccc(Cl)c(Cl)c1 ZINC000096505137 569360982 /nfs/dbraw/zinc/36/09/82/569360982.db2.gz FJWOLZUWKXIJOC-VGOFMYFVSA-N 0 0 418.729 6.192 40 10 HKCBRN Cc1cc(C=O)c(C)n1-c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 ZINC000096525836 559111147 /nfs/dbraw/zinc/11/11/47/559111147.db2.gz CJSTZEOUSSCACM-UHFFFAOYSA-N 0 0 404.344 5.626 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccc(Oc4ccccc4)c3)SC2=S)cc1C ZINC000096921076 568721937 /nfs/dbraw/zinc/72/19/37/568721937.db2.gz FPGRLVKLXVPYGR-PXLXIMEGSA-N 0 0 417.555 6.502 40 10 HKCBRN Cc1ccc(/N=N\c2ccc(C)cc2NC(=O)Nc2ccccc2C(F)(F)F)cc1 ZINC000100138618 559130362 /nfs/dbraw/zinc/13/03/62/559130362.db2.gz JFSSGPQRAXLHRN-ZIADKAODSA-N 0 0 412.415 7.382 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1ccccc1Cl ZINC000100147754 560723877 /nfs/dbraw/zinc/72/38/77/560723877.db2.gz LLAKCYHWWYXNRR-RCCKNPSSSA-N 0 0 402.881 5.725 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1ccc(Cl)cc1 ZINC000100147766 559164451 /nfs/dbraw/zinc/16/44/51/559164451.db2.gz XCLMRPWCWJRINN-PXLXIMEGSA-N 0 0 402.881 5.725 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(Cl)ccc1OCc1ccccc1 ZINC000100147800 568935676 /nfs/dbraw/zinc/93/56/76/568935676.db2.gz ASLXMDFMCUGYIZ-PXLXIMEGSA-N 0 0 402.881 5.725 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000100148029 560723890 /nfs/dbraw/zinc/72/38/90/560723890.db2.gz DUSUHJSRWGSFGD-LDADJPATSA-N 0 0 407.813 5.314 40 10 HKCBRN CC1=NN(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(-c2ccc3c(c2)COC3=O)o1 ZINC000100148165 560723862 /nfs/dbraw/zinc/72/38/62/560723862.db2.gz DELFQMFYMHQQHD-RGVLZGJSSA-N 0 0 418.836 5.077 40 10 HKCBRN Cc1nn(-c2ccccc2)c(Cl)c1/N=N/c1c(C)nn(-c2ccccc2)c1Cl ZINC000100150350 559130822 /nfs/dbraw/zinc/13/08/22/559130822.db2.gz VGSUNZCKJGGZIZ-WCWDXBQESA-N 0 0 411.296 6.397 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccccc1CC ZINC000100163498 560723904 /nfs/dbraw/zinc/72/39/04/560723904.db2.gz GWMJVERUJMVGNI-QNGOZBTKSA-N 0 0 404.539 5.748 40 10 HKCBRN CCN1C(=O)/C(=C/C=C2/Sc3ccc(-c4ccccc4)cc3N2CC)SC1=S ZINC000100199149 560723940 /nfs/dbraw/zinc/72/39/40/560723940.db2.gz MHCSYPJEEZMWRW-ZEDXCMECSA-N 0 0 424.616 5.891 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000100207937 560723965 /nfs/dbraw/zinc/72/39/65/560723965.db2.gz JLRSDIROCDWMIH-BOPFTXTBSA-N 0 0 402.277 5.261 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000100208166 560723949 /nfs/dbraw/zinc/72/39/49/560723949.db2.gz YXTBHSLWXATREI-KQWNVCNZSA-N 0 0 417.549 5.868 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(OC)cc2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000100208171 560723937 /nfs/dbraw/zinc/72/39/37/560723937.db2.gz LBWDHSSKHHJKBE-JWGURIENSA-N 0 0 419.521 5.260 40 10 HKCBRN Cc1ccc(NC(=O)C2=Cc3ccccc3C(=NNc3ccccc3O)C2=O)c(C)c1 ZINC000100250858 559133395 /nfs/dbraw/zinc/13/33/95/559133395.db2.gz JSSROCUNTZVPCI-DQSJHHFOSA-N 0 0 411.461 6.536 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(Cl)c2)C(=O)/C1=C/c1c(F)cccc1Cl ZINC000100275279 560724206 /nfs/dbraw/zinc/72/42/06/560724206.db2.gz OBEPMLKGPABHOK-XNTDXEJSSA-N 0 0 406.240 5.010 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C(C)C)cc2)C(=O)/C1=C/c1c(F)cccc1Cl ZINC000100275285 560724209 /nfs/dbraw/zinc/72/42/09/560724209.db2.gz CWCYTEMFYOHAMV-LDADJPATSA-N 0 0 413.876 5.480 40 10 HKCBRN COC(=O)c1cccc(-c2ccc(/C=C3/C(=O)N(c4ccc(Cl)cc4)N=C3C)o2)c1 ZINC000100278515 559133574 /nfs/dbraw/zinc/13/35/74/559133574.db2.gz SVROOWWOHYYWAF-DEDYPNTBSA-N 0 0 420.852 5.193 40 10 HKCBRN COc1ccc(Cl)cc1NC(=O)Nc1cc(C)ccc1/N=N\c1ccc(C)cc1 ZINC000100295884 559133799 /nfs/dbraw/zinc/13/37/99/559133799.db2.gz HLYJVLHHRKQBTE-RQZHXJHFSA-N 0 0 408.889 7.025 40 10 HKCBRN COc1ccc(-n2c(C)cc(C=CNc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c2C)cc1 ZINC000100306107 559133986 /nfs/dbraw/zinc/13/39/86/559133986.db2.gz YLNKNVKOWQYULK-ZHACJKMWSA-N 0 0 408.414 5.002 40 10 HKCBRN O=C1C=CC(=NNc2ccccc2)C(N=NC2=CC(=O)C=CC2=NNc2ccccc2)=C1 ZINC000100367793 559134475 /nfs/dbraw/zinc/13/44/75/559134475.db2.gz VASNUSURBQADNP-OUBLILEFSA-N 0 0 422.448 8.344 40 10 HKCBRN O=C1C=CC(=NNc2ccccc2)C(N=NC2=CC(=O)C=CC2=NNc2ccccc2)=C1 ZINC000100367798 559134472 /nfs/dbraw/zinc/13/44/72/559134472.db2.gz VASNUSURBQADNP-DJZLEYEBSA-N 0 0 422.448 8.344 40 10 HKCBRN O=C1C=CC(=NNc2ccccc2)C(N=NC2=CC(=O)C=CC2=NNc2ccccc2)=C1 ZINC000100367807 559134498 /nfs/dbraw/zinc/13/44/98/559134498.db2.gz VASNUSURBQADNP-BHYDKEGGSA-N 0 0 422.448 8.344 40 10 HKCBRN CC(=O)Nc1ccc(N=Nc2ccc([N+](=O)[N-]c3ccc(NC(C)=O)cc3)cc2)cc1 ZINC000100368340 559134625 /nfs/dbraw/zinc/13/46/25/559134625.db2.gz BRIVSOJUIFMMLK-LYJPHZJBSA-N 0 0 416.441 5.945 40 10 HKCBRN CC(=O)Nc1ccc(N=Nc2ccc([N+](=O)[N-]c3ccc(NC(C)=O)cc3)cc2)cc1 ZINC000100368344 559134583 /nfs/dbraw/zinc/13/45/83/559134583.db2.gz BRIVSOJUIFMMLK-PAMTUDGESA-N 0 0 416.441 5.945 40 10 HKCBRN CC(=O)Nc1ccc(N=Nc2ccc([N+](=O)[N-]c3ccc(NC(C)=O)cc3)cc2)cc1 ZINC000100368346 559134586 /nfs/dbraw/zinc/13/45/86/559134586.db2.gz BRIVSOJUIFMMLK-FNBANUKLSA-N 0 0 416.441 5.945 40 10 HKCBRN O=[N+]([N-]c1ccccc1)c1ccc(N=Nc2ccc([N+](=O)[N-]c3ccccc3)cc2)cc1 ZINC000100368948 559134611 /nfs/dbraw/zinc/13/46/11/559134611.db2.gz PJPSEMFRNAXBJQ-VFGSGIOWSA-N 0 0 422.448 7.953 40 10 HKCBRN O=[N+]([N-]c1ccccc1)c1ccc(N=Nc2ccc([N+](=O)[N-]c3ccccc3)cc2)cc1 ZINC000100368951 559134569 /nfs/dbraw/zinc/13/45/69/559134569.db2.gz PJPSEMFRNAXBJQ-YBBPUISWSA-N 0 0 422.448 7.953 40 10 HKCBRN O=[N+]([N-]c1ccccc1)c1ccc(N=Nc2ccc([N+](=O)[N-]c3ccccc3)cc2)cc1 ZINC000100368954 559134590 /nfs/dbraw/zinc/13/45/90/559134590.db2.gz PJPSEMFRNAXBJQ-HKRGUZEBSA-N 0 0 422.448 7.953 40 10 HKCBRN CN(C)c1ccc(/N=N/c2ccccc2C(=O)OCC(=O)NCC2CCCCC2)cc1 ZINC000100495118 569050216 /nfs/dbraw/zinc/05/02/16/569050216.db2.gz FIWOJDHHIMLTPK-CYYJNZCTSA-N 0 0 422.529 5.021 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C(/C=C/c1ccc(N(C)C)cc1)c1ccccc1 ZINC000100548277 560725242 /nfs/dbraw/zinc/72/52/42/560725242.db2.gz GQUDYIZSUMQXEL-MNXRNAIKSA-N 0 0 407.517 5.642 40 10 HKCBRN CCOc1ccc2[nH]c(=NC=C3C(=O)N(c4ccc(C)cc4C)N=C3C)sc2c1 ZINC000100552387 560725248 /nfs/dbraw/zinc/72/52/48/560725248.db2.gz IGZRDZHQRCDCFC-ATVHPVEESA-N 0 0 406.511 5.030 40 10 HKCBRN COc1ccc2[nH]c(=NC=C3C(=O)N(c4cccc5ccccc54)N=C3C)sc2c1 ZINC000100552389 560725246 /nfs/dbraw/zinc/72/52/46/560725246.db2.gz JBIFDZPKKXSDGR-AQTBWJFISA-N 0 0 414.490 5.177 40 10 HKCBRN CCOc1ccc2[nH]c(=NC=C3C(=O)N(c4ccc(Cl)cc4)N=C3C)sc2c1 ZINC000100552402 560725243 /nfs/dbraw/zinc/72/52/43/560725243.db2.gz UKAILOGTVDDCOO-WJDWOHSUSA-N 0 0 412.902 5.067 40 10 HKCBRN CC1=NN(c2cccc(Cl)c2)C(=O)C1=CN=c1[nH]c2ccc(Cl)cc2s1 ZINC000100552416 559136376 /nfs/dbraw/zinc/13/63/76/559136376.db2.gz BIKMNCYTBUNLCL-ZROIWOOFSA-N 0 0 403.294 5.322 40 10 HKCBRN COc1ccc(-c2csc(N3N=C(C)/C(=C\c4ccc(Cl)cc4)C3=O)n2)cc1 ZINC000100614769 560725734 /nfs/dbraw/zinc/72/57/34/560725734.db2.gz FCKGZWQBYRMYOA-WOJGMQOQSA-N 0 0 409.898 5.278 40 10 HKCBRN CC1=NN(c2c(Cl)cc(Cl)cc2Cl)C(=O)C1=CNc1cc(C)ccc1C ZINC000101112998 559163245 /nfs/dbraw/zinc/16/32/45/559163245.db2.gz MFVMMKBFSQDHKO-NTEUORMPSA-N 0 0 408.716 5.982 40 10 HKCBRN CCOc1cc2c(c([N+](=O)[O-])c1)N[C@@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@@H]21 ZINC000101151556 559143594 /nfs/dbraw/zinc/14/35/94/559143594.db2.gz LFJRRMWGJUWZMX-QHRIQVFBSA-N 0 0 405.281 6.127 40 10 HKCBRN CCOc1cc2c(c([N+](=O)[O-])c1)N[C@@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@@H]21 ZINC000101151560 559143589 /nfs/dbraw/zinc/14/35/89/559143589.db2.gz LFJRRMWGJUWZMX-VLXJIEOASA-N 0 0 405.281 6.127 40 10 HKCBRN CN1c2ccccc2S/C1=C1\SC(=S)N(c2cccc(C(F)(F)F)c2)C1=O ZINC000101262788 559144273 /nfs/dbraw/zinc/14/42/73/559144273.db2.gz PVDGCCLDZJLRED-PEZBUJJGSA-N 0 0 424.494 5.481 40 10 HKCBRN C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000101700161 559147782 /nfs/dbraw/zinc/14/77/82/559147782.db2.gz DQXWFOCJQYKYMF-IEUDEEBGSA-N 0 0 406.957 6.181 40 10 HKCBRN Cc1ccc(/N=N/c2cc(C)ccc2NC(=O)c2cccc(S(C)(=O)=O)c2)cc1 ZINC000102324396 569050192 /nfs/dbraw/zinc/05/01/92/569050192.db2.gz XANADBBKVAVPKN-OCOZRVBESA-N 0 0 407.495 5.375 40 10 HKCBRN CC1=CSC2=NC(=O)/C(=C\c3ccc(OCc4cccc(C)c4)c(Cl)c3)C(=N)N12 ZINC000102469375 568418055 /nfs/dbraw/zinc/41/80/55/568418055.db2.gz VFAAFPXEPANIAL-ALRRYEELSA-N 0 0 423.925 5.394 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1ccc(C(C)C)cc1 ZINC000102469399 568418051 /nfs/dbraw/zinc/41/80/51/568418051.db2.gz PQPICROVGBCKAX-JFNNLOOZSA-N 0 0 404.539 5.385 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1N[C@@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@@H]21 ZINC000102711959 559152092 /nfs/dbraw/zinc/15/20/92/559152092.db2.gz NDNSCLBAKMRQSJ-VGTOOOLASA-N 0 0 418.673 7.492 40 10 HKCBRN Cc1ccc(/N=N/c2cc(C)ccc2NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)cc1 ZINC000102828699 569041747 /nfs/dbraw/zinc/04/17/47/569041747.db2.gz GCOWHEDHVMBZDZ-BYYHNAKLSA-N 0 0 420.557 5.942 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=CNCCSc1ccc(Cl)cc1 ZINC000102882040 559153308 /nfs/dbraw/zinc/15/33/08/559153308.db2.gz XTGHAHWUJHCDBC-XMHGGMMESA-N 0 0 417.937 5.248 40 10 HKCBRN CCN(C(=O)COC(=O)c1ccccc1NN=C1C=CC(=O)C=C1)c1ccc(F)cc1 ZINC000102907721 569042111 /nfs/dbraw/zinc/04/21/11/569042111.db2.gz GXPIAOZZHWWIDJ-OCEACIFDSA-N 0 0 421.428 5.157 40 10 HKCBRN Cc1ccc(/N=N/c2cc(C)ccc2NC(=O)Nc2cccc(C(F)(F)F)c2)cc1 ZINC000102949789 569050245 /nfs/dbraw/zinc/05/02/45/569050245.db2.gz RQCXNSLBCHZAJB-ZQHSETAFSA-N 0 0 412.415 7.382 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2c(F)cccc2Cl)cc1 ZINC000103557379 560734139 /nfs/dbraw/zinc/73/41/39/560734139.db2.gz RCDMAYIXSKDUKC-XSFVSMFZSA-N 0 0 420.871 5.864 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cccc(OCc2ccc(Cl)cc2)c1 ZINC000103557542 560734150 /nfs/dbraw/zinc/73/41/50/560734150.db2.gz YHBYGIWLNMAIBK-HZHRSRAPSA-N 0 0 402.881 5.725 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1ccc(F)c(Cl)c1 ZINC000103563261 560843341 /nfs/dbraw/zinc/84/33/41/560843341.db2.gz CRVSWHJGFMPKEN-JFBLTNLISA-N 0 0 414.893 5.054 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1cccc2ccccc21 ZINC000103563281 560843360 /nfs/dbraw/zinc/84/33/60/560843360.db2.gz WJRZRJKHTMZSJR-RKQNKVCSSA-N 0 0 412.518 5.414 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1ccc2ccccc2c1 ZINC000103563328 560843307 /nfs/dbraw/zinc/84/33/07/560843307.db2.gz CVHDCXAJTGKCEN-ARBPROEFSA-N 0 0 412.518 5.414 40 10 HKCBRN CC1=CSC2=NC(=O)/C(=C\c3ccc(OCc4ccc(C)cc4)c(Cl)c3)C(=N)N12 ZINC000103563485 560843325 /nfs/dbraw/zinc/84/33/25/560843325.db2.gz PVDWRNZWQXGLSZ-ALRRYEELSA-N 0 0 423.925 5.394 40 10 HKCBRN CC1=CSC2=NC(=O)/C(=C\c3ccc(OCc4ccccc4)c(Cl)c3)C(=N)N12 ZINC000103563500 560843327 /nfs/dbraw/zinc/84/33/27/560843327.db2.gz MOMZRWCSQPMYTR-NJOZZACWSA-N 0 0 409.898 5.086 40 10 HKCBRN CC1=CSC2=NC(=O)/C(=C\c3ccc(OCc4ccccc4C)c(Cl)c3)C(=N)N12 ZINC000103563505 560843339 /nfs/dbraw/zinc/84/33/39/560843339.db2.gz HXXUXZPCTZUGTA-ALRRYEELSA-N 0 0 423.925 5.394 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1ccc(Cl)cc1C ZINC000103604809 560843575 /nfs/dbraw/zinc/84/35/75/560843575.db2.gz ZKRAQJGEOPNGAD-GHSFWCQGSA-N 0 0 410.930 5.223 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1ccc(C)c(Cl)c1 ZINC000103604820 560843597 /nfs/dbraw/zinc/84/35/97/560843597.db2.gz BQBRQZGQYPOBFE-UOYIJQEASA-N 0 0 410.930 5.223 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1cc(Cl)ccc1C ZINC000103604840 560843541 /nfs/dbraw/zinc/84/35/41/560843541.db2.gz NONAKSDYPMELNH-UOYIJQEASA-N 0 0 410.930 5.223 40 10 HKCBRN Cc1cc(/C=C2/C(=N)N3C(C)=CSC3=NC2=O)c(C)n1-c1cccc(Cl)c1C ZINC000103604843 560843566 /nfs/dbraw/zinc/84/35/66/560843566.db2.gz ORVLVTPGGHHARR-NJOZZACWSA-N 0 0 410.930 5.223 40 10 HKCBRN CC[C@@H](C)c1ccc(-n2c(C)cc(/C=C3/C(=N)N4C(C)=CSC4=NC3=O)c2C)cc1 ZINC000103604846 560843730 /nfs/dbraw/zinc/84/37/30/560843730.db2.gz SUHSGBIPOVAKSM-BAFKOHQRSA-N 0 0 418.566 5.775 40 10 HKCBRN CC[C@H](C)c1ccc(-n2c(C)cc(/C=C3/C(=N)N4C(C)=CSC4=NC3=O)c2C)cc1 ZINC000103604850 560843699 /nfs/dbraw/zinc/84/36/99/560843699.db2.gz SUHSGBIPOVAKSM-HJHQPXSGSA-N 0 0 418.566 5.775 40 10 HKCBRN CN(C)c1ccc(/N=N/c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c(Cl)c1 ZINC000103631448 559156625 /nfs/dbraw/zinc/15/66/25/559156625.db2.gz IEZFPTLHOMGZDI-BYYHNAKLSA-N 0 0 401.901 6.879 40 10 HKCBRN CC(NCCC(c1ccccc1)c1ccccc1)=C1C(C)=NN(c2ccccc2)C1=O ZINC000103916532 560734832 /nfs/dbraw/zinc/73/48/32/560734832.db2.gz DTJGNJCLJQVIEA-QOMWVZHYSA-N 0 0 409.533 5.495 40 10 HKCBRN CC(Nc1cc(Cl)ccc1Cl)=C1C(C)=NN(c2nc3ccccc3s2)C1=O ZINC000103917089 560734880 /nfs/dbraw/zinc/73/48/80/560734880.db2.gz DKSUYVKAXNVEHN-YVLHZVERSA-N 0 0 417.321 5.712 40 10 HKCBRN CC(Nc1ccc(Cl)c(Cl)c1)=C1C(C)=NN(c2nc3ccccc3s2)C1=O ZINC000103917152 560734851 /nfs/dbraw/zinc/73/48/51/560734851.db2.gz JTDIYSJVAGIQQM-YVLHZVERSA-N 0 0 417.321 5.712 40 10 HKCBRN CC(Nc1ccccc1-c1ccccc1)=C1C(C)=NN(c2nc3ccccc3s2)C1=O ZINC000103917187 560734876 /nfs/dbraw/zinc/73/48/76/560734876.db2.gz KWYFVKBWXKHIDC-KQWNVCNZSA-N 0 0 424.529 6.072 40 10 HKCBRN CCCC1=NN(c2ccccc2)C(=O)C1=C(C)NCCSc1ccc(Cl)cc1 ZINC000103917962 560735020 /nfs/dbraw/zinc/73/50/20/560735020.db2.gz NMYMQQQGFCBQIJ-PGMHBOJBSA-N 0 0 413.974 5.499 40 10 HKCBRN CCCC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)NCCSc1ccc(C)cc1 ZINC000103917985 560735014 /nfs/dbraw/zinc/73/50/14/560735014.db2.gz YXOPWTPTUYCTOW-NKFKGCMQSA-N 0 0 423.582 5.162 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)NCCSc1ccc(C)cc1 ZINC000103917989 560735011 /nfs/dbraw/zinc/73/50/11/560735011.db2.gz PAGRSSAQAHZQDL-XLNRJJMWSA-N 0 0 411.546 5.293 40 10 HKCBRN CCCC1=NN(c2ccccc2)C(=O)C1=C(C)NCCc1c[nH]c2ccc(C)cc12 ZINC000103918447 560734726 /nfs/dbraw/zinc/73/47/26/560734726.db2.gz HNQPDCQXFQZISL-MOHJPFBDSA-N 0 0 400.526 5.085 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)NCCc1c[nH]c2ccc(C)cc12 ZINC000103918456 560734797 /nfs/dbraw/zinc/73/47/97/560734797.db2.gz DBQONGVPGPOACQ-ULJHMMPZSA-N 0 0 418.516 5.224 40 10 HKCBRN CCCC1=NN(c2ccccc2)C(=O)C1=C(C)NCCc1c[nH]c2ccc(Cl)cc12 ZINC000103918482 560734772 /nfs/dbraw/zinc/73/47/72/560734772.db2.gz XWXBJCKRBDBMKI-KQWNVCNZSA-N 0 0 420.944 5.430 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)NCCc1c[nH]c2ccc(F)cc12 ZINC000103918557 560734764 /nfs/dbraw/zinc/73/47/64/560734764.db2.gz RKJZVTZCWRQKJX-HAHDFKILSA-N 0 0 422.479 5.055 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(C)cc1C ZINC000103918694 560734746 /nfs/dbraw/zinc/73/47/46/560734746.db2.gz RXBHGZZHBQUDBG-PGMHBOJBSA-N 0 0 404.539 5.802 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(C)c(C)c1 ZINC000103918707 560734738 /nfs/dbraw/zinc/73/47/38/560734738.db2.gz DNDYVMOJJNSDAI-PGMHBOJBSA-N 0 0 404.539 5.802 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(Cl)cc1 ZINC000103918760 560734761 /nfs/dbraw/zinc/73/47/61/560734761.db2.gz IWFPELRRIJQFHS-UYRXBGFRSA-N 0 0 410.930 5.839 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(OCC)cc1 ZINC000103918958 560734843 /nfs/dbraw/zinc/73/48/43/560734843.db2.gz MUNVFZDXNAFLBW-QNGOZBTKSA-N 0 0 420.538 5.584 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1cccc(Cl)c1C ZINC000103919040 560734916 /nfs/dbraw/zinc/73/49/16/560734916.db2.gz GCZBKRHPKLWGAB-ZHZULCJRSA-N 0 0 424.957 6.147 40 10 HKCBRN CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1cccc(Cl)c1C ZINC000103919046 560734890 /nfs/dbraw/zinc/73/48/90/560734890.db2.gz ASRSGVUGEUADJM-ZHZULCJRSA-N 0 0 412.877 5.445 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(Cl)cc1C ZINC000103919055 560734910 /nfs/dbraw/zinc/73/49/10/560734910.db2.gz GGAFTLDYTKJNRU-ZHZULCJRSA-N 0 0 424.957 6.147 40 10 HKCBRN CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1cccc2ccccc21 ZINC000103919077 560734902 /nfs/dbraw/zinc/73/49/02/560734902.db2.gz UGYHWUSEOMMRAA-KQWNVCNZSA-N 0 0 414.465 5.637 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)Nc1ccc(OC)cc1 ZINC000103919209 560734921 /nfs/dbraw/zinc/73/49/21/560734921.db2.gz XRXDMWKDDGMTKF-ZHZULCJRSA-N 0 0 406.511 5.194 40 10 HKCBRN CCCC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cccc(OC(F)(F)F)c1 ZINC000103919312 560734803 /nfs/dbraw/zinc/73/48/03/560734803.db2.gz KAVMMJGAODHOTO-RGEXLXHISA-N 0 0 403.404 5.474 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)Nc1cccc(OC(F)(F)F)c1 ZINC000103919317 560734793 /nfs/dbraw/zinc/73/47/93/560734793.db2.gz TXEPDKYLVADSCG-UYRXBGFRSA-N 0 0 421.394 5.613 40 10 HKCBRN CC(NCc1ccccc1)=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 ZINC000103920430 560735118 /nfs/dbraw/zinc/73/51/18/560735118.db2.gz GUUXEEOCRRCDCP-XLNRJJMWSA-N 0 0 424.529 5.111 40 10 HKCBRN CC(Nc1ccc(C)cc1)=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1 ZINC000103920846 560735128 /nfs/dbraw/zinc/73/51/28/560735128.db2.gz YPOAQNKNCNUNIS-XLNRJJMWSA-N 0 0 424.529 5.742 40 10 HKCBRN CC(Nc1ccc(C)cc1)=C1C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1 ZINC000103920851 560735135 /nfs/dbraw/zinc/73/51/35/560735135.db2.gz PHVQRWGZSZZSLC-XLNRJJMWSA-N 0 0 412.449 5.040 40 10 HKCBRN CN1C(=O)C(=CC2=CC(=NNc3cccc(C(F)(F)F)c3)C=CC2=O)SC1=S ZINC000103957069 560735013 /nfs/dbraw/zinc/73/50/13/560735013.db2.gz RGXQUSFSUBFUMO-XFHHHWHQSA-N 0 0 423.441 5.657 40 10 HKCBRN O=[N+]([N-]c1ccc(Sc2ccccc2)cc1)c1ccc(Sc2ccccc2)cc1 ZINC000104036743 559157478 /nfs/dbraw/zinc/15/74/78/559157478.db2.gz BMRCRKGXUGEOFS-UHFFFAOYSA-N 0 0 414.555 7.915 40 10 HKCBRN O=[N+]([O-])c1cc(C(F)(F)F)ccc1/N=N\c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000104071003 559157625 /nfs/dbraw/zinc/15/76/25/559157625.db2.gz DGGOIOMXJOCAKL-DQRAZIAOSA-N 0 0 408.214 5.956 40 10 HKCBRN O=C1C=CC(=NNc2c(Br)cc([N+](=O)[O-])cc2Br)C=C1 ZINC000104081561 559157678 /nfs/dbraw/zinc/15/76/78/559157678.db2.gz NLDRBKFCMSXIMY-NXVVXOECSA-N 0 0 401.014 5.241 40 10 HKCBRN Cc1coc([N-]S(=O)(=O)c2ccc(NN=C3C=CC(=O)c4ncccc43)cc2)c1C ZINC000104090591 559157869 /nfs/dbraw/zinc/15/78/69/559157869.db2.gz VWGKRHZISCHYAY-VHXPQNKSSA-N 0 0 422.466 5.366 40 10 HKCBRN O=c1ccc(=NNc2ccc([N+](=O)[O-])cc2Cl)c2c(=O)c3ccccc3c(=O)c1=2 ZINC000104107752 559158061 /nfs/dbraw/zinc/15/80/61/559158061.db2.gz IEXCCPKNYHWLNG-FCQUAONHSA-N 0 0 407.769 5.145 40 10 HKCBRN S=C(Nc1nc(-c2ccccc2)c(/N=N\c2ccccc2)s1)Nc1ccccc1 ZINC000104113159 559158047 /nfs/dbraw/zinc/15/80/47/559158047.db2.gz OBWUJDJNCSAJII-RQZHXJHFSA-N 0 0 415.547 7.034 40 10 HKCBRN S=C(Nc1nc(-c2ccccc2)c(/N=N/c2ccccc2)s1)Nc1ccccc1 ZINC000104113164 559158071 /nfs/dbraw/zinc/15/80/71/559158071.db2.gz OBWUJDJNCSAJII-CYYJNZCTSA-N 0 0 415.547 7.034 40 10 HKCBRN COc1ccccc1N=Nc1c(-c2ccccc2)nn(C(N)=S)c1-c1ccccc1 ZINC000104115298 559158062 /nfs/dbraw/zinc/15/80/62/559158062.db2.gz AEQJWPYADAYAEW-QPLCGJKRSA-N 0 0 413.506 5.733 40 10 HKCBRN COc1ccc(N=Nc2c(-c3ccccc3)nn(C(N)=S)c2-c2ccccc2)cc1 ZINC000104115304 559158193 /nfs/dbraw/zinc/15/81/93/559158193.db2.gz FFNFNYLTWGACFJ-QPLCGJKRSA-N 0 0 413.506 5.733 40 10 HKCBRN O=[N+]([N-]c1ccc2c(c1)Cc1cc(F)ccc1-2)c1ccc2c(c1)Cc1cc(F)ccc1-2 ZINC000104120730 559158209 /nfs/dbraw/zinc/15/82/09/559158209.db2.gz PGTIPXHRXBMTBI-UHFFFAOYSA-N 0 0 410.423 7.033 40 10 HKCBRN c1ccc(/N=N/[C@@]2(c3ccccc3)CCC(c3ccccc3)=NN2c2ccccc2)cc1 ZINC000104133831 559158455 /nfs/dbraw/zinc/15/84/55/559158455.db2.gz QCBOTJNLDYEQMU-UFEOWHGLSA-N 0 0 416.528 7.328 40 10 HKCBRN c1ccc(/N=N/[C@]2(c3ccccc3)CCC(c3ccccc3)=NN2c2ccccc2)cc1 ZINC000104133838 559158460 /nfs/dbraw/zinc/15/84/60/559158460.db2.gz QCBOTJNLDYEQMU-PTBNBFCCSA-N 0 0 416.528 7.328 40 10 HKCBRN Nc1nc(-c2cccc([N+](=O)[O-])c2)c(/N=N\c2ccc(Br)cc2)s1 ZINC000104134007 571310813 /nfs/dbraw/zinc/31/08/13/571310813.db2.gz KNHASUMTWGUIKZ-VXPUYCOJSA-N 0 0 404.249 5.478 40 10 HKCBRN C[C@H](NC=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1)c1ccccc1 ZINC000104176352 559158689 /nfs/dbraw/zinc/15/86/89/559158689.db2.gz HDLBYRNZZOZVLE-IMGOXIFKSA-N 0 0 424.529 5.282 40 10 HKCBRN C[C@@H](NC=C1C(=O)N(c2nc3ccccc3s2)N=C1c1ccccc1)c1ccccc1 ZINC000104176358 559158697 /nfs/dbraw/zinc/15/86/97/559158697.db2.gz HDLBYRNZZOZVLE-XUMLYMLNSA-N 0 0 424.529 5.282 40 10 HKCBRN CCn1c2ccccc2c2cc(/N=N\c3cc4cc5ccccc5cc4cc3N)ccc21 ZINC000104202906 559159030 /nfs/dbraw/zinc/15/90/30/559159030.db2.gz LVWOHEWJKIJNAB-KTMFPKCZSA-N 0 0 414.512 8.118 40 10 HKCBRN c1c2ccccc2[nH]c1/N=N\c1cccc2c(/N=N\c3cc4ccccc4[nH]3)cccc12 ZINC000104208637 559159146 /nfs/dbraw/zinc/15/91/46/559159146.db2.gz OPYYZEZGTXAJEB-SZDCHMHBSA-N 0 0 414.472 8.633 40 10 HKCBRN c1c2ccccc2[nH]c1/N=N/c1cccc2c(/N=N\c3cc4ccccc4[nH]3)cccc12 ZINC000104208643 559159141 /nfs/dbraw/zinc/15/91/41/559159141.db2.gz OPYYZEZGTXAJEB-SNQKRLHOSA-N 0 0 414.472 8.633 40 10 HKCBRN NC(=S)n1nc(-c2ccccc2)c(/N=N/c2ccccc2Cl)c1-c1ccccc1 ZINC000104222674 559159203 /nfs/dbraw/zinc/15/92/03/559159203.db2.gz HKMFTEZOWQIZMO-OCEACIFDSA-N 0 0 417.925 6.378 40 10 HKCBRN Fc1cccc(/N=N\c2c(-c3ccccc3)nn(C(=S)S)c2-c2ccccc2)c1 ZINC000104222704 559159212 /nfs/dbraw/zinc/15/92/12/559159212.db2.gz QXKRKBKXHDUJQJ-IZHYLOQSSA-N 0 0 418.522 6.834 40 10 HKCBRN Cc1c(/N=N\c2ccc(Br)cc2)c(-c2ccccc2)nn1C(N)=S ZINC000104223340 559159224 /nfs/dbraw/zinc/15/92/24/559159224.db2.gz KCRHOLITEGEVND-MRCUWXFGSA-N 0 0 400.305 5.128 40 10 HKCBRN Cc1c(/N=N\c2ccc(Br)cc2)c(-c2ccccc2)nn1C(=S)S ZINC000104223371 559159200 /nfs/dbraw/zinc/15/92/00/559159200.db2.gz DXPAKKRVOCZXIJ-VXPUYCOJSA-N 0 0 417.357 6.099 40 10 HKCBRN Cc1ccc(N=Nc2c(-c3ccccc3)nn(C(=S)S)c2-c2ccccc2)cc1 ZINC000104223394 559159233 /nfs/dbraw/zinc/15/92/33/559159233.db2.gz DFJXJVKXCJTBSY-IZHYLOQSSA-N 0 0 414.559 7.004 40 10 HKCBRN CCCCN(CCCC)c1cc(C)c(/N=N\c2cc(Cl)ccc2Cl)c(C)c1 ZINC000104224975 559159206 /nfs/dbraw/zinc/15/92/06/559159206.db2.gz HYCSHQJJZXOJQM-QPLCGJKRSA-N 0 0 406.401 8.432 40 10 HKCBRN Cc1c(/N=N\c2cccc(Cl)c2Cl)c(-c2ccccc2)nn1C(=S)S ZINC000104225366 559159248 /nfs/dbraw/zinc/15/92/48/559159248.db2.gz KTQLMCUTPVVWOT-MRCUWXFGSA-N 0 0 407.351 6.644 40 10 HKCBRN COc1cc(/N=N\c2ccc(N)nc2N)c(OC)cc1/N=N\c1ccc([N+](=O)[O-])cc1 ZINC000104229719 559159362 /nfs/dbraw/zinc/15/93/62/559159362.db2.gz IFUWHSTUYLHHCN-YPAXQUSRSA-N 0 0 422.405 5.002 40 10 HKCBRN CCOc1c(/N=N\c2ccccc2Cl)c(-c2ccccc2)nn1C(=S)S ZINC000104231000 559159326 /nfs/dbraw/zinc/15/93/26/559159326.db2.gz ITALQPCUIJXJAA-MRCUWXFGSA-N 0 0 402.932 6.080 40 10 HKCBRN CCOc1c(/N=N\c2cccc(Cl)c2)c(-c2ccccc2)nn1C(=S)S ZINC000104231007 559159346 /nfs/dbraw/zinc/15/93/46/559159346.db2.gz LQZROICRXYVSHK-MRCUWXFGSA-N 0 0 402.932 6.080 40 10 HKCBRN CCOc1c(/N=N\c2ccc(Cl)cc2)c(-c2ccccc2)nn1C(=S)S ZINC000104231015 559159344 /nfs/dbraw/zinc/15/93/44/559159344.db2.gz JUGUFCFAXATHCK-MRCUWXFGSA-N 0 0 402.932 6.080 40 10 HKCBRN CSC(=S)n1nc(-c2cccs2)c(/N=N\c2ccccc2)c1C(F)(F)F ZINC000104235724 559159405 /nfs/dbraw/zinc/15/94/05/559159405.db2.gz BRBCEOLWXNFELI-MRCUWXFGSA-N 0 0 412.487 6.542 40 10 HKCBRN O=C(O/C(=C(\N=N/c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1 ZINC000104279768 559159715 /nfs/dbraw/zinc/15/97/15/559159715.db2.gz CRYAIAGXVMJABY-LKWRTGPGSA-N 0 0 404.469 7.153 40 10 HKCBRN O=C(O/C(=C(/N=N\c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1 ZINC000104279773 559159746 /nfs/dbraw/zinc/15/97/46/559159746.db2.gz CRYAIAGXVMJABY-VKIGSRSWSA-N 0 0 404.469 7.153 40 10 HKCBRN Cc1cccc(NC(=O)c2cc3cc(/N=N\c4ccccc4Cl)ccc3oc2=O)c1 ZINC000104293067 559159954 /nfs/dbraw/zinc/15/99/54/559159954.db2.gz HYENGBBCWLYETF-RQZHXJHFSA-N 0 0 417.852 6.423 40 10 HKCBRN COc1cc(-c2ccc(/N=N\c3ccccc3)c(OC)c2)ccc1/N=N\c1ccccc1 ZINC000104323907 559160383 /nfs/dbraw/zinc/16/03/83/559160383.db2.gz MMOYRWFODWJWKM-ZUELCTOOSA-N 0 0 422.488 8.202 40 10 HKCBRN COc1cc(-c2ccc(/N=N\c3ccccc3)c(OC)c2)ccc1/N=N/c1ccccc1 ZINC000104323911 559160400 /nfs/dbraw/zinc/16/04/00/559160400.db2.gz MMOYRWFODWJWKM-JOKXDOCYSA-N 0 0 422.488 8.202 40 10 HKCBRN O=C(Nc1ccccc1)C1=Cc2ccccc2C(=NNc2cccc([N+](=O)[O-])c2)C1=O ZINC000104367057 559160610 /nfs/dbraw/zinc/16/06/10/559160610.db2.gz QSFJILOAMVJLLT-OCEACIFDSA-N 0 0 412.405 6.121 40 10 HKCBRN O=C(Nc1ccccc1)C1=Cc2ccccc2C(=NNc2ccc([N+](=O)[O-])cc2)C1=O ZINC000104367061 559160608 /nfs/dbraw/zinc/16/06/08/559160608.db2.gz VZEZEKXEFKSTBJ-QPLCGJKRSA-N 0 0 412.405 6.121 40 10 HKCBRN O=C1N=C(Nc2ccc(Cl)cc2)SC1=Cc1cccc(OCc2ccccc2)c1 ZINC000106115596 560741501 /nfs/dbraw/zinc/74/15/01/560741501.db2.gz PHDYYFBAQDXKPP-STZFKDTASA-N 0 0 420.921 6.001 40 10 HKCBRN O=C1N=C(Nc2ccc(Cl)cc2)SC1=Cc1cccc(OCc2ccccc2)c1 ZINC000106115598 569360971 /nfs/dbraw/zinc/36/09/71/569360971.db2.gz PHDYYFBAQDXKPP-KGENOOAVSA-N 0 0 420.921 6.001 40 10 HKCBRN CCCOc1ccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1OCC ZINC000106369200 569360974 /nfs/dbraw/zinc/36/09/74/569360974.db2.gz QWWREKMONRLSMU-UYRXBGFRSA-N 0 0 416.930 5.610 40 10 HKCBRN COc1ccc(-n2c(C)cc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)c2C)cc1 ZINC000106681424 560745137 /nfs/dbraw/zinc/74/51/37/560745137.db2.gz NHXQKFZUMDRUIA-HMAPJEAMSA-N 0 0 418.518 5.339 40 10 HKCBRN O=C1S/C(=C\c2ccc(N3CCCCC3)cc2)C(=O)N1Cc1ccccc1Cl ZINC000106684071 560745275 /nfs/dbraw/zinc/74/52/75/560745275.db2.gz DGHDFTJSFWEREC-ZHZULCJRSA-N 0 0 412.942 5.567 40 10 HKCBRN CCN(CC)c1ccc(/C=C2\SC(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1 ZINC000106685549 560745232 /nfs/dbraw/zinc/74/52/32/560745232.db2.gz AXKMLYDGIFNMHM-UYRXBGFRSA-N 0 0 400.931 5.423 40 10 HKCBRN O=C1S/C(=C\c2ccc(N3CCCCC3)cc2)C(=O)N1Cc1ccc(Cl)cc1 ZINC000106688270 560745402 /nfs/dbraw/zinc/74/54/02/560745402.db2.gz FKXSCMZMXWGILY-ZHZULCJRSA-N 0 0 412.942 5.567 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(Cc3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccc1 ZINC000106689173 560745382 /nfs/dbraw/zinc/74/53/82/560745382.db2.gz SEJMPTCZCMYSPL-BKUYFWCQSA-N 0 0 422.937 5.984 40 10 HKCBRN COc1ccc(Oc2ccc(-n3c(C)cc(C=C4SC(=O)NC4=O)c3C)cc2)cc1 ZINC000106692789 560745445 /nfs/dbraw/zinc/74/54/45/560745445.db2.gz QMFKWPVVEYCIFG-BKUYFWCQSA-N 0 0 420.490 5.219 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1ccc(C)cc1 ZINC000106701905 560745438 /nfs/dbraw/zinc/74/54/38/560745438.db2.gz POONYYQOBWHBFQ-UCQKPKSFSA-N 0 0 416.546 5.947 40 10 HKCBRN Cc1ccc(OCCN2C(=O)S/C(=C\c3ccc(N4CCCCC4)cc3)C2=O)cc1 ZINC000106782639 560746261 /nfs/dbraw/zinc/74/62/61/560746261.db2.gz LKKSEFUVOUTUOR-XLNRJJMWSA-N 0 0 422.550 5.101 40 10 HKCBRN Cc1ccc(OCCN2C(=O)S/C(=C\c3ccc(N4CCCC4)cc3C)C2=O)cc1 ZINC000106788087 560746292 /nfs/dbraw/zinc/74/62/92/560746292.db2.gz FWYVZRFXUAZTQP-JWGURIENSA-N 0 0 422.550 5.019 40 10 HKCBRN COc1ccc(Br)cc1C=C1SC(Nc2ccc(Cl)cc2)=NC1=O ZINC000107545135 569360931 /nfs/dbraw/zinc/36/09/31/569360931.db2.gz LESKBJXETXVSRO-DHDCSXOGSA-N 0 0 423.719 5.194 40 10 HKCBRN COc1ccc(Br)cc1C=C1SC(Nc2ccc(Cl)cc2)=NC1=O ZINC000107545138 569360953 /nfs/dbraw/zinc/36/09/53/569360953.db2.gz LESKBJXETXVSRO-OQLLNIDSSA-N 0 0 423.719 5.194 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc3ccccc32)C(=O)/C1=C\c1cccc(Cl)c1 ZINC000107701524 569360912 /nfs/dbraw/zinc/36/09/12/569360912.db2.gz QLGRLWHWKBRFLT-ZHZULCJRSA-N 0 0 403.865 5.370 40 10 HKCBRN C#CCOc1ccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1Cl ZINC000107740796 569361116 /nfs/dbraw/zinc/36/11/16/569361116.db2.gz DMZPSAOKHSZQQV-BOPFTXTBSA-N 0 0 403.290 5.088 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc(F)c(Br)c3)SC2=S)cc1 ZINC000107761080 569361173 /nfs/dbraw/zinc/36/11/73/569361173.db2.gz DYMAEXOUZXTISG-DHDCSXOGSA-N 0 0 424.316 5.003 40 10 HKCBRN CCOc1cc(C=C2SC(Nc3cccc(C)c3C)=NC2=O)ccc1OCC(C)C ZINC000107803953 569361046 /nfs/dbraw/zinc/36/10/46/569361046.db2.gz NTFSBGQZXJSLCJ-XKZIYDEJSA-N 0 0 424.566 5.819 40 10 HKCBRN O=C1NC(=S)S/C1=C\c1cc(Cl)c(OCc2cccc(F)c2)c(Cl)c1 ZINC000107842135 569361143 /nfs/dbraw/zinc/36/11/43/569361143.db2.gz LAWSUPXISCHDTD-AUWJEWJLSA-N 0 0 414.310 5.200 40 10 HKCBRN CC1CCN(C(=O)Nc2ccc3nc4c5ccccc5c5ccccc5c4nc3c2)CC1 ZINC000107908986 569361056 /nfs/dbraw/zinc/36/10/56/569361056.db2.gz LKJDMVXOVPRWMC-UHFFFAOYSA-N 0 0 420.516 6.353 40 10 HKCBRN CCOc1cc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc(Cl)c1O ZINC000107976930 569361230 /nfs/dbraw/zinc/36/12/30/569361230.db2.gz LNKIOWGHANEEBS-DHDCSXOGSA-N 0 0 409.294 5.180 40 10 HKCBRN CCOc1ccc(/C=C2\C(=O)N(c3cccc4ccccc43)C(C)=C2C(=O)OC)cc1 ZINC000107995575 569361249 /nfs/dbraw/zinc/36/12/49/569361249.db2.gz AFHWOZGZEPAATK-JWGURIENSA-N 0 0 413.473 5.116 40 10 HKCBRN CCOc1ccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)c(OCC)c1 ZINC000108053522 569361282 /nfs/dbraw/zinc/36/12/82/569361282.db2.gz OQVMFFATAWNQSA-WQRHYEAKSA-N 0 0 402.903 5.220 40 10 HKCBRN CCCOc1ccc(C=C2SC(Nc3ccc(Cl)cc3)=NC2=O)cc1Cl ZINC000108076172 569361178 /nfs/dbraw/zinc/36/11/78/569361178.db2.gz RFAHUMMSRICPDM-BOPFTXTBSA-N 0 0 407.322 5.865 40 10 HKCBRN C=CCOc1ccc2ccccc2c1C=C1SC(Nc2ccc(Cl)cc2)=NC1=O ZINC000108253412 569361224 /nfs/dbraw/zinc/36/12/24/569361224.db2.gz DFSVBPMMJYDZFF-STZFKDTASA-N 0 0 420.921 6.140 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C\c2c(OC(C)C)ccc3ccccc32)SC1=S ZINC000108984002 569361422 /nfs/dbraw/zinc/36/14/22/569361422.db2.gz XBPZMVCLBPKVRN-HYARGMPZSA-N 0 0 419.571 6.341 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3cccc(Br)c3)c2C)SC1=S ZINC000110217855 569361424 /nfs/dbraw/zinc/36/14/24/569361424.db2.gz VFZZRLBSCATWNH-SXGWCWSVSA-N 0 0 421.385 5.078 40 10 HKCBRN CC(NCc1ccccc1Cl)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000112125195 560776710 /nfs/dbraw/zinc/77/67/10/560776710.db2.gz LSGBQVAPANBXOG-XLNRJJMWSA-N 0 0 401.897 5.155 40 10 HKCBRN CCCC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)Nc1ccc(Cl)c(F)c1 ZINC000112125257 560776675 /nfs/dbraw/zinc/77/66/75/560776675.db2.gz FCQAQIMTFDYHBJ-MOSHPQCFSA-N 0 0 401.869 5.377 40 10 HKCBRN CC(NCc1ccc(Cl)cc1)=C1C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000112125261 560776677 /nfs/dbraw/zinc/77/66/77/560776677.db2.gz HZJSSOQIWLOVTQ-XLNRJJMWSA-N 0 0 401.897 5.155 40 10 HKCBRN CC(Nc1ccc(Oc2ccccc2)cc1)=C1C(C)=NN(c2ccc(F)cc2)C1=O ZINC000112125407 560776664 /nfs/dbraw/zinc/77/66/64/560776664.db2.gz VJRZVBWNJVKFQY-KQWNVCNZSA-N 0 0 401.441 5.727 40 10 HKCBRN CC(Nc1cc(Cl)cc(Cl)c1)=C1C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1C ZINC000112125910 560776708 /nfs/dbraw/zinc/77/67/08/560776708.db2.gz UWNIJVSYTOLHEL-YVLHZVERSA-N 0 0 405.241 5.010 40 10 HKCBRN CC(Nc1ccc(Cl)c(Cl)c1)=C1C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1C ZINC000112125931 560776688 /nfs/dbraw/zinc/77/66/88/560776688.db2.gz RRPGJZGPJFAEMN-YVLHZVERSA-N 0 0 405.241 5.010 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)Nc1ccc(Cl)c(Cl)c1 ZINC000112126436 560776792 /nfs/dbraw/zinc/77/67/92/560776792.db2.gz IDBGKZUIHFIVRQ-UNOMPAQXSA-N 0 0 406.288 6.021 40 10 HKCBRN CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1ccc(Cl)c(F)c1 ZINC000112286305 560777905 /nfs/dbraw/zinc/77/79/05/560777905.db2.gz DRXYGDCRUXMQQK-UNOMPAQXSA-N 0 0 416.840 5.276 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)Nc1ccc(Br)cc1 ZINC000112287114 560778032 /nfs/dbraw/zinc/77/80/32/560778032.db2.gz CFHTZRBBWFPHLG-UYRXBGFRSA-N 0 0 416.294 5.477 40 10 HKCBRN CCCC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1=C(C)Nc1ccc(Cl)cc1C ZINC000112287185 560778000 /nfs/dbraw/zinc/77/80/00/560778000.db2.gz CMYJDFHNVITWMH-ZHZULCJRSA-N 0 0 412.877 5.445 40 10 HKCBRN CCCC1=NN(c2ccc(F)cc2)C(=O)C1=C(C)Nc1ccccc1-c1ccccc1 ZINC000112287209 560777941 /nfs/dbraw/zinc/77/79/41/560777941.db2.gz MGDSAFOSOZYGDN-BWAHOGKJSA-N 0 0 413.496 6.382 40 10 HKCBRN COc1ccc(N2N=C(C)C(=C(C)Nc3ccc(Oc4ccccc4)cc3)C2=O)cc1 ZINC000112287319 560778025 /nfs/dbraw/zinc/77/80/25/560778025.db2.gz GZVOEKGXYUAVFE-ULJHMMPZSA-N 0 0 413.477 5.596 40 10 HKCBRN COc1ccc(Nc2ccc(NC(C)=C3C(C)=NN(c4ccccc4)C3=O)cc2)cc1 ZINC000112287340 560778035 /nfs/dbraw/zinc/77/80/35/560778035.db2.gz WZPWDQVQHLZAQO-ULJHMMPZSA-N 0 0 412.493 5.547 40 10 HKCBRN CC(Nc1ccccc1-c1ccccc1)=C1C(C)=NN(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000112287395 560777987 /nfs/dbraw/zinc/77/79/87/560777987.db2.gz ZPFGBPRVILDLOG-KQWNVCNZSA-N 0 0 412.449 5.370 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)NCc1ccc(F)cc1 ZINC000112287704 560778031 /nfs/dbraw/zinc/77/80/31/560778031.db2.gz QYXPFGAIQZACCF-ZHZULCJRSA-N 0 0 408.502 5.002 40 10 HKCBRN CCCC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1ccc(Oc2ccccc2)cc1 ZINC000112288002 560778021 /nfs/dbraw/zinc/77/80/21/560778021.db2.gz SGKZRBQLRMAIHP-PLRJNAJWSA-N 0 0 411.505 6.368 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)NCCc1ccc(F)cc1 ZINC000112289387 560778191 /nfs/dbraw/zinc/77/81/91/560778191.db2.gz FNHWYAQPEXJESQ-QNGOZBTKSA-N 0 0 422.529 5.044 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)NCc1ccc(Cl)cc1 ZINC000112290352 560778170 /nfs/dbraw/zinc/77/81/70/560778170.db2.gz IFLZMFZHXBCUFB-ZHZULCJRSA-N 0 0 424.957 5.516 40 10 HKCBRN CCCC1=NN(c2nc3ccccc3s2)C(=O)C1=C(C)NCc1ccccc1Cl ZINC000112290400 560778094 /nfs/dbraw/zinc/77/80/94/560778094.db2.gz HCPGKDHYGDYVFT-ZHZULCJRSA-N 0 0 424.957 5.516 40 10 HKCBRN CC(NCc1ccccc1Cl)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 ZINC000112290750 560778124 /nfs/dbraw/zinc/77/81/24/560778124.db2.gz GGUPZAQIURMHKF-JWGURIENSA-N 0 0 419.887 5.294 40 10 HKCBRN CC(NCc1ccc(Cl)cc1)=C1C(=O)N(c2ccc(F)cc2)N=C1c1ccccc1 ZINC000112290780 560778198 /nfs/dbraw/zinc/77/81/98/560778198.db2.gz LFMPJPAFLNHPSC-JWGURIENSA-N 0 0 419.887 5.294 40 10 HKCBRN CCCC1=NN(c2ccc(OC)cc2)C(=O)C1=C(C)Nc1ccc(Cl)c(Cl)c1 ZINC000112291383 560778292 /nfs/dbraw/zinc/77/82/92/560778292.db2.gz TWYBTPZAIZPSFU-MOSHPQCFSA-N 0 0 418.324 5.891 40 10 HKCBRN O=C1/C(=C\c2c(Cl)ccc([N+](=O)[O-])c2Cl)SC(=S)N1c1ccccc1 ZINC000113830416 560804984 /nfs/dbraw/zinc/80/49/84/560804984.db2.gz ODPCIARUBUITPD-MDWZMJQESA-N 0 0 411.291 5.307 40 10 HKCBRN O=C1/C(=C\c2c(Cl)ccc([N+](=O)[O-])c2Cl)SC(=S)N1C1CCCCC1 ZINC000113830509 560804988 /nfs/dbraw/zinc/80/49/88/560804988.db2.gz FPZOHEOXDCNTHL-MDWZMJQESA-N 0 0 417.339 5.436 40 10 HKCBRN O=C1/C(=C\c2cccc(C(F)(F)F)c2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 ZINC000113830578 560805015 /nfs/dbraw/zinc/80/50/15/560805015.db2.gz MYZCTTODDKBSOO-NTEUORMPSA-N 0 0 410.398 5.019 40 10 HKCBRN O=C1/C(=C\c2cccc(C(F)(F)F)c2)SC(=S)N1c1cccc([N+](=O)[O-])c1 ZINC000113830600 560804985 /nfs/dbraw/zinc/80/49/85/560804985.db2.gz ZDHCUGXDKNSAIZ-RIYZIHGNSA-N 0 0 410.398 5.019 40 10 HKCBRN O=C1/C(=C\c2c(Cl)cccc2Cl)SC(=S)N1c1ccc([N+](=O)[O-])cc1 ZINC000113830624 560805011 /nfs/dbraw/zinc/80/50/11/560805011.db2.gz BXPLOWSUYLOPTK-RIYZIHGNSA-N 0 0 411.291 5.307 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000113830698 560805017 /nfs/dbraw/zinc/80/50/17/560805017.db2.gz VSDZEKLYWLQDJC-CJLVFECKSA-N 0 0 418.587 6.092 40 10 HKCBRN O=C1/C(=C\c2cc([N+](=O)[O-])c(Cl)cc2Cl)SC(=S)N1c1ccccc1 ZINC000113830712 560805016 /nfs/dbraw/zinc/80/50/16/560805016.db2.gz CCWSXEGBVSYLMX-VGOFMYFVSA-N 0 0 411.291 5.307 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000113831018 560805114 /nfs/dbraw/zinc/80/51/14/560805114.db2.gz KONCVGRXMSDWMZ-XDHOZWIPSA-N 0 0 411.935 5.908 40 10 HKCBRN Cc1[nH]c2ccccc2c1/C=C1/SC(=S)N(c2cccc3ccccc32)C1=O ZINC000113831118 560805126 /nfs/dbraw/zinc/80/51/26/560805126.db2.gz SUZGHIFSWXNTOX-FYJGNVAPSA-N 0 0 400.528 6.035 40 10 HKCBRN O=C1/C(=C\C=C\c2ccc3c(c2)OCO3)SC(=S)N1c1cccc(Cl)c1 ZINC000113831147 560805081 /nfs/dbraw/zinc/80/50/81/560805081.db2.gz OMRWZGFZTCTHHY-YLLJGFRVSA-N 0 0 401.896 5.031 40 10 HKCBRN Cc1ccc(-c2ccc(/C=C3/SC(=S)N(C4CCCCC4)C3=O)o2)cc1Cl ZINC000113831202 560805152 /nfs/dbraw/zinc/80/51/52/560805152.db2.gz YKJCHIBKZQDBNC-XDHOZWIPSA-N 0 0 417.983 6.442 40 10 HKCBRN O=C1/C(=C\c2ccc(Br)o2)SC(=S)N1c1cccc2ccccc21 ZINC000113831206 560805128 /nfs/dbraw/zinc/80/51/28/560805128.db2.gz TZKZCBDBMCFCPK-XNTDXEJSSA-N 0 0 416.321 5.601 40 10 HKCBRN O=C1/C(=C\C=C\c2cccc(Br)c2)SC(=S)N1c1ccccc1 ZINC000113831231 560805083 /nfs/dbraw/zinc/80/50/83/560805083.db2.gz LPEVYVIMUDPZAK-LLPGWTFISA-N 0 0 402.338 5.411 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2Cl)SC(=S)N1c1cccc2ccccc21 ZINC000113831252 560805104 /nfs/dbraw/zinc/80/51/04/560805104.db2.gz DOOMHHXJRVSBGN-VCHYOVAHSA-N 0 0 416.354 6.552 40 10 HKCBRN O=C1/C(=C\C=C\c2cccc(Br)c2)SC(=S)N1c1cccc(F)c1 ZINC000113831268 560805089 /nfs/dbraw/zinc/80/50/89/560805089.db2.gz AZACAPNMCJTOLE-ZRQJSYPSSA-N 0 0 420.328 5.550 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(OCc3c(F)cccc3Cl)cc2)SC1=S ZINC000113832439 560805101 /nfs/dbraw/zinc/80/51/01/560805101.db2.gz NPZYZVQOZMNDSZ-WOJGMQOQSA-N 0 0 421.946 5.669 40 10 HKCBRN O=C1/C(=C/c2cccc(Oc3ccccc3)c2)SC(=S)N1c1ccc(Cl)cc1 ZINC000113832661 560805066 /nfs/dbraw/zinc/80/50/66/560805066.db2.gz FTRMUJZDDSHFOO-ZHZULCJRSA-N 0 0 423.946 6.538 40 10 HKCBRN COc1ccc(-n2c(C)cc(/C=C3/SC(=S)N(c4ccccc4)C3=O)c2C)cc1 ZINC000113832696 560805112 /nfs/dbraw/zinc/80/51/12/560805112.db2.gz BYKZPRRWKYQAGV-KGENOOAVSA-N 0 0 420.559 5.509 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)c([N+](=O)[O-])c2)SC(=S)N1c1ccc(Cl)cc1 ZINC000113833717 560805116 /nfs/dbraw/zinc/80/51/16/560805116.db2.gz ZHUUUMKUMMDFMZ-RIYZIHGNSA-N 0 0 411.291 5.307 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)c(Cl)c2)SC(=S)N1c1cccc([N+](=O)[O-])c1 ZINC000113834290 560805187 /nfs/dbraw/zinc/80/51/87/560805187.db2.gz DMWXSKBFSMZURT-VGOFMYFVSA-N 0 0 411.291 5.307 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(OCc3cccc(C)c3)c(OC)c2)SC1=S ZINC000113834341 560805229 /nfs/dbraw/zinc/80/52/29/560805229.db2.gz YBAMMVGIANGOGF-DEDYPNTBSA-N 0 0 413.564 5.194 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cccc(OCc3cccc4ccccc43)c2)SC1=S ZINC000113834602 560805234 /nfs/dbraw/zinc/80/52/34/560805234.db2.gz RGWXXGCLDZUGDC-PXLXIMEGSA-N 0 0 419.571 6.030 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(OCc3cccc4ccccc43)cc2)SC1=S ZINC000113834890 560805202 /nfs/dbraw/zinc/80/52/02/560805202.db2.gz YMGSZLJZIITWDQ-PXLXIMEGSA-N 0 0 419.571 6.030 40 10 HKCBRN CN(C)c1ccc(/C=C/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000113834904 560805236 /nfs/dbraw/zinc/80/52/36/560805236.db2.gz YZEXLVBSSRKSNQ-ONCSWLTESA-N 0 0 400.956 5.368 40 10 HKCBRN CN(C)c1ccc(/C=C/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000113834907 560805199 /nfs/dbraw/zinc/80/51/99/560805199.db2.gz YZEXLVBSSRKSNQ-FKKWJZCKSA-N 0 0 400.956 5.368 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)c(Cl)c2)SC(=S)N1c1cccc2ccccc21 ZINC000113834950 560805230 /nfs/dbraw/zinc/80/52/30/560805230.db2.gz BYIMGVYVEUJMHV-WOJGMQOQSA-N 0 0 416.354 6.552 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(Cc2ccc(C)cc2)c2ccccc12 ZINC000113835505 560805372 /nfs/dbraw/zinc/80/53/72/560805372.db2.gz DFGORJQZLATCPA-PCLIKHOPSA-N 0 0 405.501 5.804 40 10 HKCBRN O=C1/C(=C\c2ccc(-c3ccccc3)o2)SC(=S)N1c1ccc([N+](=O)[O-])cc1 ZINC000113836555 560805379 /nfs/dbraw/zinc/80/53/79/560805379.db2.gz QDPRTNDWURKLPB-LDADJPATSA-N 0 0 408.460 5.261 40 10 HKCBRN O=C1/C(=C\c2ccc(-c3ccccc3)o2)SC(=S)N1c1cccc([N+](=O)[O-])c1 ZINC000113836627 560805396 /nfs/dbraw/zinc/80/53/96/560805396.db2.gz PLFNZCALAXQGHK-LDADJPATSA-N 0 0 408.460 5.261 40 10 HKCBRN O=C1/C(=C\c2ccc(-c3ccccc3)o2)SC(=S)N1c1cccc2ccccc21 ZINC000113836837 560805342 /nfs/dbraw/zinc/80/53/42/560805342.db2.gz WOEZBDJDSFTNLU-PXLXIMEGSA-N 0 0 413.523 6.506 40 10 HKCBRN O=C1/C(=C\c2cc([N+](=O)[O-])c(Cl)cc2Cl)SC(=S)N1C1CCCCC1 ZINC000113837011 560805356 /nfs/dbraw/zinc/80/53/56/560805356.db2.gz OMONYLYGXKVUGO-VGOFMYFVSA-N 0 0 417.339 5.436 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccn3-c3cccc([N+](=O)[O-])c3)SC2=S)cc1 ZINC000113838554 560805353 /nfs/dbraw/zinc/80/53/53/560805353.db2.gz LEMGRPLOORDAAF-CPNJWEJPSA-N 0 0 421.503 5.100 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000113839769 560805344 /nfs/dbraw/zinc/80/53/44/560805344.db2.gz JIIPOVSIXBUVIX-SFQUDFHCSA-N 0 0 407.813 5.314 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000118916052 568420415 /nfs/dbraw/zinc/42/04/15/568420415.db2.gz PGSCVRYPLPSIOE-MYJNHVFWSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@H]5C[C@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000118916053 568420454 /nfs/dbraw/zinc/42/04/54/568420454.db2.gz PGSCVRYPLPSIOE-XZHNBTELSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000118916054 568420109 /nfs/dbraw/zinc/42/01/09/568420109.db2.gz PGSCVRYPLPSIOE-FNKLRZSHSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@@H]5C[C@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000118916055 568420163 /nfs/dbraw/zinc/42/01/63/568420163.db2.gz PGSCVRYPLPSIOE-ITMXKKHJSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000118916178 568420652 /nfs/dbraw/zinc/42/06/52/568420652.db2.gz AFLVJSJCGOFTTI-IMEUGJQVSA-N 0 0 407.642 6.540 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000118916179 568420595 /nfs/dbraw/zinc/42/05/95/568420595.db2.gz AFLVJSJCGOFTTI-ZGVUGNRNSA-N 0 0 407.642 6.540 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000118916180 568420586 /nfs/dbraw/zinc/42/05/86/568420586.db2.gz AFLVJSJCGOFTTI-HIESWNFHSA-N 0 0 407.642 6.540 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000118916181 568420601 /nfs/dbraw/zinc/42/06/01/568420601.db2.gz AFLVJSJCGOFTTI-HXINVUJDSA-N 0 0 407.642 6.540 40 10 HKCBRN CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)C(=O)C[C@]4(C)[C@H]3CC[C@]12C ZINC000118925606 560870261 /nfs/dbraw/zinc/87/02/61/560870261.db2.gz BYSWDNBNMZHMHK-XPFWUWIUSA-N 0 0 400.647 6.856 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc(-c4ccccc4)cc3)OC2=O)cc(OC)c1OC ZINC000141256617 569361367 /nfs/dbraw/zinc/36/13/67/569361367.db2.gz WVDQMAMXOONYKD-FYJGNVAPSA-N 0 0 414.457 5.361 40 10 HKCBRN COc1ccc(-n2c(C)cc(/C=C3\SC(=O)N(c4ccccc4)C3=O)c2C)cc1 ZINC000144198003 569355080 /nfs/dbraw/zinc/35/50/80/569355080.db2.gz PTIJOCXFSPJFAW-STZFKDTASA-N 0 0 404.491 5.344 40 10 HKCBRN CCc1ccc(-n2c(C)cc(/C=C3\SC(=O)N(c4ccccc4)C3=O)c2C)cc1 ZINC000144198851 569355090 /nfs/dbraw/zinc/35/50/90/569355090.db2.gz KISCBLXOBPSNPO-JCMHNJIXSA-N 0 0 402.519 5.897 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cc(C)ccc1C ZINC000144200066 569355067 /nfs/dbraw/zinc/35/50/67/569355067.db2.gz ZKGUZGOHQVJZDL-HMAPJEAMSA-N 0 0 402.519 5.952 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc2c(c1)OCO2 ZINC000144200475 569355087 /nfs/dbraw/zinc/35/50/87/569355087.db2.gz ADXONAKJRNVUNR-NHDPSOOVSA-N 0 0 418.474 5.064 40 10 HKCBRN CCc1ccccc1-n1c(C)cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c1C ZINC000144204760 569355207 /nfs/dbraw/zinc/35/52/07/569355207.db2.gz ZZPZSCWMZWCRNF-JCMHNJIXSA-N 0 0 402.519 5.897 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1 ZINC000144204963 569355151 /nfs/dbraw/zinc/35/51/51/569355151.db2.gz DMPWKTHNCTYXSN-DEDYPNTBSA-N 0 0 419.462 5.243 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000144205399 569355143 /nfs/dbraw/zinc/35/51/43/569355143.db2.gz XTCWFYDYRAKLGI-DEDYPNTBSA-N 0 0 408.910 5.988 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc(Cl)c1 ZINC000144208955 569355148 /nfs/dbraw/zinc/35/51/48/569355148.db2.gz JJBMKHYPOZLDCV-NDENLUEZSA-N 0 0 408.910 5.988 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc2ccccc21 ZINC000144209770 569073574 /nfs/dbraw/zinc/07/35/74/569073574.db2.gz QGQLGYUURFRFGG-JLPGSUDCSA-N 0 0 424.525 6.488 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000144210628 569355183 /nfs/dbraw/zinc/35/51/83/569355183.db2.gz SBOSFCTWIKSALF-HMAPJEAMSA-N 0 0 402.519 5.952 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000144213153 569355201 /nfs/dbraw/zinc/35/52/01/569355201.db2.gz VAABGUQQRDOOSM-STZFKDTASA-N 0 0 402.519 5.952 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cc(Cl)ccc1C ZINC000144215047 569355203 /nfs/dbraw/zinc/35/52/03/569355203.db2.gz AQKLWRDZSWDVKS-MTJSOVHGSA-N 0 0 422.937 6.297 40 10 HKCBRN CCOc1ccc(-n2c(C)cc(/C=C3\SC(=O)N(c4ccccc4)C3=O)c2C)cc1 ZINC000144217911 569355174 /nfs/dbraw/zinc/35/51/74/569355174.db2.gz ZWBXVDKXJNFDAF-JCMHNJIXSA-N 0 0 418.518 5.734 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000144219527 569355204 /nfs/dbraw/zinc/35/52/04/569355204.db2.gz VADDZCCRBQSZIK-HMAPJEAMSA-N 0 0 402.519 5.952 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc2ccccc2c1 ZINC000144220776 569355159 /nfs/dbraw/zinc/35/51/59/569355159.db2.gz CFUXGVNNNHRBFC-JLPGSUDCSA-N 0 0 424.525 6.488 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc(Cl)c1C ZINC000144222031 569355176 /nfs/dbraw/zinc/35/51/76/569355176.db2.gz MBCWFWKXOXTYMN-BKUYFWCQSA-N 0 0 422.937 6.297 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 ZINC000144224342 569355191 /nfs/dbraw/zinc/35/51/91/569355191.db2.gz MORIZMLBORELLH-HAHDFKILSA-N 0 0 416.546 6.458 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000144228449 569355205 /nfs/dbraw/zinc/35/52/05/569355205.db2.gz NRNRWFUZYLQAHX-HMAPJEAMSA-N 0 0 402.519 5.952 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc(N(C)C)cc1 ZINC000144228879 568467711 /nfs/dbraw/zinc/46/77/11/568467711.db2.gz MCZNNNFHJWKXJB-JCMHNJIXSA-N 0 0 417.534 5.401 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1N[C@@H](c1ccc(Cl)cc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000169620943 560765120 /nfs/dbraw/zinc/76/51/20/560765120.db2.gz NDNSCLBAKMRQSJ-CZIZLABSSA-N 0 0 418.673 7.492 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(Cc3ccc(F)cc3Cl)C2=O)cc1 ZINC000205687963 568435963 /nfs/dbraw/zinc/43/59/63/568435963.db2.gz PLKLLIPDMCRZDM-YBFXNURJSA-N 0 0 418.921 5.562 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1OC ZINC000206207896 569361474 /nfs/dbraw/zinc/36/14/74/569361474.db2.gz SOONQQGWPOBFQP-LDADJPATSA-N 0 0 419.955 5.543 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000206294455 569361479 /nfs/dbraw/zinc/36/14/79/569361479.db2.gz HHKQCRJLXTUVLA-LDADJPATSA-N 0 0 403.956 5.925 40 10 HKCBRN CCN1C(=O)/C(=C/c2cn(CCOc3ccccc3)c3ccccc23)c2ccccc21 ZINC000207986850 569361477 /nfs/dbraw/zinc/36/14/77/569361477.db2.gz JVMXGJWEJYVFKR-HKOYGPOVSA-N 0 0 408.501 5.627 40 10 HKCBRN Cc1ccccc1NC1=NC(=O)C(=Cc2ccc3c(c2)[C@H](C)CC(C)(C)N3C)S1 ZINC000208193030 568443640 /nfs/dbraw/zinc/44/36/40/568443640.db2.gz JDJMYSVJQBIVPP-RDPIHGLISA-N 0 0 405.567 5.799 40 10 HKCBRN Cc1ccccc1NC1=NC(=O)C(=Cc2ccc3c(c2)[C@@H](C)CC(C)(C)N3C)S1 ZINC000208193067 568443589 /nfs/dbraw/zinc/44/35/89/568443589.db2.gz JDJMYSVJQBIVPP-JHDSZEHQSA-N 0 0 405.567 5.799 40 10 HKCBRN Cc1cccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)S2)c1C ZINC000208193531 568443605 /nfs/dbraw/zinc/44/36/05/568443605.db2.gz SDVKQODOPGVRPU-NXUSMQHESA-N 0 0 419.594 6.108 40 10 HKCBRN Cc1cccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)S2)c1C ZINC000208193577 568443615 /nfs/dbraw/zinc/44/36/15/568443615.db2.gz SDVKQODOPGVRPU-GLFIFPSUSA-N 0 0 419.594 6.108 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)S2)c(C)c1 ZINC000208194063 568443600 /nfs/dbraw/zinc/44/36/00/568443600.db2.gz WBQWVSAENSMIKC-VYZAVGSRSA-N 0 0 419.594 6.108 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)S2)c(C)c1 ZINC000208194104 568443587 /nfs/dbraw/zinc/44/35/87/568443587.db2.gz WBQWVSAENSMIKC-RIWZNOJBSA-N 0 0 419.594 6.108 40 10 HKCBRN C[C@@H]1CC(C)(C)N(C)c2ccc(C=C3SC(Nc4ccc(F)cc4)=NC3=O)cc21 ZINC000208195442 568443633 /nfs/dbraw/zinc/44/36/33/568443633.db2.gz JOSCSZPAZOPLPJ-FAPYRAKZSA-N 0 0 409.530 5.630 40 10 HKCBRN C[C@H]1CC(C)(C)N(C)c2ccc(C=C3SC(Nc4ccc(F)cc4)=NC3=O)cc21 ZINC000208195485 568443566 /nfs/dbraw/zinc/44/35/66/568443566.db2.gz JOSCSZPAZOPLPJ-GQFJFNLSSA-N 0 0 409.530 5.630 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)S2)cc1 ZINC000208196657 568443573 /nfs/dbraw/zinc/44/35/73/568443573.db2.gz VLPARBUVWGRDHX-LRSOKBAUSA-N 0 0 419.594 6.053 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)S2)cc1 ZINC000208196695 568443621 /nfs/dbraw/zinc/44/36/21/568443621.db2.gz VLPARBUVWGRDHX-VOMLJKFNSA-N 0 0 419.594 6.053 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)S2)cc1 ZINC000208199268 568443641 /nfs/dbraw/zinc/44/36/41/568443641.db2.gz JAWWOOQPDPAFJB-RDPIHGLISA-N 0 0 405.567 5.799 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)S2)cc1 ZINC000208199312 568443594 /nfs/dbraw/zinc/44/35/94/568443594.db2.gz JAWWOOQPDPAFJB-JHDSZEHQSA-N 0 0 405.567 5.799 40 10 HKCBRN C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)cc21 ZINC000208219386 568443619 /nfs/dbraw/zinc/44/36/19/568443619.db2.gz HFPOJQQDMIZGNJ-CTFRJJSNSA-N 0 0 408.592 5.814 40 10 HKCBRN C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)cc21 ZINC000208219429 568443549 /nfs/dbraw/zinc/44/35/49/568443549.db2.gz HFPOJQQDMIZGNJ-HYTQYMIGSA-N 0 0 408.592 5.814 40 10 HKCBRN C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3\NC(=O)N(Cc4ccc(Cl)cc4)C3=O)cc21 ZINC000208220362 568443620 /nfs/dbraw/zinc/44/36/20/568443620.db2.gz AEVLSEQHXUKPNM-GEYIUBJWSA-N 0 0 423.944 5.155 40 10 HKCBRN C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3\NC(=O)N(Cc4ccc(Cl)cc4)C3=O)cc21 ZINC000208220404 568443564 /nfs/dbraw/zinc/44/35/64/568443564.db2.gz AEVLSEQHXUKPNM-DKNZLLBESA-N 0 0 423.944 5.155 40 10 HKCBRN C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)cc21 ZINC000208221268 568443592 /nfs/dbraw/zinc/44/35/92/568443592.db2.gz RYHLCOVLNPFDSA-RDPIHGLISA-N 0 0 406.551 5.645 40 10 HKCBRN C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)cc21 ZINC000208221323 568443616 /nfs/dbraw/zinc/44/36/16/568443616.db2.gz RYHLCOVLNPFDSA-JHDSZEHQSA-N 0 0 406.551 5.645 40 10 HKCBRN C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccc(F)cc4)C3=O)cc21 ZINC000208222364 568443755 /nfs/dbraw/zinc/44/37/55/568443755.db2.gz AQDSHQKEYUOBHY-OFNOZLENSA-N 0 0 424.541 5.784 40 10 HKCBRN C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccc(F)cc4)C3=O)cc21 ZINC000208222403 568443750 /nfs/dbraw/zinc/44/37/50/568443750.db2.gz AQDSHQKEYUOBHY-RANIVTSPSA-N 0 0 424.541 5.784 40 10 HKCBRN C[C@@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccccc4F)C3=O)cc21 ZINC000208222769 568443718 /nfs/dbraw/zinc/44/37/18/568443718.db2.gz OFYFIKHODNHJEZ-OFNOZLENSA-N 0 0 424.541 5.784 40 10 HKCBRN C[C@H]1CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccccc4F)C3=O)cc21 ZINC000208222811 568443752 /nfs/dbraw/zinc/44/37/52/568443752.db2.gz OFYFIKHODNHJEZ-RANIVTSPSA-N 0 0 424.541 5.784 40 10 HKCBRN Cc1ccc(CN2C(=O)S/C(=C\c3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208223593 568443730 /nfs/dbraw/zinc/44/37/30/568443730.db2.gz ZPPIBVPFWZLGNK-VYZAVGSRSA-N 0 0 420.578 5.954 40 10 HKCBRN Cc1ccc(CN2C(=O)S/C(=C\c3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208223634 568443675 /nfs/dbraw/zinc/44/36/75/568443675.db2.gz ZPPIBVPFWZLGNK-RIWZNOJBSA-N 0 0 420.578 5.954 40 10 HKCBRN Cc1ccc(CN2C(=O)N/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C[C@@H]4C)C2=O)cc1 ZINC000208224432 568443690 /nfs/dbraw/zinc/44/36/90/568443690.db2.gz TYCGSDQNOVQSMK-FPJJECCMSA-N 0 0 417.553 5.118 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(c3ccccc3)C1=O)[C@H](C)CC(C)(C)N2C ZINC000208227392 568443677 /nfs/dbraw/zinc/44/36/77/568443677.db2.gz NXDWRWXTFVNOGZ-RDPIHGLISA-N 0 0 406.551 5.958 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(c3ccccc3)C1=O)[C@@H](C)CC(C)(C)N2C ZINC000208227428 568443751 /nfs/dbraw/zinc/44/37/51/568443751.db2.gz NXDWRWXTFVNOGZ-JHDSZEHQSA-N 0 0 406.551 5.958 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=S)N(c3ccccc3)C1=O)[C@H](C)CC(C)(C)N2C ZINC000208227471 568443705 /nfs/dbraw/zinc/44/37/05/568443705.db2.gz DLJANOIIEKXIAE-RDPIHGLISA-N 0 0 422.619 6.123 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=S)N(c3ccccc3)C1=O)[C@@H](C)CC(C)(C)N2C ZINC000208227516 568443747 /nfs/dbraw/zinc/44/37/47/568443747.db2.gz DLJANOIIEKXIAE-JHDSZEHQSA-N 0 0 422.619 6.123 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(Cc3ccccc3)C1=O)[C@H](C)CC(C)(C)N2C ZINC000208229147 568443663 /nfs/dbraw/zinc/44/36/63/568443663.db2.gz PYQROZOLABDHKP-VYZAVGSRSA-N 0 0 420.578 5.954 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(Cc3ccccc3)C1=O)[C@@H](C)CC(C)(C)N2C ZINC000208229185 568443701 /nfs/dbraw/zinc/44/37/01/568443701.db2.gz PYQROZOLABDHKP-RIWZNOJBSA-N 0 0 420.578 5.954 40 10 HKCBRN Cc1cc2c(cc1C=C1SC(Nc3ccccc3)=NC1=O)[C@H](C)CC(C)(C)N2C ZINC000208231371 568443672 /nfs/dbraw/zinc/44/36/72/568443672.db2.gz AYMKFDWYKWUKNE-RDPIHGLISA-N 0 0 405.567 5.799 40 10 HKCBRN Cc1cc2c(cc1C=C1SC(Nc3ccccc3)=NC1=O)[C@@H](C)CC(C)(C)N2C ZINC000208231408 568443746 /nfs/dbraw/zinc/44/37/46/568443746.db2.gz AYMKFDWYKWUKNE-JHDSZEHQSA-N 0 0 405.567 5.799 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@@H]4C)S2)cc1 ZINC000208231469 568443732 /nfs/dbraw/zinc/44/37/32/568443732.db2.gz VDYNNPOCJCAEGW-RIWZNOJBSA-N 0 0 419.594 6.108 40 10 HKCBRN Cc1cccc(NC2=NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@@H]4C)S2)c1 ZINC000208231699 568443670 /nfs/dbraw/zinc/44/36/70/568443670.db2.gz AOKDMQSPUTVJSI-RIWZNOJBSA-N 0 0 419.594 6.108 40 10 HKCBRN Cc1ccccc1NC1=NC(=O)C(=Cc2cc3c(cc2C)N(C)C(C)(C)C[C@@H]3C)S1 ZINC000208233846 568443703 /nfs/dbraw/zinc/44/37/03/568443703.db2.gz FHMWHQHZGCZFEB-RIWZNOJBSA-N 0 0 419.594 6.108 40 10 HKCBRN Cc1cc2c(cc1C=C1SC(Nc3ccc(F)cc3)=NC1=O)[C@H](C)CC(C)(C)N2C ZINC000208235752 568443664 /nfs/dbraw/zinc/44/36/64/568443664.db2.gz AASUBWHMAYDWCB-OFNOZLENSA-N 0 0 423.557 5.939 40 10 HKCBRN Cc1cc2c(cc1C=C1SC(Nc3ccc(F)cc3)=NC1=O)[C@@H](C)CC(C)(C)N2C ZINC000208235793 568443668 /nfs/dbraw/zinc/44/36/68/568443668.db2.gz AASUBWHMAYDWCB-RANIVTSPSA-N 0 0 423.557 5.939 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2c(cc1Cl)N(C)C(C)(C)C[C@H]2C ZINC000208238052 569361510 /nfs/dbraw/zinc/36/15/10/569361510.db2.gz RGUQIRAHTJCWBO-RVZJCZPVSA-N 0 0 407.945 5.868 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2c(cc1Cl)N(C)C(C)(C)C[C@@H]2C ZINC000208238098 568443681 /nfs/dbraw/zinc/44/36/81/568443681.db2.gz RGUQIRAHTJCWBO-SLDJAQPHSA-N 0 0 407.945 5.868 40 10 HKCBRN C[C@@H]1CC(C)(C)N(C)c2cc(Cl)c(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc21 ZINC000208257226 568443714 /nfs/dbraw/zinc/44/37/14/568443714.db2.gz GXDFCPJTURCUOL-UWOKGBPVSA-N 0 0 423.944 5.155 40 10 HKCBRN C[C@H]1CC(C)(C)N(C)c2cc(Cl)c(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc21 ZINC000208257265 568443741 /nfs/dbraw/zinc/44/37/41/568443741.db2.gz GXDFCPJTURCUOL-PFHZTYADSA-N 0 0 423.944 5.155 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208306379 569361468 /nfs/dbraw/zinc/36/14/68/569361468.db2.gz GTDMEDRTSVGIPJ-QAIWHXNASA-N 0 0 406.551 6.040 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208306420 569361472 /nfs/dbraw/zinc/36/14/72/569361472.db2.gz GEJDGYNSGOCFOI-QAIWHXNASA-N 0 0 422.619 6.205 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208307907 569361538 /nfs/dbraw/zinc/36/15/38/569361538.db2.gz UBWMQZLUXPENRG-VVRYKASASA-N 0 0 420.578 6.035 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccccc4C)=NC3=O)cc2[C@H](C)CC1(C)C ZINC000208310658 569361480 /nfs/dbraw/zinc/36/14/80/569361480.db2.gz SEBDVFCKSAOWTB-VVRYKASASA-N 0 0 419.594 6.190 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccc(F)cc4)=NC3=O)cc2[C@H](C)CC1(C)C ZINC000208311979 569361492 /nfs/dbraw/zinc/36/14/92/569361492.db2.gz WYRGMSFLWURJGU-PJMHOZITSA-N 0 0 423.557 6.020 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccccc4)=NC3=O)cc2[C@H](C)CC1(C)C ZINC000208314454 569361453 /nfs/dbraw/zinc/36/14/53/569361453.db2.gz KKCYKIIRCAKMNV-QAIWHXNASA-N 0 0 405.567 5.881 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccc(C)cc4)=NC3=O)cc2[C@H](C)CC1(C)C ZINC000208314509 569361521 /nfs/dbraw/zinc/36/15/21/569361521.db2.gz GOSDMVYBRAXRFN-VVRYKASASA-N 0 0 419.594 6.190 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4cccc(C)c4)=NC3=O)cc2[C@H](C)CC1(C)C ZINC000208314835 569361519 /nfs/dbraw/zinc/36/15/19/569361519.db2.gz NZSAVZIZVVSGIX-VVRYKASASA-N 0 0 419.594 6.190 40 10 HKCBRN CCN1c2cc(C)c(C=C3SC(Nc4ccccc4)=NC3=O)cc2[C@H](C)CC1(C)C ZINC000208317268 569361470 /nfs/dbraw/zinc/36/14/70/569361470.db2.gz XCCNBZMUCONUNG-VVRYKASASA-N 0 0 419.594 6.190 40 10 HKCBRN CCN1c2cc(C)c(/C=C3/C(=O)N(c4ccccc4)N=C3C)cc2[C@H](C)CC1(C)C ZINC000208319890 569361487 /nfs/dbraw/zinc/36/14/87/569361487.db2.gz SKZIVVSCGUCSKS-MMTNMYCKSA-N 0 0 401.554 5.913 40 10 HKCBRN CCN1c2ccc(/C=C3\NC(=O)N(Cc4ccc(F)cc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208322110 569361485 /nfs/dbraw/zinc/36/14/85/569361485.db2.gz WCZNYLNFLINVRB-RDPIHGLISA-N 0 0 421.516 5.031 40 10 HKCBRN CCN1c2ccc(/C=C3\NC(=O)N(Cc4ccccc4F)C3=O)cc2[C@H](C)CC1(C)C ZINC000208322156 569361482 /nfs/dbraw/zinc/36/14/82/569361482.db2.gz USYXBNNGGAIXAV-RDPIHGLISA-N 0 0 421.516 5.031 40 10 HKCBRN CCN1c2ccc(/C=C3\NC(=O)N(Cc4ccc(C)cc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208322372 569361506 /nfs/dbraw/zinc/36/15/06/569361506.db2.gz ZDURPROKXHFEMB-QWQBBLJPSA-N 0 0 417.553 5.200 40 10 HKCBRN CCN1c2cc(C)c(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208325617 569361626 /nfs/dbraw/zinc/36/16/26/569361626.db2.gz AMMLOZUKYZXUKN-VVRYKASASA-N 0 0 420.578 6.348 40 10 HKCBRN CCN1c2cc(C)c(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208326621 569361572 /nfs/dbraw/zinc/36/15/72/569361572.db2.gz KOEJRTSIBRUHDV-QWQBBLJPSA-N 0 0 417.553 5.200 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(/C=C3\NC(=O)N(Cc4ccc(Cl)cc4)C3=O)cc21 ZINC000208440938 568445449 /nfs/dbraw/zinc/44/54/49/568445449.db2.gz ZDBBMZDUSMZEFM-NDENLUEZSA-N 0 0 421.928 5.065 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)cc21 ZINC000208441136 568445403 /nfs/dbraw/zinc/44/54/03/568445403.db2.gz PMBZQADNIGSEMS-BKUYFWCQSA-N 0 0 404.535 5.555 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccc(F)cc4)C3=O)cc21 ZINC000208441690 568445383 /nfs/dbraw/zinc/44/53/83/568445383.db2.gz DGGGULXZPBNVBW-MTJSOVHGSA-N 0 0 422.525 5.694 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(/C=C3\SC(=O)N(Cc4ccccc4F)C3=O)cc21 ZINC000208441905 568445438 /nfs/dbraw/zinc/44/54/38/568445438.db2.gz SIJKMDADFGRBGM-MTJSOVHGSA-N 0 0 422.525 5.694 40 10 HKCBRN Cc1ccc(CN2C(=O)S/C(=C\c3ccc4c(c3)C(C)=CC(C)(C)N4C)C2=O)cc1 ZINC000208442390 568445479 /nfs/dbraw/zinc/44/54/79/568445479.db2.gz HONIUGIUXABGOX-XKZIYDEJSA-N 0 0 418.562 5.863 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)cc21 ZINC000208443580 568445492 /nfs/dbraw/zinc/44/54/92/568445492.db2.gz SMJHIYRXNPCNHG-MOSHPQCFSA-N 0 0 406.576 5.724 40 10 HKCBRN CCc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)S2)cc1 ZINC000208444530 568445433 /nfs/dbraw/zinc/44/54/33/568445433.db2.gz HLBKATBLTBXMNO-HMAPJEAMSA-N 0 0 417.578 5.963 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)S2)cc1 ZINC000208446899 568445473 /nfs/dbraw/zinc/44/54/73/568445473.db2.gz IRWOPMRCCDYQAL-BKUYFWCQSA-N 0 0 403.551 5.709 40 10 HKCBRN Cc1cccc(NC2=NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)S2)c1 ZINC000208447128 568445471 /nfs/dbraw/zinc/44/54/71/568445471.db2.gz NNWAMVYRORQJIN-BKUYFWCQSA-N 0 0 403.551 5.709 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)S2)cc1C ZINC000208447366 568445459 /nfs/dbraw/zinc/44/54/59/568445459.db2.gz KEWBAFCSUMSOHQ-XKZIYDEJSA-N 0 0 417.578 6.018 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(C=C3SC(Nc4ccc(Cl)cc4)=NC3=O)cc21 ZINC000208447652 568445410 /nfs/dbraw/zinc/44/54/10/568445410.db2.gz KMRWYBPIEVBHOH-NDENLUEZSA-N 0 0 423.969 6.054 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(C=C3SC(Nc4cccc(Cl)c4)=NC3=O)cc21 ZINC000208447994 568445415 /nfs/dbraw/zinc/44/54/15/568445415.db2.gz BUCUWGPGUZDTHJ-JAIQZWGSSA-N 0 0 423.969 6.054 40 10 HKCBRN Cc1ccccc1NC1=NC(=O)C(=Cc2ccc3c(c2)C(C)=CC(C)(C)N3C)S1 ZINC000208448397 568445417 /nfs/dbraw/zinc/44/54/17/568445417.db2.gz IGBYKNLIOVQBCF-BKUYFWCQSA-N 0 0 403.551 5.709 40 10 HKCBRN Cc1cccc(NC2=NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)S2)c1C ZINC000208448706 568445483 /nfs/dbraw/zinc/44/54/83/568445483.db2.gz OAAFCCOUSWFSKO-XKZIYDEJSA-N 0 0 417.578 6.018 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)S2)c(C)c1 ZINC000208448982 568445576 /nfs/dbraw/zinc/44/55/76/568445576.db2.gz RXWFQVZXODSHGH-XKZIYDEJSA-N 0 0 417.578 6.018 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc(C=C3SC(Nc4ccc(F)cc4)=NC3=O)cc21 ZINC000208449723 568445536 /nfs/dbraw/zinc/44/55/36/568445536.db2.gz RXOYFFRLRCSPAC-NDENLUEZSA-N 0 0 407.514 5.540 40 10 HKCBRN Cc1ccccc1NC1=NC(=O)C(=Cc2cc3c(cc2C)N(C)C(C)(C)C=C3C)S1 ZINC000208449823 568445580 /nfs/dbraw/zinc/44/55/80/568445580.db2.gz KOSIHEMLKORIOP-XKZIYDEJSA-N 0 0 417.578 6.018 40 10 HKCBRN Cc1cc2c(cc1C=C1SC(Nc3ccc(F)cc3)=NC1=O)C(C)=CC(C)(C)N2C ZINC000208451147 568445606 /nfs/dbraw/zinc/44/56/06/568445606.db2.gz GSRGSRGUHHAPFR-MTJSOVHGSA-N 0 0 421.541 5.848 40 10 HKCBRN Cc1cc2c(cc1C=C1SC(Nc3ccccc3)=NC1=O)C(C)=CC(C)(C)N2C ZINC000208453779 568445518 /nfs/dbraw/zinc/44/55/18/568445518.db2.gz NFUFEKLHMQGLGY-BKUYFWCQSA-N 0 0 403.551 5.709 40 10 HKCBRN Cc1ccc(NC2=NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C=C4C)S2)cc1 ZINC000208453844 568445499 /nfs/dbraw/zinc/44/54/99/568445499.db2.gz FSPQMWKVYYMGHH-XKZIYDEJSA-N 0 0 417.578 6.018 40 10 HKCBRN Cc1cccc(NC2=NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C=C4C)S2)c1 ZINC000208454080 568445553 /nfs/dbraw/zinc/44/55/53/568445553.db2.gz QRMBXSLJJLFCMH-XKZIYDEJSA-N 0 0 417.578 6.018 40 10 HKCBRN Cc1ccc(CN2C(=O)N/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)cc1 ZINC000208459879 568445800 /nfs/dbraw/zinc/44/58/00/568445800.db2.gz NQOTZVBDOWLYGE-XKZIYDEJSA-N 0 0 415.537 5.028 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(c3ccccc3)C1=O)C(C)=CC(C)(C)N2C ZINC000208461215 568445946 /nfs/dbraw/zinc/44/59/46/568445946.db2.gz RBWBARGQQSCYDU-BKUYFWCQSA-N 0 0 404.535 5.868 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=S)N(c3ccccc3)C1=O)C(C)=CC(C)(C)N2C ZINC000208461334 568445878 /nfs/dbraw/zinc/44/58/78/568445878.db2.gz KAFUNTKNCIOSPH-BKUYFWCQSA-N 0 0 420.603 6.033 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(Cc3ccccc3)C1=O)C(C)=CC(C)(C)N2C ZINC000208462054 568445879 /nfs/dbraw/zinc/44/58/79/568445879.db2.gz YASFNZLNPABMGR-XKZIYDEJSA-N 0 0 418.562 5.863 40 10 HKCBRN CC1=CC(C)(C)N(C)c2cc(Cl)c(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc21 ZINC000208468610 568446152 /nfs/dbraw/zinc/44/61/52/568446152.db2.gz VESBUSUODUTAQZ-JAIQZWGSSA-N 0 0 424.953 6.213 40 10 HKCBRN CC1=CC(C)(C)N(C)c2cc(Cl)c(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc21 ZINC000208469519 568446317 /nfs/dbraw/zinc/44/63/17/568446317.db2.gz YUEJAAOLEBRHIU-JAIQZWGSSA-N 0 0 421.928 5.065 40 10 HKCBRN CC1=CC(C)(C)N(C)c2cc(Cl)c(C=C3SC(Nc4ccccc4)=NC3=O)cc21 ZINC000208471081 568446605 /nfs/dbraw/zinc/44/66/05/568446605.db2.gz KNXRPXKZWLTTJS-JAIQZWGSSA-N 0 0 423.969 6.054 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2c(cc1Cl)N(C)C(C)(C)C=C2C ZINC000208473895 568446713 /nfs/dbraw/zinc/44/67/13/568446713.db2.gz KMPMFKJHFPZUGK-UDWIEESQSA-N 0 0 405.929 5.778 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccccc4)=NC3=O)cc2C(C)=CC1(C)C ZINC000208503670 568446828 /nfs/dbraw/zinc/44/68/28/568446828.db2.gz LVQYFNAGJYVYQF-STZFKDTASA-N 0 0 403.551 5.791 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccc(C)cc4)=NC3=O)cc2C(C)=CC1(C)C ZINC000208503729 568446862 /nfs/dbraw/zinc/44/68/62/568446862.db2.gz OKZSCMPPYJKIPE-HMAPJEAMSA-N 0 0 417.578 6.099 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4cccc(C)c4)=NC3=O)cc2C(C)=CC1(C)C ZINC000208503962 568446833 /nfs/dbraw/zinc/44/68/33/568446833.db2.gz QPXVQJSYYDGILW-HMAPJEAMSA-N 0 0 417.578 6.099 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccccc4C)=NC3=O)cc2C(C)=CC1(C)C ZINC000208505158 568446821 /nfs/dbraw/zinc/44/68/21/568446821.db2.gz IAAMWBYXWCYNLQ-HMAPJEAMSA-N 0 0 417.578 6.099 40 10 HKCBRN CCN1c2ccc(C=C3SC(Nc4ccc(F)cc4)=NC3=O)cc2C(C)=CC1(C)C ZINC000208506405 568446856 /nfs/dbraw/zinc/44/68/56/568446856.db2.gz ZJJAMXJVUIMOBN-BKUYFWCQSA-N 0 0 421.541 5.930 40 10 HKCBRN CCN1c2ccc(/C=C3\NC(=O)N(Cc4ccc(C)cc4)C3=O)cc2C(C)=CC1(C)C ZINC000208510072 568446860 /nfs/dbraw/zinc/44/68/60/568446860.db2.gz QBKDMIYNPPTAGD-HMAPJEAMSA-N 0 0 415.537 5.110 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2C(C)=CC1(C)C ZINC000208511396 568446872 /nfs/dbraw/zinc/44/68/72/568446872.db2.gz OKCPDDQPADFPQR-STZFKDTASA-N 0 0 404.535 5.949 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)cc2C(C)=CC1(C)C ZINC000208511510 568446865 /nfs/dbraw/zinc/44/68/65/568446865.db2.gz CYIVFKQNBQRPSJ-STZFKDTASA-N 0 0 420.603 6.114 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)cc2C(C)=CC1(C)C ZINC000208512175 568446842 /nfs/dbraw/zinc/44/68/42/568446842.db2.gz ICVYJXSPCZLCEF-HMAPJEAMSA-N 0 0 418.562 5.945 40 10 HKCBRN CCN1c2cc(C)c(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2C(C)=CC1(C)C ZINC000208518104 568446957 /nfs/dbraw/zinc/44/69/57/568446957.db2.gz UABWSNXTKHOAPG-HMAPJEAMSA-N 0 0 418.562 6.258 40 10 HKCBRN CCN1c2cc(C)c(C=C3SC(Nc4ccccc4)=NC3=O)cc2C(C)=CC1(C)C ZINC000208525344 568446943 /nfs/dbraw/zinc/44/69/43/568446943.db2.gz GQKJWPOHRSRXMH-HMAPJEAMSA-N 0 0 417.578 6.099 40 10 HKCBRN CCN1c2cc(C)c(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc2C(C)=CC1(C)C ZINC000208532139 568446959 /nfs/dbraw/zinc/44/69/59/568446959.db2.gz VZKATYYKRABMRN-HMAPJEAMSA-N 0 0 415.537 5.110 40 10 HKCBRN Cc1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc(C)cc1 ZINC000208657230 569361650 /nfs/dbraw/zinc/36/16/50/569361650.db2.gz PUMTWKIHEPACSX-STZFKDTASA-N 0 0 404.560 5.808 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)c([N+](=O)[O-])c3)o2)SC1=S ZINC000208667069 569361639 /nfs/dbraw/zinc/36/16/39/569361639.db2.gz MPFQKISMYSVTCG-DHDCSXOGSA-N 0 0 408.888 5.119 40 10 HKCBRN O=C1N=C(Nc2ccccc2)SC1=Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000208669481 569361661 /nfs/dbraw/zinc/36/16/61/569361661.db2.gz UYOZXMLPZVNMEB-HAHDFKILSA-N 0 0 409.514 5.772 40 10 HKCBRN Cc1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000208675017 569361659 /nfs/dbraw/zinc/36/16/59/569361659.db2.gz KXUCJIWDNJMRNG-MOSHPQCFSA-N 0 0 424.978 6.153 40 10 HKCBRN Cc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1ccc(Cl)c(Cl)c1 ZINC000208682521 569361612 /nfs/dbraw/zinc/36/16/12/569361612.db2.gz NXRVFWWSJJQQFN-NDENLUEZSA-N 0 0 424.331 6.207 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C/c2cccn2-c2cccc([N+](=O)[O-])c2)SC1=S ZINC000208693264 569361657 /nfs/dbraw/zinc/36/16/57/569361657.db2.gz PXCJKRAWJLAHEX-UYRXBGFRSA-N 0 0 421.503 5.100 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(Cl)c(Cl)c3)c2C)SC1=S ZINC000208727720 569361652 /nfs/dbraw/zinc/36/16/52/569361652.db2.gz MTVUMFGLRAFBRM-PXNMLYILSA-N 0 0 411.379 5.622 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C\c1ccc(-c2ccc(Cl)c([N+](=O)[O-])c2)o1 ZINC000208731562 569361616 /nfs/dbraw/zinc/36/16/16/569361616.db2.gz PVHFAXACYPIZIO-ATVHPVEESA-N 0 0 407.813 5.314 40 10 HKCBRN O=C1Nc2cc(C(F)(F)F)ccc2/C1=C/c1cn(Cc2ccccc2)c2ccccc12 ZINC000209377021 569361610 /nfs/dbraw/zinc/36/16/10/569361610.db2.gz JVZITCFEVGOBGJ-MTJSOVHGSA-N 0 0 418.418 6.201 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)ccc1OC(F)F ZINC000211633721 569361583 /nfs/dbraw/zinc/36/15/83/569361583.db2.gz VFJDBWNGJYWRRV-MHWRWJLKSA-N 0 0 407.463 5.011 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)cc(Cl)c1O ZINC000211634359 569361590 /nfs/dbraw/zinc/36/15/90/569361590.db2.gz AUOXIGXMVNXOLH-MHWRWJLKSA-N 0 0 405.928 5.159 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)cc(Cl)c1OC ZINC000211634435 569361625 /nfs/dbraw/zinc/36/16/25/569361625.db2.gz QXLIOFBVPJPDJT-MHWRWJLKSA-N 0 0 405.928 5.071 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc(Cl)c1OC ZINC000211635703 569361700 /nfs/dbraw/zinc/36/17/00/569361700.db2.gz JIRKSYFTYKNGGX-LFIBNONCSA-N 0 0 405.928 5.153 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000214049760 569361696 /nfs/dbraw/zinc/36/16/96/569361696.db2.gz LQXXMYDITHVIPR-FYJGNVAPSA-N 0 0 422.937 5.984 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(Cc3ccccc3Cl)C2=O)c(C)n1-c1ccccc1 ZINC000214080909 569361737 /nfs/dbraw/zinc/36/17/37/569361737.db2.gz VTQFJBNOTGMINA-FYJGNVAPSA-N 0 0 422.937 5.984 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(Cc3ccc(F)cc3)C2=O)c(C)n1-c1ccccc1 ZINC000214208264 558986599 /nfs/dbraw/zinc/98/65/99/558986599.db2.gz RGJJHVIWZNCFHF-FYJGNVAPSA-N 0 0 406.482 5.470 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(Cc3ccccc3F)C2=O)c(C)n1-c1ccccc1 ZINC000214358078 569361710 /nfs/dbraw/zinc/36/17/10/569361710.db2.gz RNXYJXWTKCHWHU-FYJGNVAPSA-N 0 0 406.482 5.470 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1ccccc1 ZINC000214475887 569361708 /nfs/dbraw/zinc/36/17/08/569361708.db2.gz PCOVQAZTTLKHOK-HYARGMPZSA-N 0 0 402.519 5.639 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(Cc3cccc(C)c3)C2=O)c(C)n1-c1ccccc1 ZINC000214619211 558260255 /nfs/dbraw/zinc/26/02/55/558260255.db2.gz VPKDJWOMVMNGNJ-HYARGMPZSA-N 0 0 402.519 5.639 40 10 HKCBRN CN(C)c1ccc(/C=C2/SC(=O)N(Cc3c(Cl)cccc3Cl)C2=O)cc1 ZINC000214710713 558263286 /nfs/dbraw/zinc/26/32/86/558263286.db2.gz CHMTXEVCMYZTRJ-LICLKQGHSA-N 0 0 407.322 5.296 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(Cc3c(F)cccc3Cl)C2=O)cc1 ZINC000215148866 569361774 /nfs/dbraw/zinc/36/17/74/569361774.db2.gz GDQPLJWRTCDXSN-XDHOZWIPSA-N 0 0 418.921 5.562 40 10 HKCBRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000216379990 568464950 /nfs/dbraw/zinc/46/49/50/568464950.db2.gz VHNIYVSLGQTZLQ-OAQYLSRUSA-N 0 0 402.991 5.517 40 10 HKCBRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000216380033 568464948 /nfs/dbraw/zinc/46/49/48/568464948.db2.gz VHNIYVSLGQTZLQ-NRFANRHFSA-N 0 0 402.991 5.517 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000217836353 568474067 /nfs/dbraw/zinc/47/40/67/568474067.db2.gz ZWVWLNFTUWBCSD-MRXNPFEDSA-N 0 0 421.368 5.486 40 10 HKCBRN C[C@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000217836421 568474127 /nfs/dbraw/zinc/47/41/27/568474127.db2.gz ZWVWLNFTUWBCSD-INIZCTEOSA-N 0 0 421.368 5.486 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217836532 568474066 /nfs/dbraw/zinc/47/40/66/568474066.db2.gz FLFPIMIKAQFLJH-HZPDHXFCSA-N 0 0 421.368 5.486 40 10 HKCBRN C[C@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217836570 568474096 /nfs/dbraw/zinc/47/40/96/568474096.db2.gz FLFPIMIKAQFLJH-CVEARBPZSA-N 0 0 421.368 5.486 40 10 HKCBRN C[C@@H](NC(=O)c1ccc(Br)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217869175 568474232 /nfs/dbraw/zinc/47/42/32/568474232.db2.gz JNPDRKYGHORNOX-MRXNPFEDSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@H](NC(=O)c1ccc(Br)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217869245 568474212 /nfs/dbraw/zinc/47/42/12/568474212.db2.gz JNPDRKYGHORNOX-INIZCTEOSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@@H](NC(=O)c1ccc(Br)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217869355 568474207 /nfs/dbraw/zinc/47/42/07/568474207.db2.gz GRBQPAMRAXBMKU-HZPDHXFCSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@H](NC(=O)c1ccc(Br)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217869440 568474235 /nfs/dbraw/zinc/47/42/35/568474235.db2.gz GRBQPAMRAXBMKU-CVEARBPZSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000217906881 568474194 /nfs/dbraw/zinc/47/41/94/568474194.db2.gz SMYBAJNMVHSSNN-DKISHCGFSA-N 0 0 417.380 6.120 40 10 HKCBRN C[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000217906956 568474177 /nfs/dbraw/zinc/47/41/77/568474177.db2.gz SMYBAJNMVHSSNN-BHMZLHOFSA-N 0 0 417.380 6.120 40 10 HKCBRN C[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217907080 568474197 /nfs/dbraw/zinc/47/41/97/568474197.db2.gz BMIVKTPKLKEPEV-OKYZRPEMSA-N 0 0 417.380 6.120 40 10 HKCBRN C[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217907172 568474223 /nfs/dbraw/zinc/47/42/23/568474223.db2.gz BMIVKTPKLKEPEV-HARXRPJJSA-N 0 0 417.380 6.120 40 10 HKCBRN C[C@@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217952853 568474347 /nfs/dbraw/zinc/47/43/47/568474347.db2.gz ZPDPRALEJKCQHH-JTVVXKTLSA-N 0 0 404.598 6.111 40 10 HKCBRN C[C@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217952948 568474294 /nfs/dbraw/zinc/47/42/94/568474294.db2.gz ZPDPRALEJKCQHH-OMKLEDIQSA-N 0 0 404.598 6.111 40 10 HKCBRN C[C@@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217953042 568474300 /nfs/dbraw/zinc/47/43/00/568474300.db2.gz IPJAAONCUVKVIL-VJNHWAOBSA-N 0 0 404.598 6.111 40 10 HKCBRN C[C@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217953129 568474303 /nfs/dbraw/zinc/47/43/03/568474303.db2.gz IPJAAONCUVKVIL-GVXRIWOLSA-N 0 0 404.598 6.111 40 10 HKCBRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217981919 568474441 /nfs/dbraw/zinc/47/44/41/568474441.db2.gz ATEOVVAHKDWIPH-QGZVFWFLSA-N 0 0 402.991 5.546 40 10 HKCBRN C[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217982000 568474440 /nfs/dbraw/zinc/47/44/40/568474440.db2.gz ATEOVVAHKDWIPH-KRWDZBQOSA-N 0 0 402.991 5.546 40 10 HKCBRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217982095 568474419 /nfs/dbraw/zinc/47/44/19/568474419.db2.gz GOXAHJGUUQGIIR-IAGOWNOFSA-N 0 0 402.991 5.546 40 10 HKCBRN C[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217982171 568474421 /nfs/dbraw/zinc/47/44/21/568474421.db2.gz GOXAHJGUUQGIIR-SJORKVTESA-N 0 0 402.991 5.546 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217990079 568474410 /nfs/dbraw/zinc/47/44/10/568474410.db2.gz YVEISAFNMGWBGI-QZTJIDSGSA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000217990173 568474445 /nfs/dbraw/zinc/47/44/45/568474445.db2.gz YVEISAFNMGWBGI-ZWKOTPCHSA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217990249 568474453 /nfs/dbraw/zinc/47/44/53/568474453.db2.gz YVEISAFNMGWBGI-MSOLQXFVSA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000217990334 568474450 /nfs/dbraw/zinc/47/44/50/568474450.db2.gz YVEISAFNMGWBGI-ROUUACIJSA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217990425 568474449 /nfs/dbraw/zinc/47/44/49/568474449.db2.gz FTYVOTKTSXQNNB-KZNAEPCWSA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217990510 568474401 /nfs/dbraw/zinc/47/44/01/568474401.db2.gz FTYVOTKTSXQNNB-FGTMMUONSA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217990583 568474412 /nfs/dbraw/zinc/47/44/12/568474412.db2.gz FTYVOTKTSXQNNB-KURKYZTESA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000217990663 568474415 /nfs/dbraw/zinc/47/44/15/568474415.db2.gz FTYVOTKTSXQNNB-SQNIBIBYSA-N 0 0 417.018 5.934 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccccc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000218030075 568474652 /nfs/dbraw/zinc/47/46/52/568474652.db2.gz PXVNQEPMWVDTLG-GOSISDBHSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccccc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000218030172 568474630 /nfs/dbraw/zinc/47/46/30/568474630.db2.gz PXVNQEPMWVDTLG-SFHVURJKSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccccc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218030281 568474692 /nfs/dbraw/zinc/47/46/92/568474692.db2.gz OXYGQDSLDXUAKB-QZTJIDSGSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccccc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218030371 568474632 /nfs/dbraw/zinc/47/46/32/568474632.db2.gz OXYGQDSLDXUAKB-MSOLQXFVSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218037000 568474789 /nfs/dbraw/zinc/47/47/89/568474789.db2.gz ZBCIUXGXXCUUFA-GOSISDBHSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218037065 568474709 /nfs/dbraw/zinc/47/47/09/568474709.db2.gz ZBCIUXGXXCUUFA-SFHVURJKSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218037182 568474754 /nfs/dbraw/zinc/47/47/54/568474754.db2.gz AEDJOXVDGCHVLC-QZTJIDSGSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218037252 568474700 /nfs/dbraw/zinc/47/47/00/568474700.db2.gz AEDJOXVDGCHVLC-MSOLQXFVSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218043372 568474910 /nfs/dbraw/zinc/47/49/10/568474910.db2.gz HFIOYLGUCIHXFL-GOSISDBHSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218043455 568474811 /nfs/dbraw/zinc/47/48/11/568474811.db2.gz HFIOYLGUCIHXFL-SFHVURJKSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218043560 568474842 /nfs/dbraw/zinc/47/48/42/568474842.db2.gz NNZWHVNWSKULSD-QZTJIDSGSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218043630 568474825 /nfs/dbraw/zinc/47/48/25/568474825.db2.gz NNZWHVNWSKULSD-MSOLQXFVSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218088520 568474930 /nfs/dbraw/zinc/47/49/30/568474930.db2.gz RXPOYRQMSIBIPC-GOSISDBHSA-N 0 0 417.018 5.936 40 10 HKCBRN C[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218088603 568475068 /nfs/dbraw/zinc/47/50/68/568475068.db2.gz RXPOYRQMSIBIPC-SFHVURJKSA-N 0 0 417.018 5.936 40 10 HKCBRN C[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218088704 568475030 /nfs/dbraw/zinc/47/50/30/568475030.db2.gz CYMMHEZUKDWKSO-QZTJIDSGSA-N 0 0 417.018 5.936 40 10 HKCBRN C[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218088783 568475014 /nfs/dbraw/zinc/47/50/14/568475014.db2.gz CYMMHEZUKDWKSO-MSOLQXFVSA-N 0 0 417.018 5.936 40 10 HKCBRN C[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218104514 568475085 /nfs/dbraw/zinc/47/50/85/568475085.db2.gz KKQDUOIWLFZQKU-WLVUNBRHSA-N 0 0 414.549 5.934 40 10 HKCBRN C[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218104591 568475108 /nfs/dbraw/zinc/47/51/08/568475108.db2.gz KKQDUOIWLFZQKU-SWVLWACCSA-N 0 0 414.549 5.934 40 10 HKCBRN C[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218104710 568475131 /nfs/dbraw/zinc/47/51/31/568475131.db2.gz UJBWKWIISDTQDC-XALKSJJDSA-N 0 0 414.549 5.934 40 10 HKCBRN C[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218104792 568475130 /nfs/dbraw/zinc/47/51/30/568475130.db2.gz UJBWKWIISDTQDC-ZCCXOTIASA-N 0 0 414.549 5.934 40 10 HKCBRN COc1ccc(CSCC(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000218114893 568475299 /nfs/dbraw/zinc/47/52/99/568475299.db2.gz UCKIOUGQXVEUPA-IBGZPJMESA-N 0 0 412.599 5.042 40 10 HKCBRN COc1ccc(CSCC(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000218114979 568475232 /nfs/dbraw/zinc/47/52/32/568475232.db2.gz UCKIOUGQXVEUPA-LJQANCHMSA-N 0 0 412.599 5.042 40 10 HKCBRN COc1ccc(CSCC(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1 ZINC000218115080 568475267 /nfs/dbraw/zinc/47/52/67/568475267.db2.gz LXVYFUUDRVSPBG-MOPGFXCFSA-N 0 0 412.599 5.042 40 10 HKCBRN COc1ccc(CSCC(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1 ZINC000218115177 568475205 /nfs/dbraw/zinc/47/52/05/568475205.db2.gz LXVYFUUDRVSPBG-RTBURBONSA-N 0 0 412.599 5.042 40 10 HKCBRN C[C@@H](NC(=O)c1ccccc1Br)c1ccc(N2CCC(C)CC2)cc1 ZINC000218221362 568476493 /nfs/dbraw/zinc/47/64/93/568476493.db2.gz TZLRFZCUBOCUFZ-MRXNPFEDSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@H](NC(=O)c1ccccc1Br)c1ccc(N2CCC(C)CC2)cc1 ZINC000218221413 568476503 /nfs/dbraw/zinc/47/65/03/568476503.db2.gz TZLRFZCUBOCUFZ-INIZCTEOSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@@H](NC(=O)c1ccccc1Br)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218221514 568476472 /nfs/dbraw/zinc/47/64/72/568476472.db2.gz PTVGGLXUCRZFBU-HZPDHXFCSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@H](NC(=O)c1ccccc1Br)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218221613 568476509 /nfs/dbraw/zinc/47/65/09/568476509.db2.gz PTVGGLXUCRZFBU-CVEARBPZSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218498665 568481170 /nfs/dbraw/zinc/48/11/70/568481170.db2.gz YUFQEDKYQBCWBO-LJQANCHMSA-N 0 0 412.533 6.313 40 10 HKCBRN C[C@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218498753 568481068 /nfs/dbraw/zinc/48/10/68/568481068.db2.gz YUFQEDKYQBCWBO-IBGZPJMESA-N 0 0 412.533 6.313 40 10 HKCBRN C[C@@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218498867 568481106 /nfs/dbraw/zinc/48/11/06/568481106.db2.gz JQYKLVYBSCLDQJ-RTBURBONSA-N 0 0 412.533 6.313 40 10 HKCBRN C[C@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218498948 568481172 /nfs/dbraw/zinc/48/11/72/568481172.db2.gz JQYKLVYBSCLDQJ-MOPGFXCFSA-N 0 0 412.533 6.313 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218540513 568481477 /nfs/dbraw/zinc/48/14/77/568481477.db2.gz HAMSBGDHEQGJLA-OAQYLSRUSA-N 0 0 406.614 6.030 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218540594 568481542 /nfs/dbraw/zinc/48/15/42/568481542.db2.gz HAMSBGDHEQGJLA-NRFANRHFSA-N 0 0 406.614 6.030 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218540685 568481450 /nfs/dbraw/zinc/48/14/50/568481450.db2.gz ZLBJQJCNCBJTLR-NHCUHLMSSA-N 0 0 406.614 6.030 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218540751 568481454 /nfs/dbraw/zinc/48/14/54/568481454.db2.gz ZLBJQJCNCBJTLR-RTWAWAEBSA-N 0 0 406.614 6.030 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218666610 568482755 /nfs/dbraw/zinc/48/27/55/568482755.db2.gz WTZJHEOCUZQOFB-NHCUHLMSSA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000218666691 568482769 /nfs/dbraw/zinc/48/27/69/568482769.db2.gz WTZJHEOCUZQOFB-LEWJYISDSA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218666768 568482788 /nfs/dbraw/zinc/48/27/88/568482788.db2.gz WTZJHEOCUZQOFB-RTWAWAEBSA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218666847 568482733 /nfs/dbraw/zinc/48/27/33/568482733.db2.gz WTZJHEOCUZQOFB-SFTDATJTSA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218666950 568482810 /nfs/dbraw/zinc/48/28/10/568482810.db2.gz AYOIWUKUXRVYPC-NJDAHSKKSA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218667024 568482803 /nfs/dbraw/zinc/48/28/03/568482803.db2.gz AYOIWUKUXRVYPC-QHAWAJNXSA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218667106 568482811 /nfs/dbraw/zinc/48/28/11/568482811.db2.gz AYOIWUKUXRVYPC-NJYVYQBISA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218667174 568482774 /nfs/dbraw/zinc/48/27/74/568482774.db2.gz AYOIWUKUXRVYPC-HKBOAZHASA-N 0 0 422.613 5.865 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218676749 568482855 /nfs/dbraw/zinc/48/28/55/568482855.db2.gz DDKSXAAGKGZHMH-QZTJIDSGSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000218676834 568482822 /nfs/dbraw/zinc/48/28/22/568482822.db2.gz DDKSXAAGKGZHMH-ZWKOTPCHSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218676914 568482931 /nfs/dbraw/zinc/48/29/31/568482931.db2.gz DDKSXAAGKGZHMH-MSOLQXFVSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218676985 568482829 /nfs/dbraw/zinc/48/28/29/568482829.db2.gz DDKSXAAGKGZHMH-ROUUACIJSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218677077 568482870 /nfs/dbraw/zinc/48/28/70/568482870.db2.gz IFKFNWJLHUFGQD-KZNAEPCWSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218677149 568482874 /nfs/dbraw/zinc/48/28/74/568482874.db2.gz IFKFNWJLHUFGQD-FGTMMUONSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218677221 568482841 /nfs/dbraw/zinc/48/28/41/568482841.db2.gz IFKFNWJLHUFGQD-KURKYZTESA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218677298 568482849 /nfs/dbraw/zinc/48/28/49/568482849.db2.gz IFKFNWJLHUFGQD-SQNIBIBYSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218736760 568483176 /nfs/dbraw/zinc/48/31/76/568483176.db2.gz FDFBEWIAEWEOJN-LJQANCHMSA-N 0 0 414.977 5.613 40 10 HKCBRN C[C@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218736825 568483253 /nfs/dbraw/zinc/48/32/53/568483253.db2.gz FDFBEWIAEWEOJN-IBGZPJMESA-N 0 0 414.977 5.613 40 10 HKCBRN C[C@@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218736909 568483220 /nfs/dbraw/zinc/48/32/20/568483220.db2.gz XEZOBACVUZBZNC-RTBURBONSA-N 0 0 414.977 5.613 40 10 HKCBRN C[C@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218736957 568483262 /nfs/dbraw/zinc/48/32/62/568483262.db2.gz XEZOBACVUZBZNC-MOPGFXCFSA-N 0 0 414.977 5.613 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc2ccccc21)c1ccc(N2CCC(C)CC2)cc1 ZINC000218914348 568485178 /nfs/dbraw/zinc/48/51/78/568485178.db2.gz VKLXEEFIGDDOGD-HXUWFJFHSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@H](NC(=O)COc1cccc2ccccc21)c1ccc(N2CCC(C)CC2)cc1 ZINC000218914411 568485192 /nfs/dbraw/zinc/48/51/92/568485192.db2.gz VKLXEEFIGDDOGD-FQEVSTJZSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc2ccccc21)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218914522 568485106 /nfs/dbraw/zinc/48/51/06/568485106.db2.gz RBHZTYWWGOPSJM-WOJBJXKFSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@H](NC(=O)COc1cccc2ccccc21)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218914599 568485182 /nfs/dbraw/zinc/48/51/82/568485182.db2.gz RBHZTYWWGOPSJM-UXHICEINSA-N 0 0 402.538 5.332 40 10 HKCBRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc(C)c1Cl ZINC000218925148 568485165 /nfs/dbraw/zinc/48/51/65/568485165.db2.gz ZEYNYRCCHWUHKM-IBGZPJMESA-N 0 0 414.977 5.449 40 10 HKCBRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc(C)c1Cl ZINC000218925220 568485100 /nfs/dbraw/zinc/48/51/00/568485100.db2.gz ZEYNYRCCHWUHKM-LJQANCHMSA-N 0 0 414.977 5.449 40 10 HKCBRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc(C)c1Cl ZINC000218925324 568485200 /nfs/dbraw/zinc/48/52/00/568485200.db2.gz GUFCOJXGSGRXDE-APWZRJJASA-N 0 0 414.977 5.449 40 10 HKCBRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc(C)c1Cl ZINC000218925390 568485171 /nfs/dbraw/zinc/48/51/71/568485171.db2.gz GUFCOJXGSGRXDE-VQIMIIECSA-N 0 0 414.977 5.449 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218933629 568485326 /nfs/dbraw/zinc/48/53/26/568485326.db2.gz ZJRWPEDWFWYKEE-HXUWFJFHSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000218933694 568485307 /nfs/dbraw/zinc/48/53/07/568485307.db2.gz ZJRWPEDWFWYKEE-FQEVSTJZSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218933783 568485306 /nfs/dbraw/zinc/48/53/06/568485306.db2.gz AQWJNGSCWKEUNR-WOJBJXKFSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000218933846 568485228 /nfs/dbraw/zinc/48/52/28/568485228.db2.gz AQWJNGSCWKEUNR-UXHICEINSA-N 0 0 408.586 5.477 40 10 HKCBRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)ccc1Cl ZINC000218940517 568485220 /nfs/dbraw/zinc/48/52/20/568485220.db2.gz KRXHOGWTGSCIJL-SFHVURJKSA-N 0 0 400.950 5.141 40 10 HKCBRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)ccc1Cl ZINC000218940578 568485327 /nfs/dbraw/zinc/48/53/27/568485327.db2.gz KRXHOGWTGSCIJL-GOSISDBHSA-N 0 0 400.950 5.141 40 10 HKCBRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)ccc1Cl ZINC000218940655 568485237 /nfs/dbraw/zinc/48/52/37/568485237.db2.gz WKNZARNLCCDSDV-AEFFLSMTSA-N 0 0 400.950 5.141 40 10 HKCBRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)ccc1Cl ZINC000218940715 568485323 /nfs/dbraw/zinc/48/53/23/568485323.db2.gz WKNZARNLCCDSDV-SJLPKXTDSA-N 0 0 400.950 5.141 40 10 HKCBRN O=C(NCc1ccc(N2CCCCC2)cc1)c1cccc(OCc2ccccc2)c1 ZINC000218978161 568485483 /nfs/dbraw/zinc/48/54/83/568485483.db2.gz BJQREUOJFOATAW-UHFFFAOYSA-N 0 0 400.522 5.186 40 10 HKCBRN O=C(NCc1ccc(N2CCCCC2)cc1)c1ccccc1OCc1ccccc1 ZINC000218986715 568485588 /nfs/dbraw/zinc/48/55/88/568485588.db2.gz IVFBQVBTVCZEPA-UHFFFAOYSA-N 0 0 400.522 5.186 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219029453 568486034 /nfs/dbraw/zinc/48/60/34/568486034.db2.gz WBXUVEGEENKQCB-NHCUHLMSSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219029539 568486059 /nfs/dbraw/zinc/48/60/59/568486059.db2.gz WBXUVEGEENKQCB-LEWJYISDSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219029619 568486053 /nfs/dbraw/zinc/48/60/53/568486053.db2.gz WBXUVEGEENKQCB-RTWAWAEBSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219029695 568485999 /nfs/dbraw/zinc/48/59/99/568485999.db2.gz WBXUVEGEENKQCB-SFTDATJTSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219029806 568485986 /nfs/dbraw/zinc/48/59/86/568485986.db2.gz CYZUHKYEIZNWBE-NJDAHSKKSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219029891 568485987 /nfs/dbraw/zinc/48/59/87/568485987.db2.gz CYZUHKYEIZNWBE-QHAWAJNXSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219029970 568485984 /nfs/dbraw/zinc/48/59/84/568485984.db2.gz CYZUHKYEIZNWBE-NJYVYQBISA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219030054 568485983 /nfs/dbraw/zinc/48/59/83/568485983.db2.gz CYZUHKYEIZNWBE-HKBOAZHASA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc2ccccc21)c1ccc(N2CCC(C)CC2)cc1 ZINC000219044823 568486119 /nfs/dbraw/zinc/48/61/19/568486119.db2.gz KUSAZGYUSVDPTL-NHCUHLMSSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219044906 568486130 /nfs/dbraw/zinc/48/61/30/568486130.db2.gz KUSAZGYUSVDPTL-LEWJYISDSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1cccc2ccccc21)c1ccc(N2CCC(C)CC2)cc1 ZINC000219044982 568486274 /nfs/dbraw/zinc/48/62/74/568486274.db2.gz KUSAZGYUSVDPTL-RTWAWAEBSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1cccc2ccccc21)c1ccc(N2CCC(C)CC2)cc1 ZINC000219045058 568486284 /nfs/dbraw/zinc/48/62/84/568486284.db2.gz KUSAZGYUSVDPTL-SFTDATJTSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc2ccccc21)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219045171 568486279 /nfs/dbraw/zinc/48/62/79/568486279.db2.gz PXMSYAVAYWGJOW-NJDAHSKKSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219045234 568486277 /nfs/dbraw/zinc/48/62/77/568486277.db2.gz PXMSYAVAYWGJOW-QHAWAJNXSA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1cccc2ccccc21)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219045321 568486275 /nfs/dbraw/zinc/48/62/75/568486275.db2.gz PXMSYAVAYWGJOW-NJYVYQBISA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1cccc2ccccc21)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219045401 568486286 /nfs/dbraw/zinc/48/62/86/568486286.db2.gz PXMSYAVAYWGJOW-HKBOAZHASA-N 0 0 416.565 5.721 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccccc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000219058542 568486394 /nfs/dbraw/zinc/48/63/94/568486394.db2.gz AEJSBKFGHBZCBI-QZTJIDSGSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219058598 568486376 /nfs/dbraw/zinc/48/63/76/568486376.db2.gz AEJSBKFGHBZCBI-ZWKOTPCHSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000219058678 568486399 /nfs/dbraw/zinc/48/63/99/568486399.db2.gz AEJSBKFGHBZCBI-MSOLQXFVSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000219058750 568486346 /nfs/dbraw/zinc/48/63/46/568486346.db2.gz AEJSBKFGHBZCBI-ROUUACIJSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccccc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219058851 568486421 /nfs/dbraw/zinc/48/64/21/568486421.db2.gz ANJXJIKDKLTVPP-KZNAEPCWSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219058919 568486419 /nfs/dbraw/zinc/48/64/19/568486419.db2.gz ANJXJIKDKLTVPP-FGTMMUONSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219058991 568486408 /nfs/dbraw/zinc/48/64/08/568486408.db2.gz ANJXJIKDKLTVPP-KURKYZTESA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219059066 568486392 /nfs/dbraw/zinc/48/63/92/568486392.db2.gz ANJXJIKDKLTVPP-SQNIBIBYSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccc(F)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219262086 568488660 /nfs/dbraw/zinc/48/86/60/568488660.db2.gz FHCLVUKEXAZGEQ-GOSISDBHSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccc(F)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219262137 568488610 /nfs/dbraw/zinc/48/86/10/568488610.db2.gz FHCLVUKEXAZGEQ-SFHVURJKSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccc(F)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219262220 568488663 /nfs/dbraw/zinc/48/86/63/568488663.db2.gz PIPJLPMPFMHREN-QZTJIDSGSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccc(F)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219262273 568488637 /nfs/dbraw/zinc/48/86/37/568488637.db2.gz PIPJLPMPFMHREN-MSOLQXFVSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219291905 568489049 /nfs/dbraw/zinc/48/90/49/568489049.db2.gz IOEAXCNNIFMYNO-QZTJIDSGSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219291934 568488974 /nfs/dbraw/zinc/48/89/74/568488974.db2.gz IOEAXCNNIFMYNO-ZWKOTPCHSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219291966 568489031 /nfs/dbraw/zinc/48/90/31/568489031.db2.gz IOEAXCNNIFMYNO-MSOLQXFVSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000219291992 568489053 /nfs/dbraw/zinc/48/90/53/568489053.db2.gz IOEAXCNNIFMYNO-ROUUACIJSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219292034 568489068 /nfs/dbraw/zinc/48/90/68/568489068.db2.gz HNRMKWZGYWHOHV-KZNAEPCWSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219292066 568489006 /nfs/dbraw/zinc/48/90/06/568489006.db2.gz HNRMKWZGYWHOHV-FGTMMUONSA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219292099 568488983 /nfs/dbraw/zinc/48/89/83/568488983.db2.gz HNRMKWZGYWHOHV-KURKYZTESA-N 0 0 400.950 5.221 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219292128 568489012 /nfs/dbraw/zinc/48/90/12/568489012.db2.gz HNRMKWZGYWHOHV-SQNIBIBYSA-N 0 0 400.950 5.221 40 10 HKCBRN CC(C)c1ccccc1O[C@@H](C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219298667 568489103 /nfs/dbraw/zinc/48/91/03/568489103.db2.gz LPBOUJLOGQFPLA-SFTDATJTSA-N 0 0 408.586 5.691 40 10 HKCBRN CC(C)c1ccccc1O[C@H](C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219298698 568489163 /nfs/dbraw/zinc/48/91/63/568489163.db2.gz LPBOUJLOGQFPLA-LEWJYISDSA-N 0 0 408.586 5.691 40 10 HKCBRN CC(C)c1ccccc1O[C@@H](C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219298726 568489156 /nfs/dbraw/zinc/48/91/56/568489156.db2.gz LPBOUJLOGQFPLA-RTWAWAEBSA-N 0 0 408.586 5.691 40 10 HKCBRN CC(C)c1ccccc1O[C@H](C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219298755 568489106 /nfs/dbraw/zinc/48/91/06/568489106.db2.gz LPBOUJLOGQFPLA-NHCUHLMSSA-N 0 0 408.586 5.691 40 10 HKCBRN CC(C)c1ccccc1O[C@@H](C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219298799 568489121 /nfs/dbraw/zinc/48/91/21/568489121.db2.gz NUWVMOBFSRQYOR-HKBOAZHASA-N 0 0 408.586 5.691 40 10 HKCBRN CC(C)c1ccccc1O[C@H](C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219298830 568489132 /nfs/dbraw/zinc/48/91/32/568489132.db2.gz NUWVMOBFSRQYOR-QHAWAJNXSA-N 0 0 408.586 5.691 40 10 HKCBRN CC(C)c1ccccc1O[C@@H](C)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219298854 568489092 /nfs/dbraw/zinc/48/90/92/568489092.db2.gz NUWVMOBFSRQYOR-NJYVYQBISA-N 0 0 408.586 5.691 40 10 HKCBRN CC(C)c1ccccc1O[C@H](C)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219298886 568489165 /nfs/dbraw/zinc/48/91/65/568489165.db2.gz NUWVMOBFSRQYOR-NJDAHSKKSA-N 0 0 408.586 5.691 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000219302298 568489130 /nfs/dbraw/zinc/48/91/30/568489130.db2.gz CCKLCVPFFHQWAQ-VXKWHMMOSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000219302330 568489211 /nfs/dbraw/zinc/48/92/11/568489211.db2.gz CCKLCVPFFHQWAQ-FCHUYYIVSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000219302360 568489243 /nfs/dbraw/zinc/48/92/43/568489243.db2.gz CCKLCVPFFHQWAQ-YADHBBJMSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000219302389 568489280 /nfs/dbraw/zinc/48/92/80/568489280.db2.gz CCKLCVPFFHQWAQ-FGZHOGPDSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000219302431 568489274 /nfs/dbraw/zinc/48/92/74/568489274.db2.gz UZXHMVNMUYJEMR-WTNAPCKOSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000219302465 568489260 /nfs/dbraw/zinc/48/92/60/568489260.db2.gz UZXHMVNMUYJEMR-VOQZNFBZSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000219302496 568489242 /nfs/dbraw/zinc/48/92/42/568489242.db2.gz UZXHMVNMUYJEMR-YHYVQYDKSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000219302525 568489290 /nfs/dbraw/zinc/48/92/90/568489290.db2.gz UZXHMVNMUYJEMR-ZPMCFJSWSA-N 0 0 408.586 5.493 40 10 HKCBRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219321082 568489832 /nfs/dbraw/zinc/48/98/32/568489832.db2.gz SVHRNBHJYBUNMA-PGRDOPGGSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219321109 568489830 /nfs/dbraw/zinc/48/98/30/568489830.db2.gz SVHRNBHJYBUNMA-AVRDEDQJSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219321139 568489764 /nfs/dbraw/zinc/48/97/64/568489764.db2.gz SVHRNBHJYBUNMA-XMSQKQJNSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219321168 568489798 /nfs/dbraw/zinc/48/97/98/568489798.db2.gz SVHRNBHJYBUNMA-GCJKJVERSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219321207 568489810 /nfs/dbraw/zinc/48/98/10/568489810.db2.gz MMXDIOCQKDJLJD-KGVIQGDOSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219321232 568489812 /nfs/dbraw/zinc/48/98/12/568489812.db2.gz MMXDIOCQKDJLJD-FGSXEWAUSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219321263 568489818 /nfs/dbraw/zinc/48/98/18/568489818.db2.gz MMXDIOCQKDJLJD-JBYIUTFZSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219321289 568489744 /nfs/dbraw/zinc/48/97/44/568489744.db2.gz MMXDIOCQKDJLJD-HMFYCAOWSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219324178 568489802 /nfs/dbraw/zinc/48/98/02/568489802.db2.gz SFDACWXRRJNGDG-FDDCHVKYSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219324211 568489731 /nfs/dbraw/zinc/48/97/31/568489731.db2.gz SFDACWXRRJNGDG-MBSDFSHPSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219324240 568489735 /nfs/dbraw/zinc/48/97/35/568489735.db2.gz SFDACWXRRJNGDG-WZONZLPQSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219324262 568489781 /nfs/dbraw/zinc/48/97/81/568489781.db2.gz SFDACWXRRJNGDG-JPYJTQIMSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219324298 568489806 /nfs/dbraw/zinc/48/98/06/568489806.db2.gz NROMPWHSEKXIBT-IEGUWTFLSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219324329 568489746 /nfs/dbraw/zinc/48/97/46/568489746.db2.gz NROMPWHSEKXIBT-STSQHVNTSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219324359 568489739 /nfs/dbraw/zinc/48/97/39/568489739.db2.gz NROMPWHSEKXIBT-PMAPCBKXSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219324387 568489779 /nfs/dbraw/zinc/48/97/79/568489779.db2.gz NROMPWHSEKXIBT-PNCHPQGNSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219330477 568489900 /nfs/dbraw/zinc/48/99/00/568489900.db2.gz SWGGILNKBUXHBY-SQJMNOBHSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219330498 568489835 /nfs/dbraw/zinc/48/98/35/568489835.db2.gz SWGGILNKBUXHBY-OFVILXPXSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219330518 568489915 /nfs/dbraw/zinc/48/99/15/568489915.db2.gz SWGGILNKBUXHBY-PXDATVDWSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219330539 568489882 /nfs/dbraw/zinc/48/98/82/568489882.db2.gz SWGGILNKBUXHBY-BWKNWUBXSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219330566 568489859 /nfs/dbraw/zinc/48/98/59/568489859.db2.gz YCORUCXNBJTBSD-DHTSOJEISA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219330584 568489919 /nfs/dbraw/zinc/48/99/19/568489919.db2.gz YCORUCXNBJTBSD-QLWBXOBMSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219330605 568489834 /nfs/dbraw/zinc/48/98/34/568489834.db2.gz YCORUCXNBJTBSD-IOZGHAEBSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219330627 568489870 /nfs/dbraw/zinc/48/98/70/568489870.db2.gz YCORUCXNBJTBSD-JYMRHQFYSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219367719 568490547 /nfs/dbraw/zinc/49/05/47/568490547.db2.gz LKLXGADAFIMQOJ-XUZZJYLKSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219367800 568490574 /nfs/dbraw/zinc/49/05/74/568490574.db2.gz LKLXGADAFIMQOJ-URXFXBBRSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219367866 568490561 /nfs/dbraw/zinc/49/05/61/568490561.db2.gz LKLXGADAFIMQOJ-ZJSXRUAMSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219367950 568490576 /nfs/dbraw/zinc/49/05/76/568490576.db2.gz LKLXGADAFIMQOJ-QPPBQGQZSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219368055 568490553 /nfs/dbraw/zinc/49/05/53/568490553.db2.gz WMDAPEUCRJBNAH-UTSGNWPNSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219368136 568490595 /nfs/dbraw/zinc/49/05/95/568490595.db2.gz WMDAPEUCRJBNAH-ZHRMCQFGSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219368202 568490693 /nfs/dbraw/zinc/49/06/93/568490693.db2.gz WMDAPEUCRJBNAH-MEKIYTOJSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219368278 568490675 /nfs/dbraw/zinc/49/06/75/568490675.db2.gz WMDAPEUCRJBNAH-JLGINSKQSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219376739 568490662 /nfs/dbraw/zinc/49/06/62/568490662.db2.gz AOUJVRNGHSQFHV-XUZZJYLKSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219376816 568490678 /nfs/dbraw/zinc/49/06/78/568490678.db2.gz AOUJVRNGHSQFHV-URXFXBBRSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219376882 568490701 /nfs/dbraw/zinc/49/07/01/568490701.db2.gz AOUJVRNGHSQFHV-ZJSXRUAMSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219376951 568490667 /nfs/dbraw/zinc/49/06/67/568490667.db2.gz AOUJVRNGHSQFHV-QPPBQGQZSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219377063 568490668 /nfs/dbraw/zinc/49/06/68/568490668.db2.gz VYPHDNNYUSYLNM-NHCICSSKSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219377141 568490674 /nfs/dbraw/zinc/49/06/74/568490674.db2.gz VYPHDNNYUSYLNM-IZIIKQMZSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219377206 568490702 /nfs/dbraw/zinc/49/07/02/568490702.db2.gz VYPHDNNYUSYLNM-ZILOHOTNSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219377289 568490660 /nfs/dbraw/zinc/49/06/60/568490660.db2.gz VYPHDNNYUSYLNM-ZYKOEDHHSA-N 0 0 408.586 5.575 40 10 HKCBRN COc1cc2ccccc2cc1C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219393209 568491072 /nfs/dbraw/zinc/49/10/72/568491072.db2.gz NILLFVFGUANCPZ-IBGZPJMESA-N 0 0 402.538 5.576 40 10 HKCBRN COc1cc2ccccc2cc1C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219393268 568491079 /nfs/dbraw/zinc/49/10/79/568491079.db2.gz NILLFVFGUANCPZ-LJQANCHMSA-N 0 0 402.538 5.576 40 10 HKCBRN COc1cc2ccccc2cc1C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219393375 568491065 /nfs/dbraw/zinc/49/10/65/568491065.db2.gz VKAAISMKJDIDEC-MOPGFXCFSA-N 0 0 402.538 5.576 40 10 HKCBRN COc1cc2ccccc2cc1C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219393448 568491062 /nfs/dbraw/zinc/49/10/62/568491062.db2.gz VKAAISMKJDIDEC-RTBURBONSA-N 0 0 402.538 5.576 40 10 HKCBRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219611072 568496097 /nfs/dbraw/zinc/49/60/97/568496097.db2.gz FVMDZWAMAHMPDL-FDDCHVKYSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219611132 568496075 /nfs/dbraw/zinc/49/60/75/568496075.db2.gz FVMDZWAMAHMPDL-MBSDFSHPSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219611207 568495972 /nfs/dbraw/zinc/49/59/72/568495972.db2.gz FVMDZWAMAHMPDL-WZONZLPQSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000219611284 568496078 /nfs/dbraw/zinc/49/60/78/568496078.db2.gz FVMDZWAMAHMPDL-JPYJTQIMSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219611375 568496041 /nfs/dbraw/zinc/49/60/41/568496041.db2.gz QYPORUBECOJKEB-IEGUWTFLSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219611439 568495975 /nfs/dbraw/zinc/49/59/75/568495975.db2.gz QYPORUBECOJKEB-STSQHVNTSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219611511 568496038 /nfs/dbraw/zinc/49/60/38/568496038.db2.gz QYPORUBECOJKEB-PMAPCBKXSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000219611589 568496093 /nfs/dbraw/zinc/49/60/93/568496093.db2.gz QYPORUBECOJKEB-PNCHPQGNSA-N 0 0 414.977 5.611 40 10 HKCBRN Cc1ccc(N2CCC(C(=O)N[C@@H](C)c3ccc(N4CCC(C)CC4)cc3)CC2)cc1 ZINC000219864626 568499376 /nfs/dbraw/zinc/49/93/76/568499376.db2.gz LWHGUYCSTPMIHJ-QFIPXVFZSA-N 0 0 419.613 5.325 40 10 HKCBRN Cc1ccc(N2CCC(C(=O)N[C@H](C)c3ccc(N4CCC(C)CC4)cc3)CC2)cc1 ZINC000219864671 568499363 /nfs/dbraw/zinc/49/93/63/568499363.db2.gz LWHGUYCSTPMIHJ-JOCHJYFZSA-N 0 0 419.613 5.325 40 10 HKCBRN Cc1ccc(N2CCC(C(=O)N[C@@H](C)c3ccc(N4CCC[C@@H](C)C4)cc3)CC2)cc1 ZINC000219864740 568499347 /nfs/dbraw/zinc/49/93/47/568499347.db2.gz NQXGLBANFGZTMA-YADHBBJMSA-N 0 0 419.613 5.325 40 10 HKCBRN Cc1ccc(N2CCC(C(=O)N[C@H](C)c3ccc(N4CCC[C@@H](C)C4)cc3)CC2)cc1 ZINC000219864786 568499394 /nfs/dbraw/zinc/49/93/94/568499394.db2.gz NQXGLBANFGZTMA-FGZHOGPDSA-N 0 0 419.613 5.325 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2ccc([N+](=O)[O-])cc2[C@@H]2C=CC[C@@H]21 ZINC000222369416 569284000 /nfs/dbraw/zinc/28/40/00/569284000.db2.gz FVAPGMNLQMHFFK-BIENJYKASA-N 0 0 401.260 5.192 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000222369822 569284001 /nfs/dbraw/zinc/28/40/01/569284001.db2.gz VSSFMNHIUGMXMU-TYILLQQXSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000222370233 569284050 /nfs/dbraw/zinc/28/40/50/569284050.db2.gz PXIYOTCBALVQRI-NQCMUKECSA-N 0 0 406.309 5.846 40 10 HKCBRN CCn1c(Cl)nc2cc(C(=O)N(C)Cc3cc(C)n(-c4ccccc4)c3C)ccc21 ZINC000222563562 568518495 /nfs/dbraw/zinc/51/84/95/568518495.db2.gz NZFDJRXWRPFYPS-UHFFFAOYSA-N 0 0 420.944 5.389 40 10 HKCBRN CCn1c(Cl)nc2cc(C(=O)NCc3cc(C)n(-c4ccccc4)c3C)ccc21 ZINC000222564264 568518512 /nfs/dbraw/zinc/51/85/12/568518512.db2.gz DTMHPYYSAAAZMZ-UHFFFAOYSA-N 0 0 406.917 5.047 40 10 HKCBRN Cc1cc(CNC(=O)c2ccc3c(c2)nc(Cl)n3C(C)C)c(C)n1-c1ccccc1 ZINC000222564361 568518510 /nfs/dbraw/zinc/51/85/10/568518510.db2.gz HUZXWALSKPUYLF-UHFFFAOYSA-N 0 0 420.944 5.608 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)n1-c1ccc(Cl)cc1 ZINC000222588751 568519402 /nfs/dbraw/zinc/51/94/02/568519402.db2.gz MCQILKKTWIFFSG-IWMITWMQSA-N 0 0 408.958 5.423 40 10 HKCBRN Cc1ccc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)n1-c1ccc(Cl)cc1 ZINC000222588817 568519399 /nfs/dbraw/zinc/51/93/99/568519399.db2.gz MCQILKKTWIFFSG-RVHYNSKXSA-N 0 0 408.958 5.423 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)n1-c1ccc(Cl)cc1 ZINC000222588876 568519415 /nfs/dbraw/zinc/51/94/15/568519415.db2.gz MCQILKKTWIFFSG-ONGXBYRLSA-N 0 0 408.958 5.423 40 10 HKCBRN Cc1ccc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)n1-c1ccc(Cl)cc1 ZINC000222588940 568519567 /nfs/dbraw/zinc/51/95/67/568519567.db2.gz MCQILKKTWIFFSG-JHVJFLLYSA-N 0 0 408.958 5.423 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@@H](C)CN43)cc21 ZINC000222589322 568519590 /nfs/dbraw/zinc/51/95/90/568519590.db2.gz QSWQCCJEYSCPKF-KNXBSLHKSA-N 0 0 404.583 5.303 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000222602830 568520122 /nfs/dbraw/zinc/52/01/22/568520122.db2.gz BVEFENCBLVZBTO-NHCUHLMSSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222602893 568520126 /nfs/dbraw/zinc/52/01/26/568520126.db2.gz BVEFENCBLVZBTO-LEWJYISDSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000222602959 568520121 /nfs/dbraw/zinc/52/01/21/568520121.db2.gz BVEFENCBLVZBTO-RTWAWAEBSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000222603019 568520156 /nfs/dbraw/zinc/52/01/56/568520156.db2.gz BVEFENCBLVZBTO-SFTDATJTSA-N 0 0 420.597 5.446 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)c2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000222606147 568520431 /nfs/dbraw/zinc/52/04/31/568520431.db2.gz DJXCRFLWJGUTRX-UHFFFAOYSA-N 0 0 422.956 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1C ZINC000222611678 568520577 /nfs/dbraw/zinc/52/05/77/568520577.db2.gz JIXYWRKKHIOKAD-JJEOQYAHSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1C ZINC000222611759 568520639 /nfs/dbraw/zinc/52/06/39/568520639.db2.gz JIXYWRKKHIOKAD-IMRHEYAYSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1C ZINC000222611820 568520623 /nfs/dbraw/zinc/52/06/23/568520623.db2.gz JIXYWRKKHIOKAD-PDIWNELESA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1C ZINC000222611884 568520570 /nfs/dbraw/zinc/52/05/70/568520570.db2.gz JIXYWRKKHIOKAD-RTFZILSDSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1 ZINC000222611971 568520591 /nfs/dbraw/zinc/52/05/91/568520591.db2.gz LMPKRBGLNRKLDW-JJEOQYAHSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1 ZINC000222612050 568520579 /nfs/dbraw/zinc/52/05/79/568520579.db2.gz LMPKRBGLNRKLDW-IMRHEYAYSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1 ZINC000222612116 568520583 /nfs/dbraw/zinc/52/05/83/568520583.db2.gz LMPKRBGLNRKLDW-PDIWNELESA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1 ZINC000222612187 568520607 /nfs/dbraw/zinc/52/06/07/568520607.db2.gz LMPKRBGLNRKLDW-RTFZILSDSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(C)cc1 ZINC000222612274 568520592 /nfs/dbraw/zinc/52/05/92/568520592.db2.gz NYUZDYUEHVJEFI-JJEOQYAHSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(C)cc1 ZINC000222612337 568520581 /nfs/dbraw/zinc/52/05/81/568520581.db2.gz NYUZDYUEHVJEFI-IMRHEYAYSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(C)cc1 ZINC000222612407 568520613 /nfs/dbraw/zinc/52/06/13/568520613.db2.gz NYUZDYUEHVJEFI-PDIWNELESA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(C)cc1 ZINC000222612480 568520615 /nfs/dbraw/zinc/52/06/15/568520615.db2.gz NYUZDYUEHVJEFI-RTFZILSDSA-N 0 0 402.567 5.387 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c1C ZINC000222612849 568520600 /nfs/dbraw/zinc/52/06/00/568520600.db2.gz AKWSWGCQEMHNIM-PKKBDPGCSA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c1C ZINC000222612923 568520580 /nfs/dbraw/zinc/52/05/80/568520580.db2.gz AKWSWGCQEMHNIM-VWMXVWASSA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c1C ZINC000222612991 568520573 /nfs/dbraw/zinc/52/05/73/568520573.db2.gz AKWSWGCQEMHNIM-YRUKQIKQSA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c1C ZINC000222613060 568520604 /nfs/dbraw/zinc/52/06/04/568520604.db2.gz AKWSWGCQEMHNIM-DPSWKAHMSA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222613149 568520747 /nfs/dbraw/zinc/52/07/47/568520747.db2.gz OFUIIBVNOARHGU-PKKBDPGCSA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@H]3[C@@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222613210 568520737 /nfs/dbraw/zinc/52/07/37/568520737.db2.gz OFUIIBVNOARHGU-VWMXVWASSA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222613278 568520723 /nfs/dbraw/zinc/52/07/23/568520723.db2.gz OFUIIBVNOARHGU-YRUKQIKQSA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@H]3[C@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222613351 568520722 /nfs/dbraw/zinc/52/07/22/568520722.db2.gz OFUIIBVNOARHGU-DPSWKAHMSA-N 0 0 416.594 5.641 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1F ZINC000222613429 568520731 /nfs/dbraw/zinc/52/07/31/568520731.db2.gz KAYMOCMSAMCTPE-ITEAAPOESA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1F ZINC000222613502 568520742 /nfs/dbraw/zinc/52/07/42/568520742.db2.gz KAYMOCMSAMCTPE-ARBPTSGCSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1F ZINC000222613567 568520750 /nfs/dbraw/zinc/52/07/50/568520750.db2.gz KAYMOCMSAMCTPE-UZQPLGKSSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1F ZINC000222613632 568520748 /nfs/dbraw/zinc/52/07/48/568520748.db2.gz KAYMOCMSAMCTPE-RXYZOABWSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(F)c1 ZINC000222613732 568520739 /nfs/dbraw/zinc/52/07/39/568520739.db2.gz FDPFHTGZBCGMSK-ITEAAPOESA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(F)c1 ZINC000222613801 568520752 /nfs/dbraw/zinc/52/07/52/568520752.db2.gz FDPFHTGZBCGMSK-ARBPTSGCSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(F)c1 ZINC000222613884 568520721 /nfs/dbraw/zinc/52/07/21/568520721.db2.gz FDPFHTGZBCGMSK-UZQPLGKSSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(F)c1 ZINC000222613930 568520725 /nfs/dbraw/zinc/52/07/25/568520725.db2.gz FDPFHTGZBCGMSK-RXYZOABWSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(F)cc1 ZINC000222614043 568520735 /nfs/dbraw/zinc/52/07/35/568520735.db2.gz DBJXPRWGCJHYNF-ITEAAPOESA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(F)cc1 ZINC000222614099 568520730 /nfs/dbraw/zinc/52/07/30/568520730.db2.gz DBJXPRWGCJHYNF-ARBPTSGCSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(F)cc1 ZINC000222614163 568520715 /nfs/dbraw/zinc/52/07/15/568520715.db2.gz DBJXPRWGCJHYNF-UZQPLGKSSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(F)cc1 ZINC000222614223 568520754 /nfs/dbraw/zinc/52/07/54/568520754.db2.gz DBJXPRWGCJHYNF-RXYZOABWSA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1Cl ZINC000222614319 568520734 /nfs/dbraw/zinc/52/07/34/568520734.db2.gz VKKDAGRGHICLNA-ITEAAPOESA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1Cl ZINC000222614391 568520711 /nfs/dbraw/zinc/52/07/11/568520711.db2.gz VKKDAGRGHICLNA-ARBPTSGCSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1Cl ZINC000222614445 568520749 /nfs/dbraw/zinc/52/07/49/568520749.db2.gz VKKDAGRGHICLNA-UZQPLGKSSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccccc1Cl ZINC000222614514 568520751 /nfs/dbraw/zinc/52/07/51/568520751.db2.gz VKKDAGRGHICLNA-RXYZOABWSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(Cl)c1 ZINC000222614623 568520757 /nfs/dbraw/zinc/52/07/57/568520757.db2.gz JRLMYGAEZKJJQI-ITEAAPOESA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(Cl)c1 ZINC000222614692 568520709 /nfs/dbraw/zinc/52/07/09/568520709.db2.gz JRLMYGAEZKJJQI-ARBPTSGCSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(Cl)c1 ZINC000222614753 568520704 /nfs/dbraw/zinc/52/07/04/568520704.db2.gz JRLMYGAEZKJJQI-UZQPLGKSSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(Cl)c1 ZINC000222614832 568520705 /nfs/dbraw/zinc/52/07/05/568520705.db2.gz JRLMYGAEZKJJQI-RXYZOABWSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(Cl)cc1 ZINC000222614916 568520726 /nfs/dbraw/zinc/52/07/26/568520726.db2.gz OPNDOGRDEHRUJU-ITEAAPOESA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(Cl)cc1 ZINC000222614984 568520708 /nfs/dbraw/zinc/52/07/08/568520708.db2.gz OPNDOGRDEHRUJU-ARBPTSGCSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(Cl)cc1 ZINC000222615052 568520724 /nfs/dbraw/zinc/52/07/24/568520724.db2.gz OPNDOGRDEHRUJU-UZQPLGKSSA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1ccc(Cl)cc1 ZINC000222615117 568520746 /nfs/dbraw/zinc/52/07/46/568520746.db2.gz OPNDOGRDEHRUJU-RXYZOABWSA-N 0 0 422.985 5.732 40 10 HKCBRN COc1cccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)c1 ZINC000222616357 568520850 /nfs/dbraw/zinc/52/08/50/568520850.db2.gz BZQOUIBYJYDSJR-PBNUPURSSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1cccc(-n2c(C)cc([C@H]3[C@@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)c1 ZINC000222616424 568520834 /nfs/dbraw/zinc/52/08/34/568520834.db2.gz BZQOUIBYJYDSJR-FNVCAUGXSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1cccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)c1 ZINC000222616493 568520877 /nfs/dbraw/zinc/52/08/77/568520877.db2.gz BZQOUIBYJYDSJR-IRBZQWRBSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1cccc(-n2c(C)cc([C@H]3[C@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)c1 ZINC000222616560 568520853 /nfs/dbraw/zinc/52/08/53/568520853.db2.gz BZQOUIBYJYDSJR-GMWOSMDTSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1ccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222616651 568520854 /nfs/dbraw/zinc/52/08/54/568520854.db2.gz CYZDHNOBEKYHNU-PBNUPURSSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1ccc(-n2c(C)cc([C@H]3[C@@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222616714 568520844 /nfs/dbraw/zinc/52/08/44/568520844.db2.gz CYZDHNOBEKYHNU-FNVCAUGXSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1ccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222616779 568520828 /nfs/dbraw/zinc/52/08/28/568520828.db2.gz CYZDHNOBEKYHNU-IRBZQWRBSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1ccc(-n2c(C)cc([C@H]3[C@H](c4ccccn4)N=C4S[C@@H](C)CN43)c2C)cc1 ZINC000222616849 568520855 /nfs/dbraw/zinc/52/08/55/568520855.db2.gz CYZDHNOBEKYHNU-GMWOSMDTSA-N 0 0 418.566 5.087 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1C ZINC000222617790 568520842 /nfs/dbraw/zinc/52/08/42/568520842.db2.gz UXNGAPJDRYFUTG-PKKBDPGCSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1C ZINC000222617848 568520843 /nfs/dbraw/zinc/52/08/43/568520843.db2.gz UXNGAPJDRYFUTG-VWMXVWASSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1C ZINC000222617913 568520866 /nfs/dbraw/zinc/52/08/66/568520866.db2.gz UXNGAPJDRYFUTG-YRUKQIKQSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cccc(C)c1C ZINC000222617973 568520862 /nfs/dbraw/zinc/52/08/62/568520862.db2.gz UXNGAPJDRYFUTG-DPSWKAHMSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)ccc1C ZINC000222618067 568520941 /nfs/dbraw/zinc/52/09/41/568520941.db2.gz QHGRVZVSWPJEFD-NTUVXCKYSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)ccc1C ZINC000222618131 568520974 /nfs/dbraw/zinc/52/09/74/568520974.db2.gz QHGRVZVSWPJEFD-GLYQVZKVSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)ccc1C ZINC000222618188 568520949 /nfs/dbraw/zinc/52/09/49/568520949.db2.gz QHGRVZVSWPJEFD-GKVQRAMASA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)ccc1C ZINC000222618252 568520995 /nfs/dbraw/zinc/52/09/95/568520995.db2.gz QHGRVZVSWPJEFD-NWVWQQAFSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1c(C)cccc1C ZINC000222618339 568520986 /nfs/dbraw/zinc/52/09/86/568520986.db2.gz KDWTULICNUSHJM-KUWBRRTOSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1c(C)cccc1C ZINC000222618399 568520936 /nfs/dbraw/zinc/52/09/36/568520936.db2.gz KDWTULICNUSHJM-ANJVHQHFSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1c(C)cccc1C ZINC000222618456 568520931 /nfs/dbraw/zinc/52/09/31/568520931.db2.gz KDWTULICNUSHJM-JKFKMHIGSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1c(C)cccc1C ZINC000222618512 568520991 /nfs/dbraw/zinc/52/09/91/568520991.db2.gz KDWTULICNUSHJM-OEOAZWSVSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)cc(C)c1 ZINC000222618594 568520904 /nfs/dbraw/zinc/52/09/04/568520904.db2.gz BCYIWDLIGMDTMR-NTUVXCKYSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)cc(C)c1 ZINC000222618671 568520955 /nfs/dbraw/zinc/52/09/55/568520955.db2.gz BCYIWDLIGMDTMR-GLYQVZKVSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)cc(C)c1 ZINC000222618734 568520932 /nfs/dbraw/zinc/52/09/32/568520932.db2.gz BCYIWDLIGMDTMR-GKVQRAMASA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)c(C)n1-c1cc(C)cc(C)c1 ZINC000222618798 568520901 /nfs/dbraw/zinc/52/09/01/568520901.db2.gz BCYIWDLIGMDTMR-NWVWQQAFSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1c(Cl)c([C@@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)ccc1N1CCCC1 ZINC000222638952 568521832 /nfs/dbraw/zinc/52/18/32/568521832.db2.gz SYRAEMHIQHAUTQ-LVXYXVKQSA-N 0 0 412.990 5.233 40 10 HKCBRN Cc1c(Cl)c([C@H]2[C@@H](c3ccccn3)N=C3S[C@@H](C)CN32)ccc1N1CCCC1 ZINC000222639010 568521790 /nfs/dbraw/zinc/52/17/90/568521790.db2.gz SYRAEMHIQHAUTQ-DLPLYFIVSA-N 0 0 412.990 5.233 40 10 HKCBRN Cc1c(Cl)c([C@@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)ccc1N1CCCC1 ZINC000222639084 568521835 /nfs/dbraw/zinc/52/18/35/568521835.db2.gz SYRAEMHIQHAUTQ-SZFUDVHCSA-N 0 0 412.990 5.233 40 10 HKCBRN Cc1c(Cl)c([C@H]2[C@H](c3ccccn3)N=C3S[C@@H](C)CN32)ccc1N1CCCC1 ZINC000222639144 568521820 /nfs/dbraw/zinc/52/18/20/568521820.db2.gz SYRAEMHIQHAUTQ-WVFSVQOHSA-N 0 0 412.990 5.233 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(Cl)cc3)N21 ZINC000222672223 568523110 /nfs/dbraw/zinc/52/31/10/568523110.db2.gz ICFLXWXSPFXQJX-VOQZNFBZSA-N 0 0 422.985 5.814 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(Cl)cc3)N21 ZINC000222672298 568523127 /nfs/dbraw/zinc/52/31/27/568523127.db2.gz ICFLXWXSPFXQJX-BULFRSBZSA-N 0 0 422.985 5.814 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(Cl)cc3)N21 ZINC000222672355 568523107 /nfs/dbraw/zinc/52/31/07/568523107.db2.gz ICFLXWXSPFXQJX-ZPMCFJSWSA-N 0 0 422.985 5.814 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(Cl)cc3)N21 ZINC000222672429 568523105 /nfs/dbraw/zinc/52/31/05/568523105.db2.gz ICFLXWXSPFXQJX-MTNREXPMSA-N 0 0 422.985 5.814 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc4c(c3)C(C)=CC(C)(C)N4C)N21 ZINC000222672783 568523150 /nfs/dbraw/zinc/52/31/50/568523150.db2.gz LQUHWVRNEQFTQW-YFXJRYMSSA-N 0 0 418.610 5.693 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc4c(c3)C(C)=CC(C)(C)N4C)N21 ZINC000222672854 568523126 /nfs/dbraw/zinc/52/31/26/568523126.db2.gz LQUHWVRNEQFTQW-OFAXGOBFSA-N 0 0 418.610 5.693 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(F)c(N4CCCC4)cc3C)N21 ZINC000222673122 568523159 /nfs/dbraw/zinc/52/31/59/568523159.db2.gz HVYAMXQQNYXXRR-URZJWIJPSA-N 0 0 410.562 5.109 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(F)c(N4CCCC4)cc3C)N21 ZINC000222673192 568523124 /nfs/dbraw/zinc/52/31/24/568523124.db2.gz HVYAMXQQNYXXRR-WQTXXOFMSA-N 0 0 410.562 5.109 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(F)c(N4CCCC4)cc3C)N21 ZINC000222673243 568523151 /nfs/dbraw/zinc/52/31/51/568523151.db2.gz HVYAMXQQNYXXRR-NPFVIJTESA-N 0 0 410.562 5.109 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(F)c(N4CCCC4)cc3C)N21 ZINC000222673309 568523117 /nfs/dbraw/zinc/52/31/17/568523117.db2.gz HVYAMXQQNYXXRR-KNXBSLHKSA-N 0 0 410.562 5.109 40 10 HKCBRN C[C@@H](NC(=O)CCc1cccc2ccccc21)c1ccc(N2CCC(C)CC2)cc1 ZINC000222677285 568523318 /nfs/dbraw/zinc/52/33/18/568523318.db2.gz DRELKOJRPQVAER-OAQYLSRUSA-N 0 0 400.566 5.886 40 10 HKCBRN C[C@H](NC(=O)CCc1cccc2ccccc21)c1ccc(N2CCC(C)CC2)cc1 ZINC000222677359 568523389 /nfs/dbraw/zinc/52/33/89/568523389.db2.gz DRELKOJRPQVAER-NRFANRHFSA-N 0 0 400.566 5.886 40 10 HKCBRN C[C@@H](NC(=O)CCc1cccc2ccccc21)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222677452 568523356 /nfs/dbraw/zinc/52/33/56/568523356.db2.gz JFPYOSGSUKMFJR-NHCUHLMSSA-N 0 0 400.566 5.886 40 10 HKCBRN C[C@H](NC(=O)CCc1cccc2ccccc21)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222677515 568523347 /nfs/dbraw/zinc/52/33/47/568523347.db2.gz JFPYOSGSUKMFJR-RTWAWAEBSA-N 0 0 400.566 5.886 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)c(N4CCCC4)cc3C)N21 ZINC000222677827 568523331 /nfs/dbraw/zinc/52/33/31/568523331.db2.gz QOEFDZRLXYXSLJ-YFXJRYMSSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)c(N4CCCC4)cc3C)N21 ZINC000222677886 568523417 /nfs/dbraw/zinc/52/34/17/568523417.db2.gz QOEFDZRLXYXSLJ-OFAXGOBFSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)c(N4CCCC4)cc3C)N21 ZINC000222677955 568523410 /nfs/dbraw/zinc/52/34/10/568523410.db2.gz QOEFDZRLXYXSLJ-SXSPYAJSSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)c(N4CCCC4)cc3C)N21 ZINC000222678005 568523345 /nfs/dbraw/zinc/52/33/45/568523345.db2.gz QOEFDZRLXYXSLJ-CDNPAEQRSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(C)c3C)N21 ZINC000222678108 568523311 /nfs/dbraw/zinc/52/33/11/568523311.db2.gz NXHBIACKYJWGAM-YFXJRYMSSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(C)c3C)N21 ZINC000222678167 568523376 /nfs/dbraw/zinc/52/33/76/568523376.db2.gz NXHBIACKYJWGAM-OFAXGOBFSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(C)c3C)N21 ZINC000222678235 568523401 /nfs/dbraw/zinc/52/34/01/568523401.db2.gz NXHBIACKYJWGAM-SXSPYAJSSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(C)c3C)N21 ZINC000222678293 568523321 /nfs/dbraw/zinc/52/33/21/568523321.db2.gz NXHBIACKYJWGAM-CDNPAEQRSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3C)N21 ZINC000222678378 568523399 /nfs/dbraw/zinc/52/33/99/568523399.db2.gz MBESXRNGGBTBMQ-YFXJRYMSSA-N 0 0 406.599 5.360 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3C)N21 ZINC000222678439 568523359 /nfs/dbraw/zinc/52/33/59/568523359.db2.gz MBESXRNGGBTBMQ-OFAXGOBFSA-N 0 0 406.599 5.360 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3C)N21 ZINC000222678506 568523333 /nfs/dbraw/zinc/52/33/33/568523333.db2.gz MBESXRNGGBTBMQ-SXSPYAJSSA-N 0 0 406.599 5.360 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3C)N21 ZINC000222678561 568523382 /nfs/dbraw/zinc/52/33/82/568523382.db2.gz MBESXRNGGBTBMQ-CDNPAEQRSA-N 0 0 406.599 5.360 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3F)N21 ZINC000222678660 568523314 /nfs/dbraw/zinc/52/33/14/568523314.db2.gz ZJMCPLRVEFZCCZ-URZJWIJPSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3F)N21 ZINC000222678709 568523404 /nfs/dbraw/zinc/52/34/04/568523404.db2.gz ZJMCPLRVEFZCCZ-WQTXXOFMSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3F)N21 ZINC000222678771 568523384 /nfs/dbraw/zinc/52/33/84/568523384.db2.gz ZJMCPLRVEFZCCZ-NPFVIJTESA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3F)N21 ZINC000222678841 568523361 /nfs/dbraw/zinc/52/33/61/568523361.db2.gz ZJMCPLRVEFZCCZ-KNXBSLHKSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3OC)N21 ZINC000222678938 568523368 /nfs/dbraw/zinc/52/33/68/568523368.db2.gz ACAKXUSJSLHDFD-MQNAVGNWSA-N 0 0 422.598 5.060 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3OC)N21 ZINC000222679327 568523465 /nfs/dbraw/zinc/52/34/65/568523465.db2.gz ACAKXUSJSLHDFD-PDIWNELESA-N 0 0 422.598 5.060 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3OC)N21 ZINC000222679385 568523495 /nfs/dbraw/zinc/52/34/95/568523495.db2.gz ACAKXUSJSLHDFD-NLSFWIRASA-N 0 0 422.598 5.060 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)cc3OC)N21 ZINC000222679444 568523431 /nfs/dbraw/zinc/52/34/31/568523431.db2.gz ACAKXUSJSLHDFD-JJEOQYAHSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc([C@@H]2[C@@H](c3ccccn3)N=C3SC[C@@H](CC)N32)ccc1N1CCCC1 ZINC000222679536 568523432 /nfs/dbraw/zinc/52/34/32/568523432.db2.gz CLHKZJCRXGRAEF-SXSPYAJSSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc([C@H]2[C@@H](c3ccccn3)N=C3SC[C@@H](CC)N32)ccc1N1CCCC1 ZINC000222679583 568523455 /nfs/dbraw/zinc/52/34/55/568523455.db2.gz CLHKZJCRXGRAEF-YSZBQJHXSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc([C@@H]2[C@H](c3ccccn3)N=C3SC[C@@H](CC)N32)ccc1N1CCCC1 ZINC000222679660 568523445 /nfs/dbraw/zinc/52/34/45/568523445.db2.gz CLHKZJCRXGRAEF-YFXJRYMSSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc([C@H]2[C@H](c3ccccn3)N=C3SC[C@@H](CC)N32)ccc1N1CCCC1 ZINC000222679718 568523469 /nfs/dbraw/zinc/52/34/69/568523469.db2.gz CLHKZJCRXGRAEF-LEOXJPRUSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc(N(CC)CC)ccc1[C@@H]1[C@@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222688349 568523667 /nfs/dbraw/zinc/52/36/67/568523667.db2.gz BLDKGCBTQNKUMA-NLSFWIRASA-N 0 0 424.614 5.306 40 10 HKCBRN CCOc1cc(N(CC)CC)ccc1[C@H]1[C@@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222688400 568523699 /nfs/dbraw/zinc/52/36/99/568523699.db2.gz BLDKGCBTQNKUMA-ZQMYSKGWSA-N 0 0 424.614 5.306 40 10 HKCBRN CCOc1cc(N(CC)CC)ccc1[C@@H]1[C@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222688468 568523696 /nfs/dbraw/zinc/52/36/96/568523696.db2.gz BLDKGCBTQNKUMA-MQNAVGNWSA-N 0 0 424.614 5.306 40 10 HKCBRN CCOc1cc(N(CC)CC)ccc1[C@H]1[C@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222688541 568523707 /nfs/dbraw/zinc/52/37/07/568523707.db2.gz BLDKGCBTQNKUMA-VSDWSMLSSA-N 0 0 424.614 5.306 40 10 HKCBRN CCOc1cc(N2CCCC2)ccc1[C@@H]1[C@@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222690430 568523805 /nfs/dbraw/zinc/52/38/05/568523805.db2.gz ASGQWKFJGUYDQZ-NLSFWIRASA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc(N2CCCC2)ccc1[C@H]1[C@@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222690480 568523779 /nfs/dbraw/zinc/52/37/79/568523779.db2.gz ASGQWKFJGUYDQZ-ZQMYSKGWSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc(N2CCCC2)ccc1[C@@H]1[C@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222690532 568523769 /nfs/dbraw/zinc/52/37/69/568523769.db2.gz ASGQWKFJGUYDQZ-MQNAVGNWSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc(N2CCCC2)ccc1[C@H]1[C@H](c2ccccn2)N=C2SC[C@@H](CC)N21 ZINC000222690583 568523806 /nfs/dbraw/zinc/52/38/06/568523806.db2.gz ASGQWKFJGUYDQZ-VSDWSMLSSA-N 0 0 422.598 5.060 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)c(F)c3)N21 ZINC000222690969 568523797 /nfs/dbraw/zinc/52/37/97/568523797.db2.gz HQNJGFUPJIAMKC-VOQZNFBZSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)c(F)c3)N21 ZINC000222691034 568523821 /nfs/dbraw/zinc/52/38/21/568523821.db2.gz HQNJGFUPJIAMKC-BULFRSBZSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)c(F)c3)N21 ZINC000222691105 568523815 /nfs/dbraw/zinc/52/38/15/568523815.db2.gz HQNJGFUPJIAMKC-ZPMCFJSWSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCCC4)c(F)c3)N21 ZINC000222691165 568523803 /nfs/dbraw/zinc/52/38/03/568523803.db2.gz HQNJGFUPJIAMKC-MTNREXPMSA-N 0 0 410.562 5.190 40 10 HKCBRN O=C(CCCSc1ccc(Cl)cc1)NCc1ccc(N2CCCCC2)cc1 ZINC000222691343 568523798 /nfs/dbraw/zinc/52/37/98/568523798.db2.gz TWFJBPJVSIDJQX-UHFFFAOYSA-N 0 0 402.991 5.519 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4)c3C)N21 ZINC000222694474 568523827 /nfs/dbraw/zinc/52/38/27/568523827.db2.gz UHLHHCVTYCLMRD-YFXJRYMSSA-N 0 0 402.567 5.469 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4)c3C)N21 ZINC000222694532 568523773 /nfs/dbraw/zinc/52/37/73/568523773.db2.gz UHLHHCVTYCLMRD-OFAXGOBFSA-N 0 0 402.567 5.469 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4)c3C)N21 ZINC000222694610 568523908 /nfs/dbraw/zinc/52/39/08/568523908.db2.gz UHLHHCVTYCLMRD-SXSPYAJSSA-N 0 0 402.567 5.469 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4)c3C)N21 ZINC000222694659 568523935 /nfs/dbraw/zinc/52/39/35/568523935.db2.gz UHLHHCVTYCLMRD-CDNPAEQRSA-N 0 0 402.567 5.469 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4C)c3C)N21 ZINC000222694742 568523947 /nfs/dbraw/zinc/52/39/47/568523947.db2.gz IPUJLXDQHDXNGI-VEXUSMLFSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4C)c3C)N21 ZINC000222694804 568523917 /nfs/dbraw/zinc/52/39/17/568523917.db2.gz IPUJLXDQHDXNGI-WDJPJFJCSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4C)c3C)N21 ZINC000222694868 568523906 /nfs/dbraw/zinc/52/39/06/568523906.db2.gz IPUJLXDQHDXNGI-CTUHWIOQSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4C)c3C)N21 ZINC000222694921 568523921 /nfs/dbraw/zinc/52/39/21/568523921.db2.gz IPUJLXDQHDXNGI-WUMKDDEVSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(C)c4)c3C)N21 ZINC000222695014 568523949 /nfs/dbraw/zinc/52/39/49/568523949.db2.gz SPRDVBHKQUYMIL-VEXUSMLFSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(C)c4)c3C)N21 ZINC000222695071 568523912 /nfs/dbraw/zinc/52/39/12/568523912.db2.gz SPRDVBHKQUYMIL-WDJPJFJCSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(C)c4)c3C)N21 ZINC000222695133 568523931 /nfs/dbraw/zinc/52/39/31/568523931.db2.gz SPRDVBHKQUYMIL-CTUHWIOQSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(C)c4)c3C)N21 ZINC000222695195 568523914 /nfs/dbraw/zinc/52/39/14/568523914.db2.gz SPRDVBHKQUYMIL-WUMKDDEVSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cc4)c3C)N21 ZINC000222695274 568523902 /nfs/dbraw/zinc/52/39/02/568523902.db2.gz VFFHWMXHQHWWAO-VEXUSMLFSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cc4)c3C)N21 ZINC000222695338 568523929 /nfs/dbraw/zinc/52/39/29/568523929.db2.gz VFFHWMXHQHWWAO-WDJPJFJCSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cc4)c3C)N21 ZINC000222695403 568523918 /nfs/dbraw/zinc/52/39/18/568523918.db2.gz VFFHWMXHQHWWAO-CTUHWIOQSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cc4)c3C)N21 ZINC000222695461 568523922 /nfs/dbraw/zinc/52/39/22/568523922.db2.gz VFFHWMXHQHWWAO-WUMKDDEVSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4F)c3C)N21 ZINC000222696372 568523936 /nfs/dbraw/zinc/52/39/36/568523936.db2.gz WUPQPYKOTKGCSF-MQNAVGNWSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4F)c3C)N21 ZINC000222696433 568523941 /nfs/dbraw/zinc/52/39/41/568523941.db2.gz WUPQPYKOTKGCSF-PDIWNELESA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4F)c3C)N21 ZINC000222696499 568523933 /nfs/dbraw/zinc/52/39/33/568523933.db2.gz WUPQPYKOTKGCSF-NLSFWIRASA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccccc4F)c3C)N21 ZINC000222696561 568523910 /nfs/dbraw/zinc/52/39/10/568523910.db2.gz WUPQPYKOTKGCSF-JJEOQYAHSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(F)c4)c3C)N21 ZINC000222696657 568523907 /nfs/dbraw/zinc/52/39/07/568523907.db2.gz FJTCZCSKFBCTJE-YFXJRYMSSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(F)c4)c3C)N21 ZINC000222696714 568524073 /nfs/dbraw/zinc/52/40/73/568524073.db2.gz FJTCZCSKFBCTJE-OFAXGOBFSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(F)c4)c3C)N21 ZINC000222696782 568524027 /nfs/dbraw/zinc/52/40/27/568524027.db2.gz FJTCZCSKFBCTJE-SXSPYAJSSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cccc(F)c4)c3C)N21 ZINC000222696843 568524086 /nfs/dbraw/zinc/52/40/86/568524086.db2.gz FJTCZCSKFBCTJE-CDNPAEQRSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(F)cc4)c3C)N21 ZINC000222696933 568524089 /nfs/dbraw/zinc/52/40/89/568524089.db2.gz HTXFWUGBBGBVHO-YFXJRYMSSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(F)cc4)c3C)N21 ZINC000222696995 568524069 /nfs/dbraw/zinc/52/40/69/568524069.db2.gz HTXFWUGBBGBVHO-OFAXGOBFSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(F)cc4)c3C)N21 ZINC000222697052 568524068 /nfs/dbraw/zinc/52/40/68/568524068.db2.gz HTXFWUGBBGBVHO-SXSPYAJSSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(F)cc4)c3C)N21 ZINC000222697114 568524059 /nfs/dbraw/zinc/52/40/59/568524059.db2.gz HTXFWUGBBGBVHO-CDNPAEQRSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(O)cc4)c3C)N21 ZINC000222698856 568524049 /nfs/dbraw/zinc/52/40/49/568524049.db2.gz AONUXKQNOCGGRN-MQNAVGNWSA-N 0 0 418.566 5.174 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(O)cc4)c3C)N21 ZINC000222698909 568524037 /nfs/dbraw/zinc/52/40/37/568524037.db2.gz AONUXKQNOCGGRN-PDIWNELESA-N 0 0 418.566 5.174 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(O)cc4)c3C)N21 ZINC000222698962 568524046 /nfs/dbraw/zinc/52/40/46/568524046.db2.gz AONUXKQNOCGGRN-NLSFWIRASA-N 0 0 418.566 5.174 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(O)cc4)c3C)N21 ZINC000222699013 568524053 /nfs/dbraw/zinc/52/40/53/568524053.db2.gz AONUXKQNOCGGRN-JJEOQYAHSA-N 0 0 418.566 5.174 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cc(C)ccn4)c3C)N21 ZINC000222703273 568524185 /nfs/dbraw/zinc/52/41/85/568524185.db2.gz KGUAIQNZUWTTKD-YFXJRYMSSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cc(C)ccn4)c3C)N21 ZINC000222703331 568524200 /nfs/dbraw/zinc/52/42/00/568524200.db2.gz KGUAIQNZUWTTKD-OFAXGOBFSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cc(C)ccn4)c3C)N21 ZINC000222703385 568524201 /nfs/dbraw/zinc/52/42/01/568524201.db2.gz KGUAIQNZUWTTKD-SXSPYAJSSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4cc(C)ccn4)c3C)N21 ZINC000222703449 568524172 /nfs/dbraw/zinc/52/41/72/568524172.db2.gz KGUAIQNZUWTTKD-CDNPAEQRSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ncccc4C)c3C)N21 ZINC000222703531 568524181 /nfs/dbraw/zinc/52/41/81/568524181.db2.gz WEOKKAXNFPVBRL-BVYCBKJFSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ncccc4C)c3C)N21 ZINC000222703589 568524167 /nfs/dbraw/zinc/52/41/67/568524167.db2.gz WEOKKAXNFPVBRL-YUXAGFNASA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ncccc4C)c3C)N21 ZINC000222703641 568524205 /nfs/dbraw/zinc/52/42/05/568524205.db2.gz WEOKKAXNFPVBRL-STZQEDGTSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ncccc4C)c3C)N21 ZINC000222703698 568524188 /nfs/dbraw/zinc/52/41/88/568524188.db2.gz WEOKKAXNFPVBRL-VLCRHTCISA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cn4)c3C)N21 ZINC000222703790 568524177 /nfs/dbraw/zinc/52/41/77/568524177.db2.gz RAQSTVRIUQGFTC-YFXJRYMSSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cn4)c3C)N21 ZINC000222703849 568524158 /nfs/dbraw/zinc/52/41/58/568524158.db2.gz RAQSTVRIUQGFTC-OFAXGOBFSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cn4)c3C)N21 ZINC000222703916 568524195 /nfs/dbraw/zinc/52/41/95/568524195.db2.gz RAQSTVRIUQGFTC-SXSPYAJSSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(-c4ccc(C)cn4)c3C)N21 ZINC000222703994 568524186 /nfs/dbraw/zinc/52/41/86/568524186.db2.gz RAQSTVRIUQGFTC-CDNPAEQRSA-N 0 0 417.582 5.172 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccccc1F)c1ccc(N2CCC(C)CC2)cc1 ZINC000222711124 568524423 /nfs/dbraw/zinc/52/44/23/568524423.db2.gz WMWOTKZYKXAVEL-GOSISDBHSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccccc1F)c1ccc(N2CCC(C)CC2)cc1 ZINC000222711195 568524411 /nfs/dbraw/zinc/52/44/11/568524411.db2.gz WMWOTKZYKXAVEL-SFHVURJKSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccccc1F)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222711302 568524360 /nfs/dbraw/zinc/52/43/60/568524360.db2.gz PIFLKZRQLSUUPT-QZTJIDSGSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccccc1F)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222711370 568524394 /nfs/dbraw/zinc/52/43/94/568524394.db2.gz PIFLKZRQLSUUPT-MSOLQXFVSA-N 0 0 400.563 5.173 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(OC)cc3)N21 ZINC000222718806 568524631 /nfs/dbraw/zinc/52/46/31/568524631.db2.gz SLZCTUGUTCGWQA-MQNAVGNWSA-N 0 0 418.566 5.169 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(OC)cc3)N21 ZINC000222718871 568524635 /nfs/dbraw/zinc/52/46/35/568524635.db2.gz SLZCTUGUTCGWQA-PDIWNELESA-N 0 0 418.566 5.169 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(OC)cc3)N21 ZINC000222718937 568524674 /nfs/dbraw/zinc/52/46/74/568524674.db2.gz SLZCTUGUTCGWQA-NLSFWIRASA-N 0 0 418.566 5.169 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(C)n3-c3ccc(OC)cc3)N21 ZINC000222719000 568524730 /nfs/dbraw/zinc/52/47/30/568524730.db2.gz SLZCTUGUTCGWQA-JJEOQYAHSA-N 0 0 418.566 5.169 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(Cl)c3)N21 ZINC000222720174 568524700 /nfs/dbraw/zinc/52/47/00/568524700.db2.gz VLQXOWIYSFQNQQ-TYCQWZJGSA-N 0 0 412.990 5.315 40 10 HKCBRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(Cl)c3)N21 ZINC000222720228 568524714 /nfs/dbraw/zinc/52/47/14/568524714.db2.gz VLQXOWIYSFQNQQ-ORYQWCPZSA-N 0 0 412.990 5.315 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(Cl)c3)N21 ZINC000222720292 568524704 /nfs/dbraw/zinc/52/47/04/568524704.db2.gz VLQXOWIYSFQNQQ-MAODMQOUSA-N 0 0 412.990 5.315 40 10 HKCBRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(N4CCCC4)c(Cl)c3)N21 ZINC000222720361 568524753 /nfs/dbraw/zinc/52/47/53/568524753.db2.gz VLQXOWIYSFQNQQ-ZLGUVYLKSA-N 0 0 412.990 5.315 40 10 HKCBRN O=C(CSCc1ccc(Cl)cc1Cl)NCc1ccc(N2CCCCC2)cc1 ZINC000222724282 568524867 /nfs/dbraw/zinc/52/48/67/568524867.db2.gz PURDTZKPNDPGSY-UHFFFAOYSA-N 0 0 423.409 5.533 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc2ccccc21 ZINC000222735458 568525144 /nfs/dbraw/zinc/52/51/44/568525144.db2.gz SXFWSVQSVGMLKQ-DNQXCXABSA-N 0 0 412.562 5.245 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc2ccccc21 ZINC000222735985 568525101 /nfs/dbraw/zinc/52/51/01/568525101.db2.gz SXFWSVQSVGMLKQ-RPWUZVMVSA-N 0 0 412.562 5.245 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc2ccccc21 ZINC000222736045 568525156 /nfs/dbraw/zinc/52/51/56/568525156.db2.gz SXFWSVQSVGMLKQ-BJKOFHAPSA-N 0 0 412.562 5.245 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc2ccccc21 ZINC000222736104 568525170 /nfs/dbraw/zinc/52/51/70/568525170.db2.gz SXFWSVQSVGMLKQ-ZEQRLZLVSA-N 0 0 412.562 5.245 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1c(C)cc(C)cc1C ZINC000222745321 568525344 /nfs/dbraw/zinc/52/53/44/568525344.db2.gz LTFKCZBUCFYCAL-FYYLOGMGSA-N 0 0 404.583 5.017 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1c(C)cc(C)cc1C ZINC000222745379 568525361 /nfs/dbraw/zinc/52/53/61/568525361.db2.gz LTFKCZBUCFYCAL-GGAORHGYSA-N 0 0 404.583 5.017 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1c(C)cc(C)cc1C ZINC000222745453 568525360 /nfs/dbraw/zinc/52/53/60/568525360.db2.gz LTFKCZBUCFYCAL-JTHBVZDNSA-N 0 0 404.583 5.017 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1c(C)cc(C)cc1C ZINC000222745505 568525359 /nfs/dbraw/zinc/52/53/59/568525359.db2.gz LTFKCZBUCFYCAL-GMAHTHKFSA-N 0 0 404.583 5.017 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc(Cl)c1C ZINC000222745597 568525340 /nfs/dbraw/zinc/52/53/40/568525340.db2.gz ODYBQIRQJAUGBG-NHCUHLMSSA-N 0 0 410.974 5.053 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc(Cl)c1C ZINC000222745661 568525336 /nfs/dbraw/zinc/52/53/36/568525336.db2.gz ODYBQIRQJAUGBG-RTWAWAEBSA-N 0 0 410.974 5.053 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc(Cl)c1C ZINC000222745712 568525376 /nfs/dbraw/zinc/52/53/76/568525376.db2.gz ODYBQIRQJAUGBG-LEWJYISDSA-N 0 0 410.974 5.053 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cccc(Cl)c1C ZINC000222745778 568525334 /nfs/dbraw/zinc/52/53/34/568525334.db2.gz ODYBQIRQJAUGBG-SFTDATJTSA-N 0 0 410.974 5.053 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cc(Cl)ccc1C ZINC000222746407 568525436 /nfs/dbraw/zinc/52/54/36/568525436.db2.gz CXMCGSZFMLKINP-NHCUHLMSSA-N 0 0 410.974 5.053 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cc(Cl)ccc1C ZINC000222746471 568525482 /nfs/dbraw/zinc/52/54/82/568525482.db2.gz CXMCGSZFMLKINP-RTWAWAEBSA-N 0 0 410.974 5.053 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cc(Cl)ccc1C ZINC000222746531 568525474 /nfs/dbraw/zinc/52/54/74/568525474.db2.gz CXMCGSZFMLKINP-LEWJYISDSA-N 0 0 410.974 5.053 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C)c(C)n1-c1cc(Cl)ccc1C ZINC000222746584 568525476 /nfs/dbraw/zinc/52/54/76/568525476.db2.gz CXMCGSZFMLKINP-SFTDATJTSA-N 0 0 410.974 5.053 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222783134 568526420 /nfs/dbraw/zinc/52/64/20/568526420.db2.gz MSMIKFOHSPNAQU-DHIUTWEWSA-N 0 0 404.583 5.044 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222783198 568526436 /nfs/dbraw/zinc/52/64/36/568526436.db2.gz MSMIKFOHSPNAQU-PKTZIBPZSA-N 0 0 404.583 5.044 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222783257 568526397 /nfs/dbraw/zinc/52/63/97/568526397.db2.gz MSMIKFOHSPNAQU-XZOQPEGZSA-N 0 0 404.583 5.044 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222783320 568526443 /nfs/dbraw/zinc/52/64/43/568526443.db2.gz MSMIKFOHSPNAQU-GOTSBHOMSA-N 0 0 404.583 5.044 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)NC(=S)N3CC)c2C)cc1 ZINC000222783405 568526392 /nfs/dbraw/zinc/52/63/92/568526392.db2.gz QFYUGRIGOVWXKP-DHIUTWEWSA-N 0 0 404.583 5.044 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@H]3[C@@H](c4ccccn4)NC(=S)N3CC)c2C)cc1 ZINC000222783461 568526432 /nfs/dbraw/zinc/52/64/32/568526432.db2.gz QFYUGRIGOVWXKP-PKTZIBPZSA-N 0 0 404.583 5.044 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)NC(=S)N3CC)c2C)cc1 ZINC000222783523 568526374 /nfs/dbraw/zinc/52/63/74/568526374.db2.gz QFYUGRIGOVWXKP-XZOQPEGZSA-N 0 0 404.583 5.044 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@H]3[C@H](c4ccccn4)NC(=S)N3CC)c2C)cc1 ZINC000222783582 568526394 /nfs/dbraw/zinc/52/63/94/568526394.db2.gz QFYUGRIGOVWXKP-GOTSBHOMSA-N 0 0 404.583 5.044 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2Cl)c1C ZINC000222784470 568526519 /nfs/dbraw/zinc/52/65/19/568526519.db2.gz RWJJYGROXNNBPH-SFTDATJTSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2Cl)c1C ZINC000222784522 568526556 /nfs/dbraw/zinc/52/65/56/568526556.db2.gz RWJJYGROXNNBPH-RTWAWAEBSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2Cl)c1C ZINC000222784577 568526468 /nfs/dbraw/zinc/52/64/68/568526468.db2.gz RWJJYGROXNNBPH-LEWJYISDSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2Cl)c1C ZINC000222784654 568526503 /nfs/dbraw/zinc/52/65/03/568526503.db2.gz RWJJYGROXNNBPH-NHCUHLMSSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(Cl)c2)c1C ZINC000222785005 568526552 /nfs/dbraw/zinc/52/65/52/568526552.db2.gz HAUDPCLVMRGYEG-SFTDATJTSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(Cl)c2)c1C ZINC000222785059 568526474 /nfs/dbraw/zinc/52/64/74/568526474.db2.gz HAUDPCLVMRGYEG-RTWAWAEBSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(Cl)c2)c1C ZINC000222785129 568526507 /nfs/dbraw/zinc/52/65/07/568526507.db2.gz HAUDPCLVMRGYEG-LEWJYISDSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(Cl)c2)c1C ZINC000222785197 568526530 /nfs/dbraw/zinc/52/65/30/568526530.db2.gz HAUDPCLVMRGYEG-NHCUHLMSSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(Cl)cc2)c1C ZINC000222785299 568526478 /nfs/dbraw/zinc/52/64/78/568526478.db2.gz SAQFTYPXYKOGFT-SFTDATJTSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(Cl)cc2)c1C ZINC000222785352 568526526 /nfs/dbraw/zinc/52/65/26/568526526.db2.gz SAQFTYPXYKOGFT-RTWAWAEBSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(Cl)cc2)c1C ZINC000222785406 568526472 /nfs/dbraw/zinc/52/64/72/568526472.db2.gz SAQFTYPXYKOGFT-LEWJYISDSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(Cl)cc2)c1C ZINC000222785465 568526564 /nfs/dbraw/zinc/52/65/64/568526564.db2.gz SAQFTYPXYKOGFT-NHCUHLMSSA-N 0 0 410.974 5.135 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222789186 568526663 /nfs/dbraw/zinc/52/66/63/568526663.db2.gz RSFZEGYAMUORAA-GOTSBHOMSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222789245 568526646 /nfs/dbraw/zinc/52/66/46/568526646.db2.gz RSFZEGYAMUORAA-PKTZIBPZSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222789304 568526591 /nfs/dbraw/zinc/52/65/91/568526591.db2.gz RSFZEGYAMUORAA-XZOQPEGZSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222789361 568526642 /nfs/dbraw/zinc/52/66/42/568526642.db2.gz RSFZEGYAMUORAA-DHIUTWEWSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222789447 568526621 /nfs/dbraw/zinc/52/66/21/568526621.db2.gz RYSIQFGZVYNUAP-GOTSBHOMSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222789510 568526614 /nfs/dbraw/zinc/52/66/14/568526614.db2.gz RYSIQFGZVYNUAP-PKTZIBPZSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222789571 568526605 /nfs/dbraw/zinc/52/66/05/568526605.db2.gz RYSIQFGZVYNUAP-XZOQPEGZSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222789634 568526657 /nfs/dbraw/zinc/52/66/57/568526657.db2.gz RYSIQFGZVYNUAP-DHIUTWEWSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222789717 568526667 /nfs/dbraw/zinc/52/66/67/568526667.db2.gz USOFNEVFOAFHNJ-GMAHTHKFSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222789777 568526644 /nfs/dbraw/zinc/52/66/44/568526644.db2.gz USOFNEVFOAFHNJ-GGAORHGYSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222789841 568526664 /nfs/dbraw/zinc/52/66/64/568526664.db2.gz USOFNEVFOAFHNJ-JTHBVZDNSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222789888 568526600 /nfs/dbraw/zinc/52/66/00/568526600.db2.gz USOFNEVFOAFHNJ-FYYLOGMGSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222789988 568526653 /nfs/dbraw/zinc/52/66/53/568526653.db2.gz FTHXJVDBANBUDP-GOTSBHOMSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222790046 568526577 /nfs/dbraw/zinc/52/65/77/568526577.db2.gz FTHXJVDBANBUDP-PKTZIBPZSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222790114 568526608 /nfs/dbraw/zinc/52/66/08/568526608.db2.gz FTHXJVDBANBUDP-XZOQPEGZSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222790176 568526581 /nfs/dbraw/zinc/52/65/81/568526581.db2.gz FTHXJVDBANBUDP-DHIUTWEWSA-N 0 0 404.583 5.098 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2c(C)cc(C)cc2C)c1C ZINC000222790525 568526733 /nfs/dbraw/zinc/52/67/33/568526733.db2.gz JHOBTVKCGVVUHL-UPVQGACJSA-N 0 0 418.610 5.407 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2c(C)cc(C)cc2C)c1C ZINC000222790577 568526728 /nfs/dbraw/zinc/52/67/28/568526728.db2.gz JHOBTVKCGVVUHL-VWNXMTODSA-N 0 0 418.610 5.407 40 10 HKCBRN CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2c(C)cc(C)cc2C)c1C ZINC000222790644 568526763 /nfs/dbraw/zinc/52/67/63/568526763.db2.gz JHOBTVKCGVVUHL-LADGPHEKSA-N 0 0 418.610 5.407 40 10 HKCBRN CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2c(C)cc(C)cc2C)c1C ZINC000222790708 568526781 /nfs/dbraw/zinc/52/67/81/568526781.db2.gz JHOBTVKCGVVUHL-ISKFKSNPSA-N 0 0 418.610 5.407 40 10 HKCBRN CCc1cccc(C)c1-n1c(C)cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222792711 568526769 /nfs/dbraw/zinc/52/67/69/568526769.db2.gz DKVIBVLQSVZHKS-ISKFKSNPSA-N 0 0 418.610 5.352 40 10 HKCBRN CCc1cccc(C)c1-n1c(C)cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222792781 568526780 /nfs/dbraw/zinc/52/67/80/568526780.db2.gz DKVIBVLQSVZHKS-VWNXMTODSA-N 0 0 418.610 5.352 40 10 HKCBRN CCc1cccc(C)c1-n1c(C)cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222792844 568526775 /nfs/dbraw/zinc/52/67/75/568526775.db2.gz DKVIBVLQSVZHKS-LADGPHEKSA-N 0 0 418.610 5.352 40 10 HKCBRN CCc1cccc(C)c1-n1c(C)cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC)c1C ZINC000222792908 568526681 /nfs/dbraw/zinc/52/66/81/568526681.db2.gz DKVIBVLQSVZHKS-UPVQGACJSA-N 0 0 418.610 5.352 40 10 HKCBRN C[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222800816 568526796 /nfs/dbraw/zinc/52/67/96/568526796.db2.gz XPNPTEHRECFHAI-HXUWFJFHSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222800876 568526883 /nfs/dbraw/zinc/52/68/83/568526883.db2.gz XPNPTEHRECFHAI-FQEVSTJZSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222800964 568526872 /nfs/dbraw/zinc/52/68/72/568526872.db2.gz ZBNQNXBHEZNQKD-WOJBJXKFSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222801033 568526849 /nfs/dbraw/zinc/52/68/49/568526849.db2.gz ZBNQNXBHEZNQKD-UXHICEINSA-N 0 0 408.586 5.477 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@@H](c4ccccn4)NC(=S)N3C(C)C)cc21 ZINC000222817126 568527268 /nfs/dbraw/zinc/52/72/68/568527268.db2.gz KNPGEDYTPPOVFM-FGZHOGPDSA-N 0 0 406.599 5.094 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1C ZINC000222826812 568527531 /nfs/dbraw/zinc/52/75/31/568527531.db2.gz QTOYQOUFXJGPDI-DHIUTWEWSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1C ZINC000222826868 568527518 /nfs/dbraw/zinc/52/75/18/568527518.db2.gz QTOYQOUFXJGPDI-PKTZIBPZSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1C ZINC000222826922 568527476 /nfs/dbraw/zinc/52/74/76/568527476.db2.gz QTOYQOUFXJGPDI-XZOQPEGZSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1C ZINC000222826972 568527526 /nfs/dbraw/zinc/52/75/26/568527526.db2.gz QTOYQOUFXJGPDI-GOTSBHOMSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1 ZINC000222827052 568527651 /nfs/dbraw/zinc/52/76/51/568527651.db2.gz ZXETZVDOVAQBIT-DHIUTWEWSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1 ZINC000222827111 568527624 /nfs/dbraw/zinc/52/76/24/568527624.db2.gz ZXETZVDOVAQBIT-PKTZIBPZSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1 ZINC000222827171 568527606 /nfs/dbraw/zinc/52/76/06/568527606.db2.gz ZXETZVDOVAQBIT-XZOQPEGZSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1 ZINC000222827236 568527636 /nfs/dbraw/zinc/52/76/36/568527636.db2.gz ZXETZVDOVAQBIT-GOTSBHOMSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222827319 568527649 /nfs/dbraw/zinc/52/76/49/568527649.db2.gz QFSJVAWRHIEHLE-DHIUTWEWSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222827382 568527607 /nfs/dbraw/zinc/52/76/07/568527607.db2.gz QFSJVAWRHIEHLE-PKTZIBPZSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222827436 568527587 /nfs/dbraw/zinc/52/75/87/568527587.db2.gz QFSJVAWRHIEHLE-XZOQPEGZSA-N 0 0 404.583 5.178 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222827499 568527575 /nfs/dbraw/zinc/52/75/75/568527575.db2.gz QFSJVAWRHIEHLE-GOTSBHOMSA-N 0 0 404.583 5.178 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c1C ZINC000222827850 568527602 /nfs/dbraw/zinc/52/76/02/568527602.db2.gz MEVALEWKRXZKSP-DNQXCXABSA-N 0 0 418.610 5.432 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c1C ZINC000222827907 568527573 /nfs/dbraw/zinc/52/75/73/568527573.db2.gz MEVALEWKRXZKSP-RPWUZVMVSA-N 0 0 418.610 5.432 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c1C ZINC000222827964 568527596 /nfs/dbraw/zinc/52/75/96/568527596.db2.gz MEVALEWKRXZKSP-BJKOFHAPSA-N 0 0 418.610 5.432 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c1C ZINC000222828021 568527578 /nfs/dbraw/zinc/52/75/78/568527578.db2.gz MEVALEWKRXZKSP-ZEQRLZLVSA-N 0 0 418.610 5.432 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)NC(=S)N3C(C)C)c2C)cc1 ZINC000222828101 568527569 /nfs/dbraw/zinc/52/75/69/568527569.db2.gz NCKNJIFAWXBCOY-DNQXCXABSA-N 0 0 418.610 5.432 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@H]3[C@@H](c4ccccn4)NC(=S)N3C(C)C)c2C)cc1 ZINC000222828161 568527568 /nfs/dbraw/zinc/52/75/68/568527568.db2.gz NCKNJIFAWXBCOY-RPWUZVMVSA-N 0 0 418.610 5.432 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)NC(=S)N3C(C)C)c2C)cc1 ZINC000222828226 568527611 /nfs/dbraw/zinc/52/76/11/568527611.db2.gz NCKNJIFAWXBCOY-BJKOFHAPSA-N 0 0 418.610 5.432 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@H]3[C@H](c4ccccn4)NC(=S)N3C(C)C)c2C)cc1 ZINC000222828294 568527595 /nfs/dbraw/zinc/52/75/95/568527595.db2.gz NCKNJIFAWXBCOY-ZEQRLZLVSA-N 0 0 418.610 5.432 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1F ZINC000222828388 568527585 /nfs/dbraw/zinc/52/75/85/568527585.db2.gz BBIKGZBNAKTMMG-FGZHOGPDSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1F ZINC000222828448 568527613 /nfs/dbraw/zinc/52/76/13/568527613.db2.gz BBIKGZBNAKTMMG-YADHBBJMSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1F ZINC000222828505 568527579 /nfs/dbraw/zinc/52/75/79/568527579.db2.gz BBIKGZBNAKTMMG-FCHUYYIVSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccccc1F ZINC000222828561 568527620 /nfs/dbraw/zinc/52/76/20/568527620.db2.gz BBIKGZBNAKTMMG-VXKWHMMOSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(F)c1 ZINC000222828647 568527641 /nfs/dbraw/zinc/52/76/41/568527641.db2.gz RLKYJSSVPABJHR-FGZHOGPDSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(F)c1 ZINC000222828700 568527626 /nfs/dbraw/zinc/52/76/26/568527626.db2.gz RLKYJSSVPABJHR-YADHBBJMSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(F)c1 ZINC000222828753 568527600 /nfs/dbraw/zinc/52/76/00/568527600.db2.gz RLKYJSSVPABJHR-FCHUYYIVSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(F)c1 ZINC000222828818 568527628 /nfs/dbraw/zinc/52/76/28/568527628.db2.gz RLKYJSSVPABJHR-VXKWHMMOSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222828902 568527574 /nfs/dbraw/zinc/52/75/74/568527574.db2.gz QVXRUQXODLSRAN-FGZHOGPDSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222828963 568527598 /nfs/dbraw/zinc/52/75/98/568527598.db2.gz QVXRUQXODLSRAN-YADHBBJMSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222829023 568527567 /nfs/dbraw/zinc/52/75/67/568527567.db2.gz QVXRUQXODLSRAN-FCHUYYIVSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222829089 568527622 /nfs/dbraw/zinc/52/76/22/568527622.db2.gz QVXRUQXODLSRAN-VXKWHMMOSA-N 0 0 408.546 5.009 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1C ZINC000222833712 568527772 /nfs/dbraw/zinc/52/77/72/568527772.db2.gz CXTGZUXRZXSNMG-DNQXCXABSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1C ZINC000222833773 568527843 /nfs/dbraw/zinc/52/78/43/568527843.db2.gz CXTGZUXRZXSNMG-RPWUZVMVSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1C ZINC000222833820 568527839 /nfs/dbraw/zinc/52/78/39/568527839.db2.gz CXTGZUXRZXSNMG-BJKOFHAPSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cccc(C)c1C ZINC000222833888 568527882 /nfs/dbraw/zinc/52/78/82/568527882.db2.gz CXTGZUXRZXSNMG-ZEQRLZLVSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)ccc1C ZINC000222833989 568527844 /nfs/dbraw/zinc/52/78/44/568527844.db2.gz BBXSNYFSEBVAMM-DNQXCXABSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)ccc1C ZINC000222834053 568527840 /nfs/dbraw/zinc/52/78/40/568527840.db2.gz BBXSNYFSEBVAMM-RPWUZVMVSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)ccc1C ZINC000222834114 568527881 /nfs/dbraw/zinc/52/78/81/568527881.db2.gz BBXSNYFSEBVAMM-BJKOFHAPSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)ccc1C ZINC000222834181 568527871 /nfs/dbraw/zinc/52/78/71/568527871.db2.gz BBXSNYFSEBVAMM-ZEQRLZLVSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1c(C)cccc1C ZINC000222834265 568527885 /nfs/dbraw/zinc/52/78/85/568527885.db2.gz RPZDYEQBRFKUHD-ISKFKSNPSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1c(C)cccc1C ZINC000222834327 568527848 /nfs/dbraw/zinc/52/78/48/568527848.db2.gz RPZDYEQBRFKUHD-VWNXMTODSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1c(C)cccc1C ZINC000222834397 568527856 /nfs/dbraw/zinc/52/78/56/568527856.db2.gz RPZDYEQBRFKUHD-LADGPHEKSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1c(C)cccc1C ZINC000222834472 568527863 /nfs/dbraw/zinc/52/78/63/568527863.db2.gz RPZDYEQBRFKUHD-UPVQGACJSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)cc(C)c1 ZINC000222834569 568527886 /nfs/dbraw/zinc/52/78/86/568527886.db2.gz QRUUIMSSCDAAKE-DNQXCXABSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)cc(C)c1 ZINC000222834618 568527836 /nfs/dbraw/zinc/52/78/36/568527836.db2.gz QRUUIMSSCDAAKE-RPWUZVMVSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)cc(C)c1 ZINC000222834680 568527842 /nfs/dbraw/zinc/52/78/42/568527842.db2.gz QRUUIMSSCDAAKE-BJKOFHAPSA-N 0 0 418.610 5.487 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C(C)C)c(C)n1-c1cc(C)cc(C)c1 ZINC000222834738 568527853 /nfs/dbraw/zinc/52/78/53/568527853.db2.gz QRUUIMSSCDAAKE-ZEQRLZLVSA-N 0 0 418.610 5.487 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000222837119 568527865 /nfs/dbraw/zinc/52/78/65/568527865.db2.gz BFZQEJOUSZNKKW-HXUWFJFHSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000222837189 568527854 /nfs/dbraw/zinc/52/78/54/568527854.db2.gz BFZQEJOUSZNKKW-FQEVSTJZSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222837270 568527861 /nfs/dbraw/zinc/52/78/61/568527861.db2.gz KGVUORDUPXOKMG-WOJBJXKFSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222837330 568527847 /nfs/dbraw/zinc/52/78/47/568527847.db2.gz KGVUORDUPXOKMG-UXHICEINSA-N 0 0 402.538 5.332 40 10 HKCBRN Cc1cc(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)ccc1Cl ZINC000222855013 568528553 /nfs/dbraw/zinc/52/85/53/568528553.db2.gz BUACPAFHNVOKHA-OALUTQOASA-N 0 0 414.977 5.529 40 10 HKCBRN Cc1cc(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)ccc1Cl ZINC000222855065 568528537 /nfs/dbraw/zinc/52/85/37/568528537.db2.gz BUACPAFHNVOKHA-RBUKOAKNSA-N 0 0 414.977 5.529 40 10 HKCBRN Cc1cc(O[C@@H](C)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)ccc1Cl ZINC000222855117 568528570 /nfs/dbraw/zinc/52/85/70/568528570.db2.gz BUACPAFHNVOKHA-MOPGFXCFSA-N 0 0 414.977 5.529 40 10 HKCBRN Cc1cc(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)ccc1Cl ZINC000222855167 568528492 /nfs/dbraw/zinc/52/84/92/568528492.db2.gz BUACPAFHNVOKHA-RTBURBONSA-N 0 0 414.977 5.529 40 10 HKCBRN Cc1cc(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)ccc1Cl ZINC000222855244 568528467 /nfs/dbraw/zinc/52/84/67/568528467.db2.gz CSRXDSCKKDAVTL-NEWSRXKRSA-N 0 0 414.977 5.529 40 10 HKCBRN Cc1cc(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)ccc1Cl ZINC000222855297 568528525 /nfs/dbraw/zinc/52/85/25/568528525.db2.gz CSRXDSCKKDAVTL-NZSAHSFTSA-N 0 0 414.977 5.529 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000222862079 568528876 /nfs/dbraw/zinc/52/88/76/568528876.db2.gz HYALREHPWQTQAM-VXKWHMMOSA-N 0 0 406.599 5.096 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000222862152 568528864 /nfs/dbraw/zinc/52/88/64/568528864.db2.gz HYALREHPWQTQAM-YADHBBJMSA-N 0 0 406.599 5.096 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222871660 568529098 /nfs/dbraw/zinc/52/90/98/568529098.db2.gz YKUKVXSQKCMIGS-GOTSBHOMSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222871721 568529118 /nfs/dbraw/zinc/52/91/18/568529118.db2.gz YKUKVXSQKCMIGS-PKTZIBPZSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222871788 568529078 /nfs/dbraw/zinc/52/90/78/568529078.db2.gz YKUKVXSQKCMIGS-XZOQPEGZSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222871861 568529101 /nfs/dbraw/zinc/52/91/01/568529101.db2.gz YKUKVXSQKCMIGS-DHIUTWEWSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222871939 568529232 /nfs/dbraw/zinc/52/92/32/568529232.db2.gz PQSVSLRHFFGBOA-GOTSBHOMSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222871998 568529251 /nfs/dbraw/zinc/52/92/51/568529251.db2.gz PQSVSLRHFFGBOA-PKTZIBPZSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222872050 568529198 /nfs/dbraw/zinc/52/91/98/568529198.db2.gz PQSVSLRHFFGBOA-XZOQPEGZSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222872113 568529235 /nfs/dbraw/zinc/52/92/35/568529235.db2.gz PQSVSLRHFFGBOA-DHIUTWEWSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222872198 568529236 /nfs/dbraw/zinc/52/92/36/568529236.db2.gz SUAXAIZCKVSPDY-GOTSBHOMSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222872255 568529257 /nfs/dbraw/zinc/52/92/57/568529257.db2.gz SUAXAIZCKVSPDY-PKTZIBPZSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222872319 568529179 /nfs/dbraw/zinc/52/91/79/568529179.db2.gz SUAXAIZCKVSPDY-XZOQPEGZSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222872384 568529218 /nfs/dbraw/zinc/52/92/18/568529218.db2.gz SUAXAIZCKVSPDY-DHIUTWEWSA-N 0 0 404.583 5.180 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2CC)c1C ZINC000222872754 568529207 /nfs/dbraw/zinc/52/92/07/568529207.db2.gz MKDQZFHSXNPYNE-ZEQRLZLVSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2CC)c1C ZINC000222872811 568529247 /nfs/dbraw/zinc/52/92/47/568529247.db2.gz MKDQZFHSXNPYNE-RPWUZVMVSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2CC)c1C ZINC000222872874 568529193 /nfs/dbraw/zinc/52/91/93/568529193.db2.gz MKDQZFHSXNPYNE-BJKOFHAPSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2CC)c1C ZINC000222872929 568529254 /nfs/dbraw/zinc/52/92/54/568529254.db2.gz MKDQZFHSXNPYNE-DNQXCXABSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(CC)cc2)c1C ZINC000222873006 568529205 /nfs/dbraw/zinc/52/92/05/568529205.db2.gz UMOWAMYMVNMLNA-ZEQRLZLVSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(CC)cc2)c1C ZINC000222873050 568529180 /nfs/dbraw/zinc/52/91/80/568529180.db2.gz UMOWAMYMVNMLNA-RPWUZVMVSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(CC)cc2)c1C ZINC000222873103 568529243 /nfs/dbraw/zinc/52/92/43/568529243.db2.gz UMOWAMYMVNMLNA-BJKOFHAPSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(CC)cc2)c1C ZINC000222873170 568529240 /nfs/dbraw/zinc/52/92/40/568529240.db2.gz UMOWAMYMVNMLNA-DNQXCXABSA-N 0 0 418.610 5.434 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222873253 568529225 /nfs/dbraw/zinc/52/92/25/568529225.db2.gz RZNYXVNBKXQLRE-VXKWHMMOSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222873313 568529242 /nfs/dbraw/zinc/52/92/42/568529242.db2.gz RZNYXVNBKXQLRE-YADHBBJMSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222873376 568529241 /nfs/dbraw/zinc/52/92/41/568529241.db2.gz RZNYXVNBKXQLRE-FCHUYYIVSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222873428 568529200 /nfs/dbraw/zinc/52/92/00/568529200.db2.gz RZNYXVNBKXQLRE-FGZHOGPDSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222873525 568529203 /nfs/dbraw/zinc/52/92/03/568529203.db2.gz WVVGASUYCOVHCX-VXKWHMMOSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222873582 568529245 /nfs/dbraw/zinc/52/92/45/568529245.db2.gz WVVGASUYCOVHCX-YADHBBJMSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222873638 568529221 /nfs/dbraw/zinc/52/92/21/568529221.db2.gz WVVGASUYCOVHCX-FCHUYYIVSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222873694 568529252 /nfs/dbraw/zinc/52/92/52/568529252.db2.gz WVVGASUYCOVHCX-FGZHOGPDSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222873783 568529244 /nfs/dbraw/zinc/52/92/44/568529244.db2.gz CYYWOKDUYHPIMB-VXKWHMMOSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222873836 568529216 /nfs/dbraw/zinc/52/92/16/568529216.db2.gz CYYWOKDUYHPIMB-YADHBBJMSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222873897 568529255 /nfs/dbraw/zinc/52/92/55/568529255.db2.gz CYYWOKDUYHPIMB-FCHUYYIVSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222873966 568529211 /nfs/dbraw/zinc/52/92/11/568529211.db2.gz CYYWOKDUYHPIMB-FGZHOGPDSA-N 0 0 408.546 5.011 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222879008 568529373 /nfs/dbraw/zinc/52/93/73/568529373.db2.gz YFHNWRUXIWYWRG-ZEQRLZLVSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222879066 568529318 /nfs/dbraw/zinc/52/93/18/568529318.db2.gz YFHNWRUXIWYWRG-RPWUZVMVSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222879125 568529296 /nfs/dbraw/zinc/52/92/96/568529296.db2.gz YFHNWRUXIWYWRG-BJKOFHAPSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2C)c1C ZINC000222879187 568529344 /nfs/dbraw/zinc/52/93/44/568529344.db2.gz YFHNWRUXIWYWRG-DNQXCXABSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222879266 568529329 /nfs/dbraw/zinc/52/93/29/568529329.db2.gz SOJQTZBVQNDUJW-ZEQRLZLVSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222879321 568529447 /nfs/dbraw/zinc/52/94/47/568529447.db2.gz SOJQTZBVQNDUJW-RPWUZVMVSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222879386 568529467 /nfs/dbraw/zinc/52/94/67/568529467.db2.gz SOJQTZBVQNDUJW-BJKOFHAPSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000222879452 568529401 /nfs/dbraw/zinc/52/94/01/568529401.db2.gz SOJQTZBVQNDUJW-DNQXCXABSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222879539 568529463 /nfs/dbraw/zinc/52/94/63/568529463.db2.gz PBQBPOKTXVCCCF-UPVQGACJSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222879590 568529451 /nfs/dbraw/zinc/52/94/51/568529451.db2.gz PBQBPOKTXVCCCF-VWNXMTODSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222879653 568529390 /nfs/dbraw/zinc/52/93/90/568529390.db2.gz PBQBPOKTXVCCCF-LADGPHEKSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000222879727 568529411 /nfs/dbraw/zinc/52/94/11/568529411.db2.gz PBQBPOKTXVCCCF-ISKFKSNPSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222879815 568529436 /nfs/dbraw/zinc/52/94/36/568529436.db2.gz QTFROVROSSTUEU-ZEQRLZLVSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222879887 568529395 /nfs/dbraw/zinc/52/93/95/568529395.db2.gz QTFROVROSSTUEU-RPWUZVMVSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222879948 568529443 /nfs/dbraw/zinc/52/94/43/568529443.db2.gz QTFROVROSSTUEU-BJKOFHAPSA-N 0 0 418.610 5.488 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cc(C)cc(C)c2)c1C ZINC000222879998 568529387 /nfs/dbraw/zinc/52/93/87/568529387.db2.gz QTFROVROSSTUEU-DNQXCXABSA-N 0 0 418.610 5.488 40 10 HKCBRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000222898223 568530125 /nfs/dbraw/zinc/53/01/25/568530125.db2.gz IZEFOCVARDOVBR-CPJSRVTESA-N 0 0 408.586 5.520 40 10 HKCBRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000222898287 568530114 /nfs/dbraw/zinc/53/01/14/568530114.db2.gz IZEFOCVARDOVBR-NBGIEHNGSA-N 0 0 408.586 5.520 40 10 HKCBRN CCc1ccc(O[C@@H](CC)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000222898338 568530077 /nfs/dbraw/zinc/53/00/77/568530077.db2.gz IZEFOCVARDOVBR-NLFFAJNJSA-N 0 0 408.586 5.520 40 10 HKCBRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000222898398 568530094 /nfs/dbraw/zinc/53/00/94/568530094.db2.gz IZEFOCVARDOVBR-CJFMBICVSA-N 0 0 408.586 5.520 40 10 HKCBRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1 ZINC000222898472 568530117 /nfs/dbraw/zinc/53/01/17/568530117.db2.gz KHIHZTNPVJPQGC-RNHFSVANSA-N 0 0 408.586 5.520 40 10 HKCBRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1 ZINC000222898529 568530130 /nfs/dbraw/zinc/53/01/30/568530130.db2.gz KHIHZTNPVJPQGC-OHUGHZGNSA-N 0 0 408.586 5.520 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@@H](c4ccccn4)NC(=S)N3CC(C)C)cc21 ZINC000222907503 568530387 /nfs/dbraw/zinc/53/03/87/568530387.db2.gz VBWPSUMULGCJGI-DHIUTWEWSA-N 0 0 420.626 5.342 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1 ZINC000222917081 568530671 /nfs/dbraw/zinc/53/06/71/568530671.db2.gz GOMRKTPBKPDDSO-DHIUTWEWSA-N 0 0 404.583 5.118 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1 ZINC000222917145 568530678 /nfs/dbraw/zinc/53/06/78/568530678.db2.gz GOMRKTPBKPDDSO-PKTZIBPZSA-N 0 0 404.583 5.118 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1 ZINC000222917210 568530679 /nfs/dbraw/zinc/53/06/79/568530679.db2.gz GOMRKTPBKPDDSO-XZOQPEGZSA-N 0 0 404.583 5.118 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1 ZINC000222917257 568530645 /nfs/dbraw/zinc/53/06/45/568530645.db2.gz GOMRKTPBKPDDSO-GOTSBHOMSA-N 0 0 404.583 5.118 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1C ZINC000222917344 568530638 /nfs/dbraw/zinc/53/06/38/568530638.db2.gz XXJMYLKUHLRPLO-DNQXCXABSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1C ZINC000222917400 568530664 /nfs/dbraw/zinc/53/06/64/568530664.db2.gz XXJMYLKUHLRPLO-RPWUZVMVSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1C ZINC000222917478 568530636 /nfs/dbraw/zinc/53/06/36/568530636.db2.gz XXJMYLKUHLRPLO-BJKOFHAPSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1C ZINC000222917544 568530674 /nfs/dbraw/zinc/53/06/74/568530674.db2.gz XXJMYLKUHLRPLO-ZEQRLZLVSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(C)c1 ZINC000222917622 568530675 /nfs/dbraw/zinc/53/06/75/568530675.db2.gz WJWOPTCKRPDJOI-DNQXCXABSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(C)c1 ZINC000222917686 568530787 /nfs/dbraw/zinc/53/07/87/568530787.db2.gz WJWOPTCKRPDJOI-RPWUZVMVSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(C)c1 ZINC000222917741 568530774 /nfs/dbraw/zinc/53/07/74/568530774.db2.gz WJWOPTCKRPDJOI-BJKOFHAPSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(C)c1 ZINC000222917797 568530750 /nfs/dbraw/zinc/53/07/50/568530750.db2.gz WJWOPTCKRPDJOI-ZEQRLZLVSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222917873 568530762 /nfs/dbraw/zinc/53/07/62/568530762.db2.gz RDWODLQVHXHLJF-DNQXCXABSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222917939 568530795 /nfs/dbraw/zinc/53/07/95/568530795.db2.gz RDWODLQVHXHLJF-RPWUZVMVSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222917999 568530770 /nfs/dbraw/zinc/53/07/70/568530770.db2.gz RDWODLQVHXHLJF-BJKOFHAPSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(C)cc1 ZINC000222918068 568530785 /nfs/dbraw/zinc/53/07/85/568530785.db2.gz RDWODLQVHXHLJF-ZEQRLZLVSA-N 0 0 418.610 5.426 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1F ZINC000222918908 568530799 /nfs/dbraw/zinc/53/07/99/568530799.db2.gz AZVKWNJTFFYCTK-DHIUTWEWSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1F ZINC000222918974 568530756 /nfs/dbraw/zinc/53/07/56/568530756.db2.gz AZVKWNJTFFYCTK-PKTZIBPZSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1F ZINC000222919029 568530792 /nfs/dbraw/zinc/53/07/92/568530792.db2.gz AZVKWNJTFFYCTK-XZOQPEGZSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccccc1F ZINC000222919091 568530752 /nfs/dbraw/zinc/53/07/52/568530752.db2.gz AZVKWNJTFFYCTK-GOTSBHOMSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(F)c1 ZINC000222919177 568530765 /nfs/dbraw/zinc/53/07/65/568530765.db2.gz XYQVRPJHLCWKGU-DHIUTWEWSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(F)c1 ZINC000222919242 568530793 /nfs/dbraw/zinc/53/07/93/568530793.db2.gz XYQVRPJHLCWKGU-PKTZIBPZSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(F)c1 ZINC000222919297 568530771 /nfs/dbraw/zinc/53/07/71/568530771.db2.gz XYQVRPJHLCWKGU-XZOQPEGZSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1cccc(F)c1 ZINC000222919348 568530766 /nfs/dbraw/zinc/53/07/66/568530766.db2.gz XYQVRPJHLCWKGU-GOTSBHOMSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222919433 568530797 /nfs/dbraw/zinc/53/07/97/568530797.db2.gz ILDWPUAPHWZGEB-DHIUTWEWSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222919495 568530753 /nfs/dbraw/zinc/53/07/53/568530753.db2.gz ILDWPUAPHWZGEB-PKTZIBPZSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222919564 568530916 /nfs/dbraw/zinc/53/09/16/568530916.db2.gz ILDWPUAPHWZGEB-XZOQPEGZSA-N 0 0 422.573 5.257 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CC(C)C)c(C)n1-c1ccc(F)cc1 ZINC000222919631 568530899 /nfs/dbraw/zinc/53/08/99/568530899.db2.gz ILDWPUAPHWZGEB-GOTSBHOMSA-N 0 0 422.573 5.257 40 10 HKCBRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000222931388 568531380 /nfs/dbraw/zinc/53/13/80/568531380.db2.gz XOMCHCYQHAIAGO-XMMPIXPASA-N 0 0 408.586 5.448 40 10 HKCBRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000222931444 568531388 /nfs/dbraw/zinc/53/13/88/568531388.db2.gz XOMCHCYQHAIAGO-DEOSSOPVSA-N 0 0 408.586 5.448 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000222952056 568532131 /nfs/dbraw/zinc/53/21/31/568532131.db2.gz NKBTXIPXNDDOCO-GOTSBHOMSA-N 0 0 420.626 5.486 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000222952126 568532118 /nfs/dbraw/zinc/53/21/18/568532118.db2.gz NKBTXIPXNDDOCO-PKTZIBPZSA-N 0 0 420.626 5.486 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2)c1C ZINC000222961777 568532492 /nfs/dbraw/zinc/53/24/92/568532492.db2.gz GCJAGVKSFZRQGM-GOTSBHOMSA-N 0 0 404.583 5.262 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2)c1C ZINC000222961834 568532405 /nfs/dbraw/zinc/53/24/05/568532405.db2.gz GCJAGVKSFZRQGM-PKTZIBPZSA-N 0 0 404.583 5.262 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2)c1C ZINC000222961900 568532399 /nfs/dbraw/zinc/53/23/99/568532399.db2.gz GCJAGVKSFZRQGM-XZOQPEGZSA-N 0 0 404.583 5.262 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2)c1C ZINC000222961962 568532433 /nfs/dbraw/zinc/53/24/33/568532433.db2.gz GCJAGVKSFZRQGM-DHIUTWEWSA-N 0 0 404.583 5.262 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222962055 568532501 /nfs/dbraw/zinc/53/25/01/568532501.db2.gz RPKWSSOCZAQEAS-ZEQRLZLVSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222962119 568532494 /nfs/dbraw/zinc/53/24/94/568532494.db2.gz RPKWSSOCZAQEAS-RPWUZVMVSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222962183 568532427 /nfs/dbraw/zinc/53/24/27/568532427.db2.gz RPKWSSOCZAQEAS-BJKOFHAPSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2C)c1C ZINC000222962244 568532465 /nfs/dbraw/zinc/53/24/65/568532465.db2.gz RPKWSSOCZAQEAS-DNQXCXABSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222962347 568532428 /nfs/dbraw/zinc/53/24/28/568532428.db2.gz YPXNHYAZQIUJMC-ZEQRLZLVSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222962416 568532403 /nfs/dbraw/zinc/53/24/03/568532403.db2.gz YPXNHYAZQIUJMC-RPWUZVMVSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222962473 568532411 /nfs/dbraw/zinc/53/24/11/568532411.db2.gz YPXNHYAZQIUJMC-BJKOFHAPSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(C)c2)c1C ZINC000222962538 568532488 /nfs/dbraw/zinc/53/24/88/568532488.db2.gz YPXNHYAZQIUJMC-DNQXCXABSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222962629 568532480 /nfs/dbraw/zinc/53/24/80/568532480.db2.gz PUYMIALOKNTGQW-ZEQRLZLVSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222962695 568532443 /nfs/dbraw/zinc/53/24/43/568532443.db2.gz PUYMIALOKNTGQW-RPWUZVMVSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222962756 568532461 /nfs/dbraw/zinc/53/24/61/568532461.db2.gz PUYMIALOKNTGQW-BJKOFHAPSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(C)cc2)c1C ZINC000222962814 568532463 /nfs/dbraw/zinc/53/24/63/568532463.db2.gz PUYMIALOKNTGQW-DNQXCXABSA-N 0 0 418.610 5.570 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222963706 568532439 /nfs/dbraw/zinc/53/24/39/568532439.db2.gz CABLTWDEOVAPOH-GOTSBHOMSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222963751 568532451 /nfs/dbraw/zinc/53/24/51/568532451.db2.gz CABLTWDEOVAPOH-PKTZIBPZSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222963805 568532496 /nfs/dbraw/zinc/53/24/96/568532496.db2.gz CABLTWDEOVAPOH-XZOQPEGZSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccccc2F)c1C ZINC000222963872 568532473 /nfs/dbraw/zinc/53/24/73/568532473.db2.gz CABLTWDEOVAPOH-DHIUTWEWSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222963959 568532498 /nfs/dbraw/zinc/53/24/98/568532498.db2.gz WLEMCBRRGXANDF-GOTSBHOMSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222964018 568532457 /nfs/dbraw/zinc/53/24/57/568532457.db2.gz WLEMCBRRGXANDF-PKTZIBPZSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222964075 568532415 /nfs/dbraw/zinc/53/24/15/568532415.db2.gz WLEMCBRRGXANDF-XZOQPEGZSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2cccc(F)c2)c1C ZINC000222964143 568532448 /nfs/dbraw/zinc/53/24/48/568532448.db2.gz WLEMCBRRGXANDF-DHIUTWEWSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222964223 568532407 /nfs/dbraw/zinc/53/24/07/568532407.db2.gz ZSTMKSZYOATOFM-GOTSBHOMSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222964288 568532522 /nfs/dbraw/zinc/53/25/22/568532522.db2.gz ZSTMKSZYOATOFM-PKTZIBPZSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222964346 568532558 /nfs/dbraw/zinc/53/25/58/568532558.db2.gz ZSTMKSZYOATOFM-XZOQPEGZSA-N 0 0 422.573 5.401 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cc(C)n(-c2ccc(F)cc2)c1C ZINC000222964403 568532512 /nfs/dbraw/zinc/53/25/12/568532512.db2.gz ZSTMKSZYOATOFM-DHIUTWEWSA-N 0 0 422.573 5.401 40 10 HKCBRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222970264 568532617 /nfs/dbraw/zinc/53/26/17/568532617.db2.gz KHILJFMITDYXFA-XUZZJYLKSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222970338 568532622 /nfs/dbraw/zinc/53/26/22/568532622.db2.gz KHILJFMITDYXFA-URXFXBBRSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222970392 568532696 /nfs/dbraw/zinc/53/26/96/568532696.db2.gz KHILJFMITDYXFA-ZJSXRUAMSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222970441 568532673 /nfs/dbraw/zinc/53/26/73/568532673.db2.gz KHILJFMITDYXFA-QPPBQGQZSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222970525 568532639 /nfs/dbraw/zinc/53/26/39/568532639.db2.gz LQYOJZCCCQWQCW-NHCICSSKSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222970601 568532643 /nfs/dbraw/zinc/53/26/43/568532643.db2.gz LQYOJZCCCQWQCW-IZIIKQMZSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222999332 568533839 /nfs/dbraw/zinc/53/38/39/568533839.db2.gz KQUYSTBUHNXSPW-SQJMNOBHSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222999391 568533828 /nfs/dbraw/zinc/53/38/28/568533828.db2.gz KQUYSTBUHNXSPW-OFVILXPXSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222999449 568533826 /nfs/dbraw/zinc/53/38/26/568533826.db2.gz KQUYSTBUHNXSPW-PXDATVDWSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000222999503 568533838 /nfs/dbraw/zinc/53/38/38/568533838.db2.gz KQUYSTBUHNXSPW-BWKNWUBXSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222999602 568533854 /nfs/dbraw/zinc/53/38/54/568533854.db2.gz WCIYSNIEFKPJSW-DHTSOJEISA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000222999661 568533878 /nfs/dbraw/zinc/53/38/78/568533878.db2.gz WCIYSNIEFKPJSW-QLWBXOBMSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000223027149 568534700 /nfs/dbraw/zinc/53/47/00/568534700.db2.gz AJQSOKMZALOIEA-JOCHJYFZSA-N 0 0 400.950 5.113 40 10 HKCBRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000223027203 568534680 /nfs/dbraw/zinc/53/46/80/568534680.db2.gz AJQSOKMZALOIEA-QFIPXVFZSA-N 0 0 400.950 5.113 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000223109150 568537875 /nfs/dbraw/zinc/53/78/75/568537875.db2.gz BQPNIUMGQFJIMH-SFTDATJTSA-N 0 0 408.586 5.753 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000223109208 568537850 /nfs/dbraw/zinc/53/78/50/568537850.db2.gz BQPNIUMGQFJIMH-LEWJYISDSA-N 0 0 408.586 5.753 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000223109265 568537897 /nfs/dbraw/zinc/53/78/97/568537897.db2.gz BQPNIUMGQFJIMH-RTWAWAEBSA-N 0 0 408.586 5.753 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCCCC3)cc2)c1 ZINC000223109319 568537907 /nfs/dbraw/zinc/53/79/07/568537907.db2.gz BQPNIUMGQFJIMH-NHCUHLMSSA-N 0 0 408.586 5.753 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C2CCCCC2)n1-c1ccccc1 ZINC000223120739 568538255 /nfs/dbraw/zinc/53/82/55/568538255.db2.gz IMGYNFCXENWGAN-DNQXCXABSA-N 0 0 416.594 5.486 40 10 HKCBRN Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C2CCCCC2)n1-c1ccccc1 ZINC000223120814 568538246 /nfs/dbraw/zinc/53/82/46/568538246.db2.gz IMGYNFCXENWGAN-RPWUZVMVSA-N 0 0 416.594 5.486 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C2CCCCC2)n1-c1ccccc1 ZINC000223120868 568538229 /nfs/dbraw/zinc/53/82/29/568538229.db2.gz IMGYNFCXENWGAN-BJKOFHAPSA-N 0 0 416.594 5.486 40 10 HKCBRN Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2C2CCCCC2)n1-c1ccccc1 ZINC000223120922 568538382 /nfs/dbraw/zinc/53/83/82/568538382.db2.gz IMGYNFCXENWGAN-ZEQRLZLVSA-N 0 0 416.594 5.486 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000223146935 568539508 /nfs/dbraw/zinc/53/95/08/568539508.db2.gz BLZRQRVXVDSTCG-NJDAHSKKSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000223146997 568539512 /nfs/dbraw/zinc/53/95/12/568539512.db2.gz BLZRQRVXVDSTCG-QHAWAJNXSA-N 0 0 420.597 5.446 40 10 HKCBRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1Cl ZINC000223361932 568546394 /nfs/dbraw/zinc/54/63/94/568546394.db2.gz WBTIEZWPFNBDOD-KRWDZBQOSA-N 0 0 400.950 5.466 40 10 HKCBRN CCOc1ccc(C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1Cl ZINC000223361987 568546396 /nfs/dbraw/zinc/54/63/96/568546396.db2.gz WBTIEZWPFNBDOD-QGZVFWFLSA-N 0 0 400.950 5.466 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2Cc2ccccc2)n1-c1ccccc1 ZINC000223404696 568547623 /nfs/dbraw/zinc/54/76/23/568547623.db2.gz SFWBVTRTGDANCK-JWQCQUIFSA-N 0 0 424.573 5.353 40 10 HKCBRN Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2Cc2ccccc2)n1-c1ccccc1 ZINC000223404755 568547647 /nfs/dbraw/zinc/54/76/47/568547647.db2.gz SFWBVTRTGDANCK-RPBOFIJWSA-N 0 0 424.573 5.353 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2Cc2ccccc2)n1-c1ccccc1 ZINC000223404799 568547648 /nfs/dbraw/zinc/54/76/48/568547648.db2.gz SFWBVTRTGDANCK-LOSJGSFVSA-N 0 0 424.573 5.353 40 10 HKCBRN Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2Cc2ccccc2)n1-c1ccccc1 ZINC000223404858 568547626 /nfs/dbraw/zinc/54/76/26/568547626.db2.gz SFWBVTRTGDANCK-DQEYMECFSA-N 0 0 424.573 5.353 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=O)CSCc3ccc(Cl)cc3F)cc2)C1 ZINC000223457998 568549410 /nfs/dbraw/zinc/54/94/10/568549410.db2.gz ZQJQQZSUSQPILL-MRXNPFEDSA-N 0 0 420.981 5.265 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=O)CSCc3ccc(Cl)cc3F)cc2)C1 ZINC000223458058 568549386 /nfs/dbraw/zinc/54/93/86/568549386.db2.gz ZQJQQZSUSQPILL-INIZCTEOSA-N 0 0 420.981 5.265 40 10 HKCBRN CC1=CC(C)(C)N(C(C)C)c2ccc(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc21 ZINC000223492775 568550371 /nfs/dbraw/zinc/55/03/71/568550371.db2.gz XLAKDFVXCSKRQQ-HMAPJEAMSA-N 0 0 418.562 6.338 40 10 HKCBRN CC1=CC(C)(C)N(C(C)C)c2ccc(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc21 ZINC000223495513 568550510 /nfs/dbraw/zinc/55/05/10/568550510.db2.gz LCINHWPYZHMQAE-HMAPJEAMSA-N 0 0 415.537 5.190 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2c(cc1C)N(C(C)C)C(C)(C)C=C2C ZINC000223508962 568550680 /nfs/dbraw/zinc/55/06/80/568550680.db2.gz JZOZMIWPNKOUPV-BUVRLJJBSA-N 0 0 413.565 6.211 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223538870 568551143 /nfs/dbraw/zinc/55/11/43/568551143.db2.gz GTDMEDRTSVGIPJ-AKGOGDBKSA-N 0 0 406.551 6.040 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223538925 568551171 /nfs/dbraw/zinc/55/11/71/568551171.db2.gz GEJDGYNSGOCFOI-AKGOGDBKSA-N 0 0 422.619 6.205 40 10 HKCBRN CCN1c2ccc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223539305 568551153 /nfs/dbraw/zinc/55/11/53/568551153.db2.gz UBWMQZLUXPENRG-CPEHUTGBSA-N 0 0 420.578 6.035 40 10 HKCBRN CCN1c2ccc(/C=C3\NC(=O)N(Cc4ccc(F)cc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223540768 568551299 /nfs/dbraw/zinc/55/12/99/568551299.db2.gz WCZNYLNFLINVRB-JHDSZEHQSA-N 0 0 421.516 5.031 40 10 HKCBRN CCN1c2ccc(/C=C3\NC(=O)N(Cc4ccccc4F)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223540825 568551308 /nfs/dbraw/zinc/55/13/08/568551308.db2.gz USYXBNNGGAIXAV-JHDSZEHQSA-N 0 0 421.516 5.031 40 10 HKCBRN CCN1c2ccc(/C=C3\NC(=O)N(Cc4ccc(C)cc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223540892 568551285 /nfs/dbraw/zinc/55/12/85/568551285.db2.gz ZDURPROKXHFEMB-GFHXCNCHSA-N 0 0 417.553 5.200 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc2c(c1)[C@@H](C)CC(C)(C)N2C(C)C ZINC000223550922 568551508 /nfs/dbraw/zinc/55/15/08/568551508.db2.gz OKVXBPXHIQXDRJ-FSTGKYBXSA-N 0 0 401.554 5.993 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc2c(c1)[C@H](C)CC(C)(C)N2C(C)C ZINC000223550983 568551490 /nfs/dbraw/zinc/55/14/90/568551490.db2.gz OKVXBPXHIQXDRJ-MMTNMYCKSA-N 0 0 401.554 5.993 40 10 HKCBRN CC(C)N1c2ccc(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223564480 568551824 /nfs/dbraw/zinc/55/18/24/568551824.db2.gz KHVLMFOIWLIRMF-CPEHUTGBSA-N 0 0 420.578 6.428 40 10 HKCBRN CC(C)N1c2ccc(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223567900 568551970 /nfs/dbraw/zinc/55/19/70/568551970.db2.gz IBQLXVGPZCCWLH-GFHXCNCHSA-N 0 0 417.553 5.280 40 10 HKCBRN CCN1c2cc(C)c(/C=C3/C(=O)N(c4ccccc4)N=C3C)cc2[C@@H](C)CC1(C)C ZINC000223577712 568552169 /nfs/dbraw/zinc/55/21/69/568552169.db2.gz SKZIVVSCGUCSKS-FSTGKYBXSA-N 0 0 401.554 5.913 40 10 HKCBRN CCN1c2cc(C)c(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223584577 568552404 /nfs/dbraw/zinc/55/24/04/568552404.db2.gz AMMLOZUKYZXUKN-CPEHUTGBSA-N 0 0 420.578 6.348 40 10 HKCBRN CCN1c2cc(C)c(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223586365 568552440 /nfs/dbraw/zinc/55/24/40/568552440.db2.gz KOEJRTSIBRUHDV-GFHXCNCHSA-N 0 0 417.553 5.200 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2c(cc1C)N(C(C)C)C(C)(C)C[C@@H]2C ZINC000223599986 568552980 /nfs/dbraw/zinc/55/29/80/568552980.db2.gz SWCMXFJRWXHQSR-WWJLXRQJSA-N 0 0 415.581 6.302 40 10 HKCBRN O=C(CSCc1ccc(Cl)cc1F)NCc1ccc(N2CCCCC2)cc1 ZINC000223603836 568553114 /nfs/dbraw/zinc/55/31/14/568553114.db2.gz AVNXCZXDSLDSAC-UHFFFAOYSA-N 0 0 406.954 5.019 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(C(C)C)C1=O)[C@@H](C)CC(C)(C)N2C(C)C ZINC000223613766 568553400 /nfs/dbraw/zinc/55/34/00/568553400.db2.gz KKMCPHPOQVLXJL-VBNMEBLOSA-N 0 0 400.588 5.940 40 10 HKCBRN Cc1cc2c(cc1/C=C1\SC(=O)N(C(C)C)C1=O)[C@H](C)CC(C)(C)N2C(C)C ZINC000223613824 568553425 /nfs/dbraw/zinc/55/34/25/568553425.db2.gz KKMCPHPOQVLXJL-IWEBCOIVSA-N 0 0 400.588 5.940 40 10 HKCBRN CCCN1C(=O)S/C(=C\c2cc3c(cc2C)N(C(C)C)C(C)(C)C[C@@H]3C)C1=O ZINC000223614155 568553388 /nfs/dbraw/zinc/55/33/88/568553388.db2.gz GSDBNEDTONWACY-DEFALTHMSA-N 0 0 400.588 5.942 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)CSCc2ccc(Cl)c(Cl)c2)cc1 ZINC000223619723 568553456 /nfs/dbraw/zinc/55/34/56/568553456.db2.gz AIYVJFZAYOXBIR-UHFFFAOYSA-N 0 0 411.398 5.389 40 10 HKCBRN Cc1ccc(C(C)C)c(OCC(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000223623882 568553746 /nfs/dbraw/zinc/55/37/46/568553746.db2.gz MDGONIQGKBBSMH-RTWAWAEBSA-N 0 0 408.586 5.611 40 10 HKCBRN Cc1ccc(C(C)C)c(OCC(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000223623939 568553761 /nfs/dbraw/zinc/55/37/61/568553761.db2.gz MDGONIQGKBBSMH-NHCUHLMSSA-N 0 0 408.586 5.611 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)/C(=C/c2ccc(OC)cc2)c2ccccc2)cc1 ZINC000223715067 568557194 /nfs/dbraw/zinc/55/71/94/568557194.db2.gz QHJMXIBHVAYYIP-LGUFXXKBSA-N 0 0 414.549 5.398 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)c2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000223727226 568557515 /nfs/dbraw/zinc/55/75/15/568557515.db2.gz HATCSJJMRBHPCT-UHFFFAOYSA-N 0 0 422.956 5.695 40 10 HKCBRN S=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc(Sc2ccccc2)nc1 ZINC000223953350 568564264 /nfs/dbraw/zinc/56/42/64/568564264.db2.gz RPMVSTFEEQVNKO-UHFFFAOYSA-N 0 0 420.607 5.320 40 10 HKCBRN Cc1ccccc1Nc1ccc(NC(=S)NCc2ccc(N3CCCC3)cc2)cn1 ZINC000223953752 568564273 /nfs/dbraw/zinc/56/42/73/568564273.db2.gz BIDOTVBNHRTCAX-UHFFFAOYSA-N 0 0 417.582 5.220 40 10 HKCBRN Cc1cccc(Nc2ccc(NC(=S)NCc3ccc(N4CCCC4)cc3)cn2)c1 ZINC000223953831 568564338 /nfs/dbraw/zinc/56/43/38/568564338.db2.gz DDWXGDZIHZADRS-UHFFFAOYSA-N 0 0 417.582 5.220 40 10 HKCBRN Cc1ccc(Nc2ccc(NC(=S)NCc3ccc(N4CCCC4)cc3)cn2)cc1 ZINC000223953894 568564423 /nfs/dbraw/zinc/56/44/23/568564423.db2.gz BDLRLWYXFJPZKQ-UHFFFAOYSA-N 0 0 417.582 5.220 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000224038469 568567299 /nfs/dbraw/zinc/56/72/99/568567299.db2.gz XMYFZVHSFLBGFI-RTWAWAEBSA-N 0 0 408.586 5.438 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCc2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000224038527 568567301 /nfs/dbraw/zinc/56/73/01/568567301.db2.gz XMYFZVHSFLBGFI-NHCUHLMSSA-N 0 0 408.586 5.438 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc2c(c1)CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000224087598 568569330 /nfs/dbraw/zinc/56/93/30/568569330.db2.gz KCTNIQAWZWJRBP-HXUWFJFHSA-N 0 0 406.570 5.058 40 10 HKCBRN C[C@H](NC(=O)COc1ccc2c(c1)CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000224087646 568569399 /nfs/dbraw/zinc/56/93/99/568569399.db2.gz KCTNIQAWZWJRBP-FQEVSTJZSA-N 0 0 406.570 5.058 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000224109692 568570270 /nfs/dbraw/zinc/57/02/70/568570270.db2.gz LJENCWGTVONQRJ-HXUWFJFHSA-N 0 0 406.570 5.058 40 10 HKCBRN C[C@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000224109740 568570345 /nfs/dbraw/zinc/57/03/45/568570345.db2.gz LJENCWGTVONQRJ-FQEVSTJZSA-N 0 0 406.570 5.058 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2c2ccccc2)c(C)n1-c1ccccc1 ZINC000224163270 568572030 /nfs/dbraw/zinc/57/20/30/568572030.db2.gz QIVSRYWLTMLBIZ-JWQCQUIFSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2c2ccccc2)c(C)n1-c1ccccc1 ZINC000224163328 568572121 /nfs/dbraw/zinc/57/21/21/568572121.db2.gz QIVSRYWLTMLBIZ-RPBOFIJWSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2c2ccccc2)c(C)n1-c1ccccc1 ZINC000224163386 568572125 /nfs/dbraw/zinc/57/21/25/568572125.db2.gz QIVSRYWLTMLBIZ-LOSJGSFVSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2c2ccccc2)c(C)n1-c1ccccc1 ZINC000224163439 568572036 /nfs/dbraw/zinc/57/20/36/568572036.db2.gz QIVSRYWLTMLBIZ-DQEYMECFSA-N 0 0 424.573 5.666 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000224170209 568572402 /nfs/dbraw/zinc/57/24/02/568572402.db2.gz VASJVZNXTWZASI-WOJBJXKFSA-N 0 0 406.570 5.200 40 10 HKCBRN C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000224170251 568572391 /nfs/dbraw/zinc/57/23/91/568572391.db2.gz VASJVZNXTWZASI-VQTJNVASSA-N 0 0 406.570 5.200 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000224170307 568572369 /nfs/dbraw/zinc/57/23/69/568572369.db2.gz VASJVZNXTWZASI-UXHICEINSA-N 0 0 406.570 5.200 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000224170361 568572435 /nfs/dbraw/zinc/57/24/35/568572435.db2.gz VASJVZNXTWZASI-PMACEKPBSA-N 0 0 406.570 5.200 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2c2ccccc2)n1-c1ccccc1 ZINC000224186752 568572891 /nfs/dbraw/zinc/57/28/91/568572891.db2.gz MSQVWRRRZASPCC-DNQXCXABSA-N 0 0 410.546 5.358 40 10 HKCBRN Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2c2ccccc2)n1-c1ccccc1 ZINC000224186803 568572973 /nfs/dbraw/zinc/57/29/73/568572973.db2.gz MSQVWRRRZASPCC-RPWUZVMVSA-N 0 0 410.546 5.358 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2c2ccccc2)n1-c1ccccc1 ZINC000224186857 568572963 /nfs/dbraw/zinc/57/29/63/568572963.db2.gz MSQVWRRRZASPCC-BJKOFHAPSA-N 0 0 410.546 5.358 40 10 HKCBRN Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2c2ccccc2)n1-c1ccccc1 ZINC000224186911 568572945 /nfs/dbraw/zinc/57/29/45/568572945.db2.gz MSQVWRRRZASPCC-ZEQRLZLVSA-N 0 0 410.546 5.358 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2c2ccc(C)cc2)n1-c1ccccc1 ZINC000224220088 568574139 /nfs/dbraw/zinc/57/41/39/568574139.db2.gz LEBKWALALXXCQE-JWQCQUIFSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2c2ccc(C)cc2)n1-c1ccccc1 ZINC000224220126 568574110 /nfs/dbraw/zinc/57/41/10/568574110.db2.gz LEBKWALALXXCQE-RPBOFIJWSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2c2ccc(C)cc2)n1-c1ccccc1 ZINC000224220158 568574093 /nfs/dbraw/zinc/57/40/93/568574093.db2.gz LEBKWALALXXCQE-LOSJGSFVSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2c2ccc(C)cc2)n1-c1ccccc1 ZINC000224220208 568574073 /nfs/dbraw/zinc/57/40/73/568574073.db2.gz LEBKWALALXXCQE-DQEYMECFSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2c2cccc(C)c2)n1-c1ccccc1 ZINC000224252813 568575458 /nfs/dbraw/zinc/57/54/58/568575458.db2.gz CSJIHKDGLLQXGO-JWQCQUIFSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2c2cccc(C)c2)n1-c1ccccc1 ZINC000224252858 568575442 /nfs/dbraw/zinc/57/54/42/568575442.db2.gz CSJIHKDGLLQXGO-RPBOFIJWSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2c2cccc(C)c2)n1-c1ccccc1 ZINC000224252896 568575423 /nfs/dbraw/zinc/57/54/23/568575423.db2.gz CSJIHKDGLLQXGO-LOSJGSFVSA-N 0 0 424.573 5.666 40 10 HKCBRN Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2c2cccc(C)c2)n1-c1ccccc1 ZINC000224252960 568575450 /nfs/dbraw/zinc/57/54/50/568575450.db2.gz CSJIHKDGLLQXGO-DQEYMECFSA-N 0 0 424.573 5.666 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)CSCc2c(Cl)cccc2Cl)cc1 ZINC000224361710 568579141 /nfs/dbraw/zinc/57/91/41/568579141.db2.gz IGOKKQVNENIABW-UHFFFAOYSA-N 0 0 411.398 5.389 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)c2ccccc2SCc2ccccc2)cc1 ZINC000224435981 568581224 /nfs/dbraw/zinc/58/12/24/568581224.db2.gz QFRRFSAMVDGYAT-UHFFFAOYSA-N 0 0 404.579 5.755 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)CSCc2ccc(Cl)cc2Cl)cc1 ZINC000224479416 568582267 /nfs/dbraw/zinc/58/22/67/568582267.db2.gz JWSMFPVXYCZMSU-UHFFFAOYSA-N 0 0 411.398 5.389 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000224542798 568584372 /nfs/dbraw/zinc/58/43/72/568584372.db2.gz KPVUYZAOHUCWTH-NHCUHLMSSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](Oc1cccc2c1CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCC(C)CC2)cc1 ZINC000224542843 568584445 /nfs/dbraw/zinc/58/44/45/568584445.db2.gz KPVUYZAOHUCWTH-LEWJYISDSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000224542886 568584406 /nfs/dbraw/zinc/58/44/06/568584406.db2.gz KPVUYZAOHUCWTH-RTWAWAEBSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCC(C)CC2)cc1 ZINC000224542936 568584413 /nfs/dbraw/zinc/58/44/13/568584413.db2.gz KPVUYZAOHUCWTH-SFTDATJTSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccc(Cl)cc1F)c1ccc(N2CCCCC2)cc1 ZINC000224595344 568586891 /nfs/dbraw/zinc/58/68/91/568586891.db2.gz ZGQIZSVZXVMNJP-MRXNPFEDSA-N 0 0 420.981 5.580 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccc(Cl)cc1F)c1ccc(N2CCCCC2)cc1 ZINC000224595392 568586893 /nfs/dbraw/zinc/58/68/93/568586893.db2.gz ZGQIZSVZXVMNJP-INIZCTEOSA-N 0 0 420.981 5.580 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000224656800 568590989 /nfs/dbraw/zinc/59/09/89/568590989.db2.gz BUVYZHDFVFTAOP-NJDAHSKKSA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](Oc1cccc2c1CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000224656846 568590927 /nfs/dbraw/zinc/59/09/27/568590927.db2.gz BUVYZHDFVFTAOP-QHAWAJNXSA-N 0 0 420.597 5.446 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000224748958 568594888 /nfs/dbraw/zinc/59/48/88/568594888.db2.gz JDGYTIPZRAGZHA-FSSWDIPSSA-N 0 0 422.613 5.999 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000224749006 568594955 /nfs/dbraw/zinc/59/49/55/568594955.db2.gz JDGYTIPZRAGZHA-BHIFYINESA-N 0 0 422.613 5.999 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)c2ccc(CSc3ccccc3)cc2)cc1 ZINC000224754612 568595361 /nfs/dbraw/zinc/59/53/61/568595361.db2.gz FFVCTOJBELSKBG-UHFFFAOYSA-N 0 0 404.579 5.755 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C2CCCC2)c(C)n1-c1ccccc1 ZINC000225013733 568609295 /nfs/dbraw/zinc/60/92/95/568609295.db2.gz NFXUOPQDHZGKCY-DNQXCXABSA-N 0 0 416.594 5.404 40 10 HKCBRN Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C2CCCC2)c(C)n1-c1ccccc1 ZINC000225013768 568609318 /nfs/dbraw/zinc/60/93/18/568609318.db2.gz NFXUOPQDHZGKCY-RPWUZVMVSA-N 0 0 416.594 5.404 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C2CCCC2)c(C)n1-c1ccccc1 ZINC000225013806 568609223 /nfs/dbraw/zinc/60/92/23/568609223.db2.gz NFXUOPQDHZGKCY-BJKOFHAPSA-N 0 0 416.594 5.404 40 10 HKCBRN Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2C2CCCC2)c(C)n1-c1ccccc1 ZINC000225013844 568609325 /nfs/dbraw/zinc/60/93/25/568609325.db2.gz NFXUOPQDHZGKCY-ZEQRLZLVSA-N 0 0 416.594 5.404 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2C2CCCC2)n1-c1ccccc1 ZINC000225030786 568610168 /nfs/dbraw/zinc/61/01/68/568610168.db2.gz DNZYPCCASDVOGR-DHIUTWEWSA-N 0 0 402.567 5.096 40 10 HKCBRN Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2C2CCCC2)n1-c1ccccc1 ZINC000225030820 568610043 /nfs/dbraw/zinc/61/00/43/568610043.db2.gz DNZYPCCASDVOGR-PKTZIBPZSA-N 0 0 402.567 5.096 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C2CCCC2)n1-c1ccccc1 ZINC000225030855 568610158 /nfs/dbraw/zinc/61/01/58/568610158.db2.gz DNZYPCCASDVOGR-XZOQPEGZSA-N 0 0 402.567 5.096 40 10 HKCBRN Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2C2CCCC2)n1-c1ccccc1 ZINC000225030895 568610096 /nfs/dbraw/zinc/61/00/96/568610096.db2.gz DNZYPCCASDVOGR-GOTSBHOMSA-N 0 0 402.567 5.096 40 10 HKCBRN O=C(NCc1ccc(N2CCCCC2)cc1)c1cc(Br)ccc1Cl ZINC000225073469 568612695 /nfs/dbraw/zinc/61/26/95/568612695.db2.gz APCCRBPZZAHSPO-UHFFFAOYSA-N 0 0 407.739 5.023 40 10 HKCBRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000225101459 568614560 /nfs/dbraw/zinc/61/45/60/568614560.db2.gz DMVZNNZXWVWPKE-RUZDIDTESA-N 0 0 406.570 5.030 40 10 HKCBRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000225101499 568614589 /nfs/dbraw/zinc/61/45/89/568614589.db2.gz DMVZNNZXWVWPKE-VWLOTQADSA-N 0 0 406.570 5.030 40 10 HKCBRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225126596 568615849 /nfs/dbraw/zinc/61/58/49/568615849.db2.gz HDMDHZKAAORQCE-FQRUVTKNSA-N 0 0 420.597 5.276 40 10 HKCBRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)NCc1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225126637 568615923 /nfs/dbraw/zinc/61/59/23/568615923.db2.gz HDMDHZKAAORQCE-IBVKSMDESA-N 0 0 420.597 5.276 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)c2ccc(OCc3ccccc3Cl)cc2)cc1 ZINC000225156599 568618806 /nfs/dbraw/zinc/61/88/06/568618806.db2.gz PQWAFNUCINPEGW-UHFFFAOYSA-N 0 0 422.956 5.695 40 10 HKCBRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1Cl ZINC000225228139 568624706 /nfs/dbraw/zinc/62/47/06/568624706.db2.gz OEMTXQIQUKGOTN-SJORKVTESA-N 0 0 400.950 5.466 40 10 HKCBRN CCOc1ccc(C(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1Cl ZINC000225228179 568624658 /nfs/dbraw/zinc/62/46/58/568624658.db2.gz OEMTXQIQUKGOTN-IAGOWNOFSA-N 0 0 400.950 5.466 40 10 HKCBRN Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H](C)c3ccc(N4CCCCC4)cc3)cc2)n1 ZINC000225292219 568628150 /nfs/dbraw/zinc/62/81/50/568628150.db2.gz NDAJBDXMVRVJDP-NRFANRHFSA-N 0 0 416.569 5.030 40 10 HKCBRN Cc1cc(C)n(Cc2ccc(C(=O)N[C@H](C)c3ccc(N4CCCCC4)cc3)cc2)n1 ZINC000225292253 568628193 /nfs/dbraw/zinc/62/81/93/568628193.db2.gz NDAJBDXMVRVJDP-OAQYLSRUSA-N 0 0 416.569 5.030 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc2c(c1)CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225324293 568629437 /nfs/dbraw/zinc/62/94/37/568629437.db2.gz YYVXBWPFFADGDA-WOJBJXKFSA-N 0 0 406.570 5.058 40 10 HKCBRN C[C@H](NC(=O)COc1ccc2c(c1)CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225324316 568629533 /nfs/dbraw/zinc/62/95/33/568629533.db2.gz YYVXBWPFFADGDA-UXHICEINSA-N 0 0 406.570 5.058 40 10 HKCBRN CC(C)(C)c1ccc(C(=O)c2cccc(NC(=S)NCc3ccccn3)c2)cc1 ZINC000225330175 568629673 /nfs/dbraw/zinc/62/96/73/568629673.db2.gz AEIYSYVGDATJID-UHFFFAOYSA-N 0 0 403.551 5.097 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225336556 568630268 /nfs/dbraw/zinc/63/02/68/568630268.db2.gz BFSJNVBLKBKUCR-QGZVFWFLSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225336593 568630245 /nfs/dbraw/zinc/63/02/45/568630245.db2.gz BFSJNVBLKBKUCR-KRWDZBQOSA-N 0 0 419.396 6.040 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)/C(=C/c2ccccc2Cl)c2ccccc2)cc1 ZINC000225336750 568630151 /nfs/dbraw/zinc/63/01/51/568630151.db2.gz VPTPKQXUYHFMJI-HKOYGPOVSA-N 0 0 418.968 6.043 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCCCC2)cc1 ZINC000225336777 525092091 /nfs/dbraw/zinc/09/20/91/525092091.db2.gz GZDBCOVKAKQWNW-MRXNPFEDSA-N 0 0 405.369 5.794 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCCCC2)cc1 ZINC000225336819 568630136 /nfs/dbraw/zinc/63/01/36/568630136.db2.gz GZDBCOVKAKQWNW-INIZCTEOSA-N 0 0 405.369 5.794 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225336870 525092120 /nfs/dbraw/zinc/09/21/20/525092120.db2.gz FPODJUDWZCCQJD-IAGOWNOFSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225336907 524938523 /nfs/dbraw/zinc/93/85/23/524938523.db2.gz FPODJUDWZCCQJD-SJORKVTESA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=O)CCc3ccc(Cl)c(Cl)c3)cc2)C1 ZINC000225337423 568630303 /nfs/dbraw/zinc/63/03/03/568630303.db2.gz FUVUMXBZNUVLRL-MRXNPFEDSA-N 0 0 405.369 5.479 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=O)CCc3ccc(Cl)c(Cl)c3)cc2)C1 ZINC000225337461 568630127 /nfs/dbraw/zinc/63/01/27/568630127.db2.gz FUVUMXBZNUVLRL-INIZCTEOSA-N 0 0 405.369 5.479 40 10 HKCBRN C[C@@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000225360539 568631374 /nfs/dbraw/zinc/63/13/74/568631374.db2.gz BQWPVBYPMSAMOR-QGZVFWFLSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000225360573 568631336 /nfs/dbraw/zinc/63/13/36/568631336.db2.gz BQWPVBYPMSAMOR-KRWDZBQOSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCCCC2)cc1 ZINC000225360747 568631364 /nfs/dbraw/zinc/63/13/64/568631364.db2.gz OJYNQBOZULMMKY-MRXNPFEDSA-N 0 0 405.369 5.794 40 10 HKCBRN C[C@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCCCC2)cc1 ZINC000225360787 568631413 /nfs/dbraw/zinc/63/14/13/568631413.db2.gz OJYNQBOZULMMKY-INIZCTEOSA-N 0 0 405.369 5.794 40 10 HKCBRN C[C@@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225360840 568631350 /nfs/dbraw/zinc/63/13/50/568631350.db2.gz KQVXARYYIURQBQ-IAGOWNOFSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225360873 568631407 /nfs/dbraw/zinc/63/14/07/568631407.db2.gz KQVXARYYIURQBQ-SJORKVTESA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=O)CCc3c(Cl)cccc3Cl)cc2)C1 ZINC000225361357 568631673 /nfs/dbraw/zinc/63/16/73/568631673.db2.gz VWRUZQAMJZWYIB-MRXNPFEDSA-N 0 0 405.369 5.479 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=O)CCc3c(Cl)cccc3Cl)cc2)C1 ZINC000225361390 568631597 /nfs/dbraw/zinc/63/15/97/568631597.db2.gz VWRUZQAMJZWYIB-INIZCTEOSA-N 0 0 405.369 5.479 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000225377799 568632515 /nfs/dbraw/zinc/63/25/15/568632515.db2.gz YAZVCGOMWQFNAT-QGZVFWFLSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCC(C)CC2)cc1 ZINC000225377834 568632573 /nfs/dbraw/zinc/63/25/73/568632573.db2.gz YAZVCGOMWQFNAT-KRWDZBQOSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCCCC2)cc1 ZINC000225377994 568632563 /nfs/dbraw/zinc/63/25/63/568632563.db2.gz IVQNXWOXRXYWHQ-MRXNPFEDSA-N 0 0 405.369 5.794 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCCCC2)cc1 ZINC000225378021 568632599 /nfs/dbraw/zinc/63/25/99/568632599.db2.gz IVQNXWOXRXYWHQ-INIZCTEOSA-N 0 0 405.369 5.794 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225378061 568632581 /nfs/dbraw/zinc/63/25/81/568632581.db2.gz KBKHQTNOONUUFY-IAGOWNOFSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225378093 568632589 /nfs/dbraw/zinc/63/25/89/568632589.db2.gz KBKHQTNOONUUFY-SJORKVTESA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=O)CCc3ccc(Cl)cc3Cl)cc2)C1 ZINC000225378459 568632569 /nfs/dbraw/zinc/63/25/69/568632569.db2.gz NURYPENQFDVXGL-MRXNPFEDSA-N 0 0 405.369 5.479 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=O)CCc3ccc(Cl)cc3Cl)cc2)C1 ZINC000225378486 568632540 /nfs/dbraw/zinc/63/25/40/568632540.db2.gz NURYPENQFDVXGL-INIZCTEOSA-N 0 0 405.369 5.479 40 10 HKCBRN Cc1cc(NC(=S)NCc2ccc(N3CCCCC3)cc2)ccc1Br ZINC000225416521 568635782 /nfs/dbraw/zinc/63/57/82/568635782.db2.gz SPUGPRQARJFQSV-UHFFFAOYSA-N 0 0 418.404 5.234 40 10 HKCBRN Fc1cc(Br)ccc1NC(=S)NCc1ccc(N2CCCCC2)cc1 ZINC000225417338 568636011 /nfs/dbraw/zinc/63/60/11/568636011.db2.gz AGCHRDQWAKARAI-UHFFFAOYSA-N 0 0 422.367 5.065 40 10 HKCBRN S=C(NCc1ccc(N2CCCCC2)cc1)Nc1ccc(OC2CCCC2)cc1 ZINC000225418354 568635955 /nfs/dbraw/zinc/63/59/55/568635955.db2.gz JCVATTNYUKFALG-UHFFFAOYSA-N 0 0 409.599 5.485 40 10 HKCBRN FC(F)(F)c1cc(NC(=S)NCc2ccc(N3CCCC3)cc2)ccc1Cl ZINC000225423898 568636980 /nfs/dbraw/zinc/63/69/80/568636980.db2.gz BTXFXFBCHPASKE-UHFFFAOYSA-N 0 0 413.896 5.446 40 10 HKCBRN S=C(NCc1ccc(N2CCCC2)cc1)Nc1ccc(Br)c(Cl)c1 ZINC000225424356 568637051 /nfs/dbraw/zinc/63/70/51/568637051.db2.gz DZVSGSCKBNLJTN-UHFFFAOYSA-N 0 0 424.795 5.189 40 10 HKCBRN O=C(c1ccccc1)c1cc(Cl)ccc1NC(=S)Nc1ccc(Cl)cc1 ZINC000225465382 568640428 /nfs/dbraw/zinc/64/04/28/568640428.db2.gz HDBWYMONPBESOE-UHFFFAOYSA-N 0 0 401.318 6.033 40 10 HKCBRN FC(F)(F)c1cc(NC(=S)NCCCN2CCc3ccccc32)ccc1Cl ZINC000225559697 568651214 /nfs/dbraw/zinc/65/12/14/568651214.db2.gz JWSNPYRYDSKTRX-UHFFFAOYSA-N 0 0 413.896 5.098 40 10 HKCBRN CN(CCNC(=S)Nc1ccc(CSc2ccccc2)cc1)c1ccccc1 ZINC000225570932 568652313 /nfs/dbraw/zinc/65/23/13/568652313.db2.gz GZHMJSIZRNJKQI-UHFFFAOYSA-N 0 0 407.608 5.402 40 10 HKCBRN COc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)cc1C(C)C ZINC000225586985 568654714 /nfs/dbraw/zinc/65/47/14/568654714.db2.gz VXPMZVBJOQFJPJ-UHFFFAOYSA-N 0 0 423.534 5.159 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000225596825 559272116 /nfs/dbraw/zinc/27/21/16/559272116.db2.gz PGSCVRYPLPSIOE-QOCDNPHISA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000225596859 559272104 /nfs/dbraw/zinc/27/21/04/559272104.db2.gz PGSCVRYPLPSIOE-MATOAUIGSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@@H]5C[C@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000225596891 559272067 /nfs/dbraw/zinc/27/20/67/559272067.db2.gz PGSCVRYPLPSIOE-HXHKEWAKSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@H]3[C@@H]4CC[C@H]5C[C@H](O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000225596923 559272071 /nfs/dbraw/zinc/27/20/71/559272071.db2.gz PGSCVRYPLPSIOE-KLLIMAPHSA-N 0 0 423.641 5.510 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225607370 568656349 /nfs/dbraw/zinc/65/63/49/568656349.db2.gz OZYWRWLXMDCDHW-WOJBJXKFSA-N 0 0 406.570 5.058 40 10 HKCBRN C[C@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225607403 568656410 /nfs/dbraw/zinc/65/64/10/568656410.db2.gz OZYWRWLXMDCDHW-UXHICEINSA-N 0 0 406.570 5.058 40 10 HKCBRN C[C@@H](NC(=O)Cc1cccc(Br)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225621193 568657706 /nfs/dbraw/zinc/65/77/06/568657706.db2.gz APXIOKCDXRYJIA-QGZVFWFLSA-N 0 0 415.375 5.105 40 10 HKCBRN C[C@H](NC(=O)Cc1cccc(Br)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225621219 568657934 /nfs/dbraw/zinc/65/79/34/568657934.db2.gz APXIOKCDXRYJIA-KRWDZBQOSA-N 0 0 415.375 5.105 40 10 HKCBRN C[C@@H](NC(=O)Cc1cccc(Br)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225621412 568657877 /nfs/dbraw/zinc/65/78/77/568657877.db2.gz JIVLOFGRMLRNIV-IAGOWNOFSA-N 0 0 415.375 5.105 40 10 HKCBRN C[C@H](NC(=O)Cc1cccc(Br)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225621443 568657918 /nfs/dbraw/zinc/65/79/18/568657918.db2.gz JIVLOFGRMLRNIV-SJORKVTESA-N 0 0 415.375 5.105 40 10 HKCBRN C[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225654463 568660548 /nfs/dbraw/zinc/66/05/48/568660548.db2.gz YWIJXZVZXQRVMP-MRXNPFEDSA-N 0 0 421.532 5.989 40 10 HKCBRN C[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225654491 568660438 /nfs/dbraw/zinc/66/04/38/568660438.db2.gz YWIJXZVZXQRVMP-INIZCTEOSA-N 0 0 421.532 5.989 40 10 HKCBRN Cc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1Cl ZINC000225654868 568660471 /nfs/dbraw/zinc/66/04/71/568660471.db2.gz GNRUGZGYBSYRPC-KRWDZBQOSA-N 0 0 402.007 5.932 40 10 HKCBRN Cc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1Cl ZINC000225654902 568660555 /nfs/dbraw/zinc/66/05/55/568660555.db2.gz GNRUGZGYBSYRPC-QGZVFWFLSA-N 0 0 402.007 5.932 40 10 HKCBRN COc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1Cl ZINC000225654996 568660429 /nfs/dbraw/zinc/66/04/29/568660429.db2.gz NEGAPRXYAXDQQC-INIZCTEOSA-N 0 0 418.006 5.633 40 10 HKCBRN COc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1Cl ZINC000225655021 568660483 /nfs/dbraw/zinc/66/04/83/568660483.db2.gz NEGAPRXYAXDQQC-MRXNPFEDSA-N 0 0 418.006 5.633 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225655377 568660462 /nfs/dbraw/zinc/66/04/62/568660462.db2.gz GBVYCBBHNDYSKE-OAHLLOKOSA-N 0 0 405.970 5.763 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225655406 568660565 /nfs/dbraw/zinc/66/05/65/568660565.db2.gz GBVYCBBHNDYSKE-HNNXBMFYSA-N 0 0 405.970 5.763 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225655667 568660576 /nfs/dbraw/zinc/66/05/76/568660576.db2.gz INPLPIHYWHKOEA-MRXNPFEDSA-N 0 0 421.532 5.989 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225655680 568660468 /nfs/dbraw/zinc/66/04/68/568660468.db2.gz INPLPIHYWHKOEA-INIZCTEOSA-N 0 0 421.532 5.989 40 10 HKCBRN CC(C)Oc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000225656642 568660778 /nfs/dbraw/zinc/66/07/78/568660778.db2.gz HHFZVZKFDRFKHH-IBGZPJMESA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000225656669 568660679 /nfs/dbraw/zinc/66/06/79/568660679.db2.gz HHFZVZKFDRFKHH-LJQANCHMSA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1cccc(NC(=S)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225656706 568660668 /nfs/dbraw/zinc/66/06/68/568660668.db2.gz RBRUGTRIJKQQJH-IBGZPJMESA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1cccc(NC(=S)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225656728 568660806 /nfs/dbraw/zinc/66/08/06/568660806.db2.gz RBRUGTRIJKQQJH-LJQANCHMSA-N 0 0 411.615 5.758 40 10 HKCBRN C[C@@H](NC(=S)Nc1cccc(Br)c1)c1ccc(N2CCCCC2)cc1 ZINC000225663061 568661645 /nfs/dbraw/zinc/66/16/45/568661645.db2.gz ZZDRGWIPODQTMS-OAHLLOKOSA-N 0 0 418.404 5.487 40 10 HKCBRN C[C@H](NC(=S)Nc1cccc(Br)c1)c1ccc(N2CCCCC2)cc1 ZINC000225663088 568661632 /nfs/dbraw/zinc/66/16/32/568661632.db2.gz ZZDRGWIPODQTMS-HNNXBMFYSA-N 0 0 418.404 5.487 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(Br)cc1)c1ccc(N2CCCCC2)cc1 ZINC000225663123 568661585 /nfs/dbraw/zinc/66/15/85/568661585.db2.gz ZGOOROLJEIPTCW-OAHLLOKOSA-N 0 0 418.404 5.487 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(Br)cc1)c1ccc(N2CCCCC2)cc1 ZINC000225663153 568661592 /nfs/dbraw/zinc/66/15/92/568661592.db2.gz ZGOOROLJEIPTCW-HNNXBMFYSA-N 0 0 418.404 5.487 40 10 HKCBRN C[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCCCC2)cc1 ZINC000225663523 568661617 /nfs/dbraw/zinc/66/16/17/568661617.db2.gz YTRXBOHGKIMQHE-OAHLLOKOSA-N 0 0 407.505 5.743 40 10 HKCBRN C[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCCCC2)cc1 ZINC000225663549 568661659 /nfs/dbraw/zinc/66/16/59/568661659.db2.gz YTRXBOHGKIMQHE-HNNXBMFYSA-N 0 0 407.505 5.743 40 10 HKCBRN COc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCCCC3)cc2)cc1Cl ZINC000225664036 524665459 /nfs/dbraw/zinc/66/54/59/524665459.db2.gz NVFULVVJLKOYBF-HNNXBMFYSA-N 0 0 403.979 5.387 40 10 HKCBRN COc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCCCC3)cc2)cc1Cl ZINC000225664058 568661644 /nfs/dbraw/zinc/66/16/44/568661644.db2.gz NVFULVVJLKOYBF-OAHLLOKOSA-N 0 0 403.979 5.387 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCCCC2)cc1 ZINC000225664649 568661796 /nfs/dbraw/zinc/66/17/96/568661796.db2.gz ORUJSVMWWPLTNF-OAHLLOKOSA-N 0 0 407.505 5.743 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCCCC2)cc1 ZINC000225664680 568661915 /nfs/dbraw/zinc/66/19/15/568661915.db2.gz ORUJSVMWWPLTNF-HNNXBMFYSA-N 0 0 407.505 5.743 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(OC2CCCC2)cc1)c1ccc(N2CCCCC2)cc1 ZINC000225666066 568662099 /nfs/dbraw/zinc/66/20/99/568662099.db2.gz FEPQAJDJYURQKV-LJQANCHMSA-N 0 0 423.626 6.046 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(OC2CCCC2)cc1)c1ccc(N2CCCCC2)cc1 ZINC000225666087 568662027 /nfs/dbraw/zinc/66/20/27/568662027.db2.gz FEPQAJDJYURQKV-IBGZPJMESA-N 0 0 423.626 6.046 40 10 HKCBRN COc1cc(C)c(C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1C(C)C ZINC000225667002 568662137 /nfs/dbraw/zinc/66/21/37/568662137.db2.gz JTHCJYNTYUKOBX-FQEVSTJZSA-N 0 0 408.586 5.854 40 10 HKCBRN COc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCCCC3)cc2)c2cccnc12 ZINC000225667015 568662003 /nfs/dbraw/zinc/66/20/03/568662003.db2.gz QUGKKMFTNGQWIL-KRWDZBQOSA-N 0 0 420.582 5.281 40 10 HKCBRN COc1cc(C)c(C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)cc1C(C)C ZINC000225667033 568662149 /nfs/dbraw/zinc/66/21/49/568662149.db2.gz JTHCJYNTYUKOBX-HXUWFJFHSA-N 0 0 408.586 5.854 40 10 HKCBRN COc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCCCC3)cc2)c2cccnc12 ZINC000225667043 568662167 /nfs/dbraw/zinc/66/21/67/568662167.db2.gz QUGKKMFTNGQWIL-QGZVFWFLSA-N 0 0 420.582 5.281 40 10 HKCBRN COc1cc(C)c(C(=O)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1C(C)C ZINC000225667238 568662130 /nfs/dbraw/zinc/66/21/30/568662130.db2.gz JODSZKJCMCJLAN-QUCCMNQESA-N 0 0 408.586 5.854 40 10 HKCBRN COc1cc(C)c(C(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1C(C)C ZINC000225667265 568662287 /nfs/dbraw/zinc/66/22/87/568662287.db2.gz JODSZKJCMCJLAN-UYAOXDASSA-N 0 0 408.586 5.854 40 10 HKCBRN C[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225668261 568662217 /nfs/dbraw/zinc/66/22/17/568662217.db2.gz FXZKYCKXLHQPQO-HZPDHXFCSA-N 0 0 421.532 5.989 40 10 HKCBRN C[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225668297 568662277 /nfs/dbraw/zinc/66/22/77/568662277.db2.gz FXZKYCKXLHQPQO-CVEARBPZSA-N 0 0 421.532 5.989 40 10 HKCBRN Cc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1Cl ZINC000225668706 568662337 /nfs/dbraw/zinc/66/23/37/568662337.db2.gz JNJVQOUNWKEVHP-WBVHZDCISA-N 0 0 402.007 5.932 40 10 HKCBRN Cc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1Cl ZINC000225668742 568662273 /nfs/dbraw/zinc/66/22/73/568662273.db2.gz JNJVQOUNWKEVHP-NVXWUHKLSA-N 0 0 402.007 5.932 40 10 HKCBRN COc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1Cl ZINC000225668850 568662364 /nfs/dbraw/zinc/66/23/64/568662364.db2.gz JAQGPVMOZJZOLG-CVEARBPZSA-N 0 0 418.006 5.633 40 10 HKCBRN COc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1Cl ZINC000225668882 568662207 /nfs/dbraw/zinc/66/22/07/568662207.db2.gz JAQGPVMOZJZOLG-HZPDHXFCSA-N 0 0 418.006 5.633 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225669265 568662531 /nfs/dbraw/zinc/66/25/31/568662531.db2.gz CRLCNDBKSARKDT-HUUCEWRRSA-N 0 0 405.970 5.763 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225669297 568662495 /nfs/dbraw/zinc/66/24/95/568662495.db2.gz CRLCNDBKSARKDT-CABCVRRESA-N 0 0 405.970 5.763 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225669566 568662462 /nfs/dbraw/zinc/66/24/62/568662462.db2.gz SBEJAULOLGUWCS-HZPDHXFCSA-N 0 0 421.532 5.989 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225669592 568662457 /nfs/dbraw/zinc/66/24/57/568662457.db2.gz SBEJAULOLGUWCS-CVEARBPZSA-N 0 0 421.532 5.989 40 10 HKCBRN CC(C)Oc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1 ZINC000225670763 568662480 /nfs/dbraw/zinc/66/24/80/568662480.db2.gz VMHNBMPWFYLRDI-MOPGFXCFSA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1 ZINC000225670791 568662467 /nfs/dbraw/zinc/66/24/67/568662467.db2.gz VMHNBMPWFYLRDI-RTBURBONSA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1cccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000225670826 568662515 /nfs/dbraw/zinc/66/25/15/568662515.db2.gz VRQJTSPVLIRMHU-MOPGFXCFSA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1cccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000225670857 568662523 /nfs/dbraw/zinc/66/25/23/568662523.db2.gz VRQJTSPVLIRMHU-RTBURBONSA-N 0 0 411.615 5.758 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=S)Nc3cccc(Br)c3)cc2)C1 ZINC000225689697 568664636 /nfs/dbraw/zinc/66/46/36/568664636.db2.gz CJCRMHSOQSMFCV-OAHLLOKOSA-N 0 0 418.404 5.172 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=S)Nc3cccc(Br)c3)cc2)C1 ZINC000225689729 568664672 /nfs/dbraw/zinc/66/46/72/568664672.db2.gz CJCRMHSOQSMFCV-HNNXBMFYSA-N 0 0 418.404 5.172 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=S)Nc3ccc(Br)cc3)cc2)C1 ZINC000225689765 568664611 /nfs/dbraw/zinc/66/46/11/568664611.db2.gz KOCFAIZAJGPVSO-OAHLLOKOSA-N 0 0 418.404 5.172 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=S)Nc3ccc(Br)cc3)cc2)C1 ZINC000225689791 568664587 /nfs/dbraw/zinc/66/45/87/568664587.db2.gz KOCFAIZAJGPVSO-HNNXBMFYSA-N 0 0 418.404 5.172 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=S)Nc3cccc(C(F)(F)F)c3)cc2)C1 ZINC000225690021 524246819 /nfs/dbraw/zinc/24/68/19/524246819.db2.gz UTMLKSFGAWARSF-OAHLLOKOSA-N 0 0 407.505 5.428 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=S)Nc3cccc(C(F)(F)F)c3)cc2)C1 ZINC000225690049 568664591 /nfs/dbraw/zinc/66/45/91/568664591.db2.gz UTMLKSFGAWARSF-HNNXBMFYSA-N 0 0 407.505 5.428 40 10 HKCBRN COc1ccc(NC(=S)NCc2ccc(N3CCC[C@@H](C)C3)cc2)cc1Cl ZINC000225690484 524666791 /nfs/dbraw/zinc/66/67/91/524666791.db2.gz VCXFAFBNLCVROO-OAHLLOKOSA-N 0 0 403.979 5.072 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=S)Nc3ccc(C(F)(F)F)cc3)cc2)C1 ZINC000225691029 524245929 /nfs/dbraw/zinc/24/59/29/524245929.db2.gz IKYUKEJHEUFVKL-OAHLLOKOSA-N 0 0 407.505 5.428 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=S)Nc3ccc(C(F)(F)F)cc3)cc2)C1 ZINC000225691057 568664594 /nfs/dbraw/zinc/66/45/94/568664594.db2.gz IKYUKEJHEUFVKL-HNNXBMFYSA-N 0 0 407.505 5.428 40 10 HKCBRN C[C@@H]1CCCN(c2ccc(CNC(=S)Nc3ccc(OC4CCCC4)cc3)cc2)C1 ZINC000225692037 568664749 /nfs/dbraw/zinc/66/47/49/568664749.db2.gz CZNBVPMOWIJFGY-LJQANCHMSA-N 0 0 423.626 5.731 40 10 HKCBRN C[C@H]1CCCN(c2ccc(CNC(=S)Nc3ccc(OC4CCCC4)cc3)cc2)C1 ZINC000225692062 568664824 /nfs/dbraw/zinc/66/48/24/568664824.db2.gz CZNBVPMOWIJFGY-IBGZPJMESA-N 0 0 423.626 5.731 40 10 HKCBRN C[C@@H](NC(=S)Nc1cccc(Br)c1)c1ccc(N2CCCC2)cc1 ZINC000225694035 568665081 /nfs/dbraw/zinc/66/50/81/568665081.db2.gz JPQSKMNGUWYABV-CQSZACIVSA-N 0 0 404.377 5.097 40 10 HKCBRN C[C@H](NC(=S)Nc1cccc(Br)c1)c1ccc(N2CCCC2)cc1 ZINC000225694054 525276745 /nfs/dbraw/zinc/27/67/45/525276745.db2.gz JPQSKMNGUWYABV-AWEZNQCLSA-N 0 0 404.377 5.097 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(Br)cc1)c1ccc(N2CCCC2)cc1 ZINC000225694079 525385795 /nfs/dbraw/zinc/38/57/95/525385795.db2.gz DLHOLFQSTAIEDW-CQSZACIVSA-N 0 0 404.377 5.097 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(Br)cc1)c1ccc(N2CCCC2)cc1 ZINC000225694097 568665113 /nfs/dbraw/zinc/66/51/13/568665113.db2.gz DLHOLFQSTAIEDW-AWEZNQCLSA-N 0 0 404.377 5.097 40 10 HKCBRN Cc1cc(NC(=S)N[C@@H](C)c2ccc(N3CCCC3)cc2)ccc1Br ZINC000225694766 525262599 /nfs/dbraw/zinc/26/25/99/525262599.db2.gz LDFWAWGRDWFXEW-HNNXBMFYSA-N 0 0 418.404 5.405 40 10 HKCBRN Cc1cc(NC(=S)N[C@H](C)c2ccc(N3CCCC3)cc2)ccc1Br ZINC000225694786 568664950 /nfs/dbraw/zinc/66/49/50/568664950.db2.gz LDFWAWGRDWFXEW-OAHLLOKOSA-N 0 0 418.404 5.405 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(Br)cc1F)c1ccc(N2CCCC2)cc1 ZINC000225695528 568665098 /nfs/dbraw/zinc/66/50/98/568665098.db2.gz UPWAILCBUUPLKT-CYBMUJFWSA-N 0 0 422.367 5.236 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(Br)cc1F)c1ccc(N2CCCC2)cc1 ZINC000225695550 568665031 /nfs/dbraw/zinc/66/50/31/568665031.db2.gz UPWAILCBUUPLKT-ZDUSSCGKSA-N 0 0 422.367 5.236 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(OC2CCCC2)cc1)c1ccc(N2CCCC2)cc1 ZINC000225696496 525387024 /nfs/dbraw/zinc/38/70/24/525387024.db2.gz PKWFHAIEXGOZDD-GOSISDBHSA-N 0 0 409.599 5.656 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(OC2CCCC2)cc1)c1ccc(N2CCCC2)cc1 ZINC000225696524 568665383 /nfs/dbraw/zinc/66/53/83/568665383.db2.gz PKWFHAIEXGOZDD-SFHVURJKSA-N 0 0 409.599 5.656 40 10 HKCBRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000225704248 523044755 /nfs/dbraw/zinc/04/47/55/523044755.db2.gz GLTYJHCLTQXTJH-RXFWQSSRSA-N 0 0 420.597 5.591 40 10 HKCBRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000225704273 568666324 /nfs/dbraw/zinc/66/63/24/568666324.db2.gz GLTYJHCLTQXTJH-FNZWTVRRSA-N 0 0 420.597 5.591 40 10 HKCBRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000225704299 568666340 /nfs/dbraw/zinc/66/63/40/568666340.db2.gz GLTYJHCLTQXTJH-FQRUVTKNSA-N 0 0 420.597 5.591 40 10 HKCBRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000225704319 568666368 /nfs/dbraw/zinc/66/63/68/568666368.db2.gz GLTYJHCLTQXTJH-IBVKSMDESA-N 0 0 420.597 5.591 40 10 HKCBRN CCN(CCCNC(=S)Nc1ccc(Br)c(C)c1)c1ccc(C)cc1 ZINC000225733569 568668968 /nfs/dbraw/zinc/66/89/68/568668968.db2.gz IWBIIOSLVLLLRM-UHFFFAOYSA-N 0 0 420.420 5.269 40 10 HKCBRN CCN(CCCNC(=S)Nc1ccc(Br)cc1F)c1ccc(C)cc1 ZINC000225734137 568669161 /nfs/dbraw/zinc/66/91/61/568669161.db2.gz HDKCZAAYGPDHFK-UHFFFAOYSA-N 0 0 424.383 5.100 40 10 HKCBRN CCN(CCCNC(=S)Nc1ccc(OC2CCCC2)cc1)c1ccc(C)cc1 ZINC000225734820 568669390 /nfs/dbraw/zinc/66/93/90/568669390.db2.gz RGDZLHIQSZSMLZ-UHFFFAOYSA-N 0 0 411.615 5.519 40 10 HKCBRN S=C(NCCCN1CCCc2ccccc21)Nc1ccc(OC2CCCC2)cc1 ZINC000225746810 568670653 /nfs/dbraw/zinc/67/06/53/568670653.db2.gz HWBGZOREHFGOID-UHFFFAOYSA-N 0 0 409.599 5.137 40 10 HKCBRN CN(CCCNC(=S)Nc1ccc(CSc2ccccc2)cc1)c1ccccc1 ZINC000225747909 568670944 /nfs/dbraw/zinc/67/09/44/568670944.db2.gz QJNLGIAKDFBMHN-UHFFFAOYSA-N 0 0 421.635 5.792 40 10 HKCBRN Cc1ccc(C(C)C)c(OCC(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225770254 568673212 /nfs/dbraw/zinc/67/32/12/568673212.db2.gz LSCSWLJCFLMDFR-NRFANRHFSA-N 0 0 408.586 5.611 40 10 HKCBRN Cc1ccc(C(C)C)c(OCC(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225770271 568673102 /nfs/dbraw/zinc/67/31/02/568673102.db2.gz LSCSWLJCFLMDFR-OAQYLSRUSA-N 0 0 408.586 5.611 40 10 HKCBRN O=C(NCc1ccc(N2CCCC2)cc1)c1cccc(OCc2ccccc2Cl)c1 ZINC000225778001 526681253 /nfs/dbraw/zinc/68/12/53/526681253.db2.gz QVZGUXVRWMRIIO-UHFFFAOYSA-N 0 0 420.940 5.449 40 10 HKCBRN CCN(CCNC(=S)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(C)cc1 ZINC000225793202 568675067 /nfs/dbraw/zinc/67/50/67/568675067.db2.gz IQAJMDXHEKLDPU-UHFFFAOYSA-N 0 0 415.912 5.480 40 10 HKCBRN Cc1ccc(N(C)CCNC(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 ZINC000225795650 568675480 /nfs/dbraw/zinc/67/54/80/568675480.db2.gz PNYYOIHUXAYSJA-UHFFFAOYSA-N 0 0 401.885 5.090 40 10 HKCBRN Cc1ccc(N(C)CCNC(=S)Nc2ccc(CSc3ccccc3)cc2)cc1 ZINC000225795705 568675472 /nfs/dbraw/zinc/67/54/72/568675472.db2.gz YKTMVEUOVRLQAA-UHFFFAOYSA-N 0 0 421.635 5.710 40 10 HKCBRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000225797402 568675311 /nfs/dbraw/zinc/67/53/11/568675311.db2.gz NZWNNWGOKGIZHV-WOJBJXKFSA-N 0 0 406.570 5.200 40 10 HKCBRN C[C@@H](Oc1cccc2c1CCCC2)C(=O)N[C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000225797421 568675316 /nfs/dbraw/zinc/67/53/16/568675316.db2.gz NZWNNWGOKGIZHV-VQTJNVASSA-N 0 0 406.570 5.200 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000225797439 568675524 /nfs/dbraw/zinc/67/55/24/568675524.db2.gz NZWNNWGOKGIZHV-UXHICEINSA-N 0 0 406.570 5.200 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCCCC2)cc1 ZINC000225797461 568675443 /nfs/dbraw/zinc/67/54/43/568675443.db2.gz NZWNNWGOKGIZHV-PMACEKPBSA-N 0 0 406.570 5.200 40 10 HKCBRN CCN(CC)c1ccc(CNC(=O)c2ccc(CSc3ccc(C)cc3)cc2)cc1 ZINC000225813138 568676688 /nfs/dbraw/zinc/67/66/88/568676688.db2.gz XLVHLUSJEDZXIR-UHFFFAOYSA-N 0 0 418.606 6.064 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225813741 568676791 /nfs/dbraw/zinc/67/67/91/568676791.db2.gz ZDPSQRPUCDMOLU-QGZVFWFLSA-N 0 0 420.475 5.198 40 10 HKCBRN C[C@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1ccc(N2CCC(C)CC2)cc1 ZINC000225813756 568676563 /nfs/dbraw/zinc/67/65/63/568676563.db2.gz ZDPSQRPUCDMOLU-KRWDZBQOSA-N 0 0 420.475 5.198 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225813884 568676576 /nfs/dbraw/zinc/67/65/76/568676576.db2.gz SVYCXSDHTIUYGD-IAGOWNOFSA-N 0 0 420.475 5.198 40 10 HKCBRN C[C@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000225813908 568676579 /nfs/dbraw/zinc/67/65/79/568676579.db2.gz SVYCXSDHTIUYGD-SJORKVTESA-N 0 0 420.475 5.198 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225833222 568679297 /nfs/dbraw/zinc/67/92/97/568679297.db2.gz DJIDFRYDNNXKAI-VXKWHMMOSA-N 0 0 422.613 5.999 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225833242 568679268 /nfs/dbraw/zinc/67/92/68/568679268.db2.gz DJIDFRYDNNXKAI-FCHUYYIVSA-N 0 0 422.613 5.999 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225833258 526249021 /nfs/dbraw/zinc/24/90/21/526249021.db2.gz DJIDFRYDNNXKAI-YADHBBJMSA-N 0 0 422.613 5.999 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000225833279 526249813 /nfs/dbraw/zinc/24/98/13/526249813.db2.gz DJIDFRYDNNXKAI-FGZHOGPDSA-N 0 0 422.613 5.999 40 10 HKCBRN Cc1cc(CN(C(=O)c2ccc3oc(Cl)nc3c2)C(C)C)c(C)n1-c1ccccc1 ZINC000225982523 524644168 /nfs/dbraw/zinc/64/41/68/524644168.db2.gz WAVHGHAFWCTYNZ-UHFFFAOYSA-N 0 0 421.928 5.940 40 10 HKCBRN Cc1cc(CN(C(=O)c2ccc3nc(Cl)oc3c2)C(C)C)c(C)n1-c1ccccc1 ZINC000225982545 568690118 /nfs/dbraw/zinc/69/01/18/568690118.db2.gz PNNMAUJJAWFAPC-UHFFFAOYSA-N 0 0 421.928 5.940 40 10 HKCBRN Cc1cc(CN(C(=O)c2ccc3[nH]c(Cl)nc3c2)C(C)C)c(C)n1-c1ccccc1 ZINC000225982563 568689978 /nfs/dbraw/zinc/68/99/78/568689978.db2.gz JKTUPBZYJAYJBI-UHFFFAOYSA-N 0 0 420.944 5.675 40 10 HKCBRN COc1ccccc1-n1c(C)cc(CN(C)C(=O)c2ccc3oc(Cl)nc3c2)c1C ZINC000225985670 568690109 /nfs/dbraw/zinc/69/01/09/568690109.db2.gz DOLCPQPWXPCSFI-UHFFFAOYSA-N 0 0 423.900 5.170 40 10 HKCBRN COc1ccccc1-n1c(C)cc(CN(C)C(=O)c2ccc3nc(Cl)oc3c2)c1C ZINC000225985684 568690011 /nfs/dbraw/zinc/69/00/11/568690011.db2.gz YKSXGCYLVZACTC-UHFFFAOYSA-N 0 0 423.900 5.170 40 10 HKCBRN Cc1cc(CN(C)C(=O)c2ccc3sc(Cl)nc3c2)c(C)n1-c1ccccc1 ZINC000225985727 568690339 /nfs/dbraw/zinc/69/03/39/568690339.db2.gz JJWDEZTXSUZHCP-UHFFFAOYSA-N 0 0 409.942 5.629 40 10 HKCBRN Cc1cc(CN(C)C(=O)c2ccc3nc(Cl)sc3c2)c(C)n1-c1ccccc1 ZINC000225985744 568690293 /nfs/dbraw/zinc/69/02/93/568690293.db2.gz YXYLLBYPPUDADK-UHFFFAOYSA-N 0 0 409.942 5.629 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000226633474 569284988 /nfs/dbraw/zinc/28/49/88/569284988.db2.gz LTTOSZJGXVJENP-NQCMUKECSA-N 0 0 406.309 5.846 40 10 HKCBRN COc1cc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@@H]32)cc(OC)c1OC ZINC000226649214 569285023 /nfs/dbraw/zinc/28/50/23/569285023.db2.gz OWFLNCQFUNDERZ-SIFCLUCFSA-N 0 0 416.315 5.301 40 10 HKCBRN Clc1cccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226680174 569285052 /nfs/dbraw/zinc/28/50/52/569285052.db2.gz DQPOBQGPEVCFJD-VKJFTORMSA-N 0 0 407.682 5.771 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000226693247 569284972 /nfs/dbraw/zinc/28/49/72/569284972.db2.gz WEVPXBSNJYPFKD-PEBVRCNWSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226694652 569284983 /nfs/dbraw/zinc/28/49/83/569284983.db2.gz XUEBTWSKQGHHBN-VKJFTORMSA-N 0 0 418.234 5.026 40 10 HKCBRN Clc1ccc(Cl)c2c1N[C@@H](c1ccc(OCc3ccccc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000226702565 569285073 /nfs/dbraw/zinc/28/50/73/569285073.db2.gz ZRNHDBLFWGXEPB-NMMYMHLASA-N 0 0 422.355 7.399 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226707989 569285087 /nfs/dbraw/zinc/28/50/87/569285087.db2.gz RTQZHQDYROZZRV-VKJFTORMSA-N 0 0 407.682 5.771 40 10 HKCBRN CC(C)c1ccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226722373 569285000 /nfs/dbraw/zinc/28/50/00/569285000.db2.gz KVUISGIIODFQSP-LQWHRVPQSA-N 0 0 415.318 6.241 40 10 HKCBRN COC(=O)c1cccc2c1N[C@@H](c1ccc(OCc3ccccc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000226741764 569285045 /nfs/dbraw/zinc/28/50/45/569285045.db2.gz UBWFCBDFUHQSOA-SLSDLSHTSA-N 0 0 411.501 5.879 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226742447 569285009 /nfs/dbraw/zinc/28/50/09/569285009.db2.gz TVJLOTKNPXJXGH-BWACUDIHSA-N 0 0 405.679 5.837 40 10 HKCBRN Clc1ccc2c(c1Cl)N[C@@H](c1ccc(OCc3ccccc3)cc1)[C@H]1CC=C[C@@H]21 ZINC000226745572 569284985 /nfs/dbraw/zinc/28/49/85/569284985.db2.gz ABOCIAODVGAOTG-NMMYMHLASA-N 0 0 422.355 7.399 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000226747740 569285049 /nfs/dbraw/zinc/28/50/49/569285049.db2.gz NAHWCBGHNHDIFX-VBHSOAQHSA-N 0 0 405.679 5.837 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226782222 569285053 /nfs/dbraw/zinc/28/50/53/569285053.db2.gz KLYFCRCTRIKBNK-KEYYUXOJSA-N 0 0 405.133 6.038 40 10 HKCBRN O=C(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Br)cc1)N2)N1CCCC1 ZINC000226782291 569285034 /nfs/dbraw/zinc/28/50/34/569285034.db2.gz MTWZOMYMUFGQCP-XQBPLPMBSA-N 0 0 423.354 5.512 40 10 HKCBRN CCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Br)cc1)N2 ZINC000226793800 569285063 /nfs/dbraw/zinc/28/50/63/569285063.db2.gz WZXLIOXLIPNFBD-LVCYWYKZSA-N 0 0 411.343 5.415 40 10 HKCBRN CCCNC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Br)cc1)N2 ZINC000226793810 569285059 /nfs/dbraw/zinc/28/50/59/569285059.db2.gz WZXLIOXLIPNFBD-DBXWQHBBSA-N 0 0 411.343 5.415 40 10 HKCBRN COc1ccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226794989 569285039 /nfs/dbraw/zinc/28/50/39/569285039.db2.gz CKNWVHCRDLOQQJ-GJYPPUQNSA-N 0 0 403.263 5.126 40 10 HKCBRN Clc1cccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)c1Cl ZINC000226843944 569285095 /nfs/dbraw/zinc/28/50/95/569285095.db2.gz RYFNMXBLKQIFDF-KSRUKNBBSA-N 0 0 419.566 7.780 40 10 HKCBRN O=S(=O)(Nc1ccc(/N=N/c2ccccc2)cc1)c1ccc2c3c(cccc31)CC2 ZINC000226862146 559274218 /nfs/dbraw/zinc/27/42/18/559274218.db2.gz NKBAXTDMWKMBRV-OCEACIFDSA-N 0 0 413.502 6.155 40 10 HKCBRN CCOc1ccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226870312 569285099 /nfs/dbraw/zinc/28/50/99/569285099.db2.gz LOAPUCDWDTUTHQ-UWVAXJGDSA-N 0 0 417.290 5.516 40 10 HKCBRN COc1cccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226908353 569285097 /nfs/dbraw/zinc/28/50/97/569285097.db2.gz DQIQIGZJMPAPNB-GJYPPUQNSA-N 0 0 403.263 5.126 40 10 HKCBRN O=C(Oc1cccc(N=Nc2cccc(OC(=O)c3ccccc3)c2)c1)c1ccccc1 ZINC000245239076 569370373 /nfs/dbraw/zinc/37/03/73/569370373.db2.gz FCTSSWFCZGVIME-UHFFFAOYSA-N 0 0 422.440 6.540 40 10 HKCBRN CC(=O)Nc1ccc(N=Nc2ccc(N=Nc3ccc(NC(C)=O)cc3)cc2)cc1 ZINC000245239841 569370366 /nfs/dbraw/zinc/37/03/66/569370366.db2.gz MOHHIDUYBMLZAV-UHFFFAOYSA-N 0 0 400.442 6.434 40 10 HKCBRN O=C(Nc1cccc(N=Nc2cccc(NC(=O)c3ccccc3)c2)c1)c1ccccc1 ZINC000245241077 569370379 /nfs/dbraw/zinc/37/03/79/569370379.db2.gz WZUYESRIGAZGNI-UHFFFAOYSA-N 0 0 420.472 6.607 40 10 HKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccccc3Cl)cc1)N2 ZINC000247545290 569370857 /nfs/dbraw/zinc/37/08/57/569370857.db2.gz UJBOKOFHKMNDNX-CZSZKKDXSA-N 0 0 405.900 6.885 40 10 HKCBRN O=C(c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Br)cc1)N2)N1CCCC1 ZINC000250249284 569371964 /nfs/dbraw/zinc/37/19/64/569371964.db2.gz MTWZOMYMUFGQCP-DXIQSLLYSA-N 0 0 423.354 5.512 40 10 HKCBRN Clc1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccccc3)cc1)N2 ZINC000250638461 569371950 /nfs/dbraw/zinc/37/19/50/569371950.db2.gz BPRZLPAZPVOYLE-DPLHUUCSSA-N 0 0 422.355 7.399 40 10 HKCBRN COc1ccc(C2=CC(=O)c3c(C)oc(C)c3C(=O)C2=NNc2ccc(C)cc2)cc1 ZINC000252478767 569372074 /nfs/dbraw/zinc/37/20/74/569372074.db2.gz AUVADICCOCFXQS-CYYJNZCTSA-N 0 0 414.461 6.515 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000253497737 569373565 /nfs/dbraw/zinc/37/35/65/569373565.db2.gz AFLVJSJCGOFTTI-ZCCMWAGFSA-N 0 0 407.642 6.540 40 10 HKCBRN CN(C)c1ccc(/C=C2\C[C@@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000253497739 569373609 /nfs/dbraw/zinc/37/36/09/569373609.db2.gz AFLVJSJCGOFTTI-ZREJJHDXSA-N 0 0 407.642 6.540 40 10 HKCBRN CN(C)c1ccc(/C=C2/C[C@@H]3[C@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@@H]4CC[C@]3(C)[C@H]2O)cc1 ZINC000253508470 569373876 /nfs/dbraw/zinc/37/38/76/569373876.db2.gz PGSCVRYPLPSIOE-BCXLZNIDSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2/C[C@@H]3[C@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@@H]4CC[C@]3(C)[C@@H]2O)cc1 ZINC000253508473 569373880 /nfs/dbraw/zinc/37/38/80/569373880.db2.gz PGSCVRYPLPSIOE-DVNRIYIRSA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2/C[C@@H]3[C@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@@H]4CC[C@@]3(C)[C@H]2O)cc1 ZINC000253508479 569373860 /nfs/dbraw/zinc/37/38/60/569373860.db2.gz PGSCVRYPLPSIOE-NGVQUQIASA-N 0 0 423.641 5.510 40 10 HKCBRN CN(C)c1ccc(/C=C2/C[C@@H]3[C@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@@H]4CC[C@@]3(C)[C@@H]2O)cc1 ZINC000253508481 569373885 /nfs/dbraw/zinc/37/38/85/569373885.db2.gz PGSCVRYPLPSIOE-OWXZZUKZSA-N 0 0 423.641 5.510 40 10 HKCBRN Cc1ccc(NC(=O)C2=Cc3ccccc3C(=NNc3ccccc3O)C2=O)c(C)c1 ZINC000254624545 569374926 /nfs/dbraw/zinc/37/49/26/569374926.db2.gz JSSROCUNTZVPCI-UHFFFAOYSA-N 0 0 411.461 6.536 40 10 HKCBRN C[C@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260452938 569379447 /nfs/dbraw/zinc/37/94/47/569379447.db2.gz AQWJNGSCWKEUNR-PMACEKPBSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260452948 569379405 /nfs/dbraw/zinc/37/94/05/569379405.db2.gz AQWJNGSCWKEUNR-VQTJNVASSA-N 0 0 408.586 5.477 40 10 HKCBRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc(C)c1Cl ZINC000260453237 569379415 /nfs/dbraw/zinc/37/94/15/569379415.db2.gz GUFCOJXGSGRXDE-LPHOPBHVSA-N 0 0 414.977 5.449 40 10 HKCBRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc(C)c1Cl ZINC000260453243 569379449 /nfs/dbraw/zinc/37/94/49/569379449.db2.gz GUFCOJXGSGRXDE-QFBILLFUSA-N 0 0 414.977 5.449 40 10 HKCBRN C[C@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260453326 569379424 /nfs/dbraw/zinc/37/94/24/569379424.db2.gz JQYKLVYBSCLDQJ-OALUTQOASA-N 0 0 412.533 6.313 40 10 HKCBRN C[C@@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260453329 569379383 /nfs/dbraw/zinc/37/93/83/569379383.db2.gz JQYKLVYBSCLDQJ-RBUKOAKNSA-N 0 0 412.533 6.313 40 10 HKCBRN C[C@H](NC(=O)COc1cccc2ccccc21)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260455446 569379423 /nfs/dbraw/zinc/37/94/23/569379423.db2.gz RBHZTYWWGOPSJM-PMACEKPBSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc2ccccc21)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260455448 569379390 /nfs/dbraw/zinc/37/93/90/569379390.db2.gz RBHZTYWWGOPSJM-VQTJNVASSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260455490 569379406 /nfs/dbraw/zinc/37/94/06/569379406.db2.gz XEZOBACVUZBZNC-OALUTQOASA-N 0 0 414.977 5.613 40 10 HKCBRN C[C@@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260455491 569379426 /nfs/dbraw/zinc/37/94/26/569379426.db2.gz XEZOBACVUZBZNC-RBUKOAKNSA-N 0 0 414.977 5.613 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260455505 569379414 /nfs/dbraw/zinc/37/94/14/569379414.db2.gz ZLBJQJCNCBJTLR-LEWJYISDSA-N 0 0 406.614 6.030 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260455506 569379392 /nfs/dbraw/zinc/37/93/92/569379392.db2.gz ZLBJQJCNCBJTLR-SFTDATJTSA-N 0 0 406.614 6.030 40 10 HKCBRN C[C@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466008 569379391 /nfs/dbraw/zinc/37/93/91/569379391.db2.gz AEDJOXVDGCHVLC-ROUUACIJSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466023 569379387 /nfs/dbraw/zinc/37/93/87/569379387.db2.gz AEDJOXVDGCHVLC-ZWKOTPCHSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466041 569379386 /nfs/dbraw/zinc/37/93/86/569379386.db2.gz BMIVKTPKLKEPEV-MVIRQZGPSA-N 0 0 417.380 6.120 40 10 HKCBRN C[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466048 569379400 /nfs/dbraw/zinc/37/94/00/569379400.db2.gz BMIVKTPKLKEPEV-SCGCXBKJSA-N 0 0 417.380 6.120 40 10 HKCBRN C[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466096 569379398 /nfs/dbraw/zinc/37/93/98/569379398.db2.gz CYMMHEZUKDWKSO-ROUUACIJSA-N 0 0 417.018 5.936 40 10 HKCBRN C[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466102 569379444 /nfs/dbraw/zinc/37/94/44/569379444.db2.gz CYMMHEZUKDWKSO-ZWKOTPCHSA-N 0 0 417.018 5.936 40 10 HKCBRN C[C@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466133 569379394 /nfs/dbraw/zinc/37/93/94/569379394.db2.gz FLFPIMIKAQFLJH-HOTGVXAUSA-N 0 0 421.368 5.486 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466138 569379396 /nfs/dbraw/zinc/37/93/96/569379396.db2.gz FLFPIMIKAQFLJH-JKSUJKDBSA-N 0 0 421.368 5.486 40 10 HKCBRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466157 569379548 /nfs/dbraw/zinc/37/95/48/569379548.db2.gz GOXAHJGUUQGIIR-DLBZAZTESA-N 0 0 402.991 5.546 40 10 HKCBRN C[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466165 569379504 /nfs/dbraw/zinc/37/95/04/569379504.db2.gz GOXAHJGUUQGIIR-IRXDYDNUSA-N 0 0 402.991 5.546 40 10 HKCBRN C[C@H](NC(=O)c1ccc(Br)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466169 569379551 /nfs/dbraw/zinc/37/95/51/569379551.db2.gz GRBQPAMRAXBMKU-HOTGVXAUSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@@H](NC(=O)c1ccc(Br)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466174 569379502 /nfs/dbraw/zinc/37/95/02/569379502.db2.gz GRBQPAMRAXBMKU-JKSUJKDBSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466226 569379538 /nfs/dbraw/zinc/37/95/38/569379538.db2.gz IPJAAONCUVKVIL-DONYXKEHSA-N 0 0 404.598 6.111 40 10 HKCBRN C[C@@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466230 569379566 /nfs/dbraw/zinc/37/95/66/569379566.db2.gz IPJAAONCUVKVIL-HGNCSYERSA-N 0 0 404.598 6.111 40 10 HKCBRN COc1ccc(CSCC(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1 ZINC000260466276 569379534 /nfs/dbraw/zinc/37/95/34/569379534.db2.gz LXVYFUUDRVSPBG-OALUTQOASA-N 0 0 412.599 5.042 40 10 HKCBRN COc1ccc(CSCC(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1 ZINC000260466284 569379568 /nfs/dbraw/zinc/37/95/68/569379568.db2.gz LXVYFUUDRVSPBG-RBUKOAKNSA-N 0 0 412.599 5.042 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466311 569379537 /nfs/dbraw/zinc/37/95/37/569379537.db2.gz NNZWHVNWSKULSD-ROUUACIJSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466316 569379506 /nfs/dbraw/zinc/37/95/06/569379506.db2.gz NNZWHVNWSKULSD-ZWKOTPCHSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccccc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466325 569379567 /nfs/dbraw/zinc/37/95/67/569379567.db2.gz OXYGQDSLDXUAKB-ROUUACIJSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccccc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466329 569379525 /nfs/dbraw/zinc/37/95/25/569379525.db2.gz OXYGQDSLDXUAKB-ZWKOTPCHSA-N 0 0 417.018 5.687 40 10 HKCBRN C[C@H](NC(=O)c1ccccc1Br)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466338 569379535 /nfs/dbraw/zinc/37/95/35/569379535.db2.gz PTVGGLXUCRZFBU-HOTGVXAUSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@@H](NC(=O)c1ccccc1Br)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260466343 569379543 /nfs/dbraw/zinc/37/95/43/569379543.db2.gz PTVGGLXUCRZFBU-JKSUJKDBSA-N 0 0 401.348 5.176 40 10 HKCBRN C[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260467411 569379529 /nfs/dbraw/zinc/37/95/29/569379529.db2.gz UJBWKWIISDTQDC-NMIUNVJJSA-N 0 0 414.549 5.934 40 10 HKCBRN C[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260467413 569379550 /nfs/dbraw/zinc/37/95/50/569379550.db2.gz UJBWKWIISDTQDC-SRECOIMGSA-N 0 0 414.549 5.934 40 10 HKCBRN C[C@@H](NC(=O)CCc1cccc2ccccc21)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260507297 569379544 /nfs/dbraw/zinc/37/95/44/569379544.db2.gz JFPYOSGSUKMFJR-LEWJYISDSA-N 0 0 400.566 5.886 40 10 HKCBRN C[C@H](NC(=O)CCc1cccc2ccccc21)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260507304 569379511 /nfs/dbraw/zinc/37/95/11/569379511.db2.gz JFPYOSGSUKMFJR-SFTDATJTSA-N 0 0 400.566 5.886 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccccc1F)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260508020 569379497 /nfs/dbraw/zinc/37/94/97/569379497.db2.gz PIFLKZRQLSUUPT-ROUUACIJSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccccc1F)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260508034 569379518 /nfs/dbraw/zinc/37/95/18/569379518.db2.gz PIFLKZRQLSUUPT-ZWKOTPCHSA-N 0 0 400.563 5.173 40 10 HKCBRN CCCN1C(=O)S/C(=C\c2cc3c(cc2C)N(C(C)C)C(C)(C)C[C@H]3C)C1=O ZINC000260565067 569379536 /nfs/dbraw/zinc/37/95/36/569379536.db2.gz GSDBNEDTONWACY-SDLDRHLBSA-N 0 0 400.588 5.942 40 10 HKCBRN CC(C)N1c2ccc(/C=C3\NC(=O)N(Cc4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000260565338 569379508 /nfs/dbraw/zinc/37/95/08/569379508.db2.gz IBQLXVGPZCCWLH-QWQBBLJPSA-N 0 0 417.553 5.280 40 10 HKCBRN CC(C)N1c2ccc(/C=C3\SC(=O)N(c4ccccc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000260567312 569379540 /nfs/dbraw/zinc/37/95/40/569379540.db2.gz KHVLMFOIWLIRMF-VVRYKASASA-N 0 0 420.578 6.428 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc2c(cc1C)N(C(C)C)C(C)(C)C[C@H]2C ZINC000260569886 569379513 /nfs/dbraw/zinc/37/95/13/569379513.db2.gz SWCMXFJRWXHQSR-IERINAHZSA-N 0 0 415.581 6.302 40 10 HKCBRN Cc1ccc(CN2C(=O)N/C(=C\c3cc4c(cc3C)N(C)C(C)(C)C[C@H]4C)C2=O)cc1 ZINC000260570034 569379546 /nfs/dbraw/zinc/37/95/46/569379546.db2.gz TYCGSDQNOVQSMK-QLTNSANVSA-N 0 0 417.553 5.118 40 10 HKCBRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260577813 569379545 /nfs/dbraw/zinc/37/95/45/569379545.db2.gz MMXDIOCQKDJLJD-SPEDKVCISA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260577820 569379607 /nfs/dbraw/zinc/37/96/07/569379607.db2.gz MMXDIOCQKDJLJD-SVMVAKDDSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260577857 569379665 /nfs/dbraw/zinc/37/96/65/569379665.db2.gz NROMPWHSEKXIBT-BSRJHKFKSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260577861 569379595 /nfs/dbraw/zinc/37/95/95/569379595.db2.gz NROMPWHSEKXIBT-IXFSTUDKSA-N 0 0 414.977 5.611 40 10 HKCBRN C[C@H](NC(=O)CSCc1ccc(F)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260577913 569379593 /nfs/dbraw/zinc/37/95/93/569379593.db2.gz PIPJLPMPFMHREN-ROUUACIJSA-N 0 0 400.563 5.173 40 10 HKCBRN C[C@@H](NC(=O)CSCc1ccc(F)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260577919 569379670 /nfs/dbraw/zinc/37/96/70/569379670.db2.gz PIPJLPMPFMHREN-ZWKOTPCHSA-N 0 0 400.563 5.173 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260578046 569379621 /nfs/dbraw/zinc/37/96/21/569379621.db2.gz UZXHMVNMUYJEMR-BULFRSBZSA-N 0 0 408.586 5.493 40 10 HKCBRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260578054 569379678 /nfs/dbraw/zinc/37/96/78/569379678.db2.gz UZXHMVNMUYJEMR-MTNREXPMSA-N 0 0 408.586 5.493 40 10 HKCBRN COc1cc2ccccc2cc1C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578070 569379659 /nfs/dbraw/zinc/37/96/59/569379659.db2.gz VKAAISMKJDIDEC-OALUTQOASA-N 0 0 402.538 5.576 40 10 HKCBRN COc1cc2ccccc2cc1C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578076 569379631 /nfs/dbraw/zinc/37/96/31/569379631.db2.gz VKAAISMKJDIDEC-RBUKOAKNSA-N 0 0 402.538 5.576 40 10 HKCBRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578101 569379637 /nfs/dbraw/zinc/37/96/37/569379637.db2.gz VYPHDNNYUSYLNM-LEEZEASISA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578106 569379601 /nfs/dbraw/zinc/37/96/01/569379601.db2.gz VYPHDNNYUSYLNM-PTLVVNQVSA-N 0 0 408.586 5.575 40 10 HKCBRN Cc1cc(OCC(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)ccc1Cl ZINC000260578874 569379623 /nfs/dbraw/zinc/37/96/23/569379623.db2.gz WKNZARNLCCDSDV-FUHWJXTLSA-N 0 0 400.950 5.141 40 10 HKCBRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)ccc1Cl ZINC000260578881 569379663 /nfs/dbraw/zinc/37/96/63/569379663.db2.gz WKNZARNLCCDSDV-WMZOPIPTSA-N 0 0 400.950 5.141 40 10 HKCBRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578899 569379591 /nfs/dbraw/zinc/37/95/91/569379591.db2.gz WMDAPEUCRJBNAH-VNZMSGEBSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578904 569379627 /nfs/dbraw/zinc/37/96/27/569379627.db2.gz WMDAPEUCRJBNAH-XZOYJPPVSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578965 569379587 /nfs/dbraw/zinc/37/95/87/569379587.db2.gz YCORUCXNBJTBSD-HCYUJWNOSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260578981 569379626 /nfs/dbraw/zinc/37/96/26/569379626.db2.gz YCORUCXNBJTBSD-HMHJJOSWSA-N 0 0 408.586 5.575 40 10 HKCBRN Cc1ccc(N2CCC(C(=O)N[C@H](C)c3ccc(N4CCC[C@H](C)C4)cc3)CC2)cc1 ZINC000260591929 569379616 /nfs/dbraw/zinc/37/96/16/569379616.db2.gz NQXGLBANFGZTMA-FCHUYYIVSA-N 0 0 419.613 5.325 40 10 HKCBRN Cc1ccc(N2CCC(C(=O)N[C@@H](C)c3ccc(N4CCC[C@H](C)C4)cc3)CC2)cc1 ZINC000260591937 569379647 /nfs/dbraw/zinc/37/96/47/569379647.db2.gz NQXGLBANFGZTMA-VXKWHMMOSA-N 0 0 419.613 5.325 40 10 HKCBRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260592211 569379604 /nfs/dbraw/zinc/37/96/04/569379604.db2.gz QYPORUBECOJKEB-BSRJHKFKSA-N 0 0 414.977 5.611 40 10 HKCBRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260592218 569379681 /nfs/dbraw/zinc/37/96/81/569379681.db2.gz QYPORUBECOJKEB-IXFSTUDKSA-N 0 0 414.977 5.611 40 10 HKCBRN Cc1cc(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)ccc1Cl ZINC000260613095 569379643 /nfs/dbraw/zinc/37/96/43/569379643.db2.gz CSRXDSCKKDAVTL-BHIYHBOVSA-N 0 0 414.977 5.529 40 10 HKCBRN Cc1cc(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)ccc1Cl ZINC000260613102 569379599 /nfs/dbraw/zinc/37/95/99/569379599.db2.gz CSRXDSCKKDAVTL-QXAKKESOSA-N 0 0 414.977 5.529 40 10 HKCBRN Cc1cc(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)ccc1Cl ZINC000260613108 569379639 /nfs/dbraw/zinc/37/96/39/569379639.db2.gz CSRXDSCKKDAVTL-YTQUADARSA-N 0 0 414.977 5.529 40 10 HKCBRN C[C@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260619363 569379606 /nfs/dbraw/zinc/37/96/06/569379606.db2.gz KGVUORDUPXOKMG-PMACEKPBSA-N 0 0 402.538 5.332 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260619365 569379589 /nfs/dbraw/zinc/37/95/89/569379589.db2.gz KGVUORDUPXOKMG-VQTJNVASSA-N 0 0 402.538 5.332 40 10 HKCBRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)cc1 ZINC000260619368 569379640 /nfs/dbraw/zinc/37/96/40/569379640.db2.gz KHIHZTNPVJPQGC-UMEGOILYSA-N 0 0 408.586 5.520 40 10 HKCBRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1 ZINC000260619371 569379674 /nfs/dbraw/zinc/37/96/74/569379674.db2.gz KHIHZTNPVJPQGC-WZOHSFFVSA-N 0 0 408.586 5.520 40 10 HKCBRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1 ZINC000260619374 569379652 /nfs/dbraw/zinc/37/96/52/569379652.db2.gz KHIHZTNPVJPQGC-ZYLNGJIFSA-N 0 0 408.586 5.520 40 10 HKCBRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260619432 569379676 /nfs/dbraw/zinc/37/96/76/569379676.db2.gz LQYOJZCCCQWQCW-LEEZEASISA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260619433 569379661 /nfs/dbraw/zinc/37/96/61/569379661.db2.gz LQYOJZCCCQWQCW-PTLVVNQVSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000260619434 569379629 /nfs/dbraw/zinc/37/96/29/569379629.db2.gz LQYOJZCCCQWQCW-ZYKOEDHHSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260624880 569379636 /nfs/dbraw/zinc/37/96/36/569379636.db2.gz WCIYSNIEFKPJSW-HCYUJWNOSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260624887 569379584 /nfs/dbraw/zinc/37/95/84/569379584.db2.gz WCIYSNIEFKPJSW-HMHJJOSWSA-N 0 0 408.586 5.575 40 10 HKCBRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000260624893 569379667 /nfs/dbraw/zinc/37/96/67/569379667.db2.gz WCIYSNIEFKPJSW-JYMRHQFYSA-N 0 0 408.586 5.575 40 10 HKCBRN C[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260625087 569379654 /nfs/dbraw/zinc/37/96/54/569379654.db2.gz ZBNQNXBHEZNQKD-PMACEKPBSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260625091 569379597 /nfs/dbraw/zinc/37/95/97/569379597.db2.gz ZBNQNXBHEZNQKD-VQTJNVASSA-N 0 0 408.586 5.477 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260732901 569379650 /nfs/dbraw/zinc/37/96/50/569379650.db2.gz CRLCNDBKSARKDT-GJZGRUSLSA-N 0 0 405.970 5.763 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260732907 569379620 /nfs/dbraw/zinc/37/96/20/569379620.db2.gz CRLCNDBKSARKDT-LSDHHAIUSA-N 0 0 405.970 5.763 40 10 HKCBRN C[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260735188 569379609 /nfs/dbraw/zinc/37/96/09/569379609.db2.gz FXZKYCKXLHQPQO-HOTGVXAUSA-N 0 0 421.532 5.989 40 10 HKCBRN C[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260735197 569379680 /nfs/dbraw/zinc/37/96/80/569379680.db2.gz FXZKYCKXLHQPQO-JKSUJKDBSA-N 0 0 421.532 5.989 40 10 HKCBRN COc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1Cl ZINC000260735479 569379634 /nfs/dbraw/zinc/37/96/34/569379634.db2.gz JAQGPVMOZJZOLG-HOTGVXAUSA-N 0 0 418.006 5.633 40 10 HKCBRN COc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1Cl ZINC000260735482 569379669 /nfs/dbraw/zinc/37/96/69/569379669.db2.gz JAQGPVMOZJZOLG-JKSUJKDBSA-N 0 0 418.006 5.633 40 10 HKCBRN Cc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1Cl ZINC000260737371 569379614 /nfs/dbraw/zinc/37/96/14/569379614.db2.gz JNJVQOUNWKEVHP-DOTOQJQBSA-N 0 0 402.007 5.932 40 10 HKCBRN Cc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1Cl ZINC000260737378 569379672 /nfs/dbraw/zinc/37/96/72/569379672.db2.gz JNJVQOUNWKEVHP-RDJZCZTQSA-N 0 0 402.007 5.932 40 10 HKCBRN C[C@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260740049 569379737 /nfs/dbraw/zinc/37/97/37/569379737.db2.gz SBEJAULOLGUWCS-HOTGVXAUSA-N 0 0 421.532 5.989 40 10 HKCBRN C[C@@H](NC(=S)Nc1ccc(C(F)(F)F)cc1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260740052 569379689 /nfs/dbraw/zinc/37/96/89/569379689.db2.gz SBEJAULOLGUWCS-JKSUJKDBSA-N 0 0 421.532 5.989 40 10 HKCBRN COc1ccc(NC(=S)NCc2ccc(N3CCC[C@H](C)C3)cc2)cc1Cl ZINC000260742327 569379717 /nfs/dbraw/zinc/37/97/17/569379717.db2.gz VCXFAFBNLCVROO-HNNXBMFYSA-N 0 0 403.979 5.072 40 10 HKCBRN CC(C)Oc1ccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1 ZINC000260742363 569379702 /nfs/dbraw/zinc/37/97/02/569379702.db2.gz VMHNBMPWFYLRDI-OALUTQOASA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1ccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1 ZINC000260742380 569379719 /nfs/dbraw/zinc/37/97/19/569379719.db2.gz VMHNBMPWFYLRDI-RBUKOAKNSA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1cccc(NC(=S)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260742387 569379696 /nfs/dbraw/zinc/37/96/96/569379696.db2.gz VRQJTSPVLIRMHU-OALUTQOASA-N 0 0 411.615 5.758 40 10 HKCBRN CC(C)Oc1cccc(NC(=S)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260742392 569379694 /nfs/dbraw/zinc/37/96/94/569379694.db2.gz VRQJTSPVLIRMHU-RBUKOAKNSA-N 0 0 411.615 5.758 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)cc3OC)N21 ZINC000260752812 569379688 /nfs/dbraw/zinc/37/96/88/569379688.db2.gz ACAKXUSJSLHDFD-VSDWSMLSSA-N 0 0 422.598 5.060 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)cc3OC)N21 ZINC000260752823 569379713 /nfs/dbraw/zinc/37/97/13/569379713.db2.gz ACAKXUSJSLHDFD-ZQMYSKGWSA-N 0 0 422.598 5.060 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c1C ZINC000260752956 569379720 /nfs/dbraw/zinc/37/97/20/569379720.db2.gz AKWSWGCQEMHNIM-GAZXMLTASA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccccc1-n1c(C)cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c1C ZINC000260752961 569379699 /nfs/dbraw/zinc/37/96/99/569379699.db2.gz AKWSWGCQEMHNIM-UOKFIYJESA-N 0 0 416.594 5.641 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(O)cc4)c3C)N21 ZINC000260753009 569379757 /nfs/dbraw/zinc/37/97/57/569379757.db2.gz AONUXKQNOCGGRN-VSDWSMLSSA-N 0 0 418.566 5.174 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(O)cc4)c3C)N21 ZINC000260753010 569379745 /nfs/dbraw/zinc/37/97/45/569379745.db2.gz AONUXKQNOCGGRN-ZQMYSKGWSA-N 0 0 418.566 5.174 40 10 HKCBRN CCOc1cc(N2CCCC2)ccc1[C@@H]1[C@@H](c2ccccn2)N=C2SC[C@H](CC)N21 ZINC000260753015 569379729 /nfs/dbraw/zinc/37/97/29/569379729.db2.gz ASGQWKFJGUYDQZ-JJEOQYAHSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc(N2CCCC2)ccc1[C@@H]1[C@H](c2ccccn2)N=C2SC[C@H](CC)N21 ZINC000260753016 569379712 /nfs/dbraw/zinc/37/97/12/569379712.db2.gz ASGQWKFJGUYDQZ-PDIWNELESA-N 0 0 422.598 5.060 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cc(C)cc(C)c1 ZINC000260753064 569379727 /nfs/dbraw/zinc/37/97/27/569379727.db2.gz BCYIWDLIGMDTMR-DQMJNTIXSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cc(C)cc(C)c1 ZINC000260753067 569379774 /nfs/dbraw/zinc/37/97/74/569379774.db2.gz BCYIWDLIGMDTMR-PUZWTLIVSA-N 0 0 416.594 5.695 40 10 HKCBRN CCOc1cc(N(CC)CC)ccc1[C@@H]1[C@@H](c2ccccn2)N=C2SC[C@H](CC)N21 ZINC000260753121 569379705 /nfs/dbraw/zinc/37/97/05/569379705.db2.gz BLDKGCBTQNKUMA-JJEOQYAHSA-N 0 0 424.614 5.306 40 10 HKCBRN CCOc1cc(N(CC)CC)ccc1[C@@H]1[C@H](c2ccccn2)N=C2SC[C@H](CC)N21 ZINC000260753126 569379691 /nfs/dbraw/zinc/37/96/91/569379691.db2.gz BLDKGCBTQNKUMA-PDIWNELESA-N 0 0 424.614 5.306 40 10 HKCBRN COc1cccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)N=C4S[C@H](C)CN43)c2C)c1 ZINC000260755858 569379755 /nfs/dbraw/zinc/37/97/55/569379755.db2.gz BZQOUIBYJYDSJR-UZFJHSOTSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1cccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@H](C)CN43)c2C)c1 ZINC000260755862 569379730 /nfs/dbraw/zinc/37/97/30/569379730.db2.gz BZQOUIBYJYDSJR-ZGNKEGEESA-N 0 0 418.566 5.087 40 10 HKCBRN CCOc1cc([C@@H]2[C@@H](c3ccccn3)N=C3SC[C@H](CC)N32)ccc1N1CCCC1 ZINC000260755958 569379764 /nfs/dbraw/zinc/37/97/64/569379764.db2.gz CLHKZJCRXGRAEF-CDNPAEQRSA-N 0 0 422.598 5.060 40 10 HKCBRN CCOc1cc([C@@H]2[C@H](c3ccccn3)N=C3SC[C@H](CC)N32)ccc1N1CCCC1 ZINC000260755962 569379759 /nfs/dbraw/zinc/37/97/59/569379759.db2.gz CLHKZJCRXGRAEF-OFAXGOBFSA-N 0 0 422.598 5.060 40 10 HKCBRN COc1ccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)N=C4S[C@H](C)CN43)c2C)cc1 ZINC000260756028 569379697 /nfs/dbraw/zinc/37/96/97/569379697.db2.gz CYZDHNOBEKYHNU-UZFJHSOTSA-N 0 0 418.566 5.087 40 10 HKCBRN COc1ccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@H](C)CN43)c2C)cc1 ZINC000260756030 569379723 /nfs/dbraw/zinc/37/97/23/569379723.db2.gz CYZDHNOBEKYHNU-ZGNKEGEESA-N 0 0 418.566 5.087 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccc(F)cc1 ZINC000260756053 569379751 /nfs/dbraw/zinc/37/97/51/569379751.db2.gz DBJXPRWGCJHYNF-KBJGYGKASA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccc(F)cc1 ZINC000260756057 569379686 /nfs/dbraw/zinc/37/96/86/569379686.db2.gz DBJXPRWGCJHYNF-UJUVCNOISA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(F)c1 ZINC000260759149 569379703 /nfs/dbraw/zinc/37/97/03/569379703.db2.gz FDPFHTGZBCGMSK-KBJGYGKASA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(F)c1 ZINC000260759158 569379715 /nfs/dbraw/zinc/37/97/15/569379715.db2.gz FDPFHTGZBCGMSK-UJUVCNOISA-N 0 0 406.530 5.218 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4cccc(F)c4)c3C)N21 ZINC000260759231 569379733 /nfs/dbraw/zinc/37/97/33/569379733.db2.gz FJTCZCSKFBCTJE-LEOXJPRUSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4cccc(F)c4)c3C)N21 ZINC000260759237 569379735 /nfs/dbraw/zinc/37/97/35/569379735.db2.gz FJTCZCSKFBCTJE-YSZBQJHXSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)NCc1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260762255 569379856 /nfs/dbraw/zinc/37/98/56/569379856.db2.gz HDMDHZKAAORQCE-FNZWTVRRSA-N 0 0 420.597 5.276 40 10 HKCBRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)NCc1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260762261 569379848 /nfs/dbraw/zinc/37/98/48/569379848.db2.gz HDMDHZKAAORQCE-RXFWQSSRSA-N 0 0 420.597 5.276 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)c(F)c3)N21 ZINC000260762838 569379825 /nfs/dbraw/zinc/37/98/25/569379825.db2.gz HQNJGFUPJIAMKC-WTNAPCKOSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)c(F)c3)N21 ZINC000260762844 569379871 /nfs/dbraw/zinc/37/98/71/569379871.db2.gz HQNJGFUPJIAMKC-YHYVQYDKSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(F)cc4)c3C)N21 ZINC000260762864 569379860 /nfs/dbraw/zinc/37/98/60/569379860.db2.gz HTXFWUGBBGBVHO-LEOXJPRUSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(F)cc4)c3C)N21 ZINC000260762871 569379817 /nfs/dbraw/zinc/37/98/17/569379817.db2.gz HTXFWUGBBGBVHO-YSZBQJHXSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(F)c(N4CCCC4)cc3C)N21 ZINC000260762950 569379867 /nfs/dbraw/zinc/37/98/67/569379867.db2.gz HVYAMXQQNYXXRR-HVETUWLQSA-N 0 0 410.562 5.109 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(F)c(N4CCCC4)cc3C)N21 ZINC000260762955 569379816 /nfs/dbraw/zinc/37/98/16/569379816.db2.gz HVYAMXQQNYXXRR-XGRCMKMKSA-N 0 0 410.562 5.109 40 10 HKCBRN CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000260762979 569379828 /nfs/dbraw/zinc/37/98/28/569379828.db2.gz HYALREHPWQTQAM-FCHUYYIVSA-N 0 0 406.599 5.096 40 10 HKCBRN CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000260762983 569379852 /nfs/dbraw/zinc/37/98/52/569379852.db2.gz HYALREHPWQTQAM-FGZHOGPDSA-N 0 0 406.599 5.096 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(C)n3-c3ccc(Cl)cc3)N21 ZINC000260763025 569379875 /nfs/dbraw/zinc/37/98/75/569379875.db2.gz ICFLXWXSPFXQJX-WTNAPCKOSA-N 0 0 422.985 5.814 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(C)n3-c3ccc(Cl)cc3)N21 ZINC000260763029 569379814 /nfs/dbraw/zinc/37/98/14/569379814.db2.gz ICFLXWXSPFXQJX-YHYVQYDKSA-N 0 0 422.985 5.814 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccccc4C)c3C)N21 ZINC000260765978 569379854 /nfs/dbraw/zinc/37/98/54/569379854.db2.gz IPUJLXDQHDXNGI-FOVJLYNBSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccccc4C)c3C)N21 ZINC000260765983 569379865 /nfs/dbraw/zinc/37/98/65/569379865.db2.gz IPUJLXDQHDXNGI-YGOYIFOWSA-N 0 0 416.594 5.777 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccccc1C ZINC000260766215 569379836 /nfs/dbraw/zinc/37/98/36/569379836.db2.gz JIXYWRKKHIOKAD-MQNAVGNWSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccccc1C ZINC000260766221 569379832 /nfs/dbraw/zinc/37/98/32/569379832.db2.gz JIXYWRKKHIOKAD-NLSFWIRASA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(Cl)c1 ZINC000260766328 569379842 /nfs/dbraw/zinc/37/98/42/569379842.db2.gz JRLMYGAEZKJJQI-KBJGYGKASA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(Cl)c1 ZINC000260766333 569379839 /nfs/dbraw/zinc/37/98/39/569379839.db2.gz JRLMYGAEZKJJQI-UJUVCNOISA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccccc1F ZINC000260766437 569379858 /nfs/dbraw/zinc/37/98/58/569379858.db2.gz KAYMOCMSAMCTPE-KBJGYGKASA-N 0 0 406.530 5.218 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccccc1F ZINC000260766439 569379869 /nfs/dbraw/zinc/37/98/69/569379869.db2.gz KAYMOCMSAMCTPE-UJUVCNOISA-N 0 0 406.530 5.218 40 10 HKCBRN C[C@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260767475 569379815 /nfs/dbraw/zinc/37/98/15/569379815.db2.gz OZYWRWLXMDCDHW-PMACEKPBSA-N 0 0 406.570 5.058 40 10 HKCBRN CCOc1ccc(C(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1Cl ZINC000260767638 569379841 /nfs/dbraw/zinc/37/98/41/569379841.db2.gz OEMTXQIQUKGOTN-DLBZAZTESA-N 0 0 400.950 5.466 40 10 HKCBRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1Cl ZINC000260767644 569379819 /nfs/dbraw/zinc/37/98/19/569379819.db2.gz OEMTXQIQUKGOTN-IRXDYDNUSA-N 0 0 400.950 5.466 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1c(C)cccc1C ZINC000260769092 569379835 /nfs/dbraw/zinc/37/98/35/569379835.db2.gz KDWTULICNUSHJM-IHLLOCCUSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1c(C)cccc1C ZINC000260769096 569379829 /nfs/dbraw/zinc/37/98/29/569379829.db2.gz KDWTULICNUSHJM-RVSNTGDXSA-N 0 0 416.594 5.695 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4cc(C)ccn4)c3C)N21 ZINC000260769143 569379818 /nfs/dbraw/zinc/37/98/18/569379818.db2.gz KGUAIQNZUWTTKD-LEOXJPRUSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4cc(C)ccn4)c3C)N21 ZINC000260769149 569379837 /nfs/dbraw/zinc/37/98/37/569379837.db2.gz KGUAIQNZUWTTKD-YSZBQJHXSA-N 0 0 417.582 5.172 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@H](c4ccccn4)NC(=S)N3C(C)C)cc21 ZINC000260769202 569379866 /nfs/dbraw/zinc/37/98/66/569379866.db2.gz KNPGEDYTPPOVFM-FCHUYYIVSA-N 0 0 406.599 5.094 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@H]3[C@H](c4ccccn4)NC(=S)N3C(C)C)cc21 ZINC000260769210 569379833 /nfs/dbraw/zinc/37/98/33/569379833.db2.gz KNPGEDYTPPOVFM-VXKWHMMOSA-N 0 0 406.599 5.094 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@H]3[C@@H](c4ccccn4)NC(=S)N3C(C)C)cc21 ZINC000260769213 569379877 /nfs/dbraw/zinc/37/98/77/569379877.db2.gz KNPGEDYTPPOVFM-YADHBBJMSA-N 0 0 406.599 5.094 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(C)c1 ZINC000260769314 569379986 /nfs/dbraw/zinc/37/99/86/569379986.db2.gz LMPKRBGLNRKLDW-MQNAVGNWSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(C)c1 ZINC000260769319 569379955 /nfs/dbraw/zinc/37/99/55/569379955.db2.gz LMPKRBGLNRKLDW-NLSFWIRASA-N 0 0 402.567 5.387 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc4c(c3)C(C)=CC(C)(C)N4C)N21 ZINC000260769350 569379948 /nfs/dbraw/zinc/37/99/48/569379948.db2.gz LQUHWVRNEQFTQW-LEOXJPRUSA-N 0 0 418.610 5.693 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc4c(c3)C(C)=CC(C)(C)N4C)N21 ZINC000260769353 569379970 /nfs/dbraw/zinc/37/99/70/569379970.db2.gz LQUHWVRNEQFTQW-SXSPYAJSSA-N 0 0 418.610 5.693 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc4c(c3)C(C)=CC(C)(C)N4C)N21 ZINC000260769356 569379988 /nfs/dbraw/zinc/37/99/88/569379988.db2.gz LQUHWVRNEQFTQW-YSZBQJHXSA-N 0 0 418.610 5.693 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260769526 569379960 /nfs/dbraw/zinc/37/99/60/569379960.db2.gz OZYWRWLXMDCDHW-VQTJNVASSA-N 0 0 406.570 5.058 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)cc3C)N21 ZINC000260771938 569379958 /nfs/dbraw/zinc/37/99/58/569379958.db2.gz MBESXRNGGBTBMQ-LEOXJPRUSA-N 0 0 406.599 5.360 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)cc3C)N21 ZINC000260771946 569379985 /nfs/dbraw/zinc/37/99/85/569379985.db2.gz MBESXRNGGBTBMQ-YSZBQJHXSA-N 0 0 406.599 5.360 40 10 HKCBRN Cc1ccc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)n1-c1ccc(Cl)cc1 ZINC000260771995 569379931 /nfs/dbraw/zinc/37/99/31/569379931.db2.gz MCQILKKTWIFFSG-GQWLDOHISA-N 0 0 408.958 5.423 40 10 HKCBRN Cc1ccc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)n1-c1ccc(Cl)cc1 ZINC000260772003 569379964 /nfs/dbraw/zinc/37/99/64/569379964.db2.gz MCQILKKTWIFFSG-IPHXSNPTSA-N 0 0 408.958 5.423 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(N4CCCC4)c(C)c3C)N21 ZINC000260772452 569379957 /nfs/dbraw/zinc/37/99/57/569379957.db2.gz NXHBIACKYJWGAM-LEOXJPRUSA-N 0 0 406.599 5.278 40 10 HKCBRN C[C@H](NC(=O)COc1ccc2c(c1)CCCC2)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260772527 569379981 /nfs/dbraw/zinc/37/99/81/569379981.db2.gz YYVXBWPFFADGDA-PMACEKPBSA-N 0 0 406.570 5.058 40 10 HKCBRN C[C@@H](NC(=O)COc1ccc2c(c1)CCCC2)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260772532 569379978 /nfs/dbraw/zinc/37/99/78/569379978.db2.gz YYVXBWPFFADGDA-VQTJNVASSA-N 0 0 406.570 5.058 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(N4CCCC4)c(C)c3C)N21 ZINC000260774867 569379927 /nfs/dbraw/zinc/37/99/27/569379927.db2.gz NXHBIACKYJWGAM-YSZBQJHXSA-N 0 0 406.599 5.278 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccc(C)cc1 ZINC000260774872 569379982 /nfs/dbraw/zinc/37/99/82/569379982.db2.gz NYUZDYUEHVJEFI-MQNAVGNWSA-N 0 0 402.567 5.387 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccc(C)cc1 ZINC000260774876 569379969 /nfs/dbraw/zinc/37/99/69/569379969.db2.gz NYUZDYUEHVJEFI-NLSFWIRASA-N 0 0 402.567 5.387 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@H](c4ccccn4)N=C4S[C@H](C)CN43)c2C)cc1 ZINC000260774931 569379993 /nfs/dbraw/zinc/37/99/93/569379993.db2.gz OFUIIBVNOARHGU-GAZXMLTASA-N 0 0 416.594 5.641 40 10 HKCBRN CCc1ccc(-n2c(C)cc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@H](C)CN43)c2C)cc1 ZINC000260774936 569379968 /nfs/dbraw/zinc/37/99/68/569379968.db2.gz OFUIIBVNOARHGU-UOKFIYJESA-N 0 0 416.594 5.641 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccc(Cl)cc1 ZINC000260774985 569379963 /nfs/dbraw/zinc/37/99/63/569379963.db2.gz OPNDOGRDEHRUJU-KBJGYGKASA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccc(Cl)cc1 ZINC000260774989 569379936 /nfs/dbraw/zinc/37/99/36/569379936.db2.gz OPNDOGRDEHRUJU-UJUVCNOISA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cc(C)ccc1C ZINC000260777662 569379952 /nfs/dbraw/zinc/37/99/52/569379952.db2.gz QHGRVZVSWPJEFD-DQMJNTIXSA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cc(C)ccc1C ZINC000260777672 569379980 /nfs/dbraw/zinc/37/99/80/569379980.db2.gz QHGRVZVSWPJEFD-PUZWTLIVSA-N 0 0 416.594 5.695 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)c(N4CCCC4)cc3C)N21 ZINC000260777722 569379945 /nfs/dbraw/zinc/37/99/45/569379945.db2.gz QOEFDZRLXYXSLJ-LEOXJPRUSA-N 0 0 406.599 5.278 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)c(N4CCCC4)cc3C)N21 ZINC000260777727 569379971 /nfs/dbraw/zinc/37/99/71/569379971.db2.gz QOEFDZRLXYXSLJ-YSZBQJHXSA-N 0 0 406.599 5.278 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@@H](c4ccccn4)N=C4S[C@H](C)CN43)cc21 ZINC000260777918 569379956 /nfs/dbraw/zinc/37/99/56/569379956.db2.gz QSWQCCJEYSCPKF-NPFVIJTESA-N 0 0 404.583 5.303 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@H](c4ccccn4)N=C4S[C@H](C)CN43)cc21 ZINC000260777974 569380071 /nfs/dbraw/zinc/38/00/71/569380071.db2.gz QSWQCCJEYSCPKF-URZJWIJPSA-N 0 0 404.583 5.303 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@H](c4ccccn4)N=C4S[C@@H](C)CN43)cc21 ZINC000260777979 569380075 /nfs/dbraw/zinc/38/00/75/569380075.db2.gz QSWQCCJEYSCPKF-WQTXXOFMSA-N 0 0 404.583 5.303 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(C)cn4)c3C)N21 ZINC000260778119 569380098 /nfs/dbraw/zinc/38/00/98/569380098.db2.gz RAQSTVRIUQGFTC-LEOXJPRUSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(C)cn4)c3C)N21 ZINC000260778121 569380107 /nfs/dbraw/zinc/38/01/07/569380107.db2.gz RAQSTVRIUQGFTC-YSZBQJHXSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(C)n3-c3ccc(OC)cc3)N21 ZINC000260781101 569380018 /nfs/dbraw/zinc/38/00/18/569380018.db2.gz SLZCTUGUTCGWQA-VSDWSMLSSA-N 0 0 418.566 5.169 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(C)n3-c3ccc(OC)cc3)N21 ZINC000260781109 569380031 /nfs/dbraw/zinc/38/00/31/569380031.db2.gz SLZCTUGUTCGWQA-ZQMYSKGWSA-N 0 0 418.566 5.169 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4cccc(C)c4)c3C)N21 ZINC000260781279 569380099 /nfs/dbraw/zinc/38/00/99/569380099.db2.gz SPRDVBHKQUYMIL-FOVJLYNBSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4cccc(C)c4)c3C)N21 ZINC000260781290 569380083 /nfs/dbraw/zinc/38/00/83/569380083.db2.gz SPRDVBHKQUYMIL-YGOYIFOWSA-N 0 0 416.594 5.777 40 10 HKCBRN Cc1c(Cl)c([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)ccc1N1CCCC1 ZINC000260781560 569380073 /nfs/dbraw/zinc/38/00/73/569380073.db2.gz SYRAEMHIQHAUTQ-PUCZYUMASA-N 0 0 412.990 5.233 40 10 HKCBRN Cc1c(Cl)c([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)ccc1N1CCCC1 ZINC000260781563 569380086 /nfs/dbraw/zinc/38/00/86/569380086.db2.gz SYRAEMHIQHAUTQ-XMDBHEJHSA-N 0 0 412.990 5.233 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccccc4)c3C)N21 ZINC000260781647 569380061 /nfs/dbraw/zinc/38/00/61/569380061.db2.gz UHLHHCVTYCLMRD-LEOXJPRUSA-N 0 0 402.567 5.469 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccccc4)c3C)N21 ZINC000260783744 569380096 /nfs/dbraw/zinc/38/00/96/569380096.db2.gz UHLHHCVTYCLMRD-YSZBQJHXSA-N 0 0 402.567 5.469 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(C)c1C ZINC000260784111 569380100 /nfs/dbraw/zinc/38/01/00/569380100.db2.gz UXNGAPJDRYFUTG-GAZXMLTASA-N 0 0 416.594 5.695 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1cccc(C)c1C ZINC000260784118 569380043 /nfs/dbraw/zinc/38/00/43/569380043.db2.gz UXNGAPJDRYFUTG-UOKFIYJESA-N 0 0 416.594 5.695 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@H]3[C@H](c4ccccn4)NC(=S)N3CC(C)C)cc21 ZINC000260784152 569380065 /nfs/dbraw/zinc/38/00/65/569380065.db2.gz VBWPSUMULGCJGI-GOTSBHOMSA-N 0 0 420.626 5.342 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@H]3[C@@H](c4ccccn4)NC(=S)N3CC(C)C)cc21 ZINC000260784158 569380053 /nfs/dbraw/zinc/38/00/53/569380053.db2.gz VBWPSUMULGCJGI-PKTZIBPZSA-N 0 0 420.626 5.342 40 10 HKCBRN CC1=CC(C)(C)N(C)c2ccc([C@@H]3[C@H](c4ccccn4)NC(=S)N3CC(C)C)cc21 ZINC000260784161 569380057 /nfs/dbraw/zinc/38/00/57/569380057.db2.gz VBWPSUMULGCJGI-XZOQPEGZSA-N 0 0 420.626 5.342 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(C)cc4)c3C)N21 ZINC000260784172 569380039 /nfs/dbraw/zinc/38/00/39/569380039.db2.gz VFFHWMXHQHWWAO-FOVJLYNBSA-N 0 0 416.594 5.777 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccc(C)cc4)c3C)N21 ZINC000260784176 569380063 /nfs/dbraw/zinc/38/00/63/569380063.db2.gz VFFHWMXHQHWWAO-YGOYIFOWSA-N 0 0 416.594 5.777 40 10 HKCBRN Cc1cc([C@@H]2[C@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccccc1Cl ZINC000260784239 569380106 /nfs/dbraw/zinc/38/01/06/569380106.db2.gz VKKDAGRGHICLNA-KBJGYGKASA-N 0 0 422.985 5.732 40 10 HKCBRN Cc1cc([C@@H]2[C@@H](c3ccccn3)N=C3S[C@H](C)CN32)c(C)n1-c1ccccc1Cl ZINC000260784241 569380089 /nfs/dbraw/zinc/38/00/89/569380089.db2.gz VKKDAGRGHICLNA-UJUVCNOISA-N 0 0 422.985 5.732 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(N4CCCC4)c(Cl)c3)N21 ZINC000260784246 569380081 /nfs/dbraw/zinc/38/00/81/569380081.db2.gz VLQXOWIYSFQNQQ-CZAAIQMYSA-N 0 0 412.990 5.315 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(N4CCCC4)c(Cl)c3)N21 ZINC000260784248 569380033 /nfs/dbraw/zinc/38/00/33/569380033.db2.gz VLQXOWIYSFQNQQ-HBGVWJBISA-N 0 0 412.990 5.315 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ncccc4C)c3C)N21 ZINC000260786329 569380069 /nfs/dbraw/zinc/38/00/69/569380069.db2.gz WEOKKAXNFPVBRL-COPCDDAFSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ncccc4C)c3C)N21 ZINC000260786333 569380091 /nfs/dbraw/zinc/38/00/91/569380091.db2.gz WEOKKAXNFPVBRL-QIJUGHKUSA-N 0 0 417.582 5.172 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccccc4F)c3C)N21 ZINC000260786391 569380050 /nfs/dbraw/zinc/38/00/50/569380050.db2.gz WUPQPYKOTKGCSF-VSDWSMLSSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3cc(C)n(-c4ccccc4F)c3C)N21 ZINC000260786395 569380103 /nfs/dbraw/zinc/38/01/03/569380103.db2.gz WUPQPYKOTKGCSF-ZQMYSKGWSA-N 0 0 420.557 5.608 40 10 HKCBRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)cc3F)N21 ZINC000260788366 569380023 /nfs/dbraw/zinc/38/00/23/569380023.db2.gz ZJMCPLRVEFZCCZ-HVETUWLQSA-N 0 0 410.562 5.190 40 10 HKCBRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@H](c3ccc(N4CCCCC4)cc3F)N21 ZINC000260788368 569380156 /nfs/dbraw/zinc/38/01/56/569380156.db2.gz ZJMCPLRVEFZCCZ-XGRCMKMKSA-N 0 0 410.562 5.190 40 10 HKCBRN Cc1ccc(C(C)C)c(OCC(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260795857 569380234 /nfs/dbraw/zinc/38/02/34/569380234.db2.gz MDGONIQGKBBSMH-LEWJYISDSA-N 0 0 408.586 5.611 40 10 HKCBRN Cc1ccc(C(C)C)c(OCC(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260795858 569380240 /nfs/dbraw/zinc/38/02/40/569380240.db2.gz MDGONIQGKBBSMH-SFTDATJTSA-N 0 0 408.586 5.611 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260800797 569380216 /nfs/dbraw/zinc/38/02/16/569380216.db2.gz XMYFZVHSFLBGFI-LEWJYISDSA-N 0 0 408.586 5.438 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCc2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260800799 569380225 /nfs/dbraw/zinc/38/02/25/569380225.db2.gz XMYFZVHSFLBGFI-SFTDATJTSA-N 0 0 408.586 5.438 40 10 HKCBRN C[C@@H](NC(=O)Cc1cccc(Br)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260801634 569380183 /nfs/dbraw/zinc/38/01/83/569380183.db2.gz JIVLOFGRMLRNIV-DLBZAZTESA-N 0 0 415.375 5.105 40 10 HKCBRN C[C@H](NC(=O)Cc1cccc(Br)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260801635 569380190 /nfs/dbraw/zinc/38/01/90/569380190.db2.gz JIVLOFGRMLRNIV-IRXDYDNUSA-N 0 0 415.375 5.105 40 10 HKCBRN COc1cc(C)c(C(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1C(C)C ZINC000260801645 569380271 /nfs/dbraw/zinc/38/02/71/569380271.db2.gz JODSZKJCMCJLAN-AZUAARDMSA-N 0 0 408.586 5.854 40 10 HKCBRN COc1cc(C)c(C(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)cc1C(C)C ZINC000260801648 569380204 /nfs/dbraw/zinc/38/02/04/569380204.db2.gz JODSZKJCMCJLAN-ICSRJNTNSA-N 0 0 408.586 5.854 40 10 HKCBRN C[C@@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260802941 569380223 /nfs/dbraw/zinc/38/02/23/569380223.db2.gz SVYCXSDHTIUYGD-DLBZAZTESA-N 0 0 420.475 5.198 40 10 HKCBRN C[C@H](NC(=O)COc1cccc(C(F)(F)F)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260802944 569380250 /nfs/dbraw/zinc/38/02/50/569380250.db2.gz SVYCXSDHTIUYGD-IRXDYDNUSA-N 0 0 420.475 5.198 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000260805357 569380172 /nfs/dbraw/zinc/38/01/72/569380172.db2.gz BLZRQRVXVDSTCG-HKBOAZHASA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1ccc2c(c1)CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000260805358 569380265 /nfs/dbraw/zinc/38/02/65/569380265.db2.gz BLZRQRVXVDSTCG-NJYVYQBISA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@H](NC(=O)[C@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000260836951 569380331 /nfs/dbraw/zinc/38/03/31/569380331.db2.gz BUVYZHDFVFTAOP-HKBOAZHASA-N 0 0 420.597 5.446 40 10 HKCBRN C[C@@H](NC(=O)[C@H](C)Oc1cccc2c1CCCC2)c1ccc(N2CCC[C@@H](C)C2)cc1 ZINC000260836954 569380301 /nfs/dbraw/zinc/38/03/01/569380301.db2.gz BUVYZHDFVFTAOP-NJYVYQBISA-N 0 0 420.597 5.446 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260839147 569380346 /nfs/dbraw/zinc/38/03/46/569380346.db2.gz JDGYTIPZRAGZHA-BHDDXSALSA-N 0 0 422.613 5.999 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(N3CCC[C@H](C)C3)cc2)c1 ZINC000260839148 569380389 /nfs/dbraw/zinc/38/03/89/569380389.db2.gz JDGYTIPZRAGZHA-FDFHNCONSA-N 0 0 422.613 5.999 40 10 HKCBRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(N3CCC[C@@H](C)C3)cc2)c1 ZINC000260839150 569380433 /nfs/dbraw/zinc/38/04/33/569380433.db2.gz JDGYTIPZRAGZHA-YPAWHYETSA-N 0 0 422.613 5.999 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260892951 569380592 /nfs/dbraw/zinc/38/05/92/569380592.db2.gz FPODJUDWZCCQJD-DLBZAZTESA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260892954 569380591 /nfs/dbraw/zinc/38/05/91/569380591.db2.gz FPODJUDWZCCQJD-IRXDYDNUSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260897689 569380567 /nfs/dbraw/zinc/38/05/67/569380567.db2.gz KBKHQTNOONUUFY-DLBZAZTESA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260897690 569380484 /nfs/dbraw/zinc/38/04/84/569380484.db2.gz KBKHQTNOONUUFY-IRXDYDNUSA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260899260 569380536 /nfs/dbraw/zinc/38/05/36/569380536.db2.gz KQVXARYYIURQBQ-DLBZAZTESA-N 0 0 419.396 6.040 40 10 HKCBRN C[C@H](NC(=O)CCc1c(Cl)cccc1Cl)c1ccc(N2CCC[C@H](C)C2)cc1 ZINC000260899263 569380588 /nfs/dbraw/zinc/38/05/88/569380588.db2.gz KQVXARYYIURQBQ-IRXDYDNUSA-N 0 0 419.396 6.040 40 10 HKCBRN CCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000260919754 569380599 /nfs/dbraw/zinc/38/05/99/569380599.db2.gz NKBTXIPXNDDOCO-DHIUTWEWSA-N 0 0 420.626 5.486 40 10 HKCBRN CCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc2c(c1)C(C)=CC(C)(C)N2C ZINC000260919758 569380579 /nfs/dbraw/zinc/38/05/79/569380579.db2.gz NKBTXIPXNDDOCO-XZOQPEGZSA-N 0 0 420.626 5.486 40 10 HKCBRN CCN(CCOc1ccc(OC)cc1)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000299888437 558851436 /nfs/dbraw/zinc/85/14/36/558851436.db2.gz JRGMBLADXKQLLB-UHFFFAOYSA-N 0 0 420.469 5.924 40 10 HKCBRN O=C(Nc1ccc(/N=N/c2ccccc2)cc1)[C@H]1CCCN1C(=O)c1cccs1 ZINC000301198823 569382616 /nfs/dbraw/zinc/38/26/16/569382616.db2.gz PWEOHABMUQOQND-WWDJGNSZSA-N 0 0 404.495 5.407 40 10 HKCBRN O=C(Nc1ccc(/N=N/c2ccccc2)cc1)[C@@H]1CCCN1C(=O)c1cccs1 ZINC000301198824 569382641 /nfs/dbraw/zinc/38/26/41/569382641.db2.gz PWEOHABMUQOQND-ZFZZVZNFSA-N 0 0 404.495 5.407 40 10 HKCBRN Oc1ccc(Cl)cc1Nc1cc(Cl)nc(-c2cccc(C(F)(F)F)c2)n1 ZINC000328963416 571308419 /nfs/dbraw/zinc/30/84/19/571308419.db2.gz BMWJSEKQJCWCPJ-UHFFFAOYSA-N 0 0 400.187 5.918 40 10 HKCBRN Oc1ccc(Cl)cc1Nc1cc(Cl)nc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000329002898 569384600 /nfs/dbraw/zinc/38/46/00/569384600.db2.gz KKOJAGSKOSWFTI-UHFFFAOYSA-N 0 0 400.187 5.340 40 10 HKCBRN Cc1ccc(N=Nc2cc(C)c(NN=C3C(=O)C=Cc4ccccc43)cc2C)c(C)c1 ZINC000390822355 571257947 /nfs/dbraw/zinc/25/79/47/571257947.db2.gz KRVPDQWVGALASH-XOXGWFOHSA-N 0 0 408.505 8.610 40 10 HKCBRN CC1=NN(c2ccc(Br)c(C)c2C)C(=O)C1=CNc1ccc(C)cc1C ZINC000408526376 558464435 /nfs/dbraw/zinc/46/44/35/558464435.db2.gz BEVLNPOFNQSRNU-BOPFTXTBSA-N 0 0 412.331 5.401 40 10 HKCBRN CC1=NN(c2ccc(Br)c(C)c2C)C(=O)C1=CNc1cc(C)ccc1C ZINC000408527627 558463423 /nfs/dbraw/zinc/46/34/23/558463423.db2.gz DRXYVBWJEZQRNN-BOPFTXTBSA-N 0 0 412.331 5.401 40 10 HKCBRN O=C1NC(=S)S/C1=C\c1ccc(OCc2cccc3ccccc32)c(Cl)c1 ZINC000408529500 558466339 /nfs/dbraw/zinc/46/63/39/558466339.db2.gz IHSDYBCFCVLJFS-ODLFYWEKSA-N 0 0 411.935 5.561 40 10 HKCBRN CCCCOc1ccc(Br)cc1/C=C1\C(=O)N(c2ccccc2)N=C1C ZINC000408530067 558466577 /nfs/dbraw/zinc/46/65/77/558466577.db2.gz IMRDDDTWZCUBLE-RGEXLXHISA-N 0 0 413.315 5.434 40 10 HKCBRN CC1=NN(c2ccc(Br)c(C)c2C)C(=O)C1=CNc1c(C)cccc1C ZINC000408531431 557305007 /nfs/dbraw/zinc/30/50/07/557305007.db2.gz OBOINLNHXQDVDL-BOPFTXTBSA-N 0 0 412.331 5.401 40 10 HKCBRN Cc1ccc(COc2c(Cl)cc(C=C3SC(=S)NC3=O)cc2Cl)cc1 ZINC000408531664 558471906 /nfs/dbraw/zinc/47/19/06/558471906.db2.gz PWCWZVRNWHYFRC-NVNXTCNLSA-N 0 0 410.347 5.370 40 10 HKCBRN O=C1NC(=S)S/C1=C\c1cc(Cl)c(OCc2ccccc2F)c(Cl)c1 ZINC000408532072 558474499 /nfs/dbraw/zinc/47/44/99/558474499.db2.gz SGMACPYQEJTKGJ-AUWJEWJLSA-N 0 0 414.310 5.200 40 10 HKCBRN CC1=NN(c2ccc(C)c(Cl)c2)C(=O)C1=CNNc1cccc(Cl)c1Cl ZINC000408532307 558466727 /nfs/dbraw/zinc/46/67/27/558466727.db2.gz MIBJKAHYCLWCLG-LCYFTJDESA-N 0 0 409.704 5.178 40 10 HKCBRN CC1=NN(c2ccc(Br)cc2C)C(=O)C1=CNc1ccc(Cl)cc1 ZINC000408535355 558476861 /nfs/dbraw/zinc/47/68/61/558476861.db2.gz SKKBYESXZDXDSS-YBEGLDIGSA-N 0 0 404.695 5.129 40 10 HKCBRN CC1=NN(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C(=O)/C1=C\N1CCCCC1 ZINC000408536779 558477633 /nfs/dbraw/zinc/47/76/33/558477633.db2.gz XZLFRTXVRWVQBP-ULJHMMPZSA-N 0 0 403.570 5.247 40 10 HKCBRN CCc1ccccc1NC=C1C(=O)N(c2ccc(Br)c(C)c2C)N=C1C ZINC000408537260 557338205 /nfs/dbraw/zinc/33/82/05/557338205.db2.gz ZTMCXDBSFAOJHX-ATVHPVEESA-N 0 0 412.331 5.347 40 10 HKCBRN CCCCCCOc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2C)cc1OCC ZINC000408540060 558488412 /nfs/dbraw/zinc/48/84/12/558488412.db2.gz MJPKYCACZXMCSP-XLNRJJMWSA-N 0 0 406.526 5.851 40 10 HKCBRN CCOC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cccc(Oc2ccccc2)c1 ZINC000408585413 557488897 /nfs/dbraw/zinc/48/88/97/557488897.db2.gz DCWPZUZTXJSMNL-JCMHNJIXSA-N 0 0 405.494 5.198 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1cccc(F)c1 ZINC000408585424 558518426 /nfs/dbraw/zinc/51/84/26/558518426.db2.gz DHFDPTKZWDWCNQ-DHDCSXOGSA-N 0 0 406.240 5.010 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1cccc(C)c1 ZINC000408585495 558518655 /nfs/dbraw/zinc/51/86/55/558518655.db2.gz GCAQFPLBNBAFBN-LSCVHKIXSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1cccc(C)c1 ZINC000408585963 557489718 /nfs/dbraw/zinc/48/97/18/557489718.db2.gz KQYRRUOKTSEBBJ-YBEGLDIGSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1cccc(F)c1 ZINC000408587700 558519397 /nfs/dbraw/zinc/51/93/97/558519397.db2.gz TVULLBCWMVRNNL-IDUWFGFVSA-N 0 0 406.240 5.010 40 10 HKCBRN CC(C)COc1ccccc1/C=C1\SC(=S)N(c2cccc3ccccc32)C1=O ZINC000408598901 558533028 /nfs/dbraw/zinc/53/30/28/558533028.db2.gz CJFNFYOOUQQSPH-HMAPJEAMSA-N 0 0 419.571 6.280 40 10 HKCBRN CC(C)COc1ccccc1/C=C1\SC(=S)N(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000408599028 558533275 /nfs/dbraw/zinc/53/32/75/558533275.db2.gz CQLJWZPJHBYHFL-WQRHYEAKSA-N 0 0 414.508 5.035 40 10 HKCBRN CCCOc1ccccc1/C=C1\SC(=S)N(c2ccc(F)c(Cl)c2)C1=O ZINC000408599177 558533504 /nfs/dbraw/zinc/53/35/04/558533504.db2.gz FPOBROKBKWJNIO-YVLHZVERSA-N 0 0 407.919 5.674 40 10 HKCBRN CC(C)COc1ccccc1/C=C1\SC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000408599685 557509963 /nfs/dbraw/zinc/50/99/63/557509963.db2.gz JDTYWSMJMHSSSU-WQRHYEAKSA-N 0 0 403.956 5.781 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3OCC(C)C)SC2=S)cc1 ZINC000408599864 558534560 /nfs/dbraw/zinc/53/45/60/558534560.db2.gz NDMJDOPGFKTKBD-DEDYPNTBSA-N 0 0 413.564 5.526 40 10 HKCBRN CC(C)COc1ccccc1/C=C1\SC(=S)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000408599938 558534784 /nfs/dbraw/zinc/53/47/84/558534784.db2.gz PAOMJXVOWIDFPM-ZDLGFXPLSA-N 0 0 414.508 5.035 40 10 HKCBRN CCCOc1ccccc1/C=C1\SC(=S)N(c2ccc(OC)c(Cl)c2)C1=O ZINC000408600049 558534763 /nfs/dbraw/zinc/53/47/63/558534763.db2.gz SDWXFOGTGBRKML-WQRHYEAKSA-N 0 0 419.955 5.543 40 10 HKCBRN CC(C)COc1ccccc1/C=C1\SC(=S)N(c2ccc(F)c(Cl)c2)C1=O ZINC000408600056 558534826 /nfs/dbraw/zinc/53/48/26/558534826.db2.gz SHDBREUUPGEUHG-NVMNQCDNSA-N 0 0 421.946 5.920 40 10 HKCBRN CC(C)COc1ccccc1/C=C1/SC(=S)N(c2ccc(N(C)C)cc2)C1=O ZINC000408600126 558535057 /nfs/dbraw/zinc/53/50/57/558535057.db2.gz VDSXFUFEFQOKJO-DEDYPNTBSA-N 0 0 412.580 5.193 40 10 HKCBRN CC(C)COc1ccccc1/C=C1\SC(=S)N(c2cccc(Cl)c2)C1=O ZINC000408600446 558535077 /nfs/dbraw/zinc/53/50/77/558535077.db2.gz YPLWKIQNCFQYSS-ZDLGFXPLSA-N 0 0 403.956 5.781 40 10 HKCBRN CCCOc1ccccc1/C=C1\SC(=S)N(c2cccc3ccccc32)C1=O ZINC000408600536 558535024 /nfs/dbraw/zinc/53/50/24/558535024.db2.gz CRFAZYFZYUINDZ-QNGOZBTKSA-N 0 0 405.544 6.034 40 10 HKCBRN CCCOc1ccccc1/C=C1/SC(=S)N(c2cccc(SC)c2)C1=O ZINC000408600554 558532542 /nfs/dbraw/zinc/53/25/42/558532542.db2.gz DEOHVHMFSWGZRO-LDADJPATSA-N 0 0 401.578 5.603 40 10 HKCBRN CCCOc1ccccc1/C=C1\SC(=S)N(c2ccc(Cl)cc2Cl)C1=O ZINC000408600707 558532830 /nfs/dbraw/zinc/53/28/30/558532830.db2.gz FFDAVDMHFVTMFB-YVLHZVERSA-N 0 0 424.374 6.188 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C\c1ccc(OCC(C)C)c(Br)c1 ZINC000408600929 558538361 /nfs/dbraw/zinc/53/83/61/558538361.db2.gz HIDYZWDTNZCDFW-WQRHYEAKSA-N 0 0 413.315 5.290 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccc(F)cc3F)o2)SC(=S)N1c1ccccc1F ZINC000408600949 558538294 /nfs/dbraw/zinc/53/82/94/558538294.db2.gz HPKMJNFGQJRHDK-ZDLGFXPLSA-N 0 0 417.433 5.770 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(OCC(C)C)c(Br)c2)SC1=S ZINC000408601423 558538576 /nfs/dbraw/zinc/53/85/76/558538576.db2.gz JTGIYHYQEFXUKJ-DHDCSXOGSA-N 0 0 414.390 5.095 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C\c2ccc(-c3ccc(F)cc3F)o2)SC1=S ZINC000408601531 558538635 /nfs/dbraw/zinc/53/86/35/558538635.db2.gz KLGSDBFGNNSDCB-YBFXNURJSA-N 0 0 413.470 5.939 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccc(F)cc3F)o2)SC(=S)N1C1CCCCC1 ZINC000408601828 558538619 /nfs/dbraw/zinc/53/86/19/558538619.db2.gz LLWGTZIBPRQQTH-WQRHYEAKSA-N 0 0 405.491 5.759 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(-c4ccc(F)cc4F)o3)SC2=S)cc1 ZINC000408602447 558538589 /nfs/dbraw/zinc/53/85/89/558538589.db2.gz NYWKIEFFTLOSCM-ODLFYWEKSA-N 0 0 413.470 5.939 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3ccccc3OCC(C)C)SC2=S)c1 ZINC000408603465 557523841 /nfs/dbraw/zinc/52/38/41/557523841.db2.gz QYWXNPSACYERLQ-YBFXNURJSA-N 0 0 415.605 5.849 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2ccc(-c3ccc(F)cc3F)o2)SC1=S ZINC000408604146 557525142 /nfs/dbraw/zinc/52/51/42/557525142.db2.gz TUGWJCBOLHZPHN-VCHYOVAHSA-N 0 0 416.474 5.181 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccc(F)cc3F)o2)SC(=S)N1c1cccc(F)c1 ZINC000408604228 558538873 /nfs/dbraw/zinc/53/88/73/558538873.db2.gz ULPGKAGUYYMSLQ-ZDLGFXPLSA-N 0 0 417.433 5.770 40 10 HKCBRN CCCOc1ccccc1/C=C1\SC(=S)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000408604518 557527018 /nfs/dbraw/zinc/52/70/18/557527018.db2.gz VAOWSIMZHKXNEM-YVLHZVERSA-N 0 0 424.374 6.188 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C/c3ccc(-c4ccc(F)cc4F)o3)SC2=S)c1 ZINC000408604675 558539000 /nfs/dbraw/zinc/53/90/00/558539000.db2.gz WBTCNOHWQLIZLF-ODLFYWEKSA-N 0 0 413.470 5.939 40 10 HKCBRN CCCOc1ccccc1/C=C1\SC(=S)N(c2cccc(C(F)(F)F)c2)C1=O ZINC000408605629 558539104 /nfs/dbraw/zinc/53/91/04/558539104.db2.gz YKVFCVOHNCSGMK-BOPFTXTBSA-N 0 0 423.481 5.900 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccc(F)cc3F)o2)SC(=S)N1Cc1ccccc1 ZINC000408605879 558539135 /nfs/dbraw/zinc/53/91/35/558539135.db2.gz ZBMRUXURQJGUKF-ODLFYWEKSA-N 0 0 413.470 5.626 40 10 HKCBRN O=C(Nc1ccc(Oc2cccc3ccccc32)cc1)[C@H]1CC(=O)N(c2ccccc2)C1 ZINC000408639553 557607143 /nfs/dbraw/zinc/60/71/43/557607143.db2.gz FYBGTESCSHAHNX-FQEVSTJZSA-N 0 0 422.484 5.624 40 10 HKCBRN O=C(Nc1ccc(Oc2cccc3ccccc32)cc1)[C@@H]1CC(=O)N(c2ccccc2)C1 ZINC000408639554 557607157 /nfs/dbraw/zinc/60/71/57/557607157.db2.gz FYBGTESCSHAHNX-HXUWFJFHSA-N 0 0 422.484 5.624 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(NC(=O)[C@@H]2CC(=O)N(c3cccc(Cl)c3C)C2)cc1 ZINC000408706512 558583042 /nfs/dbraw/zinc/58/30/42/558583042.db2.gz AMNBQQRYEAUBAJ-GOSISDBHSA-N 0 0 421.928 5.048 40 10 HKCBRN Cc1ccc(C)n1-c1ccc(NC(=O)[C@H]2CC(=O)N(c3cccc(Cl)c3C)C2)cc1 ZINC000408706513 558583127 /nfs/dbraw/zinc/58/31/27/558583127.db2.gz AMNBQQRYEAUBAJ-SFHVURJKSA-N 0 0 421.928 5.048 40 10 HKCBRN O=C1/C(=C\c2cc(Cl)ccc2O)SC(=S)N1c1cccc(C(F)(F)F)c1 ZINC000408718856 558585778 /nfs/dbraw/zinc/58/57/78/558585778.db2.gz ORHGUOALJDJADC-VGOFMYFVSA-N 0 0 415.845 5.470 40 10 HKCBRN Cc1ccc(NCN2C(=O)/C(=C\c3cccc(Br)c3)SC2=S)cc1 ZINC000408719026 558585764 /nfs/dbraw/zinc/58/57/64/558585764.db2.gz GDMAKFSSAPDCAX-MHWRWJLKSA-N 0 0 419.369 5.028 40 10 HKCBRN Cc1cccc(-n2c(-c3ccc(Br)cc3)cc3c2CC(C)(C)CC3=O)c1C ZINC000408720298 558583978 /nfs/dbraw/zinc/58/39/78/558583978.db2.gz KZBAEXXAGIALRY-UHFFFAOYSA-N 0 0 422.366 6.679 40 10 HKCBRN O=C1C(=Cc2cccc(Cl)c2)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 ZINC000408721038 557768719 /nfs/dbraw/zinc/76/87/19/557768719.db2.gz IPVHSWBMXJDYSN-UHFFFAOYSA-N 0 0 418.905 5.088 40 10 HKCBRN Cc1ccc(-n2c(-c3ccccc3)cc3c2CC(C)(C)CC3=O)c(Br)c1 ZINC000408721071 557768684 /nfs/dbraw/zinc/76/86/84/557768684.db2.gz JWDOMFZUPJQAON-UHFFFAOYSA-N 0 0 408.339 6.370 40 10 HKCBRN O=C(Nc1ccccc1F)c1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408721627 558587832 /nfs/dbraw/zinc/58/78/32/558587832.db2.gz KFTXXPRIQWJAMY-UHFFFAOYSA-N 0 0 417.443 6.481 40 10 HKCBRN COc1ccc(OC)c(C2=C/C(=C/c3ccc(OCc4ccccc4)cc3)C(=O)O2)c1 ZINC000408721848 558588280 /nfs/dbraw/zinc/58/82/80/558588280.db2.gz ALKSGGXKDJFIQM-ZHZULCJRSA-N 0 0 414.457 5.264 40 10 HKCBRN COc1ccc2cc(C3=C/C(=C\c4c(OC)ccc5ccccc54)C(=O)O3)ccc2c1 ZINC000408721987 558588288 /nfs/dbraw/zinc/58/82/88/558588288.db2.gz BYNNYMDYMLHXTL-RCCKNPSSSA-N 0 0 408.453 5.992 40 10 HKCBRN COc1ccc(C2=C/C(=C/c3ccc(OCc4ccccc4)cc3)C(=O)O2)c(OC)c1 ZINC000408722091 558588596 /nfs/dbraw/zinc/58/85/96/558588596.db2.gz DILRYLQNFQOEAC-ZHZULCJRSA-N 0 0 414.457 5.264 40 10 HKCBRN COc1ccc2cc(C3=C/C(=C/c4ccc(Br)cc4)C(=O)O3)ccc2c1 ZINC000408722100 558588557 /nfs/dbraw/zinc/58/85/57/558588557.db2.gz DOMNREDQBSIEIT-ZDLGFXPLSA-N 0 0 407.263 5.592 40 10 HKCBRN O=C1OC(c2cccc3ccccc32)=C/C1=C/c1ccc(OCc2ccccc2)cc1 ZINC000408722745 558588686 /nfs/dbraw/zinc/58/86/86/558588686.db2.gz MVZIQTGLCSHVIQ-QJOMJCCJSA-N 0 0 404.465 6.400 40 10 HKCBRN CCCCOc1ccc(/C=C2/C=C(c3ccc4cc(OC)ccc4c3)OC2=O)cc1 ZINC000408722814 558588711 /nfs/dbraw/zinc/58/87/11/558588711.db2.gz NLJIRYWBXONDKD-HMAPJEAMSA-N 0 0 400.474 6.009 40 10 HKCBRN COc1ccc2cc(C3=C/C(=C/c4cccc(Br)c4)C(=O)O3)ccc2c1 ZINC000408723094 558588912 /nfs/dbraw/zinc/58/89/12/558588912.db2.gz QGTAORRASHERPT-NVMNQCDNSA-N 0 0 407.263 5.592 40 10 HKCBRN O=C1OC(c2ccc3ccccc3c2)=C/C1=C/c1ccc(OCc2ccccc2)cc1 ZINC000408723110 558588907 /nfs/dbraw/zinc/58/89/07/558588907.db2.gz QJMZUKHJHLZQFF-XYGWBWBKSA-N 0 0 404.465 6.400 40 10 HKCBRN O=C1OC(c2ccc(Br)cc2)=C/C1=C/c1cccc(Br)c1 ZINC000408723223 558588974 /nfs/dbraw/zinc/58/89/74/558588974.db2.gz RJVKGXJUJQGVDX-JYRVWZFOSA-N 0 0 406.073 5.193 40 10 HKCBRN O=C1NC(=S)SC1=CC1=CC(=NNc2cccc(C(F)(F)F)c2)C=CC1=O ZINC000408724612 558586927 /nfs/dbraw/zinc/58/69/27/558586927.db2.gz GCXWODKFVCPPFE-QSTNYVNOSA-N 0 0 409.414 5.315 40 10 HKCBRN Cc1ccc2cc(C3=C/C(=C/c4ccc(OCc5ccccc5)cc4)C(=O)O3)ccc2c1 ZINC000408725050 558587666 /nfs/dbraw/zinc/58/76/66/558587666.db2.gz GKCAYIQAAVEXRB-QQXSKIMKSA-N 0 0 418.492 6.709 40 10 HKCBRN CCN1C(=O)C(=CC2=CC(=NNc3cccc(Cl)c3)C=CC2=O)SC1=S ZINC000408725741 558590336 /nfs/dbraw/zinc/59/03/36/558590336.db2.gz HEWXPJICOUWBHI-UKAHEONWSA-N 0 0 403.916 5.682 40 10 HKCBRN CN1C(=O)C(=CC2=CC(=NNc3cccc4ccccc43)C=CC2=O)SC1=S ZINC000408726294 558590748 /nfs/dbraw/zinc/59/07/48/558590748.db2.gz LCWWOYDOGLLFFS-POJNRUHKSA-N 0 0 405.504 5.792 40 10 HKCBRN CCN1C(=O)C(=CC2=CC(=NNc3cccc4ccccc43)C=CC2=O)SC1=S ZINC000408726394 558589167 /nfs/dbraw/zinc/58/91/67/558589167.db2.gz LZSBCKUWVCDVPN-RLYGRLLTSA-N 0 0 419.531 6.182 40 10 HKCBRN O=C1NC(=S)SC1=CC1=CC(=NNc2ccc(Cl)cc2Cl)C=CC1=O ZINC000408727171 558589405 /nfs/dbraw/zinc/58/94/05/558589405.db2.gz VAMGLYDFOCNIPE-SXKXGMSHSA-N 0 0 410.307 5.603 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)c(O)c1 ZINC000408727810 558592137 /nfs/dbraw/zinc/59/21/37/558592137.db2.gz XVYMUZFADGXVLN-VCHYOVAHSA-N 0 0 418.971 5.298 40 10 HKCBRN CCN1C(=O)C(=CC2=CC(=NNc3ccccc3Cl)C=CC2=O)SC1=S ZINC000408727861 558592140 /nfs/dbraw/zinc/59/21/40/558592140.db2.gz YFCMAZQLVWQCTQ-BCUDMANESA-N 0 0 403.916 5.682 40 10 HKCBRN CN1C(=O)C(=CC2=CC(=NNc3ccc(Cl)cc3Cl)C=CC2=O)SC1=S ZINC000408727867 558592099 /nfs/dbraw/zinc/59/20/99/558592099.db2.gz YFMQTDQUERTIMW-FKTJNPQFSA-N 0 0 424.334 5.945 40 10 HKCBRN C1=C[C@H]2c3c4c5c(c6c3N(C[C@@H]2C1)C[C@@H]1CC=C[C@H]61)[C@H]1C=CC[C@H]1CN5C[C@H]1CC=C[C@@H]41 ZINC000408731030 558591042 /nfs/dbraw/zinc/59/10/42/558591042.db2.gz IMIXCJGIPPIHNN-FOJXQPQASA-N 0 0 420.600 5.993 40 10 HKCBRN C1=C[C@H]2c3c4c5c(c6c3N(C[C@@H]2C1)C[C@@H]1CC=C[C@H]61)[C@@H]1C=CC[C@@H]1CN5C[C@H]1CC=C[C@@H]41 ZINC000408731040 558590989 /nfs/dbraw/zinc/59/09/89/558590989.db2.gz IMIXCJGIPPIHNN-MBLBZBMASA-N 0 0 420.600 5.993 40 10 HKCBRN C1=C[C@H]2c3c4c5c(c6c3N(C[C@@H]2C1)C[C@@H]1CC=C[C@H]61)[C@H]1C=CC[C@@H]1CN5C[C@H]1CC=C[C@@H]41 ZINC000408731041 557794742 /nfs/dbraw/zinc/79/47/42/557794742.db2.gz IMIXCJGIPPIHNN-OAKLKQKCSA-N 0 0 420.600 5.993 40 10 HKCBRN C1=C[C@H]2c3c4c5c(c6c3N(C[C@@H]2C1)C[C@@H]1CC=C[C@H]61)[C@@H]1C=CC[C@H]1CN5C[C@H]1CC=C[C@@H]41 ZINC000408731045 557794781 /nfs/dbraw/zinc/79/47/81/557794781.db2.gz IMIXCJGIPPIHNN-SQSLRXIWSA-N 0 0 420.600 5.993 40 10 HKCBRN Cc1cc(-c2nc3sc4c(c3c(=O)[nH]2)CCCC4)c(C)n1-c1cccc(Cl)c1C ZINC000408734457 558592983 /nfs/dbraw/zinc/59/29/83/558592983.db2.gz GNRGRZAXWGNNDB-UHFFFAOYSA-N 0 0 423.969 6.312 40 10 HKCBRN Cc1cc(-c2nc3sc4c(c3c(=O)[nH]2)CCCC4)c(C)n1-c1ccc(C)c(Cl)c1 ZINC000408734693 557800872 /nfs/dbraw/zinc/80/08/72/557800872.db2.gz IOZREXVHGMPMBE-UHFFFAOYSA-N 0 0 423.969 6.312 40 10 HKCBRN Cc1cc(-c2nc3sc4c(c3c(=O)[nH]2)CCCC4)c(C)n1-c1cccc(Cl)c1 ZINC000408734785 558593810 /nfs/dbraw/zinc/59/38/10/558593810.db2.gz JVQJPUMVODDJLP-UHFFFAOYSA-N 0 0 409.942 6.004 40 10 HKCBRN O=C(Nc1ccccc1)Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408734798 558593879 /nfs/dbraw/zinc/59/38/79/558593879.db2.gz DWZFSWLEFWEEAI-UHFFFAOYSA-N 0 0 414.468 6.733 40 10 HKCBRN CCOc1ccc(-n2c(C)cc(-c3nc4sc5c(c4c(=O)[nH]3)CCCC5)c2C)cc1 ZINC000408734889 558593816 /nfs/dbraw/zinc/59/38/16/558593816.db2.gz LESDPCDBQKMTBM-UHFFFAOYSA-N 0 0 419.550 5.749 40 10 HKCBRN Cc1cc(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)c(C)n1-c1cccc(C)c1C ZINC000408735032 558593837 /nfs/dbraw/zinc/59/38/37/558593837.db2.gz MOCDCSRAYBHROY-UHFFFAOYSA-N 0 0 403.551 5.967 40 10 HKCBRN O=C(Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)NC1CCCCC1 ZINC000408735138 558593791 /nfs/dbraw/zinc/59/37/91/558593791.db2.gz JXZOVTKCUSHCEW-UHFFFAOYSA-N 0 0 420.516 6.544 40 10 HKCBRN O=C1C(=CC2=CC(=NNc3ccccc3)C=CC2=O)SC(=S)N1c1ccccc1 ZINC000408735190 558593799 /nfs/dbraw/zinc/59/37/99/558593799.db2.gz LLPSABTTXFNVTF-TWGQILOBSA-N 0 0 417.515 6.213 40 10 HKCBRN CCOC(=O)c1ccc(-n2c(C)cc(-c3nc4sc(C)c(C)c4c(=O)[nH]3)c2C)cc1 ZINC000408735214 557801788 /nfs/dbraw/zinc/80/17/88/557801788.db2.gz ORHRFUBRTKKSJH-UHFFFAOYSA-N 0 0 421.522 5.265 40 10 HKCBRN O=C(Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)N1CCCCC1 ZINC000408735229 558593807 /nfs/dbraw/zinc/59/38/07/558593807.db2.gz MQJJLADUPFVRJZ-UHFFFAOYSA-N 0 0 406.489 6.107 40 10 HKCBRN COc1ccc(-n2c(C)cc(-c3nc4sc5c(c4c(=O)[nH]3)CCCC5)c2C)cc1 ZINC000408735301 558594097 /nfs/dbraw/zinc/59/40/97/558594097.db2.gz QBNJTMIMCZDDHD-UHFFFAOYSA-N 0 0 405.523 5.359 40 10 HKCBRN S=C(Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)N1CCCC1 ZINC000408735341 558594103 /nfs/dbraw/zinc/59/41/03/558594103.db2.gz NPFLNZJWZYLHPM-UHFFFAOYSA-N 0 0 409.514 5.849 40 10 HKCBRN O=C(Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)N1CCCCCC1 ZINC000408735385 558594105 /nfs/dbraw/zinc/59/41/05/558594105.db2.gz PGLZLJKBCLYSRU-UHFFFAOYSA-N 0 0 420.516 6.497 40 10 HKCBRN S=C(Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)N1CCCCC1 ZINC000408735430 558594087 /nfs/dbraw/zinc/59/40/87/558594087.db2.gz PWVQAIFGLKYJEK-UHFFFAOYSA-N 0 0 423.541 6.239 40 10 HKCBRN Cc1cc(-c2nc3sc4c(c3c(=O)[nH]2)CCCC4)c(C)n1-c1ccc(Cl)cc1 ZINC000408735627 557801896 /nfs/dbraw/zinc/80/18/96/557801896.db2.gz VEAYKCMWRMFVIT-UHFFFAOYSA-N 0 0 409.942 6.004 40 10 HKCBRN Cc1cc(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)c(C)n1-c1ccc(C)c(C)c1 ZINC000408735700 558594100 /nfs/dbraw/zinc/59/41/00/558594100.db2.gz WIJNCSPISOPWBF-UHFFFAOYSA-N 0 0 403.551 5.967 40 10 HKCBRN O=C(Nc1ccncc1)Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408735727 558594094 /nfs/dbraw/zinc/59/40/94/558594094.db2.gz VUVSHNREEGTHQQ-UHFFFAOYSA-N 0 0 415.456 5.550 40 10 HKCBRN S=C(Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)N1CCCCC1 ZINC000408735769 558592851 /nfs/dbraw/zinc/59/28/51/558592851.db2.gz WSVLDIOEZXKYAW-UHFFFAOYSA-N 0 0 422.557 6.272 40 10 HKCBRN COc1cc([C@@H]2Nc3ccc(F)cc3[C@@H]3C=CC[C@@H]32)ccc1OCc1ccccc1 ZINC000408736020 558594485 /nfs/dbraw/zinc/59/44/85/558594485.db2.gz ABKZAXUSUJUIQI-SWYRRKHMSA-N 0 0 401.481 6.240 40 10 HKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3cccc4ccccc43)cc1)N2 ZINC000408736026 558594489 /nfs/dbraw/zinc/59/44/89/558594489.db2.gz APFQWMAVENBSQZ-ALTZYDRJSA-N 0 0 421.515 7.384 40 10 HKCBRN Cc1ccc(COc2ccc([C@@H]3Nc4ccc([N+](=O)[O-])cc4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000408736030 558594492 /nfs/dbraw/zinc/59/44/92/558594492.db2.gz BBBCUWDZKLJHEU-UMFSSWHCSA-N 0 0 412.489 6.309 40 10 HKCBRN Cc1ccc(COc2ccc([C@@H]3Nc4c5ccccc5ccc4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000408736033 558594575 /nfs/dbraw/zinc/59/45/75/558594575.db2.gz BDZUXTBNLGWBAL-XQFUHLNNSA-N 0 0 417.552 7.554 40 10 HKCBRN Clc1ccc(COc2ccc([C@@H]3Nc4ccc(Cl)cc4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000408736042 558594505 /nfs/dbraw/zinc/59/45/05/558594505.db2.gz BWGFZTDZQHKWEV-SLSDLSHTSA-N 0 0 422.355 7.399 40 10 HKCBRN O=C(Oc1ccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)cc1)c1ccccc1 ZINC000408736061 558594507 /nfs/dbraw/zinc/59/45/07/558594507.db2.gz CNWBYNXOGMGCLA-QTEQDKRBSA-N 0 0 401.893 6.386 40 10 HKCBRN Brc1cccc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000408736065 558594562 /nfs/dbraw/zinc/59/45/62/558594562.db2.gz CQRKRZPLFMDOSC-VKJFTORMSA-N 0 0 405.133 6.038 40 10 HKCBRN O=C(Oc1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1)c1ccccc1 ZINC000408736085 558594737 /nfs/dbraw/zinc/59/47/37/558594737.db2.gz DSQYYTGHEBVEMF-DPLHUUCSSA-N 0 0 401.893 6.386 40 10 HKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccc4ccccc4c3)cc1)N2 ZINC000408736088 558594818 /nfs/dbraw/zinc/59/48/18/558594818.db2.gz DUIQAURDJDIKCA-ALTZYDRJSA-N 0 0 421.515 7.384 40 10 HKCBRN Brc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc3c4c(cccc41)CC3)N2 ZINC000408736092 558594702 /nfs/dbraw/zinc/59/47/02/558594702.db2.gz DYSHKGLCJINYLB-YIGJPRQDSA-N 0 0 402.335 6.527 40 10 HKCBRN Clc1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC3CSC3)cc1)N2 ZINC000408736103 558594692 /nfs/dbraw/zinc/59/46/92/558594692.db2.gz FLDRPZQFKVVDGX-UWVAXJGDSA-N 0 0 404.362 6.314 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c3ccccc3ccc2[C@@H]2C=CC[C@@H]21 ZINC000408736108 558594706 /nfs/dbraw/zinc/59/47/06/558594706.db2.gz FOGCBOFGUSHRCE-IEGUWTFLSA-N 0 0 406.323 6.437 40 10 HKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2ccc(Oc3ccccc3)cc2[C@@H]2C=CC[C@@H]21 ZINC000408736114 558594831 /nfs/dbraw/zinc/59/48/31/558594831.db2.gz FSOLHEZUCCOKOV-YDIMBITNSA-N 0 0 407.435 7.324 40 10 HKCBRN Clc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccccc3Cl)cc1)N2 ZINC000408736116 558594715 /nfs/dbraw/zinc/59/47/15/558594715.db2.gz GEINQEXKYIJPNO-CZSZKKDXSA-N 0 0 422.355 7.399 40 10 HKCBRN C1=C[C@H]2c3cc(Oc4ccccc4)ccc3N[C@@H](c3ccc4c5c(cccc53)CC4)[C@H]2C1 ZINC000408736122 558594705 /nfs/dbraw/zinc/59/47/05/558594705.db2.gz GPIWLKRYLJVMDL-FWVWFNHBSA-N 0 0 415.536 7.557 40 10 HKCBRN Cc1ccc(COc2ccc([C@@H]3Nc4ccc(Cl)cc4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000408736125 558594772 /nfs/dbraw/zinc/59/47/72/558594772.db2.gz GSIOERCELITCBZ-UMFSSWHCSA-N 0 0 401.937 7.054 40 10 HKCBRN Brc1cc2c(cc1[C@@H]1Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]31)OCO2 ZINC000408736128 558594747 /nfs/dbraw/zinc/59/47/47/558594747.db2.gz GVJNUAIKPBSWJZ-VBURHUQHSA-N 0 0 420.306 6.158 40 10 HKCBRN CC(C)COc1ccc([C@@H]2Nc3ccc(Oc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000408736172 557802514 /nfs/dbraw/zinc/80/25/14/557802514.db2.gz JLAORRPFCANTTC-QQNWGBJXSA-N 0 0 411.545 7.340 40 10 HKCBRN Clc1ccc(COc2ccc([C@@H]3Nc4c(Cl)cccc4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000408736181 558594806 /nfs/dbraw/zinc/59/48/06/558594806.db2.gz KAFWTYQAPQDOFV-DPLHUUCSSA-N 0 0 422.355 7.399 40 10 HKCBRN Clc1cccc2c1N[C@@H](c1cc3c(cc1Br)OCO3)[C@H]1CC=C[C@@H]21 ZINC000408736199 557802526 /nfs/dbraw/zinc/80/25/26/557802526.db2.gz KYFQWLJNHMBKBF-LIBAHTEVSA-N 0 0 404.691 5.658 40 10 HKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCc3ccc(Cl)cc3)cc1)N2 ZINC000408736219 558594741 /nfs/dbraw/zinc/59/47/41/558594741.db2.gz MJLRTIHXEGOHMF-SLSDLSHTSA-N 0 0 405.900 6.885 40 10 HKCBRN COc1cc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)ccc1OCc1ccccc1 ZINC000408736231 558594731 /nfs/dbraw/zinc/59/47/31/558594731.db2.gz MTBYBFPMFBVZTN-RNHFSVANSA-N 0 0 417.936 6.754 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(Oc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1Cl ZINC000408736239 558594768 /nfs/dbraw/zinc/59/47/68/558594768.db2.gz NJOHZXVLBSBJSC-IMWIBFENSA-N 0 0 408.328 7.612 40 10 HKCBRN COc1ccc([C@@H]2Nc3ccc(Oc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1[N+](=O)[O-] ZINC000408736240 558594759 /nfs/dbraw/zinc/59/47/59/558594759.db2.gz NKPSGRXOTMTEJO-RNHFSVANSA-N 0 0 414.461 6.222 40 10 HKCBRN CCOC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OCC)c(OCC)c1)N2 ZINC000408736241 558594777 /nfs/dbraw/zinc/59/47/77/558594777.db2.gz NLFNHLOQBLGJRH-IMWIBFENSA-N 0 0 407.510 5.487 40 10 HKCBRN Brc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC3CSC3)cc1)N2 ZINC000408736263 558594946 /nfs/dbraw/zinc/59/49/46/558594946.db2.gz OIDULMDXDSMRDJ-LQWHRVPQSA-N 0 0 414.368 5.770 40 10 HKCBRN CCOC(=O)c1cccc2c1N[C@@H](c1ccc(OC3CSC3)cc1)[C@H]1CC=C[C@@H]21 ZINC000408736291 558594908 /nfs/dbraw/zinc/59/49/08/558594908.db2.gz PHJJRFBHVDBIEU-DXIQSLLYSA-N 0 0 407.535 5.184 40 10 HKCBRN O=C(Oc1ccc([C@@H]2Nc3ccc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)cc1)c1ccccc1 ZINC000408736347 558594917 /nfs/dbraw/zinc/59/49/17/558594917.db2.gz QOYZREOGNYGHAA-DPLHUUCSSA-N 0 0 412.445 5.641 40 10 HKCBRN O=[N+]([O-])c1ccc(COc2ccc([C@@H]3Nc4ccc(F)cc4[C@@H]4C=CC[C@@H]43)cc2)cc1 ZINC000408736455 558594955 /nfs/dbraw/zinc/59/49/55/558594955.db2.gz UEVRXVIXGXCODC-SLSDLSHTSA-N 0 0 416.452 6.139 40 10 HKCBRN COc1cc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)ccc1OCc1ccccc1 ZINC000408736469 558595125 /nfs/dbraw/zinc/59/51/25/558595125.db2.gz UZFIZYNQEWHPFA-SWYRRKHMSA-N 0 0 417.936 6.754 40 10 HKCBRN Clc1ccc2c(c1Cl)N[C@@H](c1ccc(OC3CSC3)cc1)[C@H]1CC=C[C@@H]21 ZINC000408736475 558595051 /nfs/dbraw/zinc/59/50/51/558595051.db2.gz VIIRVARVXNIPTP-GUXCAODWSA-N 0 0 404.362 6.314 40 10 HKCBRN Brc1cccc([C@@H]2Nc3ccc(Oc4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000408736524 558595331 /nfs/dbraw/zinc/59/53/31/558595331.db2.gz XIHQGGATHHXVOW-DPLHUUCSSA-N 0 0 418.334 7.068 40 10 HKCBRN C1=C[C@H]2c3ccc4ccccc4c3N[C@@H](c3ccc(OCc4ccccc4)cc3)[C@H]2C1 ZINC000408736530 558595360 /nfs/dbraw/zinc/59/53/60/558595360.db2.gz XLOSPAOVRBRTLG-PBWSGDRGSA-N 0 0 403.525 7.245 40 10 HKCBRN O=C(Oc1ccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)cc1)c1ccccc1 ZINC000408736624 558595373 /nfs/dbraw/zinc/59/53/73/558595373.db2.gz XVICLSKGYBFAIA-OBDYRVMHSA-N 0 0 417.508 6.886 40 10 HKCBRN COC(=O)c1cccc2c1N[C@@H](c1cc(Br)ccc1OC)[C@H]1CC=C[C@@H]21 ZINC000408736643 558595336 /nfs/dbraw/zinc/59/53/36/558595336.db2.gz YPWDPPFHTFGBTA-ZQGRQUNCSA-N 0 0 414.299 5.071 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)ccc(Cl)c2[C@@H]2C=CC[C@@H]21 ZINC000408736941 557802989 /nfs/dbraw/zinc/80/29/89/557802989.db2.gz DZEHBJWTJPXURH-LAPQFRIASA-N 0 0 404.735 6.246 40 10 HKCBRN CCOc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC(=O)c3ccccc3)cc1)N2 ZINC000408736966 558595306 /nfs/dbraw/zinc/59/53/06/558595306.db2.gz FJBPWWXVMDSSCH-UMFSSWHCSA-N 0 0 411.501 6.131 40 10 HKCBRN CCOc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc(Br)ccc1OC)N2 ZINC000408737075 558595371 /nfs/dbraw/zinc/59/53/71/558595371.db2.gz HOTRJSNVCSOSSB-VWKPWSFCSA-N 0 0 400.316 5.683 40 10 HKCBRN Clc1ccc([C@@H]2Nc3ccc(C45CC6CC(CC(C6)C4)C5)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000408737127 558595344 /nfs/dbraw/zinc/59/53/44/558595344.db2.gz KIWVIKOCVIMTPA-ZPSYUOPISA-N 0 0 416.008 7.634 40 10 HKCBRN COc1cc(OC)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1c3ccccc3cc3ccccc31)N2 ZINC000408737389 557803887 /nfs/dbraw/zinc/80/38/87/557803887.db2.gz ODJPEZJVAXWVLT-AWVRMFGXSA-N 0 0 407.513 6.837 40 10 HKCBRN CCOc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cc3c(cc1Br)OCO3)N2 ZINC000408737393 557803845 /nfs/dbraw/zinc/80/38/45/557803845.db2.gz ONFRRRWQZJCRNO-HKZYLEAXSA-N 0 0 414.299 5.403 40 10 HKCBRN CN(C)c1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3)C=C2c2ccccc2)cc1 ZINC000408737464 558595682 /nfs/dbraw/zinc/59/56/82/558595682.db2.gz BAMUKDOOHJJJGN-CAPFRKAQSA-N 0 0 400.909 5.877 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2)C=C(c2ccccc2)N1c1cccc2ccccc21 ZINC000408737507 558595775 /nfs/dbraw/zinc/59/57/75/558595775.db2.gz CEGXGETYFMFPEQ-OQKWZONESA-N 0 0 407.900 6.965 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C/c3ccc(Br)cc3)C=C2c2ccccc2)c1 ZINC000408737540 558595760 /nfs/dbraw/zinc/59/57/60/558595760.db2.gz CXMQNTJGFDJJSV-HMMYKYKNSA-N 0 0 416.318 6.229 40 10 HKCBRN O=C1/C(=C/c2ccc(Br)cc2)C=C(c2ccccc2)N1Cc1ccccc1 ZINC000408737981 558596482 /nfs/dbraw/zinc/59/64/82/558596482.db2.gz HDDBZSITLGDUHB-RCCKNPSSSA-N 0 0 416.318 5.916 40 10 HKCBRN O=C1/C(=C/c2ccc(Br)cc2)C=C(c2ccccc2)N1c1cccc(O)c1 ZINC000408737996 558596590 /nfs/dbraw/zinc/59/65/90/558596590.db2.gz HODXTCOQRYIHMI-QGOAFFKASA-N 0 0 418.290 5.626 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2)C=C(c2ccccc2)N1c1ccc2ncccc2c1 ZINC000408738035 558596743 /nfs/dbraw/zinc/59/67/43/558596743.db2.gz MFXDCHNGQRXMMD-RCCKNPSSSA-N 0 0 408.888 6.360 40 10 HKCBRN CCOc1cccc(N2C(=O)/C(=C/c3ccc(Cl)cc3)C=C2c2ccccc2)c1 ZINC000408738080 558596894 /nfs/dbraw/zinc/59/68/94/558596894.db2.gz MZSFLHLKJNFGNS-HMMYKYKNSA-N 0 0 401.893 6.210 40 10 HKCBRN CCOc1ccccc1N1C(=O)/C(=C/c2ccc(Cl)cc2)C=C1c1ccccc1 ZINC000408738138 558597144 /nfs/dbraw/zinc/59/71/44/558597144.db2.gz QBXJFKVDMZGLRH-CAPFRKAQSA-N 0 0 401.893 6.210 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(C)c([N+](=O)[O-])c3)C2=O)cc1 ZINC000408738416 558596318 /nfs/dbraw/zinc/59/63/18/558596318.db2.gz KOHKPBDEDAQQTJ-XSFVSMFZSA-N 0 0 412.445 5.383 40 10 HKCBRN O=C1/C(=C/c2ccc(Br)cc2)C=C(c2ccccc2)N1c1ccccc1 ZINC000408738562 558598459 /nfs/dbraw/zinc/59/84/59/558598459.db2.gz MBSKSGCZEZBZNM-XDJHFCHBSA-N 0 0 402.291 5.920 40 10 HKCBRN CCOc1cccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C=C2c2ccccc2)c1 ZINC000408738615 558598641 /nfs/dbraw/zinc/59/86/41/558598641.db2.gz MLTKFRQVYJSZRU-HMMYKYKNSA-N 0 0 412.445 5.465 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(Cl)c(O)c3)C2=O)cc1 ZINC000408738751 558598787 /nfs/dbraw/zinc/59/87/87/558598787.db2.gz NQMSDPMCSACWGO-QGOAFFKASA-N 0 0 403.865 5.526 40 10 HKCBRN CC(=O)c1ccc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)C=C2c2ccccc2)cc1 ZINC000408738764 558598809 /nfs/dbraw/zinc/59/88/09/558598809.db2.gz NZBUINGYONYNAS-RCCKNPSSSA-N 0 0 410.429 5.269 40 10 HKCBRN COC(=O)c1ccccc1N1C(=O)/C(=C/c2ccc(Cl)cc2)C=C1c1ccccc1 ZINC000408738766 558598818 /nfs/dbraw/zinc/59/88/18/558598818.db2.gz OAOSARDWTLNNGH-XDJHFCHBSA-N 0 0 415.876 5.598 40 10 HKCBRN O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)C=C(c2ccccc2)N1c1ccc2ncccc2c1 ZINC000408738787 558598761 /nfs/dbraw/zinc/59/87/61/558598761.db2.gz OLUQXYLBLYYZQL-RCCKNPSSSA-N 0 0 419.440 5.614 40 10 HKCBRN CCOc1ccccc1N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)C=C1c1ccccc1 ZINC000408738856 558598705 /nfs/dbraw/zinc/59/87/05/558598705.db2.gz PIIYTMWNGSISGP-CAPFRKAQSA-N 0 0 412.445 5.465 40 10 HKCBRN Cc1cc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C=C2c2ccccc2)ccc1F ZINC000408739072 558599213 /nfs/dbraw/zinc/59/92/13/558599213.db2.gz SOGYERBHEZLMJR-XMHGGMMESA-N 0 0 400.409 5.514 40 10 HKCBRN CC(C)c1ccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C=C2c2ccccc2)cc1 ZINC000408739312 558598039 /nfs/dbraw/zinc/59/80/39/558598039.db2.gz VKFBQKSYEDBXFK-CJLVFECKSA-N 0 0 410.473 6.190 40 10 HKCBRN CCN(CC)c1ccc(N2C(=O)/C(=C/c3ccc(OC)cc3)C=C2c2ccccc2)cc1 ZINC000408739449 558598253 /nfs/dbraw/zinc/59/82/53/558598253.db2.gz WHCKLNYRIRAZMS-FCDQGJHFSA-N 0 0 424.544 6.013 40 10 HKCBRN O=C1/C(=C/c2ccc(Br)cc2)C=C(c2ccccc2)N1c1ccc(O)cc1 ZINC000408739509 558598218 /nfs/dbraw/zinc/59/82/18/558598218.db2.gz XDZYWSKFVPBPIR-NBVRZTHBSA-N 0 0 418.290 5.626 40 10 HKCBRN O=C1/C(=C/c2ccc(Br)cc2)C=C(c2ccccc2)N1c1ccc(F)cc1 ZINC000408739526 558598153 /nfs/dbraw/zinc/59/81/53/558598153.db2.gz XIKHUBADHHBXBR-NBVRZTHBSA-N 0 0 420.281 6.060 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\C=C(c2ccc(Br)cc2)OC1=O ZINC000408740173 558599492 /nfs/dbraw/zinc/59/94/92/558599492.db2.gz AEVYBUJOYVUCAR-GHRIWEEISA-N 0 0 421.290 5.982 40 10 HKCBRN O=C1OC(c2ccc(Cl)cc2)=C/C1=C\c1ccc(OCc2ccccc2F)cc1 ZINC000408740200 558599403 /nfs/dbraw/zinc/59/94/03/558599403.db2.gz ALNYWUSDAAJGIM-CPNJWEJPSA-N 0 0 406.840 6.039 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)ccc1OCc1ccc(F)cc1 ZINC000408740340 558599503 /nfs/dbraw/zinc/59/95/03/558599503.db2.gz BDYDDZXXIQAROG-FYJGNVAPSA-N 0 0 416.448 5.703 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)ccc1OCc1cccc(C)c1 ZINC000408740365 558599520 /nfs/dbraw/zinc/59/95/20/558599520.db2.gz BKDMYQLEGXLIRQ-OEAKJJBVSA-N 0 0 412.485 5.872 40 10 HKCBRN O=C1OC(c2ccc(Cl)cc2)=C/C1=C/c1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000408740603 558599434 /nfs/dbraw/zinc/59/94/34/558599434.db2.gz CMTGASZTZLDGFE-ZROIWOOFSA-N 0 0 417.675 6.888 40 10 HKCBRN Cc1cccc(COc2ccc(/C=C3\C=C(c4ccc(Cl)cc4)OC3=O)cc2)c1 ZINC000408740657 558599409 /nfs/dbraw/zinc/59/94/09/558599409.db2.gz CVBMXYYOJJFPPC-KGENOOAVSA-N 0 0 402.877 6.209 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3cn(Cc4cccc(C)c4)c4ccccc34)C(=O)O2)cc1 ZINC000408740982 558599737 /nfs/dbraw/zinc/59/97/37/558599737.db2.gz GCCYZXUKIKEWLW-PXLXIMEGSA-N 0 0 421.496 5.988 40 10 HKCBRN O=C1OC(c2ccc(Cl)cc2)=C/C1=C/c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000408741003 558599765 /nfs/dbraw/zinc/59/97/65/558599765.db2.gz GIIJWRFXKQBTAX-LCYFTJDESA-N 0 0 417.675 6.888 40 10 HKCBRN Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/C=C(c3ccc(Cl)cc3)OC2=O)o1 ZINC000408741090 558599679 /nfs/dbraw/zinc/59/96/79/558599679.db2.gz GQENYMVGLHNFNK-PTNGSMBKSA-N 0 0 407.809 5.798 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3ccc(OCc4cccc(F)c4)cc3)C(=O)O2)cc1 ZINC000408741206 558599709 /nfs/dbraw/zinc/59/97/09/558599709.db2.gz HMAUHHCQOSQWRR-DEDYPNTBSA-N 0 0 402.421 5.395 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3cn(Cc4ccc(F)cc4)c4ccccc34)C(=O)O2)cc1 ZINC000408741556 558599928 /nfs/dbraw/zinc/59/99/28/558599928.db2.gz JNCJVPDLRGTCNT-KGENOOAVSA-N 0 0 409.460 6.118 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc(OCc4ccc([N+](=O)[O-])cc4)cc3)C(=O)O2)cc1 ZINC000408741888 558599893 /nfs/dbraw/zinc/59/98/93/558599893.db2.gz LUXPYKNVJWOJPM-KGENOOAVSA-N 0 0 413.429 5.464 40 10 HKCBRN O=C1OC(c2ccc(Cl)cc2)=C/C1=C\c1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000408742015 558599859 /nfs/dbraw/zinc/59/98/59/558599859.db2.gz MLHUBWYWUNYVPA-UKTHLTGXSA-N 0 0 417.675 6.888 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)ccc1OCc1ccccc1F ZINC000408742110 558600150 /nfs/dbraw/zinc/60/01/50/558600150.db2.gz NALFZALMSKMFBZ-FYJGNVAPSA-N 0 0 416.448 5.703 40 10 HKCBRN COc1cc(C)c(/C=C2\C=C(c3ccc(Br)cc3)OC2=O)cc1C(C)C ZINC000408742170 558600017 /nfs/dbraw/zinc/60/00/17/558600017.db2.gz NNTCJHWIZJJHAM-LICLKQGHSA-N 0 0 413.311 5.871 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc(Br)cc3)OC2=O)ccc1OC(C)C ZINC000408742182 558600128 /nfs/dbraw/zinc/60/01/28/558600128.db2.gz NPXPPJJAGVQCRT-MHWRWJLKSA-N 0 0 415.283 5.226 40 10 HKCBRN CCOC(=O)c1ccc(-c2ccc(/C=C3\C=C(c4ccc(Cl)cc4)OC3=O)o2)cc1 ZINC000408742536 558600641 /nfs/dbraw/zinc/60/06/41/558600641.db2.gz POWCBNJJXMZXOK-QGOAFFKASA-N 0 0 420.848 5.758 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Br)cc3)OC2=O)c2ccccc12 ZINC000408742766 558600646 /nfs/dbraw/zinc/60/06/46/558600646.db2.gz PTSKYGFRDLRWOS-GHRIWEEISA-N 0 0 421.290 5.982 40 10 HKCBRN COc1cc(OC)c(/C=C2\C=C(c3ccc(Cl)cc3)OC2=O)cc1Br ZINC000408742963 558600592 /nfs/dbraw/zinc/60/05/92/558600592.db2.gz QVJRFUIOLAASHU-NTUHNPAUSA-N 0 0 421.674 5.101 40 10 HKCBRN CC(=O)Oc1ccc(/N=N/c2ccccc2)cc1/C=C1\C=C(c2ccc(C)cc2)OC1=O ZINC000408742981 558600642 /nfs/dbraw/zinc/60/06/42/558600642.db2.gz QXBDHZMCABWDGB-JCVVDVMVSA-N 0 0 424.456 6.317 40 10 HKCBRN Cc1ccc([N+](=O)[O-])cc1-c1ccc(/C=C2\C=C(c3ccc(Cl)cc3)OC2=O)o1 ZINC000408743240 558600781 /nfs/dbraw/zinc/60/07/81/558600781.db2.gz RRMWCLQAQWFZFE-XNTDXEJSSA-N 0 0 407.809 5.798 40 10 HKCBRN O=C1OC(c2ccc(Cl)cc2)=C/C1=C\c1ccc(OCc2cccc(F)c2)cc1 ZINC000408743257 558600828 /nfs/dbraw/zinc/60/08/28/558600828.db2.gz RVCXZAGIKYDMIU-XDHOZWIPSA-N 0 0 406.840 6.039 40 10 HKCBRN COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)o1 ZINC000408743396 558600868 /nfs/dbraw/zinc/60/08/68/558600868.db2.gz SQNOVBQXDGTWDF-LFIBNONCSA-N 0 0 403.390 5.153 40 10 HKCBRN CC(=O)Oc1c(Cl)cc(Cl)cc1/C=C1\C=C(c2ccc(Cl)cc2)OC1=O ZINC000408743409 558600750 /nfs/dbraw/zinc/60/07/50/558600750.db2.gz SWEPFRPKFNKHCB-AWNIVKPZSA-N 0 0 409.652 5.553 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Br)cc3)OC2=O)c2ccccc12 ZINC000408743416 558600824 /nfs/dbraw/zinc/60/08/24/558600824.db2.gz TVYQFNSSDULIDS-FOWTUZBSSA-N 0 0 407.263 5.592 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)ccc1OCc1cccc(F)c1 ZINC000408743801 558599817 /nfs/dbraw/zinc/59/98/17/558599817.db2.gz VHPVCPGQDGLKRD-CIAFOILYSA-N 0 0 416.448 5.703 40 10 HKCBRN CC(=O)Oc1ccc(Cl)cc1/C=C1\C=C(c2ccc(Br)cc2)OC1=O ZINC000408744123 558605628 /nfs/dbraw/zinc/60/56/28/558605628.db2.gz WVXPUUZQWMSNHL-RIYZIHGNSA-N 0 0 419.658 5.009 40 10 HKCBRN O=C1OC(c2ccc(Cl)cc2)=C/C1=C/c1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000408744172 558601113 /nfs/dbraw/zinc/60/11/13/558601113.db2.gz XGTBVGMJZNUZBH-RAXLEYEMSA-N 0 0 417.675 6.888 40 10 HKCBRN CCN(CC)c1ccc(/C=C2\C=C(c3ccc(Cl)cc3)OC2=O)c(OC(C)=O)c1 ZINC000408744198 558601159 /nfs/dbraw/zinc/60/11/59/558601159.db2.gz XHTUNCCERUDNEO-LDADJPATSA-N 0 0 411.885 5.093 40 10 HKCBRN COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2\C=C(c3ccc(Cl)cc3)OC2=O)o1 ZINC000408744494 558601570 /nfs/dbraw/zinc/60/15/70/558601570.db2.gz YEQLGIWIBQKOAJ-GXDHUFHOSA-N 0 0 423.808 5.498 40 10 HKCBRN COc1ccc(C2=C/C(=C\c3ccc(OCc4ccccc4F)cc3)C(=O)O2)cc1 ZINC000408744551 558601540 /nfs/dbraw/zinc/60/15/40/558601540.db2.gz YMLBJABITJZKJM-XSFVSMFZSA-N 0 0 402.421 5.395 40 10 HKCBRN COc1cc(/C=C2\C=C(c3ccc(Cl)cc3)OC2=O)ccc1OCc1ccccc1 ZINC000408744690 558601635 /nfs/dbraw/zinc/60/16/35/558601635.db2.gz ZIXMIGSUHANEJU-DEDYPNTBSA-N 0 0 418.876 5.909 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(C)cc3)N(c3ccc(C)cc3)C2=O)c(OC)c1 ZINC000408751673 558608381 /nfs/dbraw/zinc/60/83/81/558608381.db2.gz BIPGHTOMJHYMCF-HZHRSRAPSA-N 0 0 412.489 5.155 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408752117 558608649 /nfs/dbraw/zinc/60/86/49/558608649.db2.gz BUNGGYIPWTUNSE-KGENOOAVSA-N 0 0 423.299 5.837 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2ccc(O)cc2)cc1 ZINC000408752119 558608642 /nfs/dbraw/zinc/60/86/42/558608642.db2.gz BURFTFMILWVGBD-CIAFOILYSA-N 0 0 423.299 5.842 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2)N=C(c2ccccc2Cl)N1c1ccc(F)cc1 ZINC000408752182 558608703 /nfs/dbraw/zinc/60/87/03/558608703.db2.gz GETFKSCVHGUSPY-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccccc3)N=C2c2ccccc2Br)cc1 ZINC000408752215 558608776 /nfs/dbraw/zinc/60/87/76/558608776.db2.gz CIAJRDUNBVSCNW-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3Cl)N=C2c2ccccc2)cc1 ZINC000408752233 558608794 /nfs/dbraw/zinc/60/87/94/558608794.db2.gz GYIBAIMCWZSCMA-FYJGNVAPSA-N 0 0 423.299 5.837 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2)N=C(c2ccc(F)cc2)N1c1ccc(Cl)cc1 ZINC000408752260 558608906 /nfs/dbraw/zinc/60/89/06/558608906.db2.gz CPRYGFIGIIWKEP-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408752333 558608844 /nfs/dbraw/zinc/60/88/44/558608844.db2.gz AAGRVIVXYHHLLP-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(O)cc3)C2=O)cc1 ZINC000408752364 558608909 /nfs/dbraw/zinc/60/89/09/558608909.db2.gz DUEZDLJALBQPJL-PXLXIMEGSA-N 0 0 418.880 5.279 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408752372 558608869 /nfs/dbraw/zinc/60/88/69/558608869.db2.gz IDBDPYFTWPCWCD-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccccc2F)N1c1ccc(F)cc1 ZINC000408752393 558608889 /nfs/dbraw/zinc/60/88/89/558608889.db2.gz AIILKUWPOCEMOH-LFVJCYFKSA-N 0 0 410.423 5.953 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408752625 557816350 /nfs/dbraw/zinc/81/63/50/557816350.db2.gz FOIGXUJWYVRGRP-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3cccc(C)c3)C2=O)cc1 ZINC000408752691 558609113 /nfs/dbraw/zinc/60/91/13/558609113.db2.gz GAPVLONSGSEKNC-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccccc3F)C2=O)cc1 ZINC000408752750 558609797 /nfs/dbraw/zinc/60/97/97/558609797.db2.gz GONGQAOZVYRYQG-JXAWBTAJSA-N 0 0 405.856 5.959 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3cccnc3)C2=O)cc1OC ZINC000408752804 558610052 /nfs/dbraw/zinc/61/00/52/558610052.db2.gz CKCJPQYAIPQKTC-LDADJPATSA-N 0 0 418.880 5.224 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3F)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000408752903 558610433 /nfs/dbraw/zinc/61/04/33/558610433.db2.gz DGSBLYOLEFKADE-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(F)cc2)c1 ZINC000408752905 558610342 /nfs/dbraw/zinc/61/03/42/558610342.db2.gz DHHSMASVKXOOOC-KOEQRZSOSA-N 0 0 406.460 6.122 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccccc2F)cc1 ZINC000408752933 558610544 /nfs/dbraw/zinc/61/05/44/558610544.db2.gz DMGYHSBQUOWKHG-KOEQRZSOSA-N 0 0 406.460 6.122 40 10 HKCBRN O=C1/C(=C\c2cccs2)N=C(c2ccccc2)N1c1cccc(Br)c1 ZINC000408752946 558610601 /nfs/dbraw/zinc/61/06/01/558610601.db2.gz DNKLHAJGMQFKOC-QGOAFFKASA-N 0 0 409.308 5.345 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccccc2Cl)cc1 ZINC000408753089 558610753 /nfs/dbraw/zinc/61/07/53/558610753.db2.gz HSNMQYGRYCLYRD-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408753144 558610767 /nfs/dbraw/zinc/61/07/67/558610767.db2.gz ICSAGVMHNYCOHI-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2cccc(C)c2)cc1 ZINC000408753225 558611032 /nfs/dbraw/zinc/61/10/32/558611032.db2.gz FNZYXOSERYQFIV-NLRVBDNBSA-N 0 0 402.497 6.291 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2)N=C(c2ccc(Cl)cc2)N1c1ccc(F)cc1 ZINC000408753275 558611059 /nfs/dbraw/zinc/61/10/59/558611059.db2.gz GBANHSICBRHTAG-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccccc3Cl)C2=O)cc1 ZINC000408753483 558611087 /nfs/dbraw/zinc/61/10/87/558611087.db2.gz MYQLQYCVXMDRJP-JXAWBTAJSA-N 0 0 422.311 6.473 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccccc3Cl)N(c3cccc(C)c3)C2=O)c1 ZINC000408753558 558611047 /nfs/dbraw/zinc/61/10/47/558611047.db2.gz JLQFOIMZZSLTPI-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccc(F)cc2)N(c2ccc(Cl)cc2)C1=O ZINC000408753563 558611272 /nfs/dbraw/zinc/61/12/72/558611272.db2.gz NLPDYJJVGIXGPI-XSFVSMFZSA-N 0 0 406.844 5.322 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccc(OC)cc2)cc1 ZINC000408753630 558611217 /nfs/dbraw/zinc/61/12/17/558611217.db2.gz GXOXYFDANSEAJP-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN Cc1ccc2cc(C3=C/C(=C/c4ccc(-c5ccc(Cl)cc5)o4)C(=O)O3)ccc2c1 ZINC000408753702 558611472 /nfs/dbraw/zinc/61/14/72/558611472.db2.gz BPTVFGWUQMGCQT-STZFKDTASA-N 0 0 412.872 7.043 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccc(Cl)cc2)N1c1ccccc1 ZINC000408753741 558611436 /nfs/dbraw/zinc/61/14/36/558611436.db2.gz CCSQRADHDPJULI-JJIBRWJFSA-N 0 0 408.888 6.328 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccc(F)cc3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408753823 558611502 /nfs/dbraw/zinc/61/15/02/558611502.db2.gz KNCOXMHRAQSNCR-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN O=C1/C(=C\c2ccc3c(c2)OCO3)N=C(c2ccccc2F)N1c1ccc(Cl)cc1 ZINC000408753853 558611478 /nfs/dbraw/zinc/61/14/78/558611478.db2.gz KSJVRXUMVYEOHH-YBFXNURJSA-N 0 0 420.827 5.042 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408753895 558611522 /nfs/dbraw/zinc/61/15/22/558611522.db2.gz OPIBOHNBQGFZCV-XQNSMLJCSA-N 0 0 415.924 5.549 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3OC)N=C2c2ccccc2F)cc1 ZINC000408753970 558611668 /nfs/dbraw/zinc/61/16/68/558611668.db2.gz OVTRNMXJSBUKBZ-CJLVFECKSA-N 0 0 416.452 5.068 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc(Br)cc3)N=C2c2ccccc2)c1 ZINC000408753971 558611729 /nfs/dbraw/zinc/61/17/29/558611729.db2.gz LIPULPOWRGJAFL-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN O=C1/C(=C\c2ccccc2F)N=C(c2ccccc2)N1c1ccc(Br)cc1 ZINC000408754014 558611656 /nfs/dbraw/zinc/61/16/56/558611656.db2.gz CZWAIRQPWMNSCX-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(OC)cc3)N(c3cccc(C)c3)C2=O)cc1 ZINC000408754035 558611663 /nfs/dbraw/zinc/61/16/63/558611663.db2.gz PEZBTOAAQHLZDP-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccc(C)cc3)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408754041 558611635 /nfs/dbraw/zinc/61/16/35/558611635.db2.gz PFDYZGJRFHPUKW-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN O=C1/C(=C\c2ccc(Br)cc2)N=C(c2ccccc2)N1c1ccc(F)cc1 ZINC000408754045 558611660 /nfs/dbraw/zinc/61/16/60/558611660.db2.gz IGRCDQMGAFECCS-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccccc3)C(=O)N2c2cccc(Br)c2)cc1 ZINC000408754048 558611679 /nfs/dbraw/zinc/61/16/79/558611679.db2.gz PGDKFDHIHAAYAA-KGENOOAVSA-N 0 0 417.306 5.592 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(F)cc3)C2=O)c1 ZINC000408754110 558611723 /nfs/dbraw/zinc/61/17/23/558611723.db2.gz PJYWQXCWGNOYEV-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3)N=C2c2ccccc2Cl)cc1 ZINC000408754248 558611835 /nfs/dbraw/zinc/61/18/35/558611835.db2.gz FPUQEGUXCXEGDJ-CJLVFECKSA-N 0 0 402.881 5.573 40 10 HKCBRN O=C1/C(=C\c2cccs2)N=C(c2ccccc2)N1c1ccc(Br)cc1 ZINC000408754277 557816569 /nfs/dbraw/zinc/81/65/69/557816569.db2.gz GBEXCGAGCIYXQG-QGOAFFKASA-N 0 0 409.308 5.345 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2cccc(C)c2)cc1 ZINC000408754441 558612023 /nfs/dbraw/zinc/61/20/23/558612023.db2.gz NKRUWIMNJKHIAG-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN O=C1/C(=C\c2ccccc2F)N=C(c2ccccc2Br)N1c1ccccc1 ZINC000408754538 558612233 /nfs/dbraw/zinc/61/22/33/558612233.db2.gz REJHMKTWRLUGJL-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(OC)cc3)N=C2c2ccc(C)cc2)cc1 ZINC000408754572 558612285 /nfs/dbraw/zinc/61/22/85/558612285.db2.gz RHGZMWBYWWJFAC-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc(Cl)cc3)C(=O)N2c2ccc(Cl)cc2)c1 ZINC000408754619 558612277 /nfs/dbraw/zinc/61/22/77/558612277.db2.gz KYTIJQZXXREQTF-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3F)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408754622 558612265 /nfs/dbraw/zinc/61/22/65/558612265.db2.gz KZHXUPVZMJSUNC-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(OC)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408754714 558612403 /nfs/dbraw/zinc/61/24/03/558612403.db2.gz LIYQWYXMMSFVQN-PXLXIMEGSA-N 0 0 418.880 5.192 40 10 HKCBRN CCOc1ccc(C2=C/C(=C/c3cc(C)n(-c4cccc(C)c4C)c3C)C(=O)O2)cc1 ZINC000408754730 558612427 /nfs/dbraw/zinc/61/24/27/558612427.db2.gz HMVBQIHFDHLEFX-HAHDFKILSA-N 0 0 413.517 6.091 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccc(C)cc2)cc1 ZINC000408754822 558612724 /nfs/dbraw/zinc/61/27/24/558612724.db2.gz LJPCDDDOPXRQRB-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccc(Cl)cc2)N1c1ccc(O)cc1 ZINC000408754839 558612653 /nfs/dbraw/zinc/61/26/53/558612653.db2.gz OOFWLSPMMBJNBV-LFVJCYFKSA-N 0 0 424.887 6.033 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3cc(C)ccc3C)C2=O)cc1 ZINC000408754852 558612620 /nfs/dbraw/zinc/61/26/20/558612620.db2.gz SHOFUOYYCRSUJY-QNGOZBTKSA-N 0 0 415.920 6.437 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(F)cc3)C2=O)c1 ZINC000408754860 558612675 /nfs/dbraw/zinc/61/26/75/558612675.db2.gz OQIFNNPCQYXTDR-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccco3)C(=O)N2c2cccc(Br)c2)cc1 ZINC000408754911 558612897 /nfs/dbraw/zinc/61/28/97/558612897.db2.gz PCDAOAZIIUAWLC-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccs3)N=C2c2ccccc2Br)c1 ZINC000408754944 558612840 /nfs/dbraw/zinc/61/28/40/558612840.db2.gz LVSCXMNMFXDTNZ-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408755010 558612885 /nfs/dbraw/zinc/61/28/85/558612885.db2.gz SZUKEBVKNZEBSU-JXAWBTAJSA-N 0 0 422.311 6.473 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(O)cc3)C2=O)cc1 ZINC000408755073 558612861 /nfs/dbraw/zinc/61/28/61/558612861.db2.gz MIYZOGGGDOKCJT-JXAWBTAJSA-N 0 0 403.865 5.526 40 10 HKCBRN Cc1nn(-c2cccc3ccccc32)c(C)c1/C=C1\C(=O)N(c2ccccc2C)N=C1C ZINC000408755140 558612830 /nfs/dbraw/zinc/61/28/30/558612830.db2.gz BPVWHGAQMFYZJY-LFVJCYFKSA-N 0 0 420.516 5.757 40 10 HKCBRN Cc1cc(/C=C2/C=C(c3ccc4cc(C)ccc4c3)OC2=O)c(C)n1-c1ccccc1C ZINC000408755227 558612851 /nfs/dbraw/zinc/61/28/51/558612851.db2.gz ITMRGJOCILNVKO-QQXSKIMKSA-N 0 0 419.524 6.845 40 10 HKCBRN Cc1cc(/C=C2/C=C(c3ccc4cc(C)ccc4c3)OC2=O)c(C)n1-c1cccc(C)c1 ZINC000408755300 558612853 /nfs/dbraw/zinc/61/28/53/558612853.db2.gz JIYNELPQOCZADZ-QQXSKIMKSA-N 0 0 419.524 6.845 40 10 HKCBRN O=C1/C(=C\c2ccccc2F)N=C(c2ccccc2)N1c1cccc(Br)c1 ZINC000408755313 558612923 /nfs/dbraw/zinc/61/29/23/558612923.db2.gz JMWQFVCQDRDORY-DEDYPNTBSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccccc2F)N(c2ccc(Cl)cc2)C1=O ZINC000408755328 558612912 /nfs/dbraw/zinc/61/29/12/558612912.db2.gz KCPOYPUCCBPBKH-XSFVSMFZSA-N 0 0 406.844 5.322 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccc(Cl)cc2)N(c2cccc(C)c2)C1=O ZINC000408755363 558612906 /nfs/dbraw/zinc/61/29/06/558612906.db2.gz KVTHXPXGXILFQY-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccccc2Cl)N1c1ccccc1 ZINC000408755370 558613062 /nfs/dbraw/zinc/61/30/62/558613062.db2.gz UKAXTJAPLFZOJG-JJIBRWJFSA-N 0 0 408.888 6.328 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(O)cc2)cc1 ZINC000408755382 558613050 /nfs/dbraw/zinc/61/30/50/558613050.db2.gz NEPIGTGQAZCRDK-KOEQRZSOSA-N 0 0 420.468 5.389 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(F)c(C)c3)C2=O)cc1 ZINC000408755449 558613054 /nfs/dbraw/zinc/61/30/54/558613054.db2.gz UZHDIEZAMTVOJI-RGEXLXHISA-N 0 0 419.883 6.267 40 10 HKCBRN O=C1/C(=C\c2ccc(F)cc2)N=C(c2ccccc2Cl)N1c1ccc(Cl)cc1 ZINC000408755477 558613057 /nfs/dbraw/zinc/61/30/57/558613057.db2.gz NWPUUTSUCQSDOW-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(F)cc3)N(c3cccc(C)c3)C2=O)cc1 ZINC000408755488 558613070 /nfs/dbraw/zinc/61/30/70/558613070.db2.gz NZGVDAXUTCBMKP-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3cccc(OC)c3)C2=O)cc1 ZINC000408755489 558613065 /nfs/dbraw/zinc/61/30/65/558613065.db2.gz NZHZZCQWWSFCNC-RGEXLXHISA-N 0 0 417.892 5.829 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(Cl)cc3)C2=O)cc1OC ZINC000408755727 571037771 /nfs/dbraw/zinc/03/77/71/571037771.db2.gz OXULLYJDJLFQMJ-XSFVSMFZSA-N 0 0 418.880 5.192 40 10 HKCBRN Cc1cc(/C=C2\C=C(c3ccc(C(C)(C)C)cc3)OC2=O)c(C)n1-c1cccc(C)c1 ZINC000408755747 558613279 /nfs/dbraw/zinc/61/32/79/558613279.db2.gz MRZAQAWECHRUQO-XQNSMLJCSA-N 0 0 411.545 6.681 40 10 HKCBRN Cc1nn(-c2cccc3ccccc32)c(C)c1/C=C1\C(=O)N(c2ccc(C)cc2)N=C1C ZINC000408755760 557817498 /nfs/dbraw/zinc/81/74/98/557817498.db2.gz FIFYDEBSYYVEHG-PCLIKHOPSA-N 0 0 420.516 5.757 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(Cl)cc2)c1 ZINC000408755831 558613288 /nfs/dbraw/zinc/61/32/88/558613288.db2.gz NHYMFVMXNRMJRW-KGENOOAVSA-N 0 0 417.852 5.391 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3cccs3)C(=O)N2c2ccc(Br)cc2)cc1 ZINC000408755875 558613195 /nfs/dbraw/zinc/61/31/95/558613195.db2.gz WOFQKPONUABZTO-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccc(Cl)cc3)C(=O)N2c2cccc(C)c2)cc1 ZINC000408755881 557817487 /nfs/dbraw/zinc/81/74/87/557817487.db2.gz PTSHKMKTQDVJLP-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1/C(=O)N(c2cccc(Cl)c2)N=C1C ZINC000408755915 558609229 /nfs/dbraw/zinc/60/92/29/558609229.db2.gz GIJMDEOSENLHQH-LPYMAVHISA-N 0 0 404.901 5.257 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccc(Cl)cc2)N(c2ccc(Cl)cc2)C1=O ZINC000408755942 558609511 /nfs/dbraw/zinc/60/95/11/558609511.db2.gz PYARUYFLXSQKCJ-XSFVSMFZSA-N 0 0 423.299 5.837 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccccc2Cl)N(c2ccc(Cl)cc2)C1=O ZINC000408756046 558617402 /nfs/dbraw/zinc/61/74/02/558617402.db2.gz SYBRTHNLVWXFCB-XSFVSMFZSA-N 0 0 423.299 5.837 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccc(F)cc2)N1c1ccc(F)cc1 ZINC000408756081 558617423 /nfs/dbraw/zinc/61/74/23/558617423.db2.gz TWIAIRJSZSRDQB-LFVJCYFKSA-N 0 0 410.423 5.953 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2Cl)N=C(c2ccccc2)N1c1ccc(O)cc1 ZINC000408756119 558617513 /nfs/dbraw/zinc/61/75/13/558617513.db2.gz TXZJZNRJIPYGSS-UDWIEESQSA-N 0 0 409.272 5.534 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccc(F)cc2)cc1 ZINC000408756137 558617533 /nfs/dbraw/zinc/61/75/33/558617533.db2.gz XVBKPOMLKWJNFS-PXLXIMEGSA-N 0 0 404.416 5.198 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(C)c(C)c3)C2=O)cc1 ZINC000408756191 558613494 /nfs/dbraw/zinc/61/34/94/558613494.db2.gz XXQZTMCPVPPUJC-QNGOZBTKSA-N 0 0 415.920 6.437 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccccc2F)cc1 ZINC000408756210 558613572 /nfs/dbraw/zinc/61/35/72/558613572.db2.gz YDOLGBOZXULSQG-PXLXIMEGSA-N 0 0 404.416 5.198 40 10 HKCBRN O=C1/C(=C\c2ccc(F)cc2)N=C(c2ccccc2)N1c1cccc(Br)c1 ZINC000408756283 558613569 /nfs/dbraw/zinc/61/35/69/558613569.db2.gz RCPFQMXHDTZEFS-DEDYPNTBSA-N 0 0 421.269 5.423 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccc(F)cc2)cc1 ZINC000408756351 558613486 /nfs/dbraw/zinc/61/34/86/558613486.db2.gz ZCAGHMQONRZBRS-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(O)cc2)cc1 ZINC000408756363 558613500 /nfs/dbraw/zinc/61/35/00/558613500.db2.gz QSFDNMBGPMCEOL-KOEQRZSOSA-N 0 0 404.469 5.688 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccccc2Cl)N1c1ccc(O)cc1 ZINC000408756384 558613462 /nfs/dbraw/zinc/61/34/62/558613462.db2.gz ROMVXCPPNBNDED-LFVJCYFKSA-N 0 0 424.887 6.033 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccc(F)cc2)N1c1ccc(O)cc1 ZINC000408756409 558613521 /nfs/dbraw/zinc/61/35/21/558613521.db2.gz ZKJMZKRMHHQOLE-LFVJCYFKSA-N 0 0 408.432 5.519 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(C)cc2)cc1 ZINC000408756415 558613576 /nfs/dbraw/zinc/61/35/76/558613576.db2.gz ZKLDWEGWCFHPMR-NLRVBDNBSA-N 0 0 418.496 5.991 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2c2ccccc2Cl)c1 ZINC000408756437 558613559 /nfs/dbraw/zinc/61/35/59/558613559.db2.gz RUVOQTFTXQFSOW-UDWIEESQSA-N 0 0 416.864 5.212 40 10 HKCBRN O=C1/C(=C\c2ccccc2F)N=C(c2ccc(Cl)cc2)N1c1ccc(Cl)cc1 ZINC000408756478 558613503 /nfs/dbraw/zinc/61/35/03/558613503.db2.gz VOPHZQWTORSJTI-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2cccc(C)c2)cc1 ZINC000408756529 558613680 /nfs/dbraw/zinc/61/36/80/558613680.db2.gz SPLZGZJWTMDSAG-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3ccc(C)cc3)C2=O)c(OC)c1 ZINC000408756552 558613645 /nfs/dbraw/zinc/61/36/45/558613645.db2.gz ZVMODILKLDVIEI-HZHRSRAPSA-N 0 0 412.489 5.155 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccccc2F)c1 ZINC000408756576 558613622 /nfs/dbraw/zinc/61/36/22/558613622.db2.gz WHXOQNSTRVLXNR-KOEQRZSOSA-N 0 0 406.460 6.122 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1/C(=O)N(c2ccc(C)cc2C)N=C1C ZINC000408756617 558613601 /nfs/dbraw/zinc/61/36/01/558613601.db2.gz IIXXSVCHOCAPRU-UCQKPKSFSA-N 0 0 412.537 5.529 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1/C(=O)N(c2ccc(C)c(Cl)c2)N=C1C ZINC000408756624 558613650 /nfs/dbraw/zinc/61/36/50/558613650.db2.gz IOWVNRPCOUZWHG-LPYMAVHISA-N 0 0 418.928 5.565 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(F)cc2)cc1 ZINC000408756646 558613677 /nfs/dbraw/zinc/61/36/77/558613677.db2.gz RVIMDEYMYLMQTL-KOEQRZSOSA-N 0 0 406.460 6.122 40 10 HKCBRN CCOc1ccc(C2=C/C(=C/c3cc(C)n(-c4cc(C)cc(C)c4)c3C)C(=O)O2)cc1 ZINC000408756666 558613745 /nfs/dbraw/zinc/61/37/45/558613745.db2.gz SDALQTMIDGODPV-HAHDFKILSA-N 0 0 413.517 6.091 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccco3)C(=O)N2c2cccc(Br)c2)c1 ZINC000408756681 558613661 /nfs/dbraw/zinc/61/36/61/558613661.db2.gz SIDYUWRHAPJPRP-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN Cc1nn(-c2cccc3ccccc32)c(C)c1/C=C1\C(=O)N(c2ccc(F)cc2)N=C1C ZINC000408756735 557816321 /nfs/dbraw/zinc/81/63/21/557816321.db2.gz JDSLITHYYUBXHV-BUVRLJJBSA-N 0 0 424.479 5.588 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccc(F)cc2)cc1 ZINC000408756753 558613756 /nfs/dbraw/zinc/61/37/56/558613756.db2.gz XBINUPJPJBBKSF-PXLXIMEGSA-N 0 0 404.416 5.198 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408756822 558613903 /nfs/dbraw/zinc/61/39/03/558613903.db2.gz URDSRKNGRFHXHR-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408756823 558613919 /nfs/dbraw/zinc/61/39/19/558613919.db2.gz XREHGVZXIUQSSC-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccc(Cl)cc2)cc1 ZINC000408756861 558613944 /nfs/dbraw/zinc/61/39/44/558613944.db2.gz XVPYHCVPJIPCSK-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN Cc1cc(/C=C2/C=C(c3ccc4cc(C)ccc4c3)OC2=O)c(C)n1-c1ccc(C)cc1 ZINC000408756903 558613979 /nfs/dbraw/zinc/61/39/79/558613979.db2.gz UQLFWYFXOAWZTN-QQXSKIMKSA-N 0 0 419.524 6.845 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccccc2Cl)cc1 ZINC000408756911 558613901 /nfs/dbraw/zinc/61/39/01/558613901.db2.gz YFFUNDMSGGKVTR-KGENOOAVSA-N 0 0 423.299 5.837 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(C)cc3)C2=O)c1 ZINC000408756932 558613941 /nfs/dbraw/zinc/61/39/41/558613941.db2.gz UTMJLHBUSFSREW-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccccc3)C(=O)N2c2ccc(Br)cc2)c1 ZINC000408756966 558613951 /nfs/dbraw/zinc/61/39/51/558613951.db2.gz YQBCOVGWSFCZDQ-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1/C(=O)N(c2cccc(Cl)c2)N=C1C ZINC000408756969 557816398 /nfs/dbraw/zinc/81/63/98/557816398.db2.gz KWHCRPBJVAHWMH-QRVIBDJDSA-N 0 0 418.928 5.565 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)N=C2c2ccccc2Cl)c1 ZINC000408756977 558613891 /nfs/dbraw/zinc/61/38/91/558613891.db2.gz YSWQGPLPGNLOLH-XQNSMLJCSA-N 0 0 415.924 5.549 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2Cl)N=C(c2ccccc2)N1c1ccc(F)cc1 ZINC000408757098 558613954 /nfs/dbraw/zinc/61/39/54/558613954.db2.gz WQMPDWRKUICPPT-UDWIEESQSA-N 0 0 411.263 5.967 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2cccc(C)c2)cc1 ZINC000408757141 558613933 /nfs/dbraw/zinc/61/39/33/558613933.db2.gz XJVIXMCIROEWQH-NLRVBDNBSA-N 0 0 418.496 5.991 40 10 HKCBRN Cc1cc(/C=C2/C=C(c3ccc4cc(C)ccc4c3)OC2=O)c(C)n1-c1ccccc1 ZINC000408757150 558614124 /nfs/dbraw/zinc/61/41/24/558614124.db2.gz UXZXYECKDIWFGS-XYGWBWBKSA-N 0 0 405.497 6.537 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3cccc(OC)c3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408757163 558614139 /nfs/dbraw/zinc/61/41/39/558614139.db2.gz VDUMBMOABISMIZ-PXLXIMEGSA-N 0 0 418.880 5.192 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3)N=C2c2ccccc2Cl)cc1 ZINC000408757224 557816389 /nfs/dbraw/zinc/81/63/89/557816389.db2.gz WIWIEDHNDQITQW-PXLXIMEGSA-N 0 0 418.880 5.192 40 10 HKCBRN Cc1ccc2cc(C3=C/C(=C/c4ccc(-c5ccc([N+](=O)[O-])cc5)o4)C(=O)O3)ccc2c1 ZINC000408757234 557816544 /nfs/dbraw/zinc/81/65/44/557816544.db2.gz WRCDDQOXWOZNOB-STZFKDTASA-N 0 0 423.424 6.298 40 10 HKCBRN Cc1cc(/C=C2/C=C(c3ccc4cc(C)ccc4c3)OC2=O)c(C)n1C1CCCCC1 ZINC000408757269 558614134 /nfs/dbraw/zinc/61/41/34/558614134.db2.gz XCDJTZOWGWMXRK-XYGWBWBKSA-N 0 0 411.545 7.053 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(O)cc3)C2=O)cc1 ZINC000408757282 558614117 /nfs/dbraw/zinc/61/41/17/558614117.db2.gz XWYKJASYXKTHCN-PXLXIMEGSA-N 0 0 418.880 5.279 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(F)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408757298 558614105 /nfs/dbraw/zinc/61/41/05/558614105.db2.gz YGNHQVICBZSMDJ-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccc(Cl)cc2)N(c2ccc(C)cc2)C1=O ZINC000408757313 558614089 /nfs/dbraw/zinc/61/40/89/558614089.db2.gz YJRQZCBHWRCQOG-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1/C(=O)N(c2ccc(F)cc2)N=C1C ZINC000408757454 558614036 /nfs/dbraw/zinc/61/40/36/558614036.db2.gz NLYLYIBWBZAQFN-XKZIYDEJSA-N 0 0 402.473 5.051 40 10 HKCBRN CCOc1ccc(C2=C/C(=C/c3cc(C)n(-c4ccc(C)c(C)c4)c3C)C(=O)O2)cc1 ZINC000408757558 558614237 /nfs/dbraw/zinc/61/42/37/558614237.db2.gz ZXEZAPSXALPMKP-HAHDFKILSA-N 0 0 413.517 6.091 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(OC)cc3)N=C2c2cccc(C)c2)cc1 ZINC000408757597 558614284 /nfs/dbraw/zinc/61/42/84/558614284.db2.gz ARYOARBGKMKKNX-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1\C(=O)N(c2ccc(C)cc2C)N=C1C ZINC000408757693 558614539 /nfs/dbraw/zinc/61/45/39/558614539.db2.gz OVOSVYGHJGAAJN-ZVHZXABRSA-N 0 0 412.537 5.529 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1/C(=O)N(c2ccc(Cl)cc2)N=C1C ZINC000408757702 558614489 /nfs/dbraw/zinc/61/44/89/558614489.db2.gz OYKLEKFVCPORQW-LPYMAVHISA-N 0 0 404.901 5.257 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1/C(=O)N(c2ccc(Cl)cc2)N=C1C ZINC000408757718 558614542 /nfs/dbraw/zinc/61/45/42/558614542.db2.gz PIELDYKTVXWMHT-XKZIYDEJSA-N 0 0 418.928 5.565 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccc(F)cc2)cc1 ZINC000408757851 558614934 /nfs/dbraw/zinc/61/49/34/558614934.db2.gz DHKQPHMCEJBHLL-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1/C(=O)N(c2ccc(Cl)cc2)N=C1C ZINC000408757869 558788214 /nfs/dbraw/zinc/78/82/14/558788214.db2.gz QZSZFYPTBJEWIX-QRVIBDJDSA-N 0 0 418.928 5.565 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1\C(=O)N(c2cccc3ccccc32)N=C1C ZINC000408757875 558788279 /nfs/dbraw/zinc/78/82/79/558788279.db2.gz RELQANORQIYHBA-XYGWBWBKSA-N 0 0 420.516 5.757 40 10 HKCBRN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1/C(=O)N(c2ccc(F)cc2)N=C1C ZINC000408757898 558788212 /nfs/dbraw/zinc/78/82/12/558788212.db2.gz RYGPTFUWQNGRMY-QRVIBDJDSA-N 0 0 402.473 5.051 40 10 HKCBRN Cc1nn(-c2cccc3ccccc32)c(C)c1/C=C1\C(=O)N(c2cccc(C)c2)N=C1C ZINC000408757970 558615346 /nfs/dbraw/zinc/61/53/46/558615346.db2.gz SXEOFMWPOVJVSP-PCLIKHOPSA-N 0 0 420.516 5.757 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccccc2Cl)c1 ZINC000408757989 558615306 /nfs/dbraw/zinc/61/53/06/558615306.db2.gz FINQEKFZHGUOBC-KOEQRZSOSA-N 0 0 422.915 6.636 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccc(F)cc2)N1c1ccc(Br)cc1 ZINC000408757991 558615374 /nfs/dbraw/zinc/61/53/74/558615374.db2.gz FJHOUBRKQQUVTO-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN Cc1nn(-c2cccc3ccccc32)c(C)c1/C=C1\C(=O)N(c2ccccc2)N=C1C ZINC000408758018 558615325 /nfs/dbraw/zinc/61/53/25/558615325.db2.gz UNLDMGZGSHZPFH-LFVJCYFKSA-N 0 0 406.489 5.448 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccc(Cl)cc2)c1 ZINC000408758036 558615507 /nfs/dbraw/zinc/61/55/07/558615507.db2.gz FXFHSZRIOKWMRJ-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(O)cc2)c1 ZINC000408758046 558825861 /nfs/dbraw/zinc/82/58/61/558825861.db2.gz GBFVEEBRHJWLIM-KOEQRZSOSA-N 0 0 404.469 5.688 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(Cc3ccccc3)C2=O)cc1 ZINC000408758072 558615477 /nfs/dbraw/zinc/61/54/77/558615477.db2.gz GILPOIBBEHLGSW-QNGOZBTKSA-N 0 0 401.893 5.816 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2c2ccc(Cl)cc2)c1 ZINC000408758103 558857602 /nfs/dbraw/zinc/85/76/02/558857602.db2.gz GPLZCUKJBOHAJB-UDWIEESQSA-N 0 0 416.864 5.212 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2)N=C(c2ccccc2F)N1c1ccc(Cl)cc1 ZINC000408758186 558615804 /nfs/dbraw/zinc/61/58/04/558615804.db2.gz HGPHTDDAOWUQIM-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccccc2F)cc1 ZINC000408758220 558615799 /nfs/dbraw/zinc/61/57/99/558615799.db2.gz HQNFPRQPAHEJGN-PXLXIMEGSA-N 0 0 404.416 5.198 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(C)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408758327 558889172 /nfs/dbraw/zinc/88/91/72/558889172.db2.gz IWTIEEYPXXFARU-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1/C(=O)N(c2ccc(C)c(C)c2)N=C1C ZINC000408758351 558615964 /nfs/dbraw/zinc/61/59/64/558615964.db2.gz YKOJDCPWLURKQO-OYKKKHCWSA-N 0 0 412.537 5.529 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccc(C)cc2)cc1 ZINC000408758377 558616255 /nfs/dbraw/zinc/61/62/55/558616255.db2.gz JGJOOFYOUWRUGW-NLRVBDNBSA-N 0 0 418.496 5.991 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3cccc(C)c3)C2=O)cc1 ZINC000408758389 558616234 /nfs/dbraw/zinc/61/62/34/558616234.db2.gz JLWRIOWMQWUCRP-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3)N=C2c2ccccc2F)cc1 ZINC000408758393 559264324 /nfs/dbraw/zinc/26/43/24/559264324.db2.gz JODYUWXOXVNLOL-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1\C(=O)N(c2ccc(C)c(C)c2)N=C1C ZINC000408758416 559270049 /nfs/dbraw/zinc/27/00/49/559270049.db2.gz ZXBRGNMTMFHHTD-AFUMVMLFSA-N 0 0 412.537 5.529 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2)N=C(c2ccc(Cl)cc2)N1c1ccc(O)cc1 ZINC000408758439 558616213 /nfs/dbraw/zinc/61/62/13/558616213.db2.gz JZXAXPHDLWMREX-DEDYPNTBSA-N 0 0 409.272 5.534 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3cccc(C)c3)C2=O)c(OC)c1 ZINC000408758443 559270215 /nfs/dbraw/zinc/27/02/15/559270215.db2.gz KAZOUCJUFRBFGS-HZHRSRAPSA-N 0 0 412.489 5.155 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccccc3)C2=O)cc1 ZINC000408758494 559270718 /nfs/dbraw/zinc/27/07/18/559270718.db2.gz LAXPPQUNLIVRSE-CJLVFECKSA-N 0 0 402.881 5.573 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2cccc(C)c2)cc1 ZINC000408758497 559270317 /nfs/dbraw/zinc/27/03/17/559270317.db2.gz LCMCEPFROKRNCE-LPYMAVHISA-N 0 0 421.327 6.445 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccco3)N=C2c2sc3ccccc3c2Cl)cc1 ZINC000408758521 558616407 /nfs/dbraw/zinc/61/64/07/558616407.db2.gz LRQNJVJTDFZWBJ-QGOAFFKASA-N 0 0 418.905 6.291 40 10 HKCBRN O=C1/C(=C\c2cccs2)N=C(c2ccccc2Br)N1c1ccccc1 ZINC000408758598 559271351 /nfs/dbraw/zinc/27/13/51/559271351.db2.gz NMLQDABLUSQSHI-QGOAFFKASA-N 0 0 409.308 5.345 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(OC)cc3)N=C2c2ccccc2F)cc1 ZINC000408758609 558616584 /nfs/dbraw/zinc/61/65/84/558616584.db2.gz NQRCGBYYCOXXCT-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3cccc(C)c3)C2=O)cc1 ZINC000408758650 558616624 /nfs/dbraw/zinc/61/66/24/558616624.db2.gz OMUJOGZXYSTPSP-HKWRFOASSA-N 0 0 401.893 6.128 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2)N=C(c2ccccc2Cl)N1c1ccc(O)cc1 ZINC000408758683 559271303 /nfs/dbraw/zinc/27/13/03/559271303.db2.gz PDGPASMDLIBMKE-DEDYPNTBSA-N 0 0 409.272 5.534 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3cccc(C)c3)C2=O)cc1OC ZINC000408758769 559271318 /nfs/dbraw/zinc/27/13/18/559271318.db2.gz QWHPCOPQRODHAE-PXLXIMEGSA-N 0 0 412.489 5.155 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000408758786 558616798 /nfs/dbraw/zinc/61/67/98/558616798.db2.gz REYLKPUXJQNGPG-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(OC)cc3)N=C2c2ccc(F)cc2)cc1 ZINC000408758814 558616855 /nfs/dbraw/zinc/61/68/55/558616855.db2.gz RQNJJIRWDRAFDY-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc(Br)cc3)C(=O)N2c2ccccc2)cc1 ZINC000408758845 559271340 /nfs/dbraw/zinc/27/13/40/559271340.db2.gz SHPQEBDSLSCAQP-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccc(C)cc2)cc1 ZINC000408758883 559271452 /nfs/dbraw/zinc/27/14/52/559271452.db2.gz TYCRQJKRLIRBPP-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(F)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408758894 559271438 /nfs/dbraw/zinc/27/14/38/559271438.db2.gz UFKZOFMWZJGHKJ-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(C)cc2)cc1 ZINC000408758944 559271439 /nfs/dbraw/zinc/27/14/39/559271439.db2.gz VFXQQQXVPPIXNT-NLRVBDNBSA-N 0 0 402.497 6.291 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3F)N(c3cccc(C)c3)C2=O)cc1 ZINC000408759005 559271419 /nfs/dbraw/zinc/27/14/19/559271419.db2.gz WJRKDSXXAAEBPJ-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccco3)N=C2c2sc3ccccc3c2Cl)c1 ZINC000408759034 559271613 /nfs/dbraw/zinc/27/16/13/559271613.db2.gz WUDGYRXVRUMCFM-QGOAFFKASA-N 0 0 418.905 6.291 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc(N(C)C)cc3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408759083 559271442 /nfs/dbraw/zinc/27/14/42/559271442.db2.gz XPGQWOQTOWYHOK-XQNSMLJCSA-N 0 0 415.924 5.549 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccc(Cl)cc2)c1 ZINC000408759086 559271618 /nfs/dbraw/zinc/27/16/18/559271618.db2.gz XPYMJYSWHXKSLB-KOEQRZSOSA-N 0 0 422.915 6.636 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2cccc(C)c2)cc1 ZINC000408759123 558617067 /nfs/dbraw/zinc/61/70/67/558617067.db2.gz YBSYEHIPDUNJGK-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN CCc1ccc(N2C(=O)/C(=C\c3ccc(OC)cc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408759152 558619593 /nfs/dbraw/zinc/61/95/93/558619593.db2.gz YTWPYFITFOVMJN-PGMHBOJBSA-N 0 0 415.920 6.382 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408759155 559272680 /nfs/dbraw/zinc/27/26/80/559272680.db2.gz YWXJECMAVIFKIB-CJLVFECKSA-N 0 0 401.897 5.241 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408759180 559273807 /nfs/dbraw/zinc/27/38/07/559273807.db2.gz ZERHKVIDEDCRJL-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2c2ccc(Cl)cc2)cc1 ZINC000408759234 559274497 /nfs/dbraw/zinc/27/44/97/559274497.db2.gz AGAIJHUGXMMURR-UDWIEESQSA-N 0 0 416.864 5.212 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2cccc(C)c2)c1 ZINC000408759243 558619479 /nfs/dbraw/zinc/61/94/79/558619479.db2.gz ALJCYXSQLWBWPX-NLRVBDNBSA-N 0 0 402.497 6.291 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccccc2F)N1c1ccc(Br)cc1 ZINC000408759350 558619431 /nfs/dbraw/zinc/61/94/31/558619431.db2.gz COGKBEFGLOUTPV-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccccc2Cl)N(c2cccc(C)c2)C1=O ZINC000408759369 558619473 /nfs/dbraw/zinc/61/94/73/558619473.db2.gz CXBGQMFOUIJRGP-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN O=C1/C(=C\c2ccc3c(c2)OCO3)N=C(c2ccc(F)cc2)N1c1ccc(Cl)cc1 ZINC000408759383 559275680 /nfs/dbraw/zinc/27/56/80/559275680.db2.gz DDOQMUFIPFYDRS-YBFXNURJSA-N 0 0 420.827 5.042 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408759385 558619486 /nfs/dbraw/zinc/61/94/86/558619486.db2.gz DEHGBPPUORDDGX-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3ccccc3F)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408759540 558619517 /nfs/dbraw/zinc/61/95/17/558619517.db2.gz GSPLZHCQOOYLSP-PXLXIMEGSA-N 0 0 419.887 5.380 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408759592 559275713 /nfs/dbraw/zinc/27/57/13/559275713.db2.gz HPLGLDXNXDLJSN-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccccc2F)cc1 ZINC000408759684 558619749 /nfs/dbraw/zinc/61/97/49/558619749.db2.gz JPXJYCPZXLRXBM-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccccc3O)C2=O)cc1 ZINC000408759707 559275565 /nfs/dbraw/zinc/27/55/65/559275565.db2.gz KCHIYUNDXXBQDH-JXAWBTAJSA-N 0 0 403.865 5.526 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3F)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408759749 559275764 /nfs/dbraw/zinc/27/57/64/559275764.db2.gz KURKLMHMGQMQLO-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccccc2Cl)cc1 ZINC000408759767 559275810 /nfs/dbraw/zinc/27/58/10/559275810.db2.gz LEXXBKWDSMNJLF-KOEQRZSOSA-N 0 0 422.915 6.636 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)N=C2c2ccccc2Cl)cc1 ZINC000408759795 558619779 /nfs/dbraw/zinc/61/97/79/558619779.db2.gz LSGLAHBAZRHPCD-XQNSMLJCSA-N 0 0 415.924 5.549 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc(Cl)cc3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408759862 558619720 /nfs/dbraw/zinc/61/97/20/558619720.db2.gz NAVHQAFTRGOUGZ-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2cccc(C)c2)N(c2ccc(Cl)cc2)C1=O ZINC000408759863 558619758 /nfs/dbraw/zinc/61/97/58/558619758.db2.gz NAYCXPGUDQTLJL-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN O=C1/C(=C\c2ccc(F)cc2)N=C(c2ccccc2Br)N1c1ccccc1 ZINC000408759873 559275913 /nfs/dbraw/zinc/27/59/13/559275913.db2.gz NGQBMHPWEHOERU-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccccc2Cl)cc1 ZINC000408759915 559275907 /nfs/dbraw/zinc/27/59/07/559275907.db2.gz NZYVDUJYEDLMPA-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccco3)C(=O)N2c2ccc(Br)cc2)c1 ZINC000408759917 559275932 /nfs/dbraw/zinc/27/59/32/559275932.db2.gz OAZFPMAIQMDASR-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3cccc(C)c3)C2=O)c1 ZINC000408759949 558619775 /nfs/dbraw/zinc/61/97/75/558619775.db2.gz OUDVTYHGNZZYEW-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(F)cc3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408760030 559275925 /nfs/dbraw/zinc/27/59/25/559275925.db2.gz QFCLXWFTRCVXAX-PXLXIMEGSA-N 0 0 404.416 5.198 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408760054 559275916 /nfs/dbraw/zinc/27/59/16/559275916.db2.gz QRWNNXRYBNLNGS-JXAWBTAJSA-N 0 0 405.856 5.959 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccc(OC)cc2)cc1 ZINC000408760079 558619769 /nfs/dbraw/zinc/61/97/69/558619769.db2.gz RETQJZHFQGUWRX-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408760139 558619722 /nfs/dbraw/zinc/61/97/22/558619722.db2.gz SGHPCUJPVYXKMZ-CJLVFECKSA-N 0 0 402.881 5.573 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccccc2Cl)N(c2ccc(C)cc2)C1=O ZINC000408760239 558619718 /nfs/dbraw/zinc/61/97/18/558619718.db2.gz VBTODSRLQMGHQY-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3cccs3)C(=O)N2c2ccc(Br)cc2)c1 ZINC000408760252 558619743 /nfs/dbraw/zinc/61/97/43/558619743.db2.gz VLZKSNHHZFQJOZ-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccccc2)N1c1ccc(Cl)cc1 ZINC000408760268 559275921 /nfs/dbraw/zinc/27/59/21/559275921.db2.gz VRICEISVZSSDRM-JJIBRWJFSA-N 0 0 408.888 6.328 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3)N=C2c2ccc(F)cc2)cc1 ZINC000408760269 559275914 /nfs/dbraw/zinc/27/59/14/559275914.db2.gz VRQAGCWJQPUGRK-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccccc3)C2=O)c(OC)c1 ZINC000408760309 559275917 /nfs/dbraw/zinc/27/59/17/559275917.db2.gz WJWOPMZNQZOZRD-KGENOOAVSA-N 0 0 418.880 5.192 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc(Br)cc3)C(=O)N2c2ccccc2)c1 ZINC000408760323 559275911 /nfs/dbraw/zinc/27/59/11/559275911.db2.gz WRFUZYMEUDEWIL-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3ccc(C)cc3)C2=O)cc1OC ZINC000408760367 558619932 /nfs/dbraw/zinc/61/99/32/558619932.db2.gz XLBYLTYJRIRKOU-PXLXIMEGSA-N 0 0 412.489 5.155 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3cccc(O)c3)C2=O)cc1 ZINC000408760617 559275969 /nfs/dbraw/zinc/27/59/69/559275969.db2.gz BTIKFVYBADYBNV-AQTBWJFISA-N 0 0 403.865 5.526 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2cccc(C)c2)c1 ZINC000408760698 559276050 /nfs/dbraw/zinc/27/60/50/559276050.db2.gz DITNLOGBBGMUCG-LPYMAVHISA-N 0 0 421.327 6.445 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2ccccc2Br)N1c1ccc(F)cc1 ZINC000408760735 558617674 /nfs/dbraw/zinc/61/76/74/558617674.db2.gz FFFORPZYRMWKAU-LDADJPATSA-N 0 0 411.230 5.016 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408760787 558617651 /nfs/dbraw/zinc/61/76/51/558617651.db2.gz FYSPORJIPRPGSD-KGENOOAVSA-N 0 0 423.299 5.837 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccc(F)cc2)N1c1cccc(Br)c1 ZINC000408760847 559276080 /nfs/dbraw/zinc/27/60/80/559276080.db2.gz AIYIGOXPXSQPJU-DEDYPNTBSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408760880 558617890 /nfs/dbraw/zinc/61/78/90/558617890.db2.gz AOHGJZBDQHHEQX-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3cccs3)C(=O)N2c2cccc(Br)c2)cc1 ZINC000408760906 558617897 /nfs/dbraw/zinc/61/78/97/558617897.db2.gz AVVDQHVQNDPGPH-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(OCC)cc3)C2=O)cc1 ZINC000408760911 559276128 /nfs/dbraw/zinc/27/61/28/559276128.db2.gz AYMQMPFYUHJQJE-HKOYGPOVSA-N 0 0 412.489 5.319 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3cccc(C)c3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408760968 558617918 /nfs/dbraw/zinc/61/79/18/558617918.db2.gz BNIJABPKNSGSBY-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(OC)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408760984 559276119 /nfs/dbraw/zinc/27/61/19/559276119.db2.gz BJWOAYIMFQTAAY-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccccc2)N1c1cccc(Br)c1 ZINC000408761033 559276134 /nfs/dbraw/zinc/27/61/34/559276134.db2.gz GRJMMPAUDAVLHJ-XSFVSMFZSA-N 0 0 403.279 5.284 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2sc3ccccc3c2Cl)N1c1ccccc1 ZINC000408761143 559276105 /nfs/dbraw/zinc/27/61/05/559276105.db2.gz CGTNYWSLEOFKEM-GHRIWEEISA-N 0 0 404.878 5.982 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccc(F)cc3)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408761200 558618253 /nfs/dbraw/zinc/61/82/53/558618253.db2.gz CWFMFNHKRVILIT-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)N=C(c2ccc(Cl)cc2)N1c1ccccc1 ZINC000408761241 559276076 /nfs/dbraw/zinc/27/60/76/559276076.db2.gz CSJSVVBNKVPCCG-XSFVSMFZSA-N 0 0 403.825 5.083 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3Cl)N=C2c2cccc(C)c2)cc1 ZINC000408761274 559276107 /nfs/dbraw/zinc/27/61/07/559276107.db2.gz DBNMRERBJMCPGM-LPYMAVHISA-N 0 0 421.327 6.445 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2sc3ccccc3c2Cl)N1c1ccc(F)cc1 ZINC000408761283 559276077 /nfs/dbraw/zinc/27/60/77/559276077.db2.gz DRGUZKUQQHFIJF-SFQUDFHCSA-N 0 0 422.868 6.121 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccccc3)C2=O)cc1OC ZINC000408761294 559276130 /nfs/dbraw/zinc/27/61/30/559276130.db2.gz DFYZBUYUUKDLEI-XMHGGMMESA-N 0 0 417.892 5.829 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408761451 559276235 /nfs/dbraw/zinc/27/62/35/559276235.db2.gz FNJSZPPODLFASM-KGENOOAVSA-N 0 0 417.852 5.391 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2ccc(C)cc2)cc1 ZINC000408761542 559276260 /nfs/dbraw/zinc/27/62/60/559276260.db2.gz GOHQCRHNUPROMY-LPYMAVHISA-N 0 0 421.327 6.445 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2Cl)c1 ZINC000408761716 558618447 /nfs/dbraw/zinc/61/84/47/558618447.db2.gz KZCCFGCJIPXPIG-KGENOOAVSA-N 0 0 417.852 5.391 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccccc3C)C2=O)cc1 ZINC000408761760 558618433 /nfs/dbraw/zinc/61/84/33/558618433.db2.gz HKBZCSLBBQHEOA-HKWRFOASSA-N 0 0 401.893 6.128 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3cccs3)C(=O)N2c2cccc(Br)c2)c1 ZINC000408761819 559276266 /nfs/dbraw/zinc/27/62/66/559276266.db2.gz HUWLWTBQJZSBGG-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccccc3)C(=O)N2c2cccc(Br)c2)c1 ZINC000408761861 558618640 /nfs/dbraw/zinc/61/86/40/558618640.db2.gz IARSDAGFHSBDSD-KGENOOAVSA-N 0 0 417.306 5.592 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccc(Cl)cc3)C(=O)N2c2ccc(F)cc2)cc1 ZINC000408761876 559276270 /nfs/dbraw/zinc/27/62/70/559276270.db2.gz IBEJDLWCSWCPPF-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2cccc(C)c2)cc1 ZINC000408761913 558618729 /nfs/dbraw/zinc/61/87/29/558618729.db2.gz IGBIUOSEVOMBRH-NLRVBDNBSA-N 0 0 418.496 5.991 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccccc2Br)N1c1ccccc1 ZINC000408761955 558618710 /nfs/dbraw/zinc/61/87/10/558618710.db2.gz IGHHWQCZEUEZOX-HMMYKYKNSA-N 0 0 403.279 5.284 40 10 HKCBRN O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)N=C(c2ccccc2)N1c1ccc(Cl)cc1 ZINC000408761968 558618699 /nfs/dbraw/zinc/61/86/99/558618699.db2.gz IJALCIKICFDKBM-XSFVSMFZSA-N 0 0 403.825 5.083 40 10 HKCBRN O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)N=C(c2ccc(F)cc2)N1c1ccc(Cl)cc1 ZINC000408761986 559276375 /nfs/dbraw/zinc/27/63/75/559276375.db2.gz IOILXSNZKPAWDV-DEDYPNTBSA-N 0 0 421.815 5.222 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccccc2F)cc1 ZINC000408762048 559276267 /nfs/dbraw/zinc/27/62/67/559276267.db2.gz MPRXSZZTUKLJQV-KOEQRZSOSA-N 0 0 422.459 5.822 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2ccc(O)cc2)c1 ZINC000408762125 559282157 /nfs/dbraw/zinc/28/21/57/559282157.db2.gz CVSNFCRDIIZOJO-CIAFOILYSA-N 0 0 423.299 5.842 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000408762138 558618873 /nfs/dbraw/zinc/61/88/73/558618873.db2.gz JIGMVKRLWQZUFQ-PXLXIMEGSA-N 0 0 418.880 5.192 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccccc2)cc1 ZINC000408762210 558618819 /nfs/dbraw/zinc/61/88/19/558618819.db2.gz DGZPBHDXNVHTCT-XIEYBQDHSA-N 0 0 404.469 5.683 40 10 HKCBRN O=C1/C(=C\c2ccc3c(c2)OCO3)N=C(c2ccccc2Cl)N1c1ccc(F)cc1 ZINC000408762262 558618802 /nfs/dbraw/zinc/61/88/02/558618802.db2.gz ALIUEXCHTJOPEG-YBFXNURJSA-N 0 0 420.827 5.042 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccco3)N=C2c2ccccc2Br)c1 ZINC000408762284 558618799 /nfs/dbraw/zinc/61/87/99/558618799.db2.gz NWWXRHGINRWDQL-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccccc2F)cc1 ZINC000408762288 558618834 /nfs/dbraw/zinc/61/88/34/558618834.db2.gz NXCPOMQOHCDSFC-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(F)cc2)cc1 ZINC000408762289 558618813 /nfs/dbraw/zinc/61/88/13/558618813.db2.gz JXQCSAFUDQCJSX-KOEQRZSOSA-N 0 0 422.459 5.822 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408762345 558618808 /nfs/dbraw/zinc/61/88/08/558618808.db2.gz OGAHYKNMWOLVHM-HKWRFOASSA-N 0 0 401.893 6.128 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc(N(C)C)cc3)C(=O)N2c2ccc(Cl)cc2)c1 ZINC000408762390 560546115 /nfs/dbraw/zinc/54/61/15/560546115.db2.gz OLFIKMDRANCBHY-XQNSMLJCSA-N 0 0 415.924 5.549 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccc(C)cc2)cc1 ZINC000408762499 558619087 /nfs/dbraw/zinc/61/90/87/558619087.db2.gz BQUZGRSOAKNRHL-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2sc3ccccc3c2Cl)N1c1ccccc1 ZINC000408762508 558619157 /nfs/dbraw/zinc/61/91/57/558619157.db2.gz BUOAKEXFTBKDPQ-XDJHFCHBSA-N 0 0 414.917 6.389 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(OC)cc3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408762511 558619175 /nfs/dbraw/zinc/61/91/75/558619175.db2.gz BVVYTSXJEOPAOJ-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2ccc(F)cc2)N1c1cccc(Br)c1 ZINC000408762576 558619063 /nfs/dbraw/zinc/61/90/63/558619063.db2.gz DZSKJZUZAWYLFI-LDADJPATSA-N 0 0 411.230 5.016 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000408762670 558619037 /nfs/dbraw/zinc/61/90/37/558619037.db2.gz LSYHGYPDLKKXLE-AQTBWJFISA-N 0 0 422.311 6.473 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccccc3)C2=O)cc1 ZINC000408762698 558619364 /nfs/dbraw/zinc/61/93/64/558619364.db2.gz LVNQBRZNCHDYNE-CJLVFECKSA-N 0 0 401.897 5.241 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2sc3ccccc3c2Cl)N1c1ccc(O)cc1 ZINC000408762723 558619254 /nfs/dbraw/zinc/61/92/54/558619254.db2.gz FWIIJODTEAGMJH-SFQUDFHCSA-N 0 0 420.877 5.688 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccccc2)cc1 ZINC000408762731 558619279 /nfs/dbraw/zinc/61/92/79/558619279.db2.gz LAANJTMPEIJGSA-CJLVFECKSA-N 0 0 402.881 5.573 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccccc3)C2=O)cc1 ZINC000408762789 558619253 /nfs/dbraw/zinc/61/92/53/558619253.db2.gz GGZCEJMDLMUBGJ-CJLVFECKSA-N 0 0 402.881 5.573 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc4c(c3)OCO4)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408762862 558619456 /nfs/dbraw/zinc/61/94/56/558619456.db2.gz GQKCJEGVDXVDHL-UDWIEESQSA-N 0 0 416.864 5.212 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3)N=C2c2cccc(C)c2)cc1 ZINC000408762919 558619550 /nfs/dbraw/zinc/61/95/50/558619550.db2.gz CNCKHYYPBGAMNN-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2ccccc2)c1 ZINC000408762946 558617856 /nfs/dbraw/zinc/61/78/56/558617856.db2.gz CQPOWLYWKHNQEB-FYJGNVAPSA-N 0 0 407.300 6.136 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccco3)C(=O)N2c2ccc(Br)cc2)cc1 ZINC000408762951 558618690 /nfs/dbraw/zinc/61/86/90/558618690.db2.gz CRLGLMIMUDKHHU-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408762954 558618643 /nfs/dbraw/zinc/61/86/43/558618643.db2.gz MAZKKKDWPIMYJZ-PXLXIMEGSA-N 0 0 419.887 5.380 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccccc2Cl)cc1 ZINC000408763000 558622546 /nfs/dbraw/zinc/62/25/46/558622546.db2.gz QSIVYHJEJDPTNH-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2ccccc2F)N1c1cccc(Br)c1 ZINC000408763143 558622502 /nfs/dbraw/zinc/62/25/02/558622502.db2.gz HUKHQKHGKZWKRK-LDADJPATSA-N 0 0 411.230 5.016 40 10 HKCBRN O=C1/C(=C\c2cccs2)N=C(c2sc3ccccc3c2Cl)N1c1ccccc1 ZINC000408763155 558622447 /nfs/dbraw/zinc/62/24/47/558622447.db2.gz RMJVTGDVCBQBND-GHRIWEEISA-N 0 0 420.946 6.451 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccccc2Br)N1c1ccc(F)cc1 ZINC000408763174 558622539 /nfs/dbraw/zinc/62/25/39/558622539.db2.gz NZRAAHZSXQKLLO-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3cccc(C)c3)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408763285 558622783 /nfs/dbraw/zinc/62/27/83/558622783.db2.gz OVMYQSQJKSBSII-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN O=C1/C(=C\c2ccccc2F)N=C(c2ccccc2Cl)N1c1ccc(Cl)cc1 ZINC000408763358 558619959 /nfs/dbraw/zinc/61/99/59/558619959.db2.gz SHEPWWDCZKJTFR-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccccc2)cc1 ZINC000408763373 558620202 /nfs/dbraw/zinc/62/02/02/558620202.db2.gz NIUVSIQZRDENCO-LGUFXXKBSA-N 0 0 418.496 6.073 40 10 HKCBRN O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)N=C(c2ccccc2Cl)N1c1ccccc1 ZINC000408763605 558621594 /nfs/dbraw/zinc/62/15/94/558621594.db2.gz PWQRWVJBMFBPIT-XSFVSMFZSA-N 0 0 403.825 5.083 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)N=C2c2ccccc2Cl)cc1 ZINC000408763751 560629556 /nfs/dbraw/zinc/62/95/56/560629556.db2.gz QPRGUXPZZYUVEK-KGENOOAVSA-N 0 0 417.852 5.391 40 10 HKCBRN O=C1/C(=C\c2ccc(F)cc2)N=C(c2ccccc2)N1c1ccc(Br)cc1 ZINC000408763793 558621759 /nfs/dbraw/zinc/62/17/59/558621759.db2.gz OYFHAQWUAGILSD-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccc(F)cc2)cc1 ZINC000408763816 558621717 /nfs/dbraw/zinc/62/17/17/558621717.db2.gz PBVGGQKQNUQPFL-KOEQRZSOSA-N 0 0 406.460 6.122 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccccc2Cl)c1 ZINC000408763850 558621727 /nfs/dbraw/zinc/62/17/27/558621727.db2.gz KRHOJXQYXOHZOI-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408763874 558621910 /nfs/dbraw/zinc/62/19/10/558621910.db2.gz PNBVKSNBTGKMNG-KGENOOAVSA-N 0 0 423.299 5.837 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccc(F)cc2)c1 ZINC000408764003 558621926 /nfs/dbraw/zinc/62/19/26/558621926.db2.gz VLYORBPFAISNGY-KOEQRZSOSA-N 0 0 406.460 6.122 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408764033 558621979 /nfs/dbraw/zinc/62/19/79/558621979.db2.gz VQYYSYPVDOUNCC-PXLXIMEGSA-N 0 0 418.880 5.192 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3ccc(F)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408764098 558622071 /nfs/dbraw/zinc/62/20/71/558622071.db2.gz LFIBKYCVYVVFAM-PXLXIMEGSA-N 0 0 419.887 5.380 40 10 HKCBRN O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)N=C(c2ccc(Cl)cc2)N1c1ccc(F)cc1 ZINC000408764133 558622136 /nfs/dbraw/zinc/62/21/36/558622136.db2.gz LKRBDTVPLIPANM-DEDYPNTBSA-N 0 0 421.815 5.222 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408764165 558622164 /nfs/dbraw/zinc/62/21/64/558622164.db2.gz SDFNYVXYRLVOGW-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)N=C(c2ccccc2Cl)N1c1ccc(F)cc1 ZINC000408764194 558622183 /nfs/dbraw/zinc/62/21/83/558622183.db2.gz LPNCOFMQLMRRKF-DEDYPNTBSA-N 0 0 421.815 5.222 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccc(Cl)cc2)cc1 ZINC000408764195 558622084 /nfs/dbraw/zinc/62/20/84/558622084.db2.gz SHTGACWLALPQDP-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(Cl)cc2)c1 ZINC000408764347 558622428 /nfs/dbraw/zinc/62/24/28/558622428.db2.gz REGNSTAFPZVDNC-KOEQRZSOSA-N 0 0 422.915 6.636 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccc(Cl)cc2)cc1 ZINC000408764377 558622360 /nfs/dbraw/zinc/62/23/60/558622360.db2.gz MPNUCSIYSOZVPV-KOEQRZSOSA-N 0 0 422.915 6.636 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3cccc(F)c3)C2=O)cc1 ZINC000408764416 558622437 /nfs/dbraw/zinc/62/24/37/558622437.db2.gz RXWPXUFLZWVDLO-AQTBWJFISA-N 0 0 405.856 5.959 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000408764463 558622399 /nfs/dbraw/zinc/62/23/99/558622399.db2.gz WYHYUYCSJJSOKN-PXLXIMEGSA-N 0 0 418.880 5.192 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408764516 558622394 /nfs/dbraw/zinc/62/23/94/558622394.db2.gz UHNXAILDBQCTQN-KGENOOAVSA-N 0 0 417.852 5.391 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2ccccc2)cc1 ZINC000408764709 558622315 /nfs/dbraw/zinc/62/23/15/558622315.db2.gz MZVWJWYSQINIMU-FYJGNVAPSA-N 0 0 407.300 6.136 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccc(F)cc2)cc1 ZINC000408764741 558622417 /nfs/dbraw/zinc/62/24/17/558622417.db2.gz VIGIQTJNTJZFCD-KOEQRZSOSA-N 0 0 422.459 5.822 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408764758 558622424 /nfs/dbraw/zinc/62/24/24/558622424.db2.gz YFMXGSAEIWWEGZ-PXLXIMEGSA-N 0 0 419.887 5.380 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000408764775 558622364 /nfs/dbraw/zinc/62/23/64/558622364.db2.gz ADYHKJBDLYKTMU-ZDLGFXPLSA-N 0 0 416.304 5.487 40 10 HKCBRN COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000408764818 558622519 /nfs/dbraw/zinc/62/25/19/558622519.db2.gz AGKVEZZSLUHXRB-IGWPVBGESA-N 0 0 416.304 5.427 40 10 HKCBRN COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000408764821 558622461 /nfs/dbraw/zinc/62/24/61/558622461.db2.gz AGKVEZZSLUHXRB-KAECEXQPSA-N 0 0 416.304 5.427 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2cccc(C)c2)cc1 ZINC000408764856 558622555 /nfs/dbraw/zinc/62/25/55/558622555.db2.gz NLNFKYMDSAZWBK-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN O=C1/C(=C\c2ccc3c(c2)OCO3)N=C(c2ccc(Cl)cc2)N1c1ccc(F)cc1 ZINC000408764880 558622551 /nfs/dbraw/zinc/62/25/51/558622551.db2.gz UARQJPCOJMBYOF-YBFXNURJSA-N 0 0 420.827 5.042 40 10 HKCBRN Cc1cc2c(C=C3C(=O)OC4(CCCC4)OC3=O)c(-c3ccccc3)[nH]c2c(C)c1 ZINC000408764895 558622471 /nfs/dbraw/zinc/62/24/71/558622471.db2.gz AKINTWFRJZXGTD-UHFFFAOYSA-N 0 0 401.462 5.205 40 10 HKCBRN CC(C)(C)c1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)cc(C(C)(C)C)c1O ZINC000408764954 560629708 /nfs/dbraw/zinc/62/97/08/560629708.db2.gz APKPIFWJFZAWQA-UHFFFAOYSA-N 0 0 400.515 5.131 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccccc3F)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408765167 558624021 /nfs/dbraw/zinc/62/40/21/558624021.db2.gz WYFZVVGBFHJOJI-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3OC)N=C2c2cccc(C)c2)cc1 ZINC000408765172 558624071 /nfs/dbraw/zinc/62/40/71/558624071.db2.gz WYNFAJHQMUNMCS-HAVVHWLPSA-N 0 0 412.489 5.237 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccc(Cl)cc3Cl)C(=O)N2c2ccccc2)cc1 ZINC000408765186 558624080 /nfs/dbraw/zinc/62/40/80/558624080.db2.gz ZXIDLKIAJVAQCP-FYJGNVAPSA-N 0 0 423.299 5.837 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(F)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408765202 558624198 /nfs/dbraw/zinc/62/41/98/558624198.db2.gz ZYXSYCWFNCIASX-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN O=C1/C(=C\c2cccc3ccccc23)N=C(c2ccccc2F)N1c1ccc(O)cc1 ZINC000408765229 558624212 /nfs/dbraw/zinc/62/42/12/558624212.db2.gz XKRHWGMCQLZSHS-LFVJCYFKSA-N 0 0 408.432 5.519 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3Cl)N=C2c2ccccc2)cc1 ZINC000408765280 558624467 /nfs/dbraw/zinc/62/44/67/558624467.db2.gz KZTMESYAMFDNKO-FYJGNVAPSA-N 0 0 407.300 6.136 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccccc2Cl)cc1 ZINC000408765283 558624361 /nfs/dbraw/zinc/62/43/61/558624361.db2.gz OTQAZPKCJBBSAA-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccccc3)N=C2c2ccccc2Br)c1 ZINC000408765289 558624379 /nfs/dbraw/zinc/62/43/79/558624379.db2.gz OUKGYXFYIHSVAQ-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(OC)nc3)C2=O)cc1 ZINC000408765298 558624635 /nfs/dbraw/zinc/62/46/35/558624635.db2.gz OWRJVUXGZXBWPL-AQTBWJFISA-N 0 0 418.880 5.224 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccc(Cl)cc2)N(c2ccc(F)cc2)C1=O ZINC000408765326 558624543 /nfs/dbraw/zinc/62/45/43/558624543.db2.gz VIDXVQNGBSAZNX-XSFVSMFZSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc(Cl)cc3Cl)N=C2c2ccccc2)c1 ZINC000408765340 558624878 /nfs/dbraw/zinc/62/48/78/558624878.db2.gz LDSADRKUBBVVOF-FYJGNVAPSA-N 0 0 407.300 6.136 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccccc3F)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408765355 558624799 /nfs/dbraw/zinc/62/47/99/558624799.db2.gz PEDCKGJNWKSFDN-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2cccc(C)c2)cc1 ZINC000408765371 558624843 /nfs/dbraw/zinc/62/48/43/558624843.db2.gz LIOANRHNANYEAX-NLRVBDNBSA-N 0 0 402.497 6.291 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccc(Cl)cc3)C(=O)N2c2ccc(OC)cc2)cc1 ZINC000408765383 558624991 /nfs/dbraw/zinc/62/49/91/558624991.db2.gz PFVRBJYBBIOLAS-PXLXIMEGSA-N 0 0 418.880 5.192 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3OC)N=C2c2ccc(F)cc2)cc1 ZINC000408765397 558625126 /nfs/dbraw/zinc/62/51/26/558625126.db2.gz LNLGFPIJEHCNIA-CJLVFECKSA-N 0 0 416.452 5.068 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3F)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408765439 558625413 /nfs/dbraw/zinc/62/54/13/558625413.db2.gz PPISRBBXUCDRLZ-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2Cl)N=C(c2ccccc2F)N1c1ccccc1 ZINC000408765468 558625405 /nfs/dbraw/zinc/62/54/05/558625405.db2.gz WEULFNUGFVUFKZ-UDWIEESQSA-N 0 0 411.263 5.967 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408765611 558626510 /nfs/dbraw/zinc/62/65/10/558626510.db2.gz YYVORDQLKSNVCR-KGENOOAVSA-N 0 0 423.299 5.837 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccccc3OC)N=C2c2ccc(Cl)cc2)cc1 ZINC000408765692 558626625 /nfs/dbraw/zinc/62/66/25/558626625.db2.gz ZLNTWPZYFVHTNY-RCCKNPSSSA-N 0 0 418.880 5.192 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccccc2F)N1c1cccc(Br)c1 ZINC000408765772 558626628 /nfs/dbraw/zinc/62/66/28/558626628.db2.gz QEGMQVFPDAAWAN-DEDYPNTBSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(F)cc3F)C2=O)cc1 ZINC000408765832 558626686 /nfs/dbraw/zinc/62/66/86/558626686.db2.gz YGZGCJVJJBOPOC-ATVHPVEESA-N 0 0 423.846 6.098 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3cccc4ccccc34)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408765902 558626653 /nfs/dbraw/zinc/62/66/53/558626653.db2.gz RLXWAJRBQBDJOE-KOEQRZSOSA-N 0 0 422.915 6.636 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccc4c(c3)OCO4)C(=O)N2c2ccc(Cl)cc2)c1 ZINC000408765946 558626696 /nfs/dbraw/zinc/62/66/96/558626696.db2.gz SAKOSHKFNLCDGD-UDWIEESQSA-N 0 0 416.864 5.212 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408765951 558626660 /nfs/dbraw/zinc/62/66/60/558626660.db2.gz SCEGBNOWGRMVRB-CJLVFECKSA-N 0 0 402.881 5.573 40 10 HKCBRN Cc1cccc2c(C=C3C(=O)OC4(CCCCC4)OC3=O)c(-c3ccccc3)[nH]c21 ZINC000408765977 558626668 /nfs/dbraw/zinc/62/66/68/558626668.db2.gz CFQKEYLBLKAABW-UHFFFAOYSA-N 0 0 401.462 5.287 40 10 HKCBRN O=C1/C(=C\c2ccc(Br)cc2)N=C(c2ccccc2F)N1c1ccccc1 ZINC000408766028 558626675 /nfs/dbraw/zinc/62/66/75/558626675.db2.gz YSSSZCGMJKPRNC-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)N=C2c2ccccc2)cc1 ZINC000408766041 558626707 /nfs/dbraw/zinc/62/67/07/558626707.db2.gz ODQAKWSSKJPJAN-XIEYBQDHSA-N 0 0 404.469 5.683 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccc(C)cc2)cc1 ZINC000408766076 558626709 /nfs/dbraw/zinc/62/67/09/558626709.db2.gz ZDQVHNSZJWZQLZ-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc(OC)c3)N=C2c2ccc(C)cc2)cc1 ZINC000408766162 558626875 /nfs/dbraw/zinc/62/68/75/558626875.db2.gz ZVKBGODVXMRBBK-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccccc2Cl)cc1 ZINC000408766228 558626904 /nfs/dbraw/zinc/62/69/04/558626904.db2.gz SRYUUIUZKHSNGU-PXLXIMEGSA-N 0 0 420.871 5.712 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2ccc(F)cc2)N1c1ccc(Br)cc1 ZINC000408766310 558626987 /nfs/dbraw/zinc/62/69/87/558626987.db2.gz UGBBBOCAFOKSTA-LDADJPATSA-N 0 0 411.230 5.016 40 10 HKCBRN O=C1/C(=C\c2ccco2)N=C(c2ccccc2F)N1c1ccc(Br)cc1 ZINC000408766322 558626923 /nfs/dbraw/zinc/62/69/23/558626923.db2.gz UHHCDHHUHMXBHO-LDADJPATSA-N 0 0 411.230 5.016 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccc(C)cc3C)C2=O)cc1 ZINC000408766405 558626939 /nfs/dbraw/zinc/62/69/39/558626939.db2.gz QAQVYADRZFMDIY-QNGOZBTKSA-N 0 0 415.920 6.437 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccco3)C2=O)cc1OC ZINC000408766407 558626926 /nfs/dbraw/zinc/62/69/26/558626926.db2.gz QBMDQDJHDIKMJG-SFQUDFHCSA-N 0 0 407.853 5.422 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408766447 558626887 /nfs/dbraw/zinc/62/68/87/558626887.db2.gz QSESESOXIHLANL-KGENOOAVSA-N 0 0 406.844 5.322 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc(N(C)C)cc3)N=C2c2ccc(Cl)cc2)c1 ZINC000408766588 558626990 /nfs/dbraw/zinc/62/69/90/558626990.db2.gz VTJJXSUYLURKNH-XQNSMLJCSA-N 0 0 415.924 5.549 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3cccc(C)c3)C2=O)cc1 ZINC000408766868 558626921 /nfs/dbraw/zinc/62/69/21/558626921.db2.gz TXKNTDXGQXERAP-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(C)cc3)N(c3cccc(C)c3)C2=O)cc1OC ZINC000408766872 558626942 /nfs/dbraw/zinc/62/69/42/558626942.db2.gz TXZCFOIVORNKDK-PXLXIMEGSA-N 0 0 412.489 5.155 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(F)cc3)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000408766886 560630090 /nfs/dbraw/zinc/63/00/90/560630090.db2.gz UFZSCLYTRADQNH-XQNSMLJCSA-N 0 0 416.452 5.068 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccccc3F)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408766890 560630058 /nfs/dbraw/zinc/63/00/58/560630058.db2.gz UHGVPYRJUUXBCM-PXLXIMEGSA-N 0 0 404.416 5.198 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(C)cc3)C2=O)c1 ZINC000408766932 560630055 /nfs/dbraw/zinc/63/00/55/560630055.db2.gz XDMZKMFLEUJHSP-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN COc1ccc(/C=C2/C=C(c3ccc(Cl)cc3)N(c3ccccc3OC)C2=O)cc1 ZINC000408767162 558626909 /nfs/dbraw/zinc/62/69/09/558626909.db2.gz WBELSOWKGNBCSM-CYVLTUHYSA-N 0 0 417.892 5.829 40 10 HKCBRN CCc1ccccc1N1C(=O)/C(=C\c2ccc(OC)cc2)C=C1c1ccc(Cl)cc1 ZINC000408767272 560630186 /nfs/dbraw/zinc/63/01/86/560630186.db2.gz YTBIOWOYWYNNAH-PGMHBOJBSA-N 0 0 415.920 6.382 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccc([N+](=O)[O-])cc3)N=C2c2ccc(Cl)cc2)c1 ZINC000408767342 558627039 /nfs/dbraw/zinc/62/70/39/558627039.db2.gz ZLESKVRBKFSGAE-KGENOOAVSA-N 0 0 417.852 5.391 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccccc2Cl)N(c2ccc(F)cc2)C1=O ZINC000408767438 558627163 /nfs/dbraw/zinc/62/71/63/558627163.db2.gz XQIQAEXZUNUXHI-XSFVSMFZSA-N 0 0 406.844 5.322 40 10 HKCBRN O=C1/C(=C\c2ccc(F)cc2)N=C(c2ccc(Cl)cc2)N1c1ccc(Cl)cc1 ZINC000408767451 558627148 /nfs/dbraw/zinc/62/71/48/558627148.db2.gz XTONPHKSIRFHJY-DEDYPNTBSA-N 0 0 411.263 5.967 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2c2ccccc2Br)cc1 ZINC000408767546 558627142 /nfs/dbraw/zinc/62/71/42/558627142.db2.gz YJLFVKTXJYRAHQ-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN Cc1cc(C=C2C(=O)OC3(CCCC3)OC2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 ZINC000408767623 558627086 /nfs/dbraw/zinc/62/70/86/558627086.db2.gz FTUILAGQMGYOSE-UHFFFAOYSA-N 0 0 420.292 5.155 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccccc3OC)N=C2c2ccccc2Cl)cc1 ZINC000408767636 558627035 /nfs/dbraw/zinc/62/70/35/558627035.db2.gz ZGYARFPCSOAXSK-RCCKNPSSSA-N 0 0 418.880 5.192 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccccc3)C2=O)cc1 ZINC000408767645 558627160 /nfs/dbraw/zinc/62/71/60/558627160.db2.gz ZIJZSRZUWOGXSX-CJLVFECKSA-N 0 0 401.897 5.241 40 10 HKCBRN O=C1/C(=C\c2ccc(Cl)cc2Cl)N=C(c2ccc(F)cc2)N1c1ccccc1 ZINC000408767658 558627104 /nfs/dbraw/zinc/62/71/04/558627104.db2.gz ZNZBRRXZXUIDLD-UDWIEESQSA-N 0 0 411.263 5.967 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccccc2F)cc1 ZINC000408767830 558627438 /nfs/dbraw/zinc/62/74/38/558627438.db2.gz PKIFXXMSDANEKJ-XMHGGMMESA-N 0 0 400.409 5.514 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc4ccccc34)C(C(=O)OC)=C2C)cc1 ZINC000408767865 558627529 /nfs/dbraw/zinc/62/75/29/558627529.db2.gz GWNOIBSXEWLQSV-KQWNVCNZSA-N 0 0 413.473 5.116 40 10 HKCBRN O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc(Sc2ccc(Cl)cc2)o1 ZINC000408768436 560638856 /nfs/dbraw/zinc/63/88/56/560638856.db2.gz JCSYDZZNEBOFMT-UHFFFAOYSA-N 0 0 404.871 5.228 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccccc1Cl ZINC000408768760 560638839 /nfs/dbraw/zinc/63/88/39/560638839.db2.gz KDBVEXFQYGCZRJ-ATVHPVEESA-N 0 0 402.277 5.261 40 10 HKCBRN CCc1ccc(N[C@@H]2NC(=O)/C(=C/c3cc(C)n(-c4ccccc4F)c3C)S2)cc1 ZINC000408769156 560638917 /nfs/dbraw/zinc/63/89/17/560638917.db2.gz PAYLYECNWVLVQW-IGSWSUAKSA-N 0 0 421.541 5.395 40 10 HKCBRN CCc1ccc(N[C@H]2NC(=O)/C(=C/c3cc(C)n(-c4ccccc4F)c3C)S2)cc1 ZINC000408769157 560638915 /nfs/dbraw/zinc/63/89/15/560638915.db2.gz PAYLYECNWVLVQW-YMSBRDKKSA-N 0 0 421.541 5.395 40 10 HKCBRN Cc1cc2c(C=C3C(=O)OC4(CCCCC4)OC3=O)c(-c3ccccc3)[nH]c2c(C)c1 ZINC000408769174 560638919 /nfs/dbraw/zinc/63/89/19/560638919.db2.gz LNVVQFGKMNGOBI-UHFFFAOYSA-N 0 0 415.489 5.596 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000408769524 560638909 /nfs/dbraw/zinc/63/89/09/560638909.db2.gz NKYJVBVBPGWZCY-DHDCSXOGSA-N 0 0 406.240 5.010 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1c(O)ccc2ccccc21 ZINC000408769555 558630340 /nfs/dbraw/zinc/63/03/40/558630340.db2.gz NXCURWNQTCTXIJ-JCMHNJIXSA-N 0 0 413.473 5.121 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C/c1c(F)cccc1Cl ZINC000408769566 558630270 /nfs/dbraw/zinc/63/02/70/558630270.db2.gz OBUHVGQXUGDJFZ-LDADJPATSA-N 0 0 413.876 5.363 40 10 HKCBRN CCc1ccc(N[C@H]2NC(=O)/C(=C/c3cc(C)n(-c4ccccc4C)c3C)S2)cc1 ZINC000408769655 560639039 /nfs/dbraw/zinc/63/90/39/560639039.db2.gz YNTSWQQZRUYNMT-GJFKPFFXSA-N 0 0 417.578 5.565 40 10 HKCBRN CCc1ccc(N[C@@H]2NC(=O)/C(=C/c3cc(C)n(-c4ccccc4C)c3C)S2)cc1 ZINC000408769656 560639044 /nfs/dbraw/zinc/63/90/44/560639044.db2.gz YNTSWQQZRUYNMT-LWUPDDLQSA-N 0 0 417.578 5.565 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408769948 558630536 /nfs/dbraw/zinc/63/05/36/558630536.db2.gz QZFNWFOEQLLPLE-WJDWOHSUSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2F)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408770084 560639070 /nfs/dbraw/zinc/63/90/70/560639070.db2.gz SNCIWADPHCKFEC-RAXLEYEMSA-N 0 0 406.240 5.010 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1c(F)cccc1Cl ZINC000408770285 558630638 /nfs/dbraw/zinc/63/06/38/558630638.db2.gz VPZYSERCSWJGKY-LFIBNONCSA-N 0 0 420.267 5.400 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408770332 560639027 /nfs/dbraw/zinc/63/90/27/560639027.db2.gz WHWAKXRLVYFYRO-VBKFSLOCSA-N 0 0 402.277 5.261 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccccc2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000408770433 560639042 /nfs/dbraw/zinc/63/90/42/560639042.db2.gz XNDCMOZEHGLCLN-VBKFSLOCSA-N 0 0 402.277 5.261 40 10 HKCBRN Cc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)c(C)n1-c1ccc(F)c(Cl)c1 ZINC000408770627 558629699 /nfs/dbraw/zinc/62/96/99/558629699.db2.gz ZRMGWOIGIDDWAI-UHFFFAOYSA-N 0 0 417.864 5.030 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2cccc(Cl)c2)cc1 ZINC000408770843 558631321 /nfs/dbraw/zinc/63/13/21/558631321.db2.gz BEMPVPKNQDYCJS-CPNJWEJPSA-N 0 0 416.864 6.028 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1ccc(C(C)(C)C)cc1 ZINC000408771074 558631599 /nfs/dbraw/zinc/63/15/99/558631599.db2.gz CSISPQOWPLADQP-KOEQRZSOSA-N 0 0 411.549 6.198 40 10 HKCBRN CC(=O)c1ccc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)C=C2c2ccc(C)cc2)cc1 ZINC000408771093 558631593 /nfs/dbraw/zinc/63/15/93/558631593.db2.gz CEEONJIRJYEGTJ-PXLXIMEGSA-N 0 0 424.456 5.577 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(Sc2nc3ccccc3[nH]2)o1 ZINC000408771429 558631849 /nfs/dbraw/zinc/63/18/49/558631849.db2.gz GIVUHBXLISUMHH-GHRIWEEISA-N 0 0 400.463 5.113 40 10 HKCBRN CC(=O)c1cccc(N2C(=O)C(=Cc3ccc([N+](=O)[O-])cc3)C=C2c2ccc(C)cc2)c1 ZINC000408772073 558630984 /nfs/dbraw/zinc/63/09/84/558630984.db2.gz ALHUXOCJBOYWGZ-HYARGMPZSA-N 0 0 424.456 5.577 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2cc(C)ccc2C)cc1 ZINC000408772709 560639264 /nfs/dbraw/zinc/63/92/64/560639264.db2.gz FHKHZXYOYLVFQT-PXLXIMEGSA-N 0 0 410.473 5.991 40 10 HKCBRN CCc1ccc(N[C@H]2NC(=O)/C(=C/c3cc(C)n(-c4cccc(C)c4)c3C)S2)cc1 ZINC000408772879 558633731 /nfs/dbraw/zinc/63/37/31/558633731.db2.gz NTAUBTFNWUEWLS-GJFKPFFXSA-N 0 0 417.578 5.565 40 10 HKCBRN CCc1ccc(N[C@@H]2NC(=O)/C(=C/c3cc(C)n(-c4cccc(C)c4)c3C)S2)cc1 ZINC000408772881 558633749 /nfs/dbraw/zinc/63/37/49/558633749.db2.gz NTAUBTFNWUEWLS-LWUPDDLQSA-N 0 0 417.578 5.565 40 10 HKCBRN CCc1ccc(N[C@@H]2NC(=O)/C(=C/c3cc(C)n(-c4ccc(F)cc4)c3C)S2)cc1 ZINC000408772904 558633671 /nfs/dbraw/zinc/63/36/71/558633671.db2.gz IYCAQKWGPKBQFG-IGSWSUAKSA-N 0 0 421.541 5.395 40 10 HKCBRN CCc1ccc(N[C@H]2NC(=O)/C(=C/c3cc(C)n(-c4ccc(F)cc4)c3C)S2)cc1 ZINC000408772907 560639228 /nfs/dbraw/zinc/63/92/28/560639228.db2.gz IYCAQKWGPKBQFG-YMSBRDKKSA-N 0 0 421.541 5.395 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(C(C)C)cc2)cc1 ZINC000408774280 560639367 /nfs/dbraw/zinc/63/93/67/560639367.db2.gz UKFOCWLLXUXSRV-XQNSMLJCSA-N 0 0 424.500 6.498 40 10 HKCBRN CCc1ccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C=C2c2ccc(C)cc2)cc1 ZINC000408774853 558633102 /nfs/dbraw/zinc/63/31/02/558633102.db2.gz YIXFGJFXDMWGHH-CJLVFECKSA-N 0 0 410.473 5.937 40 10 HKCBRN COc1cccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C=C2c2ccc(C)cc2)c1 ZINC000408775685 558633529 /nfs/dbraw/zinc/63/35/29/558633529.db2.gz JXRWKOOVBWXCFB-XSFVSMFZSA-N 0 0 412.445 5.383 40 10 HKCBRN CCc1ccc(N[C@@H]2NC(=O)/C(=C\c3cc(C)n(-c4ccc(C)cc4)c3C)S2)cc1 ZINC000408775888 558633907 /nfs/dbraw/zinc/63/39/07/558633907.db2.gz WCNRHWUQEBTZEM-XSZPGNIMSA-N 0 0 417.578 5.565 40 10 HKCBRN CCc1ccc(N[C@H]2NC(=O)/C(=C\c3cc(C)n(-c4ccc(C)cc4)c3C)S2)cc1 ZINC000408775890 560639052 /nfs/dbraw/zinc/63/90/52/560639052.db2.gz WCNRHWUQEBTZEM-XXMKCSCWSA-N 0 0 417.578 5.565 40 10 HKCBRN CCc1ccc(N[C@H]2NC(=O)/C(=C\c3cc(C)n(-c4ccccc4)c3C)S2)cc1 ZINC000408777052 560640047 /nfs/dbraw/zinc/64/00/47/560640047.db2.gz UXHHCTBAWCOSQR-NLZIUFDSSA-N 0 0 403.551 5.256 40 10 HKCBRN CCc1ccc(N[C@@H]2NC(=O)/C(=C\c3cc(C)n(-c4ccccc4)c3C)S2)cc1 ZINC000408777053 558634458 /nfs/dbraw/zinc/63/44/58/558634458.db2.gz UXHHCTBAWCOSQR-WLGHQHAYSA-N 0 0 403.551 5.256 40 10 HKCBRN COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc(C)n(-c2ccc(C)c(C)c2)c1C ZINC000408779822 560640915 /nfs/dbraw/zinc/64/09/15/560640915.db2.gz LNBIIRQPEVWNJZ-QRVIBDJDSA-N 0 0 420.553 5.040 40 10 HKCBRN COc1ccccc1N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)C=C1c1ccc(C)cc1 ZINC000408780032 560640908 /nfs/dbraw/zinc/64/09/08/560640908.db2.gz QNNCQZSCFPDLCM-HMMYKYKNSA-N 0 0 412.445 5.383 40 10 HKCBRN CCc1ccc(N[C@H]2NC(=O)/C(=C/c3cc(C)n(-c4cccc(F)c4)c3C)S2)cc1 ZINC000408781976 560641120 /nfs/dbraw/zinc/64/11/20/560641120.db2.gz FAXOGOIHHKZIKU-MFUBYVTQSA-N 0 0 421.541 5.395 40 10 HKCBRN CCc1ccc(N[C@@H]2NC(=O)/C(=C/c3cc(C)n(-c4cccc(F)c4)c3C)S2)cc1 ZINC000408781979 558637934 /nfs/dbraw/zinc/63/79/34/558637934.db2.gz FAXOGOIHHKZIKU-RWTNITNYSA-N 0 0 421.541 5.395 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3c(I)cccc3[C@@H]3C=CC[C@H]32)c1 ZINC000408782002 560641145 /nfs/dbraw/zinc/64/11/45/560641145.db2.gz GFRRTORMIUFRAF-CPUCHLNUSA-N 0 0 418.234 5.026 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3c(I)cccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000408782006 558638021 /nfs/dbraw/zinc/63/80/21/558638021.db2.gz GFRRTORMIUFRAF-KEYYUXOJSA-N 0 0 418.234 5.026 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3c(I)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000408782010 558637991 /nfs/dbraw/zinc/63/79/91/558637991.db2.gz GFRRTORMIUFRAF-VBQJREDUSA-N 0 0 418.234 5.026 40 10 HKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3c(I)cccc3[C@H]3C=CC[C@@H]32)c1 ZINC000408782012 558637944 /nfs/dbraw/zinc/63/79/44/558637944.db2.gz GFRRTORMIUFRAF-ZQIUZPCESA-N 0 0 418.234 5.026 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(C)c(C)c2)cc1 ZINC000408783053 558639662 /nfs/dbraw/zinc/63/96/62/558639662.db2.gz JPNYOTWZEBWBOL-PXLXIMEGSA-N 0 0 410.473 5.991 40 10 HKCBRN CCc1ccccc1N1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)C=C1c1ccc(C)cc1 ZINC000408783392 560641218 /nfs/dbraw/zinc/64/12/18/560641218.db2.gz ONMBDVSZCFYPFH-CJLVFECKSA-N 0 0 410.473 5.937 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(F)cc2F)cc1 ZINC000408783676 558639834 /nfs/dbraw/zinc/63/98/34/558639834.db2.gz OINHGBNCNPQIEC-LDADJPATSA-N 0 0 418.399 5.653 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408783761 560641253 /nfs/dbraw/zinc/64/12/53/560641253.db2.gz QSBZRLAUIVDYGI-XMHGGMMESA-N 0 0 416.864 6.028 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(-c2ccccc2)n1-c1ccccc1 ZINC000408784730 558640191 /nfs/dbraw/zinc/64/01/91/558640191.db2.gz SEUKJYCEAGOMCT-LGUFXXKBSA-N 0 0 417.512 6.259 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccccc2C(C)C)cc1 ZINC000408784773 558640195 /nfs/dbraw/zinc/64/01/95/558640195.db2.gz SPKQWEOWELTOBO-CJLVFECKSA-N 0 0 424.500 6.498 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(F)c(C)c2)cc1 ZINC000408785506 560641424 /nfs/dbraw/zinc/64/14/24/560641424.db2.gz ZUBWZNPMLARVNC-XSFVSMFZSA-N 0 0 414.436 5.822 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(F)cc2)cc1 ZINC000408785596 560641462 /nfs/dbraw/zinc/64/14/62/560641462.db2.gz HWKKQXDTSUEAHK-XMHGGMMESA-N 0 0 400.409 5.514 40 10 HKCBRN CCOc1ccc2ccc(OCC)c(/C=C3/C(=O)N(c4ccccc4)N=C3C)c2c1 ZINC000408785920 560641464 /nfs/dbraw/zinc/64/14/64/560641464.db2.gz JUSHFGPUBCVYBG-LTGZKZEYSA-N 0 0 400.478 5.443 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccccc2Cl)cc1 ZINC000408787157 558640336 /nfs/dbraw/zinc/64/03/36/558640336.db2.gz SNZJVACXEOSWFL-XMHGGMMESA-N 0 0 416.864 6.028 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C=C2c2ccc(C)cc2)cc1 ZINC000408788029 560641792 /nfs/dbraw/zinc/64/17/92/560641792.db2.gz AAMYYWRPVWYRRB-HMMYKYKNSA-N 0 0 412.445 5.383 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000408789284 560641606 /nfs/dbraw/zinc/64/16/06/560641606.db2.gz IJAGMIXNSBYQFE-YBEGLDIGSA-N 0 0 402.277 5.179 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2ccc(C)cc2C)cc1 ZINC000408789321 558641156 /nfs/dbraw/zinc/64/11/56/558641156.db2.gz JAFOJZUFPNXSFB-PXLXIMEGSA-N 0 0 410.473 5.991 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2c2cccc(F)c2)cc1 ZINC000408791271 558641521 /nfs/dbraw/zinc/64/15/21/558641521.db2.gz XYYDKYMVLXPSSY-CPNJWEJPSA-N 0 0 400.409 5.514 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccc(SC)cc1 ZINC000408791391 560641950 /nfs/dbraw/zinc/64/19/50/560641950.db2.gz WYKUQFHKVATFSI-STZFKDTASA-N 0 0 407.535 5.293 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000408794624 560641905 /nfs/dbraw/zinc/64/19/05/560641905.db2.gz JRRUZTAFVVVOFK-YVLHZVERSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1c(O)ccc2ccccc21 ZINC000408799151 558642716 /nfs/dbraw/zinc/64/27/16/558642716.db2.gz YAUWZIWMZSEDFJ-HMAPJEAMSA-N 0 0 413.473 5.039 40 10 HKCBRN COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000408799231 558642689 /nfs/dbraw/zinc/64/26/89/558642689.db2.gz YOUZGWXKRWIRJW-RVAQLADHSA-N 0 0 415.411 5.139 40 10 HKCBRN COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000408799233 560642235 /nfs/dbraw/zinc/64/22/35/560642235.db2.gz YOUZGWXKRWIRJW-VVTMIQRTSA-N 0 0 415.411 5.139 40 10 HKCBRN Cc1cc(/C=C2\SC(Nc3cc(Cl)ccc3C)NC2=O)c(C)n1-c1ccccc1 ZINC000408801271 558642722 /nfs/dbraw/zinc/64/27/22/558642722.db2.gz UOXIHHPGSNVFGY-UHFFFAOYSA-N 0 0 422.961 5.819 40 10 HKCBRN COc1ccc(C)cc1NC1NC(=O)/C(=C/c2cc(C)n(-c3ccccc3)c2C)S1 ZINC000408801950 560642584 /nfs/dbraw/zinc/64/25/84/560642584.db2.gz XGWASZILOASNPV-UHFFFAOYSA-N 0 0 418.542 5.174 40 10 HKCBRN Cc1cc(/C=C2\SC(Nc3ccccc3F)NC2=O)c(C)n1-c1ccc(F)cc1 ZINC000408804414 558645024 /nfs/dbraw/zinc/64/50/24/558645024.db2.gz FQOXFSGHVMWHFY-UHFFFAOYSA-N 0 0 410.469 5.135 40 10 HKCBRN Cc1cc(/C=C2\SC(Nc3ccc(Cl)cc3C)NC2=O)c(C)n1-c1ccccc1 ZINC000408804608 560643298 /nfs/dbraw/zinc/64/32/98/560643298.db2.gz YVOLZGOOLZPLES-UHFFFAOYSA-N 0 0 422.961 5.819 40 10 HKCBRN C[C@H]1CCCC[C@H]1N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1Nc1ccccc1 ZINC000408807271 560642666 /nfs/dbraw/zinc/64/26/66/560642666.db2.gz GTYKOJMBGKTZPU-GXEQYHJJSA-N 0 0 420.602 5.807 40 10 HKCBRN C[C@H]1CCCC[C@@H]1N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1Nc1ccccc1 ZINC000408807272 560642744 /nfs/dbraw/zinc/64/27/44/560642744.db2.gz GTYKOJMBGKTZPU-QMJJWYKPSA-N 0 0 420.602 5.807 40 10 HKCBRN C[C@@H]1CCCC[C@H]1N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1Nc1ccccc1 ZINC000408807273 558645601 /nfs/dbraw/zinc/64/56/01/558645601.db2.gz GTYKOJMBGKTZPU-XDQGBWCSSA-N 0 0 420.602 5.807 40 10 HKCBRN C[C@@H]1CCCC[C@@H]1N1C(=O)/C(=C/c2ccc(N(C)C)cc2)SC1Nc1ccccc1 ZINC000408807274 560642750 /nfs/dbraw/zinc/64/27/50/560642750.db2.gz GTYKOJMBGKTZPU-ZUZVBVLKSA-N 0 0 420.602 5.807 40 10 HKCBRN O=C1NC(=S)S/C1=C\c1c(OCc2ccc(Cl)cc2)ccc2ccccc21 ZINC000408810451 560643987 /nfs/dbraw/zinc/64/39/87/560643987.db2.gz KOZLMJJDDUSQJW-ODLFYWEKSA-N 0 0 411.935 5.561 40 10 HKCBRN Cc1cc(/C=C2\SC(Nc3ccccc3F)NC2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000408810761 558647623 /nfs/dbraw/zinc/64/76/23/558647623.db2.gz USBHANMSKQZVSS-UHFFFAOYSA-N 0 0 420.533 5.613 40 10 HKCBRN COc1ccc(-n2c(C)cc(/C=C3\SC(Nc4ccccc4F)NC3=O)c2C)cc1 ZINC000408811047 558647515 /nfs/dbraw/zinc/64/75/15/558647515.db2.gz NHUVVABZKVGGLJ-UHFFFAOYSA-N 0 0 422.505 5.005 40 10 HKCBRN Cc1cc(/C=C2\SC(Nc3ccccc3F)NC2=O)c(C)n1-c1c(C)cccc1C ZINC000408812349 558649003 /nfs/dbraw/zinc/64/90/03/558649003.db2.gz MTNWGQKTAZZLMF-UHFFFAOYSA-N 0 0 420.533 5.613 40 10 HKCBRN O=C1SC(=CC2=CC(=NNc3ccccc3)C=CC2=O)C(=O)N1c1ccccc1 ZINC000408816147 560644437 /nfs/dbraw/zinc/64/44/37/560644437.db2.gz SPQRFJUUMVOPEG-QIEPSYMVSA-N 0 0 401.447 6.049 40 10 HKCBRN Cc1cc(/C=C2\SC(Nc3ccccc3F)NC2=O)c(C)n1-c1ccc(C)cc1 ZINC000408818998 560644965 /nfs/dbraw/zinc/64/49/65/560644965.db2.gz WEISXMOADKEEOH-UHFFFAOYSA-N 0 0 406.506 5.305 40 10 HKCBRN Cc1cc(/C=C2\SC(Nc3ccccc3F)NC2=O)c(C)n1-c1cccc(C)c1C ZINC000408819923 560645413 /nfs/dbraw/zinc/64/54/13/560645413.db2.gz ZGYNYQCOSIZDAQ-UHFFFAOYSA-N 0 0 420.533 5.613 40 10 HKCBRN CCOc1ccc(N2Cc3cc4c(cc3C2)CN(c2ccc(OCC)cc2)C4)cc1 ZINC000408822024 560645634 /nfs/dbraw/zinc/64/56/34/560645634.db2.gz CRVBODGKRZAMDA-UHFFFAOYSA-N 0 0 400.522 5.524 40 10 HKCBRN Cc1cccc(NCN2C(=O)/C(=C\c3cccc(Br)c3)SC2=S)c1 ZINC000408822750 560645223 /nfs/dbraw/zinc/64/52/23/560645223.db2.gz VKJFCPSTLURVOL-MHWRWJLKSA-N 0 0 419.369 5.028 40 10 HKCBRN Cc1cc(C=C2C(=O)OC3(CCCCC3)OC2=O)c(C)n1-c1ccc(Cl)c(F)c1 ZINC000408828411 558663146 /nfs/dbraw/zinc/66/31/46/558663146.db2.gz MITKJRBKJVQDPZ-UHFFFAOYSA-N 0 0 417.864 5.030 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(C)C2=O)c(C)n1-c1ccc(OCc2ccccc2)cc1 ZINC000408830205 558664454 /nfs/dbraw/zinc/66/44/54/558664454.db2.gz OPWSLAFJQSNDHC-HMAPJEAMSA-N 0 0 418.518 5.339 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c1ccc1c2[C@@H]2C=CC[C@@H]2[C@H](c2ccc(Cl)cc2)N1 ZINC000408831744 560645710 /nfs/dbraw/zinc/64/57/10/560645710.db2.gz WPRNXURJUVVPKO-KCYKTTMJSA-N 0 0 411.888 5.942 40 10 HKCBRN COC(=O)C1=C(C)N(C2CCCCC2)C(=O)/C1=C\c1cc(C)n(-c2ccccc2)c1C ZINC000408834706 558667521 /nfs/dbraw/zinc/66/75/21/558667521.db2.gz UZKDJWGSSJZDAC-KQWNVCNZSA-N 0 0 418.537 5.099 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c1ccc1c2[C@@H]2C=CC[C@@H]2[C@H](c2ccc([N+](=O)[O-])cc2)N1 ZINC000408837502 558670638 /nfs/dbraw/zinc/67/06/38/558670638.db2.gz HHEGCGMTTNPATB-KCYKTTMJSA-N 0 0 422.440 5.197 40 10 HKCBRN O=C1/C(=C\c2cccc(Br)c2)N=C(c2ccccc2)N1c1ccccc1 ZINC000408839824 560645892 /nfs/dbraw/zinc/64/58/92/560645892.db2.gz AQBSKEDRLXOPHN-HMMYKYKNSA-N 0 0 403.279 5.284 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2ccc(Cl)cc2)C(=O)N1c1ccc(Cl)cc1 ZINC000408840148 558672834 /nfs/dbraw/zinc/67/28/34/558672834.db2.gz BMLZQIOXGVVUCD-XSFVSMFZSA-N 0 0 423.299 5.837 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3F)N=C2c2ccccc2OC)cc1 ZINC000408840178 558672952 /nfs/dbraw/zinc/67/29/52/558672952.db2.gz CHGGPAYLAHXWTL-CJLVFECKSA-N 0 0 416.452 5.068 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2c2ccc(Br)cc2)cc1 ZINC000408840240 558672876 /nfs/dbraw/zinc/67/28/76/558672876.db2.gz CSLHROKQDRUTGE-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2ccc(Cl)cc2)C(=O)N1c1ccc(C)cc1 ZINC000408840532 558673128 /nfs/dbraw/zinc/67/31/28/558673128.db2.gz CFIURRGDTPFBKJ-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccccc3)N=C2c2ccc(Br)cc2)cc1 ZINC000408840712 560646092 /nfs/dbraw/zinc/64/60/92/560646092.db2.gz FDMHGNVBQJPKSX-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3ccccc3[N+](=O)[O-])C(=O)N2c2ccc(Cl)cc2)c1 ZINC000408840722 560646086 /nfs/dbraw/zinc/64/60/86/560646086.db2.gz DISDPPMFVOAPBK-XSFVSMFZSA-N 0 0 417.852 5.391 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(F)cc3)N=C2c2ccccc2OC)cc1 ZINC000408840741 560646081 /nfs/dbraw/zinc/64/60/81/560646081.db2.gz FIDYEHVBHGMABF-CJLVFECKSA-N 0 0 416.452 5.068 40 10 HKCBRN CN(C)c1ccc(/C=C2/N=C(c3sc4cc(Cl)ccc4c3Cl)OC2=O)cc1 ZINC000408840878 560646079 /nfs/dbraw/zinc/64/60/79/560646079.db2.gz CRGCPLVCPIVDEW-OQLLNIDSSA-N 0 0 417.317 5.619 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2ccc(F)cc2)C(=O)N1c1ccc(Cl)cc1 ZINC000408841091 560646090 /nfs/dbraw/zinc/64/60/90/560646090.db2.gz FODCUPFZDPBLJW-XSFVSMFZSA-N 0 0 406.844 5.322 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2ccc(Cl)cc2)C(=O)N1c1ccc(F)cc1 ZINC000408841289 560646046 /nfs/dbraw/zinc/64/60/46/560646046.db2.gz IDPUDDQCTLFTFS-XSFVSMFZSA-N 0 0 406.844 5.322 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2cccc3ccccc23)C(=O)N1c1ccccc1 ZINC000408841296 560646062 /nfs/dbraw/zinc/64/60/62/560646062.db2.gz GASGACBZLLRAFE-HKOYGPOVSA-N 0 0 404.469 5.683 40 10 HKCBRN Cc1ccc(/C=C2/N=C(c3ccccc3)N(c3cccc(Br)c3)C2=O)cc1 ZINC000408841403 560646057 /nfs/dbraw/zinc/64/60/57/560646057.db2.gz GVFVXPSEXVCFBE-KGENOOAVSA-N 0 0 417.306 5.592 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(C)cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408841410 560646069 /nfs/dbraw/zinc/64/60/69/560646069.db2.gz IWKAXFIBBVTRCC-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(C)cc3)N=C2c2ccc(OC)cc2)cc1 ZINC000408841518 560646050 /nfs/dbraw/zinc/64/60/50/560646050.db2.gz JNFGLZYLWXNQAC-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccc(C)cc3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408841558 560646038 /nfs/dbraw/zinc/64/60/38/560646038.db2.gz JTBWXPICGNQSEG-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccs3)N=C2c2ccc(Br)cc2)c1 ZINC000408841737 558673456 /nfs/dbraw/zinc/67/34/56/558673456.db2.gz KKGPQEYUWBPWGO-CPNJWEJPSA-N 0 0 423.335 5.654 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3OC)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408841740 560646112 /nfs/dbraw/zinc/64/61/12/560646112.db2.gz KLWPFEVZQNXELX-RCCKNPSSSA-N 0 0 418.880 5.192 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2cccc3ccccc23)C(=O)N1c1ccc(O)cc1 ZINC000408841813 558673528 /nfs/dbraw/zinc/67/35/28/558673528.db2.gz LSTGPULLDARKLU-JJIBRWJFSA-N 0 0 420.468 5.389 40 10 HKCBRN O=C1/C(=C\c2ccccc2F)N=C(c2ccc(Br)cc2)N1c1ccccc1 ZINC000408841887 558673519 /nfs/dbraw/zinc/67/35/19/558673519.db2.gz ILRZEMDYRQNTCS-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2cccc3ccccc23)C(=O)N1c1ccc(F)cc1 ZINC000408842633 560646145 /nfs/dbraw/zinc/64/61/45/560646145.db2.gz PGDVXSHQWUKFEP-JJIBRWJFSA-N 0 0 422.459 5.822 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(C)cc3)N=C2c2ccccc2Cl)cc1 ZINC000408842660 558673305 /nfs/dbraw/zinc/67/33/05/558673305.db2.gz PKTNZUNPLSNVHU-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])N=C2c2ccc(Cl)cc2)c1 ZINC000408842877 558674524 /nfs/dbraw/zinc/67/45/24/558674524.db2.gz LNIZKQKOJBXQDS-XSFVSMFZSA-N 0 0 417.852 5.391 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccccc2OC)N(c2ccc(Cl)cc2)C1=O ZINC000408843086 560645896 /nfs/dbraw/zinc/64/58/96/560645896.db2.gz QGJXHSFHAFOVSM-HMMYKYKNSA-N 0 0 418.880 5.192 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccco3)N=C2c2ccc(Br)cc2)c1 ZINC000408843128 560646771 /nfs/dbraw/zinc/64/67/71/560646771.db2.gz QJWLVXYQROMDKK-CPNJWEJPSA-N 0 0 407.267 5.185 40 10 HKCBRN O=C1/C(=C\c2ccccc2[N+](=O)[O-])N=C(c2ccc(F)cc2)N1c1ccc(Cl)cc1 ZINC000408843224 558674576 /nfs/dbraw/zinc/67/45/76/558674576.db2.gz QZLKXUDRDFJHPN-CPNJWEJPSA-N 0 0 421.815 5.222 40 10 HKCBRN Cc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408843269 560646761 /nfs/dbraw/zinc/64/67/61/560646761.db2.gz RGRANMUMPXOSID-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(C)cc3)N=C2c2ccc(F)cc2)cc1 ZINC000408843476 560646741 /nfs/dbraw/zinc/64/67/41/560646741.db2.gz MZDDEMBKMSPZJB-XQNSMLJCSA-N 0 0 400.453 5.367 40 10 HKCBRN COc1cccc(/C=C2/N=C(c3ccccc3OC)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408843685 560646268 /nfs/dbraw/zinc/64/62/68/560646268.db2.gz RQZVZOYLJSZXHP-RCCKNPSSSA-N 0 0 418.880 5.192 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])N=C2c2ccc(Cl)cc2)cc1 ZINC000408843888 558673900 /nfs/dbraw/zinc/67/39/00/558673900.db2.gz SRWNHGNONUWQEZ-XSFVSMFZSA-N 0 0 417.852 5.391 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])N=C2c2ccccc2Cl)cc1 ZINC000408843896 560646255 /nfs/dbraw/zinc/64/62/55/560646255.db2.gz SSYOIXOSKVRSSM-XSFVSMFZSA-N 0 0 417.852 5.391 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(C)cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408844695 558677363 /nfs/dbraw/zinc/67/73/63/558677363.db2.gz PBWNCZVMXIORER-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(C)cc3)N=C2c2ccccc2Cl)cc1 ZINC000408844741 558674827 /nfs/dbraw/zinc/67/48/27/558674827.db2.gz UTWMATXMWHLIMG-PXLXIMEGSA-N 0 0 402.881 5.492 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccccc3)N=C2c2ccc(Br)cc2)c1 ZINC000408845247 560646440 /nfs/dbraw/zinc/64/64/40/560646440.db2.gz VKKJKLJRLAHGJG-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN Cc1ccc(/C=C2/N=C(c3ccccc3Br)N(c3ccccc3)C2=O)cc1 ZINC000408845364 560646483 /nfs/dbraw/zinc/64/64/83/560646483.db2.gz WFHLGQOSBMIRJK-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN O=C1/C(=C\c2cccc(Br)c2)N=C(c2ccccc2)N1c1ccc(F)cc1 ZINC000408845426 558675579 /nfs/dbraw/zinc/67/55/79/558675579.db2.gz WPCMJLCEBKBLGY-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3ccccc3[N+](=O)[O-])N=C2c2ccccc2Cl)c1 ZINC000408845833 560646453 /nfs/dbraw/zinc/64/64/53/560646453.db2.gz RXNMMUBJBRGCLA-XSFVSMFZSA-N 0 0 417.852 5.391 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C\c3cccc(Br)c3)N=C2c2ccccc2)c1 ZINC000408846012 560646467 /nfs/dbraw/zinc/64/64/67/560646467.db2.gz XDDGREJZQSMOOR-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(C)cc3)N=C2c2ccccc2OC)cc1 ZINC000408846164 560646522 /nfs/dbraw/zinc/64/65/22/560646522.db2.gz XRFZFTZCAGNZOJ-HAVVHWLPSA-N 0 0 412.489 5.237 40 10 HKCBRN COc1ccc(N2C(=N)S/C(=C\c3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)cc1 ZINC000408846445 560646524 /nfs/dbraw/zinc/64/65/24/560646524.db2.gz SKPKMKMLZQJOTG-NZBFAAGASA-N 0 0 421.497 5.298 40 10 HKCBRN O=C1/C(=C\c2ccccc2)N=C(c2ccc(Br)cc2)N1c1ccc(F)cc1 ZINC000408846549 560646507 /nfs/dbraw/zinc/64/65/07/560646507.db2.gz SWDMTLNBNXLDBV-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN Cc1cc(C=C2SC(=S)NC2=O)cc(C)c1OCc1ccc(Cl)cc1Cl ZINC000408846663 558679849 /nfs/dbraw/zinc/67/98/49/558679849.db2.gz RFSMATSWEJXWLZ-FRKPEAEDSA-N 0 0 424.374 5.678 40 10 HKCBRN Cc1cccc(C2=N/C(=C/c3cccc(Br)c3)C(=O)N2c2ccccc2)c1 ZINC000408846679 560646514 /nfs/dbraw/zinc/64/65/14/560646514.db2.gz YJJSVPNHJDPVJT-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2ccc(Cl)cc2Cl)C(=O)N1c1ccccc1 ZINC000408846697 560646543 /nfs/dbraw/zinc/64/65/43/560646543.db2.gz YNXDYCOAXYZEJN-DEDYPNTBSA-N 0 0 423.299 5.837 40 10 HKCBRN O=C1/C(=C\c2ccc(F)cc2)N=C(c2ccc(Br)cc2)N1c1ccccc1 ZINC000408846903 560646529 /nfs/dbraw/zinc/64/65/29/560646529.db2.gz ZLMQUTYOAZPOLA-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN O=C1/C(=C\c2ccccc2[N+](=O)[O-])N=C(c2ccccc2F)N1c1ccc(Cl)cc1 ZINC000408847141 560646644 /nfs/dbraw/zinc/64/66/44/560646644.db2.gz ZSUWLRVTJVXZTA-CPNJWEJPSA-N 0 0 421.815 5.222 40 10 HKCBRN Cc1ccc(/C=C2/N=C(c3ccccc3)N(c3ccc(Br)cc3)C2=O)cc1 ZINC000408847302 560646652 /nfs/dbraw/zinc/64/66/52/560646652.db2.gz UVZSFBAQLFEQIY-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN Cc1ccc(/C=C2/N=C(c3ccc(Br)cc3)N(c3ccccc3)C2=O)cc1 ZINC000408847912 560646686 /nfs/dbraw/zinc/64/66/86/560646686.db2.gz VUQABAJMDQYMGE-RCCKNPSSSA-N 0 0 417.306 5.592 40 10 HKCBRN Cc1ccc(C2=N/C(=C/c3ccccc3[N+](=O)[O-])C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408848482 560646660 /nfs/dbraw/zinc/64/66/60/560646660.db2.gz WYRCTWORVHXVRP-XSFVSMFZSA-N 0 0 417.852 5.391 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2ccc(Cl)cc2)C(=O)N1c1cccc(C)c1 ZINC000408848581 560646960 /nfs/dbraw/zinc/64/69/60/560646960.db2.gz XGBHVEZRVZPOPS-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN O=C1/C(=C\c2cccc(Br)c2)N=C(c2ccccc2F)N1c1ccccc1 ZINC000408849068 558682288 /nfs/dbraw/zinc/68/22/88/558682288.db2.gz YPDPVSFMYCYJDN-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2ccc(C)cc2)C(=O)N1c1ccc(Cl)cc1 ZINC000408849083 560647081 /nfs/dbraw/zinc/64/70/81/560647081.db2.gz YPRYHSWPVCKUQO-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN O=C1/C(=C\c2cccc(Br)c2)N=C(c2ccc(F)cc2)N1c1ccccc1 ZINC000408849136 560647091 /nfs/dbraw/zinc/64/70/91/560647091.db2.gz YVKJNMLZWQEYSI-XSFVSMFZSA-N 0 0 421.269 5.423 40 10 HKCBRN Cc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408849277 558681302 /nfs/dbraw/zinc/68/13/02/558681302.db2.gz ZHIQMOPNFXQDJR-KGENOOAVSA-N 0 0 407.300 6.136 40 10 HKCBRN COc1ccccc1C1=N/C(=C/c2cccc3ccccc23)C(=O)N1c1cccc(C)c1 ZINC000408849428 560647089 /nfs/dbraw/zinc/64/70/89/560647089.db2.gz ZXMKOZCBOMAAHY-XIEYBQDHSA-N 0 0 418.496 5.991 40 10 HKCBRN Cc1cc(C=C2SC(=S)NC2=O)cc(C)c1OCc1ccc(Cl)c(Cl)c1 ZINC000408850513 558684127 /nfs/dbraw/zinc/68/41/27/558684127.db2.gz BGSGPGQVKOYYNX-LZYBPNLTSA-N 0 0 424.374 5.678 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(C)c(OCc2ccc(F)cc2)c(C)c1 ZINC000408853612 558690059 /nfs/dbraw/zinc/69/00/59/558690059.db2.gz QIXFYDZCIGQDFQ-BUVRLJJBSA-N 0 0 414.480 5.828 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c1ccc1c2[C@@H]2C=CC[C@@H]2[C@H](c2ccc3c(c2)OCO3)N1 ZINC000408861560 558701137 /nfs/dbraw/zinc/70/11/37/558701137.db2.gz SPBPPIAQLHXUDG-TWKFVSLJSA-N 0 0 421.452 5.017 40 10 HKCBRN COc1cc([C@@H]2Nc3cc(C)cc(C)c3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000408864391 558702742 /nfs/dbraw/zinc/70/27/42/558702742.db2.gz ZRUXYANIESLVPM-XFQAVAEZSA-N 0 0 414.343 5.910 40 10 HKCBRN COc1cc([C@@H]2Nc3ccc(F)cc3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000408865140 558702531 /nfs/dbraw/zinc/70/25/31/558702531.db2.gz BUFDLMVNGTZKCE-TYILLQQXSA-N 0 0 404.279 5.432 40 10 HKCBRN COc1cc([C@@H]2Nc3c(C)ccc(C)c3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000408868085 560648543 /nfs/dbraw/zinc/64/85/43/560648543.db2.gz LHWPDOXGBHJCSM-XFQAVAEZSA-N 0 0 414.343 5.910 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c1ccc1c2[C@@H]2C=CC[C@@H]2[C@H](c2ccccc2Cl)N1 ZINC000408868385 558704167 /nfs/dbraw/zinc/70/41/67/558704167.db2.gz PZCSZMXNNRJMHV-JPMUSVJPSA-N 0 0 411.888 5.942 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c1ccc1c2[C@@H]2C=CC[C@@H]2[C@H](c2cccc([N+](=O)[O-])c2)N1 ZINC000408871395 560649021 /nfs/dbraw/zinc/64/90/21/560649021.db2.gz YXUOESQQKWURHW-KCYKTTMJSA-N 0 0 422.440 5.197 40 10 HKCBRN CC(C)c1ccc([C@@H]2Nc3ccc4c(c3[C@@H]3C=CC[C@@H]32)C(=O)c2ccccc2C4=O)cc1 ZINC000408872364 560649074 /nfs/dbraw/zinc/64/90/74/560649074.db2.gz LTOJUVPFLFFKKG-JVAFGIKQSA-N 0 0 419.524 6.412 40 10 HKCBRN COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc(C)n(-c2cc(C)ccc2C)c1C ZINC000408874995 560648848 /nfs/dbraw/zinc/64/88/48/560648848.db2.gz HCASQSQIJOPGGA-XKZIYDEJSA-N 0 0 420.553 5.040 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c1ccc1c2[C@@H]2C=CC[C@@H]2[C@H](c2ccccc2[N+](=O)[O-])N1 ZINC000408878196 558710999 /nfs/dbraw/zinc/71/09/99/558710999.db2.gz XYQSSBGXXMRYPB-JPMUSVJPSA-N 0 0 422.440 5.197 40 10 HKCBRN O=C1c2ccccc2C(=O)c2c1ccc1c2[C@@H]2C=CC[C@@H]2[C@H](c2cccc(Cl)c2)N1 ZINC000408879988 558711785 /nfs/dbraw/zinc/71/17/85/558711785.db2.gz IBEZGMLGVYQMQQ-KCYKTTMJSA-N 0 0 411.888 5.942 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000408891704 560650839 /nfs/dbraw/zinc/65/08/39/560650839.db2.gz BPZPHJQLHHBASX-BOPFTXTBSA-N 0 0 416.304 5.487 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408891860 560650831 /nfs/dbraw/zinc/65/08/31/560650831.db2.gz DADNWBCFNFAIAO-ATVHPVEESA-N 0 0 416.304 5.569 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000408891886 560650816 /nfs/dbraw/zinc/65/08/16/560650816.db2.gz DTHIYXGGNCKHBQ-YVLHZVERSA-N 0 0 402.277 5.179 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)C(C(=O)OC)=C2C)cc1 ZINC000408892199 560650989 /nfs/dbraw/zinc/65/09/89/560650989.db2.gz HDUBUMWEGXWOTA-JCMHNJIXSA-N 0 0 405.494 5.086 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408892243 560650969 /nfs/dbraw/zinc/65/09/69/560650969.db2.gz HPEDKKZGYVTWMF-WJDWOHSUSA-N 0 0 402.277 5.179 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000408892285 558717255 /nfs/dbraw/zinc/71/72/55/558717255.db2.gz HVIPFHYUHLJVFZ-JCMHNJIXSA-N 0 0 417.892 5.761 40 10 HKCBRN COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000408893155 558717806 /nfs/dbraw/zinc/71/78/06/558717806.db2.gz KWRLGZTVQBKPST-FHNWIRHTSA-N 0 0 416.304 5.427 40 10 HKCBRN COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000408893159 560651038 /nfs/dbraw/zinc/65/10/38/560651038.db2.gz KWRLGZTVQBKPST-NCUBORBFSA-N 0 0 416.304 5.427 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cccc(Cl)c1 ZINC000408893829 560650420 /nfs/dbraw/zinc/65/04/20/560650420.db2.gz NNSLOSDIRPQQTG-PDGQHHTCSA-N 0 0 402.277 5.261 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(F)cc2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000408893890 558719139 /nfs/dbraw/zinc/71/91/39/558719139.db2.gz OCXJIFKONGDMTJ-SXGWCWSVSA-N 0 0 406.240 5.010 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccccc1OCC ZINC000408894586 560650541 /nfs/dbraw/zinc/65/05/41/560650541.db2.gz RMDNMLRRZIOYOU-RGEXLXHISA-N 0 0 411.885 5.006 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408894989 560650627 /nfs/dbraw/zinc/65/06/27/560650627.db2.gz SQRPIUNPNPDIRQ-BOPFTXTBSA-N 0 0 416.304 5.487 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(OCC)cc2)C(=O)/C1=C\c1cccc(Cl)c1 ZINC000408895181 560650642 /nfs/dbraw/zinc/65/06/42/560650642.db2.gz UDTFMPOBDXLNED-ZHZULCJRSA-N 0 0 411.885 5.006 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408895647 558719411 /nfs/dbraw/zinc/71/94/11/558719411.db2.gz UZSFUKHTULUJRF-GDNBJRDFSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000408896240 560650687 /nfs/dbraw/zinc/65/06/87/560650687.db2.gz WYAGIEBSBJPYMT-PDGQHHTCSA-N 0 0 415.411 5.199 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc(Cl)c1OC(C)C ZINC000408900919 560651184 /nfs/dbraw/zinc/65/11/84/560651184.db2.gz ABRIYNKMAROFSH-GZTJUZNOSA-N 0 0 419.955 5.542 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccccc1F ZINC000408900924 558725553 /nfs/dbraw/zinc/72/55/53/558725553.db2.gz ACUXMQMBKYZSIY-DEDYPNTBSA-N 0 0 408.523 5.639 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1cc(C)ccc1C ZINC000408900936 558725661 /nfs/dbraw/zinc/72/56/61/558725661.db2.gz AGOFZTLVTMMRFR-HYARGMPZSA-N 0 0 418.587 6.117 40 10 HKCBRN CCn1c2ccccc2c2cc(/C=C3/SC(=S)N(c4ccccc4)C3=O)ccc21 ZINC000408900970 560651312 /nfs/dbraw/zinc/65/13/12/560651312.db2.gz AXUBIXMVXXGRKZ-PXLXIMEGSA-N 0 0 414.555 6.220 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1cccc2ccccc21 ZINC000408900981 560651326 /nfs/dbraw/zinc/65/13/26/560651326.db2.gz BCMLBWWERNJCPC-KOEQRZSOSA-N 0 0 405.501 6.053 40 10 HKCBRN O=C1/C(=C\c2ccc(OCc3cccc(F)c3)cc2)SC(=S)N1c1ccccc1 ZINC000408901191 560651352 /nfs/dbraw/zinc/65/13/52/560651352.db2.gz BVNJXFTYLMOPDO-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN CCc1ccc(-n2c(C)cc(/C=C3/SC(=S)N(c4ccccc4)C3=O)c2C)cc1 ZINC000408901281 560651354 /nfs/dbraw/zinc/65/13/54/560651354.db2.gz DBHITMDKSQJUBB-PXLXIMEGSA-N 0 0 418.587 6.062 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccccc1C ZINC000408901449 560651325 /nfs/dbraw/zinc/65/13/25/560651325.db2.gz FHKXVLCHWNRWLP-KGENOOAVSA-N 0 0 404.560 5.808 40 10 HKCBRN CCOc1c(Cl)cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1Cl ZINC000408901489 558724675 /nfs/dbraw/zinc/72/46/75/558724675.db2.gz FXXSPOIHKOXKTH-XNTDXEJSSA-N 0 0 410.347 5.798 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000408901561 558724579 /nfs/dbraw/zinc/72/45/79/558724579.db2.gz GKGWLBTZOKLGKU-HYARGMPZSA-N 0 0 418.587 6.117 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc(Cl)c1OCC ZINC000408901810 560651515 /nfs/dbraw/zinc/65/15/15/560651515.db2.gz HGXYNUZYDYVMNH-SFQUDFHCSA-N 0 0 419.955 5.543 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccccc1C(C)C ZINC000408901841 558725159 /nfs/dbraw/zinc/72/51/59/558725159.db2.gz HTRYBZFHMQSDSO-HZHRSRAPSA-N 0 0 416.546 6.458 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1ccc2ccccc2c1 ZINC000408902072 560651065 /nfs/dbraw/zinc/65/10/65/560651065.db2.gz KFFNZDSAQNBDSI-YZSQISJMSA-N 0 0 405.501 6.053 40 10 HKCBRN Cc1c(/C=C2/C(=O)N(c3ccccc3)N=C2C)c2ccccc2n1Cc1ccccc1F ZINC000408902114 558725849 /nfs/dbraw/zinc/72/58/49/558725849.db2.gz KGOIXLPVNYCTJJ-XQNSMLJCSA-N 0 0 423.491 5.943 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000408902140 560651171 /nfs/dbraw/zinc/65/11/71/560651171.db2.gz KTNOUOLZKYLEFH-KGENOOAVSA-N 0 0 418.587 6.117 40 10 HKCBRN CCOc1c(Cl)cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1OC ZINC000408902146 560651212 /nfs/dbraw/zinc/65/12/12/560651212.db2.gz KVTIPYXKAXIKCL-LFIBNONCSA-N 0 0 405.928 5.153 40 10 HKCBRN Cc1ccc(-c2ccc(/C=C3/SC(=S)N(c4ccccc4)C3=O)o2)cc1[N+](=O)[O-] ZINC000408902169 558725990 /nfs/dbraw/zinc/72/59/90/558725990.db2.gz LGQJFNCPBVBNHE-XDHOZWIPSA-N 0 0 422.487 5.569 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1ccc([N+](=O)[O-])cc1C ZINC000408902223 560652149 /nfs/dbraw/zinc/65/21/49/560652149.db2.gz MEVLOHGZRSBCEZ-HYARGMPZSA-N 0 0 414.465 5.117 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000408902225 560652142 /nfs/dbraw/zinc/65/21/42/560652142.db2.gz MGEYSBIXUFGCMP-HYARGMPZSA-N 0 0 418.587 6.117 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccccc1Cl ZINC000408902245 558725810 /nfs/dbraw/zinc/72/58/10/558725810.db2.gz MKZGMKIZPODVDL-DEDYPNTBSA-N 0 0 424.978 6.153 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 ZINC000408902362 560652226 /nfs/dbraw/zinc/65/22/26/560652226.db2.gz NFOPJPCHIQIKGD-DEDYPNTBSA-N 0 0 408.523 5.639 40 10 HKCBRN CC[C@H](C)Oc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccccc2)C1=O ZINC000408902378 558726155 /nfs/dbraw/zinc/72/61/55/558726155.db2.gz NHKRRPQHQHJIJV-PZBNQXIHSA-N 0 0 419.571 6.423 40 10 HKCBRN Cc1cc(/C=c2\sc3nc4ccccc4n3c2=O)c(C)n1-c1ccc2ccccc2c1 ZINC000408902391 558726185 /nfs/dbraw/zinc/72/61/85/558726185.db2.gz IIKHTSCBQVMACZ-IWIPYMOSSA-N 0 0 421.525 5.018 40 10 HKCBRN CC[C@@H](C)Oc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccccc2)C1=O ZINC000408902410 560652210 /nfs/dbraw/zinc/65/22/10/560652210.db2.gz NHKRRPQHQHJIJV-QFNCUCFLSA-N 0 0 419.571 6.423 40 10 HKCBRN CCOc1c(Cl)cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)cc1Br ZINC000408902433 558726159 /nfs/dbraw/zinc/72/61/59/558726159.db2.gz NOGRQWRGQYBPFC-OQLLNIDSSA-N 0 0 419.706 5.307 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000408902469 558726341 /nfs/dbraw/zinc/72/63/41/558726341.db2.gz ODTFUSAQWDPZBG-HYARGMPZSA-N 0 0 418.587 6.117 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(-c2cc(C)c(C)c([N+](=O)[O-])c2)o1 ZINC000408902620 560652241 /nfs/dbraw/zinc/65/22/41/560652241.db2.gz OWPSXXYECINTGE-DEDYPNTBSA-N 0 0 401.422 5.278 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1cccc(Cl)c1 ZINC000408902638 560652234 /nfs/dbraw/zinc/65/22/34/560652234.db2.gz PCUHETAUYBKTMC-UDWIEESQSA-N 0 0 424.978 6.153 40 10 HKCBRN CC(C)Oc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccccc2)C1=O ZINC000408902692 560652218 /nfs/dbraw/zinc/65/22/18/560652218.db2.gz PYTBZERHQJRHDL-KGENOOAVSA-N 0 0 405.544 6.033 40 10 HKCBRN CCOc1cc(Cl)c(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1OC ZINC000408902771 560652186 /nfs/dbraw/zinc/65/21/86/560652186.db2.gz RFGUWYANXSQKGV-LICLKQGHSA-N 0 0 405.928 5.153 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000408902949 560652312 /nfs/dbraw/zinc/65/23/12/560652312.db2.gz SOLZQYMDXMWEPU-LDADJPATSA-N 0 0 407.813 5.314 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1Cl ZINC000408903085 560652333 /nfs/dbraw/zinc/65/23/33/560652333.db2.gz UKRUSAFRZIEFTE-HTMJNSLASA-N 0 0 403.956 5.923 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1Cl ZINC000408903089 558726942 /nfs/dbraw/zinc/72/69/42/558726942.db2.gz UKRUSAFRZIEFTE-RNEAKCBISA-N 0 0 403.956 5.923 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1ccc(C)c([N+](=O)[O-])c1 ZINC000408903123 560652350 /nfs/dbraw/zinc/65/23/50/560652350.db2.gz UTTZIACTBLATKP-LPYMAVHISA-N 0 0 414.465 5.117 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1cccc(Cl)c1Cl ZINC000408903198 560652411 /nfs/dbraw/zinc/65/24/11/560652411.db2.gz VNBGNMPSEDNJDU-CPNJWEJPSA-N 0 0 424.331 6.207 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1cccc(C)c1 ZINC000408903226 558727483 /nfs/dbraw/zinc/72/74/83/558727483.db2.gz VZOGOMHFTUAFKS-KGENOOAVSA-N 0 0 404.560 5.808 40 10 HKCBRN CCOc1ccc(/C=C2/SC(=S)N(c3ccccc3)C2=O)cc1Br ZINC000408903227 558727523 /nfs/dbraw/zinc/72/75/23/558727523.db2.gz WABUIUKNXISGMU-LFIBNONCSA-N 0 0 420.353 5.254 40 10 HKCBRN COc1ccc2ccc(OC)c(/C=C3/SC(=S)N(c4ccccc4)C3=O)c2c1 ZINC000408903238 558726087 /nfs/dbraw/zinc/72/60/87/558726087.db2.gz WEJCPJNPISIIOC-DEDYPNTBSA-N 0 0 407.516 5.263 40 10 HKCBRN O=C1/C(=C\c2ccccc2OCc2cccc(F)c2)SC(=S)N1c1ccccc1 ZINC000408903249 560652448 /nfs/dbraw/zinc/65/24/48/560652448.db2.gz WJSZFFYYMRIATK-KGENOOAVSA-N 0 0 421.518 5.811 40 10 HKCBRN CCc1cccc(C)c1-n1c(C)cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c1C ZINC000408903275 560652396 /nfs/dbraw/zinc/65/23/96/560652396.db2.gz WVKCHEUCCOPCLY-PXLXIMEGSA-N 0 0 416.546 6.206 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(Cl)cc1OC ZINC000408903326 558727488 /nfs/dbraw/zinc/72/74/88/558727488.db2.gz XGUOFFBTDXOKBS-LICLKQGHSA-N 0 0 405.928 5.153 40 10 HKCBRN Cc1c(/C=C2/C(=O)N(c3ccccc3)N=C2C)c2ccccc2n1Cc1ccccc1 ZINC000408903428 558727720 /nfs/dbraw/zinc/72/77/20/558727720.db2.gz XQSRGRLICJUQCD-JJIBRWJFSA-N 0 0 405.501 5.804 40 10 HKCBRN CCCCc1ccc(-n2c(C)cc(/C=C3/C(=O)N(c4ccccc4)N=C3C)c2C)cc1 ZINC000408903449 560652461 /nfs/dbraw/zinc/65/24/61/560652461.db2.gz YBYWAWPDNLVJDZ-NLRVBDNBSA-N 0 0 411.549 6.243 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)c(C)n1-c1ccc(Cl)cc1Cl ZINC000408903461 558727711 /nfs/dbraw/zinc/72/77/11/558727711.db2.gz YFGMGIMKJJVANX-UDWIEESQSA-N 0 0 424.331 6.207 40 10 HKCBRN CCOc1ccc(Br)cc1/C=C1/SC(=S)N(c2ccccc2)C1=O ZINC000408903462 560652459 /nfs/dbraw/zinc/65/24/59/560652459.db2.gz YFIWHJHJFNAHFL-LFIBNONCSA-N 0 0 420.353 5.254 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1cccc(F)c1 ZINC000408903466 558727700 /nfs/dbraw/zinc/72/77/00/558727700.db2.gz YHJGNKIOZJKKSU-UDWIEESQSA-N 0 0 408.523 5.639 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000408903576 558727940 /nfs/dbraw/zinc/72/79/40/558727940.db2.gz ZXVDHJXTPWMYTM-DEDYPNTBSA-N 0 0 406.532 5.206 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1ccc2ccccc2c1 ZINC000408903927 558728154 /nfs/dbraw/zinc/72/81/54/558728154.db2.gz BINMYABEIWHLNB-NLRVBDNBSA-N 0 0 418.496 6.225 40 10 HKCBRN CCOc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)cc(Cl)c1O[C@H](C)CC ZINC000408904367 558728430 /nfs/dbraw/zinc/72/84/30/558728430.db2.gz IJLQYVNONXKYQC-IYSPOMMRSA-N 0 0 412.917 5.722 40 10 HKCBRN CCOc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)cc(Cl)c1O[C@@H](C)CC ZINC000408904368 558728396 /nfs/dbraw/zinc/72/83/96/558728396.db2.gz IJLQYVNONXKYQC-UZUMKDMXSA-N 0 0 412.917 5.722 40 10 HKCBRN CCOc1cc(C=C2SC(=S)NC2=O)cc(Cl)c1OCc1ccccc1C ZINC000408922862 558748417 /nfs/dbraw/zinc/74/84/17/558748417.db2.gz GYGWLRINOMUWKI-YVLHZVERSA-N 0 0 419.955 5.115 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(C)cc1 ZINC000408931870 560655015 /nfs/dbraw/zinc/65/50/15/560655015.db2.gz RILQAENYROVCLW-LPYMAVHISA-N 0 0 419.912 5.149 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2cccc(Cl)c2)cc1 ZINC000408935331 560655913 /nfs/dbraw/zinc/65/59/13/560655913.db2.gz CUJGYEGTXQTRFP-HZHRSRAPSA-N 0 0 402.881 5.725 40 10 HKCBRN CC1=NN(C(=O)c2ccccc2)C(=O)/C1=C/c1ccc(OCc2cc(C)cc(C)c2)cc1 ZINC000408935931 560656040 /nfs/dbraw/zinc/65/60/40/560656040.db2.gz FEYMZRAYQVEXMO-PCLIKHOPSA-N 0 0 424.500 5.324 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2cccc(F)c2)c(Cl)c1 ZINC000408936363 560656041 /nfs/dbraw/zinc/65/60/41/560656041.db2.gz FQQZGAXEXPJAAU-FYJGNVAPSA-N 0 0 420.871 5.864 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1cccc(Cl)c1 ZINC000408936578 560656037 /nfs/dbraw/zinc/65/60/37/560656037.db2.gz GSMOICRRNXDKMK-PXLXIMEGSA-N 0 0 402.881 5.725 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2ccccc2)c(Cl)c1 ZINC000408937120 560656261 /nfs/dbraw/zinc/65/62/61/560656261.db2.gz ICJABNPERLTONW-KGENOOAVSA-N 0 0 402.881 5.725 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2ccc(F)cc2)c(Cl)c1 ZINC000408937725 560656441 /nfs/dbraw/zinc/65/64/41/560656441.db2.gz JQLFAUZYMSYULS-FYJGNVAPSA-N 0 0 420.871 5.864 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1ccc(OCc2ccccc2F)c(Cl)c1 ZINC000408938559 558754222 /nfs/dbraw/zinc/75/42/22/558754222.db2.gz KXQNYWUZXYVFJL-DEDYPNTBSA-N 0 0 420.871 5.864 40 10 HKCBRN CC1=NN(C(=O)c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1cc(C)cc(C)c1 ZINC000408944267 558754960 /nfs/dbraw/zinc/75/49/60/558754960.db2.gz UFQRETQEEKSHIR-LFVJCYFKSA-N 0 0 424.500 5.324 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1c(OCc2ccccc2)ccc2ccccc21 ZINC000408945610 560656524 /nfs/dbraw/zinc/65/65/24/560656524.db2.gz XBROIOJMAIWFBM-XIEYBQDHSA-N 0 0 418.496 6.225 40 10 HKCBRN CC1=NN(C(=O)c2ccccc2)C(=O)/C1=C/c1ccc(OCc2ccc(C)cc2)cc1 ZINC000408945805 558755265 /nfs/dbraw/zinc/75/52/65/558755265.db2.gz XKIFPOMZRHVHDG-LFVJCYFKSA-N 0 0 410.473 5.016 40 10 HKCBRN CC1=NN(C(=O)c2ccccc2)C(=O)/C1=C/c1ccccc1OCc1ccc(C)cc1 ZINC000408946139 560656504 /nfs/dbraw/zinc/65/65/04/560656504.db2.gz YDHLMAQKIPYRBF-XQNSMLJCSA-N 0 0 410.473 5.016 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(Cl)ccc1OCc1ccc(C)cc1 ZINC000408946186 558755213 /nfs/dbraw/zinc/75/52/13/558755213.db2.gz YKERRVPTXHTRTR-HZHRSRAPSA-N 0 0 416.908 6.034 40 10 HKCBRN CCc1cccc(C)c1-n1c(C)cc(/C=C2\NC(=O)N(Cc3ccccc3)C2=O)c1C ZINC000408960071 560657684 /nfs/dbraw/zinc/65/76/84/560657684.db2.gz IZRLSRJGRJOICM-HAHDFKILSA-N 0 0 413.521 5.058 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1Cc1ccccc1 ZINC000408960964 558768110 /nfs/dbraw/zinc/76/81/10/558768110.db2.gz KJQOXIHHNHUGEN-KGENOOAVSA-N 0 0 404.560 5.559 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1ccc(C)cn1 ZINC000408961579 560658343 /nfs/dbraw/zinc/65/83/43/560658343.db2.gz NLXDYYDZMUBMIG-XDHOZWIPSA-N 0 0 405.548 5.203 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)C1=Cc1ccc(Sc2nc3cc(C)ccc3[nH]2)o1 ZINC000408963042 558771059 /nfs/dbraw/zinc/77/10/59/558771059.db2.gz LUQPVUHBJROYJP-AQTBWJFISA-N 0 0 414.490 5.422 40 10 HKCBRN Cc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)c(C)n1-c1cc(C)ccn1 ZINC000408963910 560658775 /nfs/dbraw/zinc/65/87/75/560658775.db2.gz DPKAIWFDSPCFAK-CPNJWEJPSA-N 0 0 405.548 5.203 40 10 HKCBRN CCc1ccccc1-n1c(C)cc(/C=C2\SC(=O)N(Cc3ccccc3)C2=O)c1C ZINC000408965444 558773940 /nfs/dbraw/zinc/77/39/40/558773940.db2.gz HMCMKHMARFBUIQ-HAHDFKILSA-N 0 0 416.546 5.893 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c(C)n1-c1c(C)cc(C)cc1C ZINC000408965632 558778479 /nfs/dbraw/zinc/77/84/79/558778479.db2.gz WQCMVBJNWDHEHC-HYARGMPZSA-N 0 0 416.546 6.260 40 10 HKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(Br)c(C)c1 ZINC000408966400 560658070 /nfs/dbraw/zinc/65/80/70/560658070.db2.gz MOPJWFWTEQMRDD-UHFFFAOYSA-N 0 0 405.133 6.286 40 10 HKCBRN CCCCOC(=O)c1ccc(-n2c(C)ccc2-c2ccc(Br)cc2)cc1 ZINC000408966993 560659317 /nfs/dbraw/zinc/65/93/17/560659317.db2.gz PDTFYJFJIYYVMA-UHFFFAOYSA-N 0 0 412.327 6.172 40 10 HKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(Br)cc1C ZINC000408967199 560659305 /nfs/dbraw/zinc/65/93/05/560659305.db2.gz QMVFTXMSGDULSS-UHFFFAOYSA-N 0 0 405.133 6.286 40 10 HKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(Nc2ccccc2)cc1 ZINC000408967222 560659328 /nfs/dbraw/zinc/65/93/28/560659328.db2.gz RCNGAGHKCOOZRD-UHFFFAOYSA-N 0 0 403.323 6.959 40 10 HKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(C)cc1Br ZINC000408967771 560659406 /nfs/dbraw/zinc/65/94/06/560659406.db2.gz UQSXRFQTMHITBT-UHFFFAOYSA-N 0 0 405.133 6.286 40 10 HKCBRN CCc1ccccc1-n1c(C)cc(/C=C2\NC(=O)N(Cc3ccc(C)cc3)C2=O)c1C ZINC000408968763 558778394 /nfs/dbraw/zinc/77/83/94/558778394.db2.gz YSQAGPQQACJJFD-HAHDFKILSA-N 0 0 413.521 5.058 40 10 HKCBRN CC(C)Oc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)c2ccccc12 ZINC000408969127 558781900 /nfs/dbraw/zinc/78/19/00/558781900.db2.gz HTLBGBSPTXEFGR-ZHZULCJRSA-N 0 0 424.422 5.976 40 10 HKCBRN O=C1/C(=C\c2ccc(-c3cccc(Cl)c3)o2)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408969326 560659582 /nfs/dbraw/zinc/65/95/82/560659582.db2.gz LUIWCIWWIXRPIP-ATVHPVEESA-N 0 0 416.786 5.949 40 10 HKCBRN Cc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)c(C)n1-c1ccccc1 ZINC000408969476 558782441 /nfs/dbraw/zinc/78/24/41/558782441.db2.gz OFJQIYQXDPLFPD-ZHZULCJRSA-N 0 0 409.411 5.443 40 10 HKCBRN O=C1/C(=C\c2ccc(Sc3ccccc3)o2)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408969567 558782526 /nfs/dbraw/zinc/78/25/26/558782526.db2.gz QDXIAOAFZMNJPA-LGMDPLHJSA-N 0 0 414.408 5.779 40 10 HKCBRN O=C1/C(=C\c2cccn2-c2ccc(Cl)cc2)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408970467 558790261 /nfs/dbraw/zinc/79/02/61/558790261.db2.gz IOUXYSXPBORBRA-AQTBWJFISA-N 0 0 415.802 5.479 40 10 HKCBRN O=C1/C(=C\c2ccc(OCc3ccccc3)cc2)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408970947 558797471 /nfs/dbraw/zinc/79/74/71/558797471.db2.gz BIVMSWVUNJJNRE-QNGOZBTKSA-N 0 0 422.406 5.614 40 10 HKCBRN CCN(CC)c1ccc(/C=C2\N=C(c3sc4cc(C)ccc4c3Cl)OC2=O)cc1 ZINC000408971098 558798260 /nfs/dbraw/zinc/79/82/60/558798260.db2.gz MATGWBGBKVPVSL-AQTBWJFISA-N 0 0 424.953 6.054 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3C(=O)N(c4ccccc4)N=C3C(F)(F)F)o2)cc1 ZINC000408971207 558798953 /nfs/dbraw/zinc/79/89/53/558798953.db2.gz DNVUFRQOOPCSMR-UYRXBGFRSA-N 0 0 424.378 5.498 40 10 HKCBRN CCOc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)c2ccccc12 ZINC000408971442 558799742 /nfs/dbraw/zinc/79/97/42/558799742.db2.gz OMGSSORXBXRPDD-RGEXLXHISA-N 0 0 410.395 5.587 40 10 HKCBRN O=C1/C(=C\c2c3ccccc3cc3ccccc32)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408971722 560659214 /nfs/dbraw/zinc/65/92/14/560659214.db2.gz PQPQZKLKXJCWSO-JCMHNJIXSA-N 0 0 416.402 6.342 40 10 HKCBRN O=C1/C(=C\c2cccc(OCc3ccccc3)c2)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408972065 558803296 /nfs/dbraw/zinc/80/32/96/558803296.db2.gz RKYTYINORAMZFG-QNGOZBTKSA-N 0 0 422.406 5.614 40 10 HKCBRN CCOc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)ccc1OC(C)C ZINC000408972076 558803299 /nfs/dbraw/zinc/80/32/99/558803299.db2.gz ROHPBVRJBVUOJE-ATVHPVEESA-N 0 0 418.415 5.221 40 10 HKCBRN Cc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)cc1Br ZINC000408972264 560659212 /nfs/dbraw/zinc/65/92/12/560659212.db2.gz QKKNMFNHKKWMIK-ZROIWOOFSA-N 0 0 409.205 5.106 40 10 HKCBRN CC(C)Oc1ccc2ccccc2c1/C=C1\C(=O)N(c2ccccc2)N=C1C(F)(F)F ZINC000408972612 560660793 /nfs/dbraw/zinc/66/07/93/560660793.db2.gz PRRJUYSCFWVPFO-ZHZULCJRSA-N 0 0 424.422 5.976 40 10 HKCBRN O=C1/C(=C\c2ccccc2OCc2ccccc2)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408972710 558809817 /nfs/dbraw/zinc/80/98/17/558809817.db2.gz QWBXXFGDWLZJHM-HKWRFOASSA-N 0 0 422.406 5.614 40 10 HKCBRN CCOc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)cc(Cl)c1OC ZINC000408973565 558811084 /nfs/dbraw/zinc/81/10/84/558811084.db2.gz YXIDQKXGHQDXLD-ZROIWOOFSA-N 0 0 424.806 5.096 40 10 HKCBRN Cc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C(F)(F)F)c(C)n1-c1ccc(C)cc1 ZINC000408973567 558811082 /nfs/dbraw/zinc/81/10/82/558811082.db2.gz YYAIKGYTJMAIER-STZFKDTASA-N 0 0 423.438 5.751 40 10 HKCBRN CC1=NN(Cc2ccccc2Cl)C(=O)/C1=C\c1ccc(OCc2ccccc2)cc1 ZINC000408973719 558811254 /nfs/dbraw/zinc/81/12/54/558811254.db2.gz PZZASWMVJCSSFF-HAHDFKILSA-N 0 0 416.908 5.721 40 10 HKCBRN O=C1/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)C(C(F)(F)F)=NN1c1ccccc1 ZINC000408974050 560659893 /nfs/dbraw/zinc/65/98/93/560659893.db2.gz WLBDEJKJDKYEHQ-ATVHPVEESA-N 0 0 416.786 5.949 40 10 HKCBRN COc1ccc(C(=O)Oc2ccc3nc4ccc5ccccc5c4nc3c2)cc1OC ZINC000408974190 558813160 /nfs/dbraw/zinc/81/31/60/558813160.db2.gz DEZXKHRYWMXSFQ-UHFFFAOYSA-N 0 0 410.429 5.173 40 10 HKCBRN O=C(Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)c1cccnc1 ZINC000408974686 558813469 /nfs/dbraw/zinc/81/34/69/558813469.db2.gz GSEYURZDOAHMCU-UHFFFAOYSA-N 0 0 401.425 5.704 40 10 HKCBRN CCCCCCC(=O)Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408974691 560660048 /nfs/dbraw/zinc/66/00/48/560660048.db2.gz GTIBCNKJRRUASB-UHFFFAOYSA-N 0 0 408.501 6.965 40 10 HKCBRN O=C(Cc1ccccc1)Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408975250 560660229 /nfs/dbraw/zinc/66/02/29/560660229.db2.gz LETZMCQVYLTOKZ-UHFFFAOYSA-N 0 0 413.480 6.271 40 10 HKCBRN CC1=NN(Cc2ccccc2Cl)C(=O)/C1=C\c1ccccc1OCc1ccccc1 ZINC000408975497 558813636 /nfs/dbraw/zinc/81/36/36/558813636.db2.gz MGWJTEDRWZEURL-JCMHNJIXSA-N 0 0 416.908 5.721 40 10 HKCBRN O=C(Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)c1cccnc1 ZINC000408976167 560660431 /nfs/dbraw/zinc/66/04/31/560660431.db2.gz PYQLJZMMRUBCDB-UHFFFAOYSA-N 0 0 400.441 5.737 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccccc1F ZINC000408976318 560660443 /nfs/dbraw/zinc/66/04/43/560660443.db2.gz FHIGRPHFNIKJLX-ZROIWOOFSA-N 0 0 406.240 5.010 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccc(F)cc1 ZINC000408976342 558820240 /nfs/dbraw/zinc/82/02/40/558820240.db2.gz FJXNMCSPLRFMTR-DHDCSXOGSA-N 0 0 406.240 5.010 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000408976373 560660516 /nfs/dbraw/zinc/66/05/16/560660516.db2.gz FLVLJBXFKZYXGV-STZFKDTASA-N 0 0 403.865 5.370 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000408976453 558821787 /nfs/dbraw/zinc/82/17/87/558821787.db2.gz RAGQUWMUVXBSHY-ATVHPVEESA-N 0 0 416.304 5.569 40 10 HKCBRN Cc1ccc(C(=O)Nc2ccc3nc4c5ccccc5c5ccccc5c4nc3c2)cc1 ZINC000408976590 560660466 /nfs/dbraw/zinc/66/04/66/560660466.db2.gz RSFLYNAZFWXVBZ-UHFFFAOYSA-N 0 0 413.480 6.650 40 10 HKCBRN COc1ccc(C(=O)Nc2ccc3nc4ccc5ccccc5c4nc3c2)cc1OC ZINC000408977152 558822550 /nfs/dbraw/zinc/82/25/50/558822550.db2.gz UPNYWBWBZOBMOY-UHFFFAOYSA-N 0 0 409.445 5.206 40 10 HKCBRN O=C(Oc1ccc2nc3ccc4ccccc4c3nc2c1)c1ccc2ccccc2c1 ZINC000408977346 560660617 /nfs/dbraw/zinc/66/06/17/560660617.db2.gz VNEXKISCIJNWNP-UHFFFAOYSA-N 0 0 400.437 6.309 40 10 HKCBRN O=C(Cc1ccccc1)Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408977380 560660635 /nfs/dbraw/zinc/66/06/35/560660635.db2.gz VRTTZEVMUKVHDO-UHFFFAOYSA-N 0 0 414.464 6.238 40 10 HKCBRN CCCCCCC(=O)Nc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408977663 558822892 /nfs/dbraw/zinc/82/28/92/558822892.db2.gz XCNCMTNVCGJIRC-UHFFFAOYSA-N 0 0 407.517 6.998 40 10 HKCBRN O=C(Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1)c1ccccc1 ZINC000408978022 560660659 /nfs/dbraw/zinc/66/06/59/560660659.db2.gz XRWIAUXRPSUODX-UHFFFAOYSA-N 0 0 400.437 6.309 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000408978074 560660787 /nfs/dbraw/zinc/66/07/87/560660787.db2.gz KMNHQVOTHYCAQN-WJDWOHSUSA-N 0 0 421.802 5.236 40 10 HKCBRN Cc1ccc(C(=O)Oc2ccc3nc4c5ccccc5c5ccccc5c4nc3c2)cc1 ZINC000408978098 558824281 /nfs/dbraw/zinc/82/42/81/558824281.db2.gz YCGWACQTYLLJSM-UHFFFAOYSA-N 0 0 414.464 6.617 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000408979135 560661297 /nfs/dbraw/zinc/66/12/97/560661297.db2.gz OVIOALDYNPKXQQ-DHDCSXOGSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000408979721 560661438 /nfs/dbraw/zinc/66/14/38/560661438.db2.gz RVMSFMUVGAPXTN-GDNBJRDFSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1ccc(Cl)cc1 ZINC000408980758 560660901 /nfs/dbraw/zinc/66/09/01/560660901.db2.gz XDTTZCCOILCSAT-DHDCSXOGSA-N 0 0 422.695 5.524 40 10 HKCBRN CCOc1cccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)c1 ZINC000408983258 558834801 /nfs/dbraw/zinc/83/48/01/558834801.db2.gz AARSYTUZBDKZIM-HMMYKYKNSA-N 0 0 401.893 6.210 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1ccc2ncccc2c1 ZINC000408983264 560661208 /nfs/dbraw/zinc/66/12/08/560661208.db2.gz ACEXBWNAUBMAJA-RCCKNPSSSA-N 0 0 408.888 6.360 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)cc1 ZINC000408983270 558835043 /nfs/dbraw/zinc/83/50/43/558835043.db2.gz AESARYKZTWOVFJ-QGOAFFKASA-N 0 0 422.311 6.473 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc4c(c3)OCO4)C2=O)cc1 ZINC000408983283 558834752 /nfs/dbraw/zinc/83/47/52/558834752.db2.gz AJCZBXMLAAFXID-XSFVSMFZSA-N 0 0 411.457 5.285 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc([C@@H](C)CC)cc3)C2=O)cc1 ZINC000408983313 560661212 /nfs/dbraw/zinc/66/12/12/560661212.db2.gz ASSZNOVGUAQLIM-ARCUFYBBSA-N 0 0 423.556 7.070 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc([C@H](C)CC)cc3)C2=O)cc1 ZINC000408983315 558834698 /nfs/dbraw/zinc/83/46/98/558834698.db2.gz ASSZNOVGUAQLIM-MDVMQCDRSA-N 0 0 423.556 7.070 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 ZINC000408983356 560661214 /nfs/dbraw/zinc/66/12/14/560661214.db2.gz BGELNIZJTDCGEE-CAPFRKAQSA-N 0 0 412.445 5.465 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccccc3O)C2=O)cc1 ZINC000408983362 558834866 /nfs/dbraw/zinc/83/48/66/558834866.db2.gz BHXMXDVEKZTWEK-XDJHFCHBSA-N 0 0 417.892 5.916 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)C=C(c2ccccc2)N1c1cccc(F)c1 ZINC000408983379 558835030 /nfs/dbraw/zinc/83/50/30/558835030.db2.gz BLYPSQCRCPVHBP-GZTJUZNOSA-N 0 0 410.275 6.604 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3cccc(O)c3)C2=O)cc1 ZINC000408983424 560661236 /nfs/dbraw/zinc/66/12/36/560661236.db2.gz BQYOWFMONBOVAH-XMHGGMMESA-N 0 0 417.892 5.916 40 10 HKCBRN CN(C)c1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408983442 560661203 /nfs/dbraw/zinc/66/12/03/560661203.db2.gz BRWRWVSWDAJCHX-CAPFRKAQSA-N 0 0 400.909 5.877 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccc(F)cc3)C2=O)cc1 ZINC000408983473 558835058 /nfs/dbraw/zinc/83/50/58/558835058.db2.gz BZMULJHUPSXQFR-XDJHFCHBSA-N 0 0 419.883 6.349 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)C=C(c2ccccc2)N1c1ccccc1O ZINC000408983735 558835653 /nfs/dbraw/zinc/83/56/53/558835653.db2.gz CDTKWFUXJVPKIV-SFQUDFHCSA-N 0 0 408.284 6.170 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3ccc(OCC)cc3)C=C2c2ccccc2)cc1 ZINC000408983800 558835645 /nfs/dbraw/zinc/83/56/45/558835645.db2.gz CRBFNWTTZUWZLC-LKUDQCMESA-N 0 0 423.556 6.899 40 10 HKCBRN COC(=O)c1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408983805 560661132 /nfs/dbraw/zinc/66/11/32/560661132.db2.gz CSIGISIRSPJGPK-HMMYKYKNSA-N 0 0 415.876 5.598 40 10 HKCBRN CCc1ccccc1N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)C=C1c1ccccc1 ZINC000408983814 560661097 /nfs/dbraw/zinc/66/10/97/560661097.db2.gz CVMLYHQZDUYWQJ-XSFVSMFZSA-N 0 0 420.339 7.027 40 10 HKCBRN CC(C)(C)c1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408983829 560661078 /nfs/dbraw/zinc/66/10/78/560661078.db2.gz DFRQHZTVERIHMU-HEHNFIMWSA-N 0 0 413.948 7.109 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1ccc([N+](=O)[O-])cc1 ZINC000408983838 560661227 /nfs/dbraw/zinc/66/12/27/560661227.db2.gz DLISLMLJARYLPX-NBVRZTHBSA-N 0 0 402.837 5.720 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000408984133 558836123 /nfs/dbraw/zinc/83/61/23/558836123.db2.gz FFJZLUNOIYVHRJ-CAPFRKAQSA-N 0 0 401.893 6.210 40 10 HKCBRN COC(=O)c1cccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)c1 ZINC000408984143 558836334 /nfs/dbraw/zinc/83/63/34/558836334.db2.gz FHPPOXRNNWBESZ-XSFVSMFZSA-N 0 0 415.876 5.598 40 10 HKCBRN COc1ccc(CN2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408984161 560661984 /nfs/dbraw/zinc/66/19/84/560661984.db2.gz FKCLYHYWGMAPDH-RCCKNPSSSA-N 0 0 401.893 5.816 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccccc3SC)C2=O)cc1 ZINC000408984164 558836515 /nfs/dbraw/zinc/83/65/15/558836515.db2.gz FKHGFRAQBRZZCB-HEHNFIMWSA-N 0 0 413.542 6.279 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(C)c(Cl)c3)C2=O)cc1 ZINC000408984186 558836333 /nfs/dbraw/zinc/83/63/33/558836333.db2.gz FLYQJJQZLCSIOQ-RCCKNPSSSA-N 0 0 415.920 6.518 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccccc3)C2=O)cc1 ZINC000408984274 558836511 /nfs/dbraw/zinc/83/65/11/558836511.db2.gz GEXQUZCWSQMBLQ-CAPFRKAQSA-N 0 0 401.893 6.210 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1ccc(F)c(Cl)c1 ZINC000408984282 558836649 /nfs/dbraw/zinc/83/66/49/558836649.db2.gz GHDIVXLHENDGHG-SFQUDFHCSA-N 0 0 410.275 6.604 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(F)c(Cl)c3)C2=O)cc1 ZINC000408984321 558836622 /nfs/dbraw/zinc/83/66/22/558836622.db2.gz GSLGWDACHLOMFQ-XMHGGMMESA-N 0 0 419.883 6.349 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)cc1 ZINC000408984468 560661956 /nfs/dbraw/zinc/66/19/56/560661956.db2.gz HLWOEXQARHWMMT-CPNJWEJPSA-N 0 0 406.312 6.773 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3cccc(OCC)c3)C2=O)cc1 ZINC000408984479 558836629 /nfs/dbraw/zinc/83/66/29/558836629.db2.gz HPPAMSCDXIBQDH-OQKWZONESA-N 0 0 411.501 5.955 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3cccc4ccccc43)C2=O)cc1 ZINC000408984491 558836607 /nfs/dbraw/zinc/83/66/07/558836607.db2.gz HRFODLWSOOAPGG-LYBHJNIJSA-N 0 0 417.508 6.710 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3cc(Cl)ccc3C)C2=O)cc1 ZINC000408984494 560661986 /nfs/dbraw/zinc/66/19/86/560661986.db2.gz HSGGPXLNLNVPNR-RCCKNPSSSA-N 0 0 415.920 6.518 40 10 HKCBRN CCCCc1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408984521 560661927 /nfs/dbraw/zinc/66/19/27/560661927.db2.gz HWPGUSVYLKJGDU-PTGBLXJZSA-N 0 0 413.948 7.154 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc4ccccc4c3)C2=O)cc1 ZINC000408984618 560661935 /nfs/dbraw/zinc/66/19/35/560661935.db2.gz IOOZRKBXSOWGJB-XIEYBQDHSA-N 0 0 417.508 6.710 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)C=C1c1ccccc1 ZINC000408984621 558836778 /nfs/dbraw/zinc/83/67/78/558836778.db2.gz IQTPDDZQTSDLGU-CPNJWEJPSA-N 0 0 406.312 6.773 40 10 HKCBRN Cc1c(Cl)cccc1N1C(=O)/C(=C/c2ccccc2)C=C1c1ccc(Cl)cc1 ZINC000408984634 560661987 /nfs/dbraw/zinc/66/19/87/560661987.db2.gz ISPSAXBIGNZCNW-XMHGGMMESA-N 0 0 406.312 6.773 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(F)cc3F)C2=O)cc1 ZINC000408984651 558836977 /nfs/dbraw/zinc/83/69/77/558836977.db2.gz IYVWLEIVPVQKHV-XMHGGMMESA-N 0 0 403.428 5.835 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccccc3OCC)C2=O)cc1 ZINC000408984682 560661961 /nfs/dbraw/zinc/66/19/61/560661961.db2.gz JDJVXCGCHVEFGX-RELWKKBWSA-N 0 0 411.501 5.955 40 10 HKCBRN COc1cccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)c1 ZINC000408984975 560661525 /nfs/dbraw/zinc/66/15/25/560661525.db2.gz JUDRCFBUDFVHCF-LDADJPATSA-N 0 0 422.311 6.473 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccccc3Cl)C2=O)cc1 ZINC000408984983 560661528 /nfs/dbraw/zinc/66/15/28/560661528.db2.gz JWZHOQUXRFJTSA-CAPFRKAQSA-N 0 0 401.893 6.210 40 10 HKCBRN Cc1cc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)ccc1F ZINC000408985038 558837052 /nfs/dbraw/zinc/83/70/52/558837052.db2.gz KROIKJBPFLDTJT-LDADJPATSA-N 0 0 424.302 6.912 40 10 HKCBRN Cc1ccc(Cl)cc1N1C(=O)/C(=C/c2ccccc2)C=C1c1ccc(Cl)cc1 ZINC000408985047 558837072 /nfs/dbraw/zinc/83/70/72/558837072.db2.gz KZFIBTWNJHWXGO-CPNJWEJPSA-N 0 0 406.312 6.773 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(Cc3ccccc3)C2=O)cc1 ZINC000408985053 558837067 /nfs/dbraw/zinc/83/70/67/558837067.db2.gz LBAGIZBNWFLNEK-CJLVFECKSA-N 0 0 415.920 6.206 40 10 HKCBRN CCc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)cc1 ZINC000408985063 560661527 /nfs/dbraw/zinc/66/15/27/560661527.db2.gz LENTYKBIVLMGOG-XSFVSMFZSA-N 0 0 420.339 7.027 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(Cc3ccc(OC)cc3)C2=O)cc1 ZINC000408985319 560661533 /nfs/dbraw/zinc/66/15/33/560661533.db2.gz LJNLKPODKANXFY-HAVVHWLPSA-N 0 0 411.501 5.561 40 10 HKCBRN CC[C@@H](C)c1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408985524 558837374 /nfs/dbraw/zinc/83/73/74/558837374.db2.gz MPVVNGQZYHOYEH-BFWROUECSA-N 0 0 413.948 7.325 40 10 HKCBRN CC[C@H](C)c1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408985527 560661484 /nfs/dbraw/zinc/66/14/84/560661484.db2.gz MPVVNGQZYHOYEH-SNAUHIFDSA-N 0 0 413.948 7.325 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000408985573 558837522 /nfs/dbraw/zinc/83/75/22/558837522.db2.gz NAXMAJQBYIOMSM-CPNJWEJPSA-N 0 0 416.864 6.028 40 10 HKCBRN Cc1ccc(C)c(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)c1 ZINC000408985808 560661539 /nfs/dbraw/zinc/66/15/39/560661539.db2.gz NJKUFHZXBQWHBV-DEDYPNTBSA-N 0 0 420.339 7.082 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(N(C)C)cc3)C2=O)cc1 ZINC000408985813 560661531 /nfs/dbraw/zinc/66/15/31/560661531.db2.gz NLFOZSSUCTWBPW-RELWKKBWSA-N 0 0 410.517 5.623 40 10 HKCBRN COc1ccccc1N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)C=C1c1ccccc1 ZINC000408985838 560661549 /nfs/dbraw/zinc/66/15/49/560661549.db2.gz NOXWYEZRRKUKIC-QGOAFFKASA-N 0 0 422.311 6.473 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)C=C(c2ccccc2)N1c1ccc(O)cc1 ZINC000408985850 560661491 /nfs/dbraw/zinc/66/14/91/560661491.db2.gz NPZRZGRZWUFSOF-SFQUDFHCSA-N 0 0 408.284 6.170 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408985868 560661628 /nfs/dbraw/zinc/66/16/28/560661628.db2.gz NTQTVKOGDBDOGE-LTGZKZEYSA-N 0 0 415.920 6.518 40 10 HKCBRN CCOc1ccc(C=C2C=C(c3ccccc3)N(c3ccc(C(C)=O)cc3)C2=O)cc1 ZINC000408986014 560661623 /nfs/dbraw/zinc/66/16/23/560661623.db2.gz OMJKFGSDFCRDAS-HAVVHWLPSA-N 0 0 409.485 5.759 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1ccc(Cl)cc1O ZINC000408986024 558837680 /nfs/dbraw/zinc/83/76/80/558837680.db2.gz OMUZGIIXJGAGDQ-SFQUDFHCSA-N 0 0 408.284 6.170 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(NC(C)=O)cc3)C2=O)cc1 ZINC000408986250 560661626 /nfs/dbraw/zinc/66/16/26/560661626.db2.gz PCPXOUWKADLCCH-OQKWZONESA-N 0 0 424.500 5.515 40 10 HKCBRN COc1ccc(Cl)cc1N1C(=O)/C(=C/c2ccccc2)C=C1c1ccc(Cl)cc1 ZINC000408986348 560661643 /nfs/dbraw/zinc/66/16/43/560661643.db2.gz PVLYXRAEBZVSHK-QGOAFFKASA-N 0 0 422.311 6.473 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)cc1C ZINC000408986349 560661624 /nfs/dbraw/zinc/66/16/24/560661624.db2.gz PWHBTVSLNRLVMU-DEDYPNTBSA-N 0 0 420.339 7.082 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)C=C(c2ccccc2)N1c1ccc(F)cc1 ZINC000408986586 558838216 /nfs/dbraw/zinc/83/82/16/558838216.db2.gz QTMYGNFXEFIWNF-SFQUDFHCSA-N 0 0 410.275 6.604 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)cn1 ZINC000408986600 558838130 /nfs/dbraw/zinc/83/81/30/558838130.db2.gz RAMKGRIUEZPUCJ-GZTJUZNOSA-N 0 0 423.299 5.868 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccccc3C(C)C)C2=O)cc1 ZINC000408986602 558838182 /nfs/dbraw/zinc/83/81/82/558838182.db2.gz RBYLULHWRPMGAY-PTGBLXJZSA-N 0 0 409.529 6.680 40 10 HKCBRN Cc1cc([N+](=O)[O-])ccc1N1C(=O)/C(=C/c2ccccc2)C=C1c1ccc(Cl)cc1 ZINC000408986615 558838199 /nfs/dbraw/zinc/83/81/99/558838199.db2.gz RMOWEQDNNMDGPF-XMHGGMMESA-N 0 0 416.864 6.028 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1ccc2c(c1)OCO2 ZINC000408986639 560661705 /nfs/dbraw/zinc/66/17/05/560661705.db2.gz RUAHGMFWMLRKBA-LDADJPATSA-N 0 0 401.849 5.540 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc4ncccc4c3)C2=O)cc1 ZINC000408986645 560661747 /nfs/dbraw/zinc/66/17/47/560661747.db2.gz RXDSVTKMWBTNQJ-HAVVHWLPSA-N 0 0 418.496 6.105 40 10 HKCBRN CCOc1ccc(C=C2C=C(c3ccccc3)N(c3cccc(C(C)=O)c3)C2=O)cc1 ZINC000408986652 558838084 /nfs/dbraw/zinc/83/80/84/558838084.db2.gz SBHWYIJROZHFNY-XQNSMLJCSA-N 0 0 409.485 5.759 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)C=C(c2ccccc2)N1Cc1ccccc1 ZINC000408986927 560661749 /nfs/dbraw/zinc/66/17/49/560661749.db2.gz SVYMXLJHYHMMNG-DEDYPNTBSA-N 0 0 406.312 6.460 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3cccc(Cl)c3C)C2=O)cc1 ZINC000408986930 558838452 /nfs/dbraw/zinc/83/84/52/558838452.db2.gz SXAZRXZPEVCELS-LTGZKZEYSA-N 0 0 415.920 6.518 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1Cl ZINC000408986938 558838546 /nfs/dbraw/zinc/83/85/46/558838546.db2.gz SZUICWDVJJMQNH-QGOAFFKASA-N 0 0 422.311 6.473 40 10 HKCBRN O=C1/C(=C/c2ccc(Cl)cc2Cl)C=C(c2ccccc2)N1c1ccccc1F ZINC000408986966 560661721 /nfs/dbraw/zinc/66/17/21/560661721.db2.gz UASUMPRTIBOSAC-SFQUDFHCSA-N 0 0 410.275 6.604 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccc(O)cc3)C2=O)cc1 ZINC000408986984 560661762 /nfs/dbraw/zinc/66/17/62/560661762.db2.gz UGJYLDGBTNVWGP-XDJHFCHBSA-N 0 0 417.892 5.916 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(C(C)C)cc3)C2=O)cc1 ZINC000408986986 560661768 /nfs/dbraw/zinc/66/17/68/560661768.db2.gz UGRGWYHLCLSPSF-HKOYGPOVSA-N 0 0 409.529 6.680 40 10 HKCBRN CC(=O)Nc1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1 ZINC000408987012 558838364 /nfs/dbraw/zinc/83/83/64/558838364.db2.gz UKHSHBUSJMJEQY-HMMYKYKNSA-N 0 0 414.892 5.770 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)c(C)c1 ZINC000408987068 560661765 /nfs/dbraw/zinc/66/17/65/560661765.db2.gz VJXVAHJMOXXPAS-DEDYPNTBSA-N 0 0 420.339 7.082 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)cc1Cl ZINC000408987273 558839348 /nfs/dbraw/zinc/83/93/48/558839348.db2.gz VQTFECASTBMVCY-CPNJWEJPSA-N 0 0 406.312 6.773 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3cccc(F)c3)C2=O)cc1 ZINC000408987278 558839351 /nfs/dbraw/zinc/83/93/51/558839351.db2.gz VTRFIRLMKQLTDG-XMHGGMMESA-N 0 0 419.883 6.349 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3cccc(C)c3)C2=O)cc1 ZINC000408987284 558839384 /nfs/dbraw/zinc/83/93/84/558839384.db2.gz VYELTYZPJQGYRX-LTGZKZEYSA-N 0 0 415.920 6.518 40 10 HKCBRN COC(=O)c1ccccc1N1C(=O)/C(=C/c2ccccc2)C=C1c1ccc(Cl)cc1 ZINC000408987285 558839366 /nfs/dbraw/zinc/83/93/66/558839366.db2.gz VYJDBKISSDOLRS-XDJHFCHBSA-N 0 0 415.876 5.598 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccccc3C)C2=O)cc1 ZINC000408987291 558839391 /nfs/dbraw/zinc/83/93/91/558839391.db2.gz WACWFKOICNCRKP-LTGZKZEYSA-N 0 0 415.920 6.518 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1cccc2ccccc21 ZINC000408987307 560661707 /nfs/dbraw/zinc/66/17/07/560661707.db2.gz WEQDFOCUWWNVGT-OQKWZONESA-N 0 0 407.900 6.965 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccccc3)C=C2c2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000408987361 560661716 /nfs/dbraw/zinc/66/17/16/560661716.db2.gz WVVDGRIOXSBCSK-XMHGGMMESA-N 0 0 416.864 6.028 40 10 HKCBRN CSc1ccccc1N1C(=O)/C(=C/c2ccccc2)C=C1c1ccc(Cl)cc1 ZINC000408987387 560661766 /nfs/dbraw/zinc/66/17/66/560661766.db2.gz XFEJFENMZQWSMJ-XDJHFCHBSA-N 0 0 403.934 6.533 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)N(c3ccccc3F)C2=O)cc1 ZINC000408987407 558839505 /nfs/dbraw/zinc/83/95/05/558839505.db2.gz XLNCBOZFXCEVMU-XDJHFCHBSA-N 0 0 419.883 6.349 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1ccc2ccccc2c1 ZINC000408987427 558839502 /nfs/dbraw/zinc/83/95/02/558839502.db2.gz XPNFDHIDPGOFQA-XQNSMLJCSA-N 0 0 407.900 6.965 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000408987783 560661849 /nfs/dbraw/zinc/66/18/49/560661849.db2.gz YCECQDDOHCQQTE-HMMYKYKNSA-N 0 0 401.893 6.210 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3ccc(C(C)(C)C)cc3)C2=O)cc1 ZINC000408987785 560661843 /nfs/dbraw/zinc/66/18/43/560661843.db2.gz YCVLXBDZAIHALG-FCDQGJHFSA-N 0 0 423.556 6.854 40 10 HKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1cccc([N+](=O)[O-])c1 ZINC000408987786 558840169 /nfs/dbraw/zinc/84/01/69/558840169.db2.gz YDULWKLOJMLBRI-QGOAFFKASA-N 0 0 402.837 5.720 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C/c3ccc(Cl)cc3Cl)C=C2c2ccccc2)c1 ZINC000408987789 560661852 /nfs/dbraw/zinc/66/18/52/560661852.db2.gz YENQCEBCYLPXLU-CPNJWEJPSA-N 0 0 406.312 6.773 40 10 HKCBRN CCOc1ccccc1N1C(=O)/C(=C/c2ccccc2)C=C1c1ccc(Cl)cc1 ZINC000408987823 560661841 /nfs/dbraw/zinc/66/18/41/560661841.db2.gz YTKOPFKCDILTLV-CAPFRKAQSA-N 0 0 401.893 6.210 40 10 HKCBRN CCOc1ccc(/C=C2\C=C(c3ccccc3)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000408987839 558840174 /nfs/dbraw/zinc/84/01/74/558840174.db2.gz YZWKEAOLHIJSHV-HMMYKYKNSA-N 0 0 412.445 5.465 40 10 HKCBRN CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(N(C)C)cc2)N=C(SCC(C)C)N1 ZINC000408991859 560662421 /nfs/dbraw/zinc/66/24/21/560662421.db2.gz RGTXJISSOHWPKW-JOCHJYFZSA-N 0 0 422.598 5.055 40 10 HKCBRN CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(N(C)C)cc2)N=C(SCC(C)C)N1 ZINC000408991861 560662349 /nfs/dbraw/zinc/66/23/49/560662349.db2.gz RGTXJISSOHWPKW-QFIPXVFZSA-N 0 0 422.598 5.055 40 10 HKCBRN COc1ccccc1/C=C1/N=C(c2ccc(C)cc2)N(c2ccc(Cl)cc2)C1=O ZINC000408995066 558852763 /nfs/dbraw/zinc/85/27/63/558852763.db2.gz IKQRLCVYYFUTOX-RCCKNPSSSA-N 0 0 402.881 5.492 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccccc3)C2=O)c(OC)c1 ZINC000408995282 560662596 /nfs/dbraw/zinc/66/25/96/560662596.db2.gz LSGZUHACQWZOBV-KGENOOAVSA-N 0 0 418.880 5.192 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2c2ccccc2Cl)cc1 ZINC000408995451 558852792 /nfs/dbraw/zinc/85/27/92/558852792.db2.gz ACKGNPGAXVYYPM-XSFVSMFZSA-N 0 0 408.910 5.635 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408995648 558852895 /nfs/dbraw/zinc/85/28/95/558852895.db2.gz KLZZMHQECPCDSJ-XSFVSMFZSA-N 0 0 408.910 5.635 40 10 HKCBRN Cc1nn(Cc2ccccc2)c(C)c1/C=C1\C(=O)N(c2cccc3ccccc32)N=C1C ZINC000408995939 558852782 /nfs/dbraw/zinc/85/27/82/558852782.db2.gz CCERFHOXGXEXAT-XYGWBWBKSA-N 0 0 420.516 5.508 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000408995971 558852884 /nfs/dbraw/zinc/85/28/84/558852884.db2.gz GBRQGSMPSHAQKR-JWGURIENSA-N 0 0 403.522 5.560 40 10 HKCBRN COC(=O)c1ccc(-c2ccc(/C=C3\C(=O)N(c4ccccc4)N=C3C)o2)cc1Cl ZINC000408996211 560662774 /nfs/dbraw/zinc/66/27/74/560662774.db2.gz GUAWODGUAOUQBB-UYRXBGFRSA-N 0 0 420.852 5.193 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000408996327 560662708 /nfs/dbraw/zinc/66/27/08/560662708.db2.gz DBEJJNKVRCOASL-YBEGLDIGSA-N 0 0 402.277 5.179 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccccc3OC)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408996459 558852888 /nfs/dbraw/zinc/85/28/88/558852888.db2.gz PEVVYRZHFYJVCG-RCCKNPSSSA-N 0 0 418.880 5.192 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3OC)N=C2c2ccc(C)cc2)cc1 ZINC000408996660 558852909 /nfs/dbraw/zinc/85/29/09/558852909.db2.gz MBKYIPOANXLGIS-HAVVHWLPSA-N 0 0 412.489 5.237 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1c(F)cccc1Cl ZINC000408996801 560662832 /nfs/dbraw/zinc/66/28/32/560662832.db2.gz JZJGAAJMEXAAKK-XNTDXEJSSA-N 0 0 406.240 5.010 40 10 HKCBRN CN(CC(=O)Nc1ccc(/N=N/c2ccccc2)cc1)C(=O)OCc1ccccc1 ZINC000408996810 560662834 /nfs/dbraw/zinc/66/28/34/560662834.db2.gz ATAAZBWONOSXNS-OCEACIFDSA-N 0 0 402.454 5.309 40 10 HKCBRN Cc1nn(Cc2ccccc2)c(C)c1/C=C1\C(=O)N(c2cccc(Cl)c2)N=C1C ZINC000408996915 560662830 /nfs/dbraw/zinc/66/28/30/560662830.db2.gz KKTHKZDKJTXHNS-LPYMAVHISA-N 0 0 404.901 5.008 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)N=C2c2ccc(Cl)cc2)cc1 ZINC000408997000 560662814 /nfs/dbraw/zinc/66/28/14/560662814.db2.gz FWIUNEGAHBLAEL-KGENOOAVSA-N 0 0 423.299 5.837 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc(Cl)cc1 ZINC000408997039 560662807 /nfs/dbraw/zinc/66/28/07/560662807.db2.gz GBHOCAPGNUBHPH-PDGQHHTCSA-N 0 0 402.277 5.261 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccccc3Cl)N(c3ccccc3)C2=O)cc1OC ZINC000408997328 560662973 /nfs/dbraw/zinc/66/29/73/560662973.db2.gz NRJAVEMKAISNCL-XSFVSMFZSA-N 0 0 418.880 5.192 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(C)cc3)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000408998359 558853889 /nfs/dbraw/zinc/85/38/89/558853889.db2.gz UHYXLAPNPAQOAM-JJIBRWJFSA-N 0 0 412.489 5.237 40 10 HKCBRN O=C(CCNC(=O)OCc1ccccc1)Nc1ccc(/N=N/c2ccccc2)cc1 ZINC000408998663 560663486 /nfs/dbraw/zinc/66/34/86/560663486.db2.gz NKJQZTWUPIABNQ-CYYJNZCTSA-N 0 0 402.454 5.357 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000408998686 560663473 /nfs/dbraw/zinc/66/34/73/560663473.db2.gz RWNZSXPWLCCXHK-WJDWOHSUSA-N 0 0 402.277 5.179 40 10 HKCBRN COc1ccc(C2=N/C(=C/c3ccc(Cl)cc3)C(=O)N2c2ccc(Cl)cc2)cc1 ZINC000408998928 560663487 /nfs/dbraw/zinc/66/34/87/560663487.db2.gz JKBAUAILPPXIGY-KGENOOAVSA-N 0 0 423.299 5.837 40 10 HKCBRN C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(/N=N/c2ccccc2)cc1 ZINC000408999275 560663543 /nfs/dbraw/zinc/66/35/43/560663543.db2.gz QLFQDILEVXAIOA-QUNNOBFSSA-N 0 0 402.454 5.355 40 10 HKCBRN COC(=O)C1=C(C)N([C@@H](C)c2ccccc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408999995 560663723 /nfs/dbraw/zinc/66/37/23/560663723.db2.gz WNTARUNUWOKVOZ-IGWPVBGESA-N 0 0 416.304 5.427 40 10 HKCBRN COC(=O)C1=C(C)N([C@H](C)c2ccccc2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000408999998 558854338 /nfs/dbraw/zinc/85/43/38/558854338.db2.gz WNTARUNUWOKVOZ-KAECEXQPSA-N 0 0 416.304 5.427 40 10 HKCBRN O=C(Nc1ccc(/N=N/c2ccccc2)cc1)[C@@H]1CCCN1C(=O)Oc1ccccc1 ZINC000409000029 558854348 /nfs/dbraw/zinc/85/43/48/558854348.db2.gz DMUHHOOSZFIRRS-KQEYZTLISA-N 0 0 414.465 5.704 40 10 HKCBRN O=C(Nc1ccc(/N=N/c2ccccc2)cc1)[C@H]1CCCN1C(=O)Oc1ccccc1 ZINC000409000031 558854382 /nfs/dbraw/zinc/85/43/82/558854382.db2.gz DMUHHOOSZFIRRS-PLFNIDSXSA-N 0 0 414.465 5.704 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(C)c2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000409000197 560663747 /nfs/dbraw/zinc/66/37/47/560663747.db2.gz XOSBJYSMFVTVDV-YVLHZVERSA-N 0 0 416.304 5.487 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000409000486 560663755 /nfs/dbraw/zinc/66/37/55/560663755.db2.gz YWBOMILKVHQPFX-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN Cc1nn(Cc2ccccc2)c(C)c1/C=C1\C(=O)N(c2ccc(C)c(Cl)c2)N=C1C ZINC000409000490 560663779 /nfs/dbraw/zinc/66/37/79/560663779.db2.gz YKJCGYQDLKGBMU-LPYMAVHISA-N 0 0 418.928 5.316 40 10 HKCBRN FC(F)(F)c1cccc([C@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000409000936 558854634 /nfs/dbraw/zinc/85/46/34/558854634.db2.gz ZBXGHXLUWNLYMP-BWACUDIHSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1cccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000409000938 558854612 /nfs/dbraw/zinc/85/46/12/558854612.db2.gz ZBXGHXLUWNLYMP-PEBVRCNWSA-N 0 0 418.673 7.492 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000409000992 560663866 /nfs/dbraw/zinc/66/38/66/560663866.db2.gz OHPLZTRHSVSETD-QNGOZBTKSA-N 0 0 423.940 5.905 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(C)cc3)N(c3ccc(C)cc3)C2=O)cc1OC ZINC000409001149 560663884 /nfs/dbraw/zinc/66/38/84/560663884.db2.gz UTZHVIIZMMDASD-PXLXIMEGSA-N 0 0 412.489 5.155 40 10 HKCBRN Cc1nn(Cc2ccccc2)c(C)c1/C=C1\C(=O)N(c2ccc(Cl)cc2)N=C1C ZINC000409001420 558854949 /nfs/dbraw/zinc/85/49/49/558854949.db2.gz PRKCKFVYQMFUPL-LPYMAVHISA-N 0 0 404.901 5.008 40 10 HKCBRN COc1ccc(/C=C2/N=C(c3ccc(C)cc3)N(c3cccc(C)c3)C2=O)c(OC)c1 ZINC000409001484 558854796 /nfs/dbraw/zinc/85/47/96/558854796.db2.gz WCRHDEGDPTUYBE-HZHRSRAPSA-N 0 0 412.489 5.155 40 10 HKCBRN CCOc1ccc(/C=C2/N=C(c3ccc(Cl)cc3)N(c3cccc(C)c3)C2=O)cc1 ZINC000409001884 560663961 /nfs/dbraw/zinc/66/39/61/560663961.db2.gz XJAGIJNDIUDOFI-XQNSMLJCSA-N 0 0 416.908 5.882 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(C)cc2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000409002307 560664065 /nfs/dbraw/zinc/66/40/65/560664065.db2.gz SWZBPNJLDSYAIB-AQTBWJFISA-N 0 0 415.411 5.281 40 10 HKCBRN CCOC(=O)C1=C(C)N(c2ccc(Cl)cc2)C(=O)/C1=C\c1ccc(OCC)cc1 ZINC000409002339 558855702 /nfs/dbraw/zinc/85/57/02/558855702.db2.gz TYOQGILRYUHANX-ZHZULCJRSA-N 0 0 411.885 5.006 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(Cc2cccc(C)c2)c2ccccc12 ZINC000409003188 560664837 /nfs/dbraw/zinc/66/48/37/560664837.db2.gz YLNURDRBVVONCG-PCLIKHOPSA-N 0 0 405.501 5.804 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C)c2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000409003292 558856876 /nfs/dbraw/zinc/85/68/76/558856876.db2.gz ZGROWZIFKBELBQ-WJDWOHSUSA-N 0 0 402.277 5.179 40 10 HKCBRN CCOC(=O)N[C@H](CC(=O)Nc1ccc(/N=N/c2ccccc2)cc1)c1ccccc1 ZINC000409003305 558856846 /nfs/dbraw/zinc/85/68/46/558856846.db2.gz RTQZDNSEFJRCGN-RBGJJZJSSA-N 0 0 416.481 5.918 40 10 HKCBRN CCOC(=O)N[C@@H](CC(=O)Nc1ccc(/N=N/c2ccccc2)cc1)c1ccccc1 ZINC000409003306 560664950 /nfs/dbraw/zinc/66/49/50/560664950.db2.gz RTQZDNSEFJRCGN-XJPNONJMSA-N 0 0 416.481 5.918 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3)c(Cl)c2)SC1=S ZINC000409004307 560664188 /nfs/dbraw/zinc/66/41/88/560664188.db2.gz AAPJWOACGYDRTJ-YVLHZVERSA-N 0 0 424.374 5.794 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCc3ccccc3F)c(Cl)c2)SC1=S ZINC000409004345 560664176 /nfs/dbraw/zinc/66/41/76/560664176.db2.gz AMMUFDBYQJNCCZ-YVLHZVERSA-N 0 0 407.919 5.279 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)c(C(F)(F)F)c3)o2)SC1=S ZINC000409005466 558857439 /nfs/dbraw/zinc/85/74/39/558857439.db2.gz DRQJGBCGMRMAQZ-ZSOIEALJSA-N 0 0 417.861 5.840 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(CC)C2=O)ccc1OCc1cccc(F)c1 ZINC000409006673 560664644 /nfs/dbraw/zinc/66/46/44/560664644.db2.gz KLORGFWOTMKFGT-UNOMPAQXSA-N 0 0 417.527 5.025 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(OCc3ccccc3Cl)c(Cl)c2)SC1=S ZINC000409007050 558857366 /nfs/dbraw/zinc/85/73/66/558857366.db2.gz NEQHUMOGGQIINE-YVLHZVERSA-N 0 0 424.374 5.794 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(CCc3ccccc3)C2=O)c(C)n1-c1ccc(C)cc1 ZINC000409007731 560664771 /nfs/dbraw/zinc/66/47/71/560664771.db2.gz QZRKAPHMKMTCQO-KQWNVCNZSA-N 0 0 416.546 5.682 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(CCc3ccccc3)C2=O)c(C)n1-c1ccc(F)cc1 ZINC000409008503 558857529 /nfs/dbraw/zinc/85/75/29/558857529.db2.gz ZKIKSXIEXATTLY-JCMHNJIXSA-N 0 0 420.509 5.512 40 10 HKCBRN CC[C@H](C)N1C(=O)S/C(=C\c2cc(C)n(-c3ccc(Cl)c(Cl)c3)c2C)C1=O ZINC000409009373 560665189 /nfs/dbraw/zinc/66/51/89/560665189.db2.gz DXNMWPHGUODEOY-HCGGYXKBSA-N 0 0 423.365 6.236 40 10 HKCBRN CC[C@@H](C)N1C(=O)S/C(=C\c2cc(C)n(-c3ccc(Cl)c(Cl)c3)c2C)C1=O ZINC000409009374 560665149 /nfs/dbraw/zinc/66/51/49/560665149.db2.gz DXNMWPHGUODEOY-RGVUVNHFSA-N 0 0 423.365 6.236 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cc(Cl)ccc1C ZINC000409009476 558857790 /nfs/dbraw/zinc/85/77/90/558857790.db2.gz AHXFKCFFKIXPKJ-UDWIEESQSA-N 0 0 405.885 5.153 40 10 HKCBRN CC[C@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)C1=O ZINC000409010320 558857772 /nfs/dbraw/zinc/85/77/72/558857772.db2.gz JWFXHVMKMNENOZ-MDBUFAAASA-N 0 0 413.499 5.146 40 10 HKCBRN CC[C@@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)C1=O ZINC000409010324 560665261 /nfs/dbraw/zinc/66/52/61/560665261.db2.gz JWFXHVMKMNENOZ-OTGIAGGSSA-N 0 0 413.499 5.146 40 10 HKCBRN CCCCc1ccc(-n2c(C)cc(/C=C3/SC(=O)N([C@@H](C)CC)C3=O)c2C)cc1 ZINC000409013426 560665170 /nfs/dbraw/zinc/66/51/70/560665170.db2.gz UYRGGDYHNUGMGD-PZBNQXIHSA-N 0 0 410.583 6.272 40 10 HKCBRN CCCCc1ccc(-n2c(C)cc(/C=C3/SC(=O)N([C@H](C)CC)C3=O)c2C)cc1 ZINC000409013429 560665136 /nfs/dbraw/zinc/66/51/36/560665136.db2.gz UYRGGDYHNUGMGD-QFNCUCFLSA-N 0 0 410.583 6.272 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1ccc(Cl)cc1 ZINC000409013690 560666122 /nfs/dbraw/zinc/66/61/22/560666122.db2.gz CVSWCKLRVFAKPM-YVLHZVERSA-N 0 0 402.277 5.179 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(c3ccccc3)C2=O)c(C)n1-c1cccc(Cl)c1C ZINC000409013800 560666136 /nfs/dbraw/zinc/66/61/36/560666136.db2.gz VTAYVHIWEYFYDT-DEDYPNTBSA-N 0 0 405.885 5.153 40 10 HKCBRN CC[C@@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3cccc4ccccc43)c2C)C1=O ZINC000409015419 560666326 /nfs/dbraw/zinc/66/63/26/560666326.db2.gz RXRMVKYOGWTOOG-QQHUYRGFSA-N 0 0 404.535 6.082 40 10 HKCBRN CC[C@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3cccc4ccccc43)c2C)C1=O ZINC000409015421 558859800 /nfs/dbraw/zinc/85/98/00/558859800.db2.gz RXRMVKYOGWTOOG-WXUSHSQQSA-N 0 0 404.535 6.082 40 10 HKCBRN CC[C@@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc4ccccc4c3)c2C)C1=O ZINC000409015441 558859866 /nfs/dbraw/zinc/85/98/66/558859866.db2.gz RCPYIKXNZWMPQC-QQHUYRGFSA-N 0 0 404.535 6.082 40 10 HKCBRN CC[C@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc4ccccc4c3)c2C)C1=O ZINC000409015446 558859818 /nfs/dbraw/zinc/85/98/18/558859818.db2.gz RCPYIKXNZWMPQC-WXUSHSQQSA-N 0 0 404.535 6.082 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C\c1ccc(Cl)cc1 ZINC000409016287 560666543 /nfs/dbraw/zinc/66/65/43/560666543.db2.gz GLPSLHFGWZJTSY-YVLHZVERSA-N 0 0 421.802 5.236 40 10 HKCBRN COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc(C)n(-c2c(C)cccc2C)c1C ZINC000409016645 560666530 /nfs/dbraw/zinc/66/65/30/560666530.db2.gz VFARDRMMERDYLP-XKZIYDEJSA-N 0 0 420.553 5.040 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1c(O)ccc2ccccc21 ZINC000409016918 558860774 /nfs/dbraw/zinc/86/07/74/558860774.db2.gz LSVLCNJMLICLAM-HMAPJEAMSA-N 0 0 413.473 5.039 40 10 HKCBRN COC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc(C)n(-c2ccc(C)cc2C)c1C ZINC000409016959 560666684 /nfs/dbraw/zinc/66/66/84/560666684.db2.gz UMNXKXLKHODMMC-XKZIYDEJSA-N 0 0 420.553 5.040 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1ccc(SC)cc1 ZINC000409016978 560666679 /nfs/dbraw/zinc/66/66/79/560666679.db2.gz CGHMCWRIPHCNRJ-WQRHYEAKSA-N 0 0 413.926 5.248 40 10 HKCBRN CC[C@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc(C(C)(C)C)cc3)c2C)C1=O ZINC000409017334 560665898 /nfs/dbraw/zinc/66/58/98/560665898.db2.gz FUKPFKSEXDFUSP-HBBMIWKISA-N 0 0 410.583 6.226 40 10 HKCBRN CC[C@@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc(C(C)(C)C)cc3)c2C)C1=O ZINC000409017337 558861321 /nfs/dbraw/zinc/86/13/21/558861321.db2.gz FUKPFKSEXDFUSP-HFITWMCCSA-N 0 0 410.583 6.226 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(C(C)C)C2=O)c(C)n1-c1cc(Cl)ccc1Cl ZINC000409018431 560666072 /nfs/dbraw/zinc/66/60/72/560666072.db2.gz MAXOSPPIIBPHLG-CAOOACKPSA-N 0 0 409.338 5.846 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1ccccc1F ZINC000409019032 560667333 /nfs/dbraw/zinc/66/73/33/560667333.db2.gz OLMIFFGYIFNLGW-APSNUPSMSA-N 0 0 406.240 5.010 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1ccccc1Cl ZINC000409019230 558861462 /nfs/dbraw/zinc/86/14/62/558861462.db2.gz QCIYYXJNEZTGTF-YBEGLDIGSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000409019548 560667439 /nfs/dbraw/zinc/66/74/39/560667439.db2.gz UBQBBRFJVJDTPZ-JCMHNJIXSA-N 0 0 403.522 5.478 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000409019561 558861811 /nfs/dbraw/zinc/86/18/11/558861811.db2.gz UFIUKDAQULADQX-BOPFTXTBSA-N 0 0 416.304 5.487 40 10 HKCBRN CC[C@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)C1=O ZINC000409020485 558862150 /nfs/dbraw/zinc/86/21/50/558862150.db2.gz PUWKDPDAOGOKIR-KECVIQKOSA-N 0 0 406.910 5.721 40 10 HKCBRN CC[C@@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)C1=O ZINC000409020486 560667485 /nfs/dbraw/zinc/66/74/85/560667485.db2.gz PUWKDPDAOGOKIR-PBFYJAPKSA-N 0 0 406.910 5.721 40 10 HKCBRN Cc1ccc(-n2cccc2/C=C2\SC(=S)N(c3ccccc3)C2=O)cc1Cl ZINC000409020579 560666723 /nfs/dbraw/zinc/66/67/23/560666723.db2.gz QSAUAKXBJNXZDU-UYRXBGFRSA-N 0 0 410.951 5.845 40 10 HKCBRN CC[C@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3cccc(Cl)c3C)c2C)C1=O ZINC000409020628 560666714 /nfs/dbraw/zinc/66/67/14/560666714.db2.gz RHAPUMFXGKXVPA-MKFNJMOCSA-N 0 0 402.947 5.891 40 10 HKCBRN CC[C@@H](C)N1C(=O)S/C(=C/c2cc(C)n(-c3cccc(Cl)c3C)c2C)C1=O ZINC000409020629 560666719 /nfs/dbraw/zinc/66/67/19/560666719.db2.gz RHAPUMFXGKXVPA-ZGXHQARYSA-N 0 0 402.947 5.891 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000409021298 558862434 /nfs/dbraw/zinc/86/24/34/558862434.db2.gz AIMMYPRTZFJPDV-PDGQHHTCSA-N 0 0 415.411 5.199 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(C(C)C)C2=O)c(C)n1-c1cccc(Cl)c1Cl ZINC000409021502 560666828 /nfs/dbraw/zinc/66/68/28/560666828.db2.gz KOLQFHOMOSZKGF-CXUHLZMHSA-N 0 0 409.338 5.846 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1cccc(Cl)c1 ZINC000409021516 560666838 /nfs/dbraw/zinc/66/68/38/560666838.db2.gz LKAWACMCBPBCDD-IDUWFGFVSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1cccc(Cl)c1 ZINC000409021747 560666895 /nfs/dbraw/zinc/66/68/95/560666895.db2.gz WTDPCROIKWHPCN-YVLHZVERSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1ccc(C(C)C)cc1 ZINC000409021763 560666928 /nfs/dbraw/zinc/66/69/28/560666928.db2.gz XSSJJUBYKHGLPT-NDENLUEZSA-N 0 0 409.913 5.649 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(C(C)C)C2=O)c(C)n1-c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000409021976 558862773 /nfs/dbraw/zinc/86/27/73/558862773.db2.gz BHXQEADFSXVRIS-CAOOACKPSA-N 0 0 419.890 5.100 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000409022026 558862844 /nfs/dbraw/zinc/86/28/44/558862844.db2.gz CFZJKSPHSDFNMF-BKUYFWCQSA-N 0 0 417.892 5.679 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(C(C)C)C2=O)c(C)n1-c1cccc(Br)c1 ZINC000409022113 560666880 /nfs/dbraw/zinc/66/68/80/560666880.db2.gz JPDOTFXQZOWSIG-RQZCQDPDSA-N 0 0 419.344 5.301 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000409022726 558863013 /nfs/dbraw/zinc/86/30/13/558863013.db2.gz QKNSTPBQCVVRFR-BOPFTXTBSA-N 0 0 416.304 5.487 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C\c1cccc(Cl)c1 ZINC000409022851 560667129 /nfs/dbraw/zinc/66/71/29/560667129.db2.gz UYHJUKDDJIUCSM-YVLHZVERSA-N 0 0 421.802 5.236 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000409022852 560667111 /nfs/dbraw/zinc/66/71/11/560667111.db2.gz GTCVBKNQYJYFCS-YVLHZVERSA-N 0 0 416.304 5.487 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1ccccc1Cl ZINC000409022867 560667086 /nfs/dbraw/zinc/66/70/86/560667086.db2.gz HAROHDBJYCKEQA-APSNUPSMSA-N 0 0 422.695 5.524 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(C(C)C)C2=O)c(C)n1-c1ccc(-c2ccccc2)cc1 ZINC000409022891 560667131 /nfs/dbraw/zinc/66/71/31/560667131.db2.gz HRHZWZMLMPXXNA-HAHDFKILSA-N 0 0 416.546 6.206 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(C(C)C)C2=O)c(C)n1-c1ccc(Br)cc1 ZINC000409023208 560667103 /nfs/dbraw/zinc/66/71/03/560667103.db2.gz UVVNBFGYXGVTGC-YVLHZVERSA-N 0 0 419.344 5.301 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1c(F)cccc1Cl ZINC000409023209 560667107 /nfs/dbraw/zinc/66/71/07/560667107.db2.gz UWJPCKCIVTZXJZ-GDNBJRDFSA-N 0 0 420.267 5.318 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C)c(Cl)c2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000409023368 560667257 /nfs/dbraw/zinc/66/72/57/560667257.db2.gz LIZORYWRIVMPBN-MOSHPQCFSA-N 0 0 423.940 5.823 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1ccc(C)cc1 ZINC000409024389 560667666 /nfs/dbraw/zinc/66/76/66/560667666.db2.gz RUFSCIPTNQOAFI-LSCVHKIXSA-N 0 0 402.277 5.179 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C(F)(F)F)c2)C(=O)/C1=C\c1ccccc1Cl ZINC000409024694 560667834 /nfs/dbraw/zinc/66/78/34/560667834.db2.gz UMDOYRUJPOQEIZ-YBEGLDIGSA-N 0 0 421.802 5.236 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(Cl)cc(Cl)c2)C(=O)/C1=C\c1ccc(Cl)cc1 ZINC000409024803 560667804 /nfs/dbraw/zinc/66/78/04/560667804.db2.gz XBMHXRNJJXCDDL-IDUWFGFVSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(c2cc(C)cc(C)c2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000409024837 558863887 /nfs/dbraw/zinc/86/38/87/558863887.db2.gz XQDTXMJDFQBLBE-ZDLGFXPLSA-N 0 0 416.304 5.487 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(C(C)(C)C)cc1 ZINC000409029470 560667667 /nfs/dbraw/zinc/66/76/67/560667667.db2.gz AEQXDVSPSZWGBX-UKTHLTGXSA-N 0 0 408.370 5.486 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C\c1ccccc1OCC(C)C ZINC000409029654 558865595 /nfs/dbraw/zinc/86/55/95/558865595.db2.gz CEMNWDKENVRMGF-JYRVWZFOSA-N 0 0 424.369 5.223 40 10 HKCBRN CCn1c(C)c(/C=C2/C(=O)N(c3ccccc3)N=C2C(F)(F)F)c2cc(C)ccc21 ZINC000409030645 560668282 /nfs/dbraw/zinc/66/82/82/560668282.db2.gz HCTHJSIKHWTUJQ-CPNJWEJPSA-N 0 0 411.427 5.627 40 10 HKCBRN CCCCOc1ccc(/C=C2/C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)cc1 ZINC000409031235 560668288 /nfs/dbraw/zinc/66/82/88/560668288.db2.gz JLXAHJPXTIJGGF-GXDHUFHOSA-N 0 0 424.369 5.367 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(OCC(C)C)cc1 ZINC000409031277 558866469 /nfs/dbraw/zinc/86/64/69/558866469.db2.gz AHCGDLFDLHONNB-RIYZIHGNSA-N 0 0 424.369 5.223 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000409031564 560668311 /nfs/dbraw/zinc/66/83/11/560668311.db2.gz HJSZCHJJLVBEAP-ALCCZGGFSA-N 0 0 421.152 5.495 40 10 HKCBRN Cc1[nH]c2c(cccc2C)c1/C=C1/C(=O)N(c2c(F)c(F)c(F)c(F)c2F)N=C1C ZINC000409033771 558878910 /nfs/dbraw/zinc/87/89/10/558878910.db2.gz PLORTGWQFJXDQU-NTUHNPAUSA-N 0 0 419.353 5.286 40 10 HKCBRN CCOc1ccc2ccc(OCC)c(/C=C3\SC(=S)N(CC(C)C)C3=O)c2c1 ZINC000409034002 558881378 /nfs/dbraw/zinc/88/13/78/558881378.db2.gz GSQWBEMEUYOHBW-NDENLUEZSA-N 0 0 415.580 5.494 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C\c1cccc2ccccc12 ZINC000409034545 558884099 /nfs/dbraw/zinc/88/40/99/558884099.db2.gz OEQXNJJTDMTVGT-ZROIWOOFSA-N 0 0 402.322 5.341 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)cc1 ZINC000409035976 560668799 /nfs/dbraw/zinc/66/87/99/560668799.db2.gz RBGQLORYILJJKC-GMROUXNLSA-N 0 0 424.369 5.366 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)cc1 ZINC000409035980 558887103 /nfs/dbraw/zinc/88/71/03/558887103.db2.gz RBGQLORYILJJKC-RSYJBZMQSA-N 0 0 424.369 5.366 40 10 HKCBRN CCn1cc(/C=C2\C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)c2ccccc21 ZINC000409036010 560668822 /nfs/dbraw/zinc/66/88/22/560668822.db2.gz KWWLQHOZENIAGG-JYRVWZFOSA-N 0 0 419.353 5.163 40 10 HKCBRN CCn1c(C)c(/C=C2/C(=O)N(c3cc(F)c(F)cc3F)N=C2C)c2cccc(C)c21 ZINC000409036218 560668793 /nfs/dbraw/zinc/66/87/93/560668793.db2.gz ATUNKFHCERANGM-CXUHLZMHSA-N 0 0 411.427 5.501 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(Cl)cc1Cl ZINC000409036652 560668782 /nfs/dbraw/zinc/66/87/82/560668782.db2.gz LECCXAHNQMHKQR-RUDMXATFSA-N 0 0 421.152 5.495 40 10 HKCBRN Cc1[nH]c2ccc(C)cc2c1/C=C1/C(=O)N(c2c(F)c(F)c(F)c(F)c2F)N=C1C ZINC000409037088 558888139 /nfs/dbraw/zinc/88/81/39/558888139.db2.gz SIHPIOKWDGJMLL-KPKJPENVSA-N 0 0 419.353 5.286 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccccc2OCc2ccc(Cl)cc2)SC1=S ZINC000409037093 558888284 /nfs/dbraw/zinc/88/82/84/558888284.db2.gz XKXWXBVINGTBFF-ODLFYWEKSA-N 0 0 417.983 5.776 40 10 HKCBRN CCn1c(C)c(/C=C2/C(=O)N(c3cc(F)c(F)cc3F)N=C2C)c2cc(C)ccc21 ZINC000409037131 558888131 /nfs/dbraw/zinc/88/81/31/558888131.db2.gz SNCIMWVUARUVAH-OQLLNIDSSA-N 0 0 411.427 5.501 40 10 HKCBRN CCn1c(C)c(/C=C2/C(=O)N(c3ccccc3)N=C2C(F)(F)F)c2cccc(C)c21 ZINC000409037590 560668867 /nfs/dbraw/zinc/66/88/67/560668867.db2.gz DECWOTHVFCSJAV-CPNJWEJPSA-N 0 0 411.427 5.627 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccccc2OCc2ccc(F)cc2)SC1=S ZINC000409038558 560668633 /nfs/dbraw/zinc/66/86/33/560668633.db2.gz PGOKZKISAKJLNN-ODLFYWEKSA-N 0 0 401.528 5.262 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(Cl)c(Cl)c1 ZINC000409038766 560668631 /nfs/dbraw/zinc/66/86/31/560668631.db2.gz FOTKYXTVRLPTDD-XBXARRHUSA-N 0 0 421.152 5.495 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccccc2OCc2ccccc2Cl)SC1=S ZINC000409039024 558891396 /nfs/dbraw/zinc/89/13/96/558891396.db2.gz QIGKZSJRRGPEQI-ODLFYWEKSA-N 0 0 417.983 5.776 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccccc2OCc2ccccc2F)SC1=S ZINC000409040256 560668888 /nfs/dbraw/zinc/66/88/88/560668888.db2.gz YBLKPZUZJYNZHQ-ODLFYWEKSA-N 0 0 401.528 5.262 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)cc3Cl)o2)SC1=S ZINC000409040325 558892447 /nfs/dbraw/zinc/89/24/47/558892447.db2.gz YIFYIYDAMXVUOQ-PXNMLYILSA-N 0 0 412.363 6.111 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(CC(C)C)C2=O)ccc1OCc1ccccc1 ZINC000409041052 560668993 /nfs/dbraw/zinc/66/89/93/560668993.db2.gz IZYJMEPLXUXCMU-NDENLUEZSA-N 0 0 413.564 5.131 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1ccc(-c2ccccc2)o1 ZINC000409042946 560669236 /nfs/dbraw/zinc/66/92/36/560669236.db2.gz LTTSPLIUFWOXEX-UKTHLTGXSA-N 0 0 418.321 5.448 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)SC1=S ZINC000409043371 558892160 /nfs/dbraw/zinc/89/21/60/558892160.db2.gz YZBMNTCDBJRBSR-BOPFTXTBSA-N 0 0 405.629 5.844 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(Cl)c(OCC(C)C)c(Cl)c1 ZINC000409044061 558896582 /nfs/dbraw/zinc/89/65/82/558896582.db2.gz AQZLKUFBOWWAJX-RQZCQDPDSA-N 0 0 403.309 5.834 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cc(Cl)cc(Cl)c1OCC(C)C ZINC000409047784 560669742 /nfs/dbraw/zinc/66/97/42/560669742.db2.gz PLELITUJNVVLIE-VCHYOVAHSA-N 0 0 403.309 5.834 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/C(=O)N(c3c(F)c(F)c(F)c(F)c3F)N=C2C)cc1 ZINC000409047876 560669753 /nfs/dbraw/zinc/66/97/53/560669753.db2.gz NOJSYVACVKONPO-GXDHUFHOSA-N 0 0 423.385 5.034 40 10 HKCBRN CC(C)CN1C(=O)/C(=C/c2ccc(OCc3cccc(F)c3)cc2)SC1=S ZINC000409049693 560669943 /nfs/dbraw/zinc/66/99/43/560669943.db2.gz ZPRMEIULVNLRGK-ODLFYWEKSA-N 0 0 401.528 5.262 40 10 HKCBRN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000409050516 560669945 /nfs/dbraw/zinc/66/99/45/560669945.db2.gz WSGAGEZANXZYOI-YVMONPNESA-N 0 0 421.152 5.495 40 10 HKCBRN CCCCOc1ccc(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)cc1 ZINC000409050859 558895876 /nfs/dbraw/zinc/89/58/76/558895876.db2.gz BJIQKXROKVYVJZ-RELWKKBWSA-N 0 0 412.485 6.639 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3c(OCc4ccccc4)ccc4ccccc43)C(=O)O2)cc1 ZINC000409050950 560669986 /nfs/dbraw/zinc/66/99/86/560669986.db2.gz FFGAPLHWZBEPEY-JJIBRWJFSA-N 0 0 418.492 6.709 40 10 HKCBRN O=C1OC(c2ccc(-c3ccccc3)cc2)=C/C1=C\c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000409050954 558895911 /nfs/dbraw/zinc/89/59/11/558895911.db2.gz FGPMSHXETJPEMV-XDHOZWIPSA-N 0 0 403.821 5.897 40 10 HKCBRN O=C1OC(c2ccc(F)cc2)=C/C1=C\c1c(OCc2ccccc2)ccc2ccccc21 ZINC000409051036 560669985 /nfs/dbraw/zinc/66/99/85/560669985.db2.gz HBHGPAPZPUZVEJ-CJLVFECKSA-N 0 0 422.455 6.539 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(Cc3ccc(C)cc3)C2=O)c(OCC)c1 ZINC000409051065 560670007 /nfs/dbraw/zinc/67/00/07/560670007.db2.gz HXXVASBYDSPTDV-NDENLUEZSA-N 0 0 413.564 5.194 40 10 HKCBRN COc1cccc(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)c1OC ZINC000409051099 558897124 /nfs/dbraw/zinc/89/71/24/558897124.db2.gz IVRVEKBIZJFGPE-XDJHFCHBSA-N 0 0 400.430 5.477 40 10 HKCBRN CCN(CC)c1ccc(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)cc1 ZINC000409051292 560669958 /nfs/dbraw/zinc/66/99/58/560669958.db2.gz KEIJMRPGRNIZFM-RELWKKBWSA-N 0 0 411.501 6.306 40 10 HKCBRN O=C1OC(c2ccc(Oc3ccccc3)cc2)=C/C1=C\c1ccc(Br)cc1 ZINC000409051341 560670005 /nfs/dbraw/zinc/67/00/05/560670005.db2.gz CGYJRVZUMUUMSC-NBVRZTHBSA-N 0 0 419.274 6.223 40 10 HKCBRN COc1ccc(OC)c(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)c1 ZINC000409051353 558897987 /nfs/dbraw/zinc/89/79/87/558897987.db2.gz CMWYKBPFKJAKJD-XMHGGMMESA-N 0 0 400.430 5.477 40 10 HKCBRN Cc1ccc(C2=C/C(=C\c3ccc(OCc4ccccc4Cl)cc3)C(=O)O2)c(C)c1 ZINC000409051356 560670100 /nfs/dbraw/zinc/67/01/00/560670100.db2.gz CNBCWIVZQBGZPI-KGENOOAVSA-N 0 0 416.904 6.517 40 10 HKCBRN COc1c(Cl)cc(Cl)cc1/C=C1\SC(=S)N(Cc2ccc(C)cc2)C1=O ZINC000409051441 560670089 /nfs/dbraw/zinc/67/00/89/560670089.db2.gz ABPJFCSWKPVRBF-PXNMLYILSA-N 0 0 424.374 5.712 40 10 HKCBRN O=C1OC(c2ccc(-c3ccccc3)cc2)=C/C1=C\c1cccc(Br)c1 ZINC000409051771 560670171 /nfs/dbraw/zinc/67/01/71/560670171.db2.gz GDDKEHZLBUTVSX-DEDYPNTBSA-N 0 0 403.275 6.097 40 10 HKCBRN COc1cc(Cl)c(/C=C2\SC(=S)N(Cc3ccc(C)cc3)C2=O)cc1OC ZINC000409051845 560670176 /nfs/dbraw/zinc/67/01/76/560670176.db2.gz GQEGWTHOCAHOCN-NVMNQCDNSA-N 0 0 419.955 5.067 40 10 HKCBRN COc1cc(C)c(/C=C2\SC(=S)N(Cc3ccc(C)cc3)C2=O)cc1C(C)C ZINC000409051859 560670201 /nfs/dbraw/zinc/67/02/01/560670201.db2.gz GZLIJTUWNGOAQU-MTJSOVHGSA-N 0 0 411.592 5.837 40 10 HKCBRN O=C1OC(c2ccc(-c3ccccc3)cc2)=C/C1=C\c1ccc(Br)cc1 ZINC000409052052 560670166 /nfs/dbraw/zinc/67/01/66/560670166.db2.gz FVROBMNDVYOYIM-XSFVSMFZSA-N 0 0 403.275 6.097 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(Cc2ccc(C)cc2)C1=O ZINC000409052063 560670188 /nfs/dbraw/zinc/67/01/88/560670188.db2.gz FWUIYIFVJHCYAB-HMAPJEAMSA-N 0 0 419.571 5.948 40 10 HKCBRN O=C1OC(c2ccc(F)cc2)=C/C1=C\c1ccc(OCc2ccccc2Cl)cc1 ZINC000409052167 558898388 /nfs/dbraw/zinc/89/83/88/558898388.db2.gz GKCYUZAHUABYOW-CPNJWEJPSA-N 0 0 406.840 6.039 40 10 HKCBRN O=C1OC(c2ccc(Oc3ccccc3)cc2)=C/C1=C\c1cccc(Br)c1 ZINC000409052186 558898475 /nfs/dbraw/zinc/89/84/75/558898475.db2.gz QRDAVTBQICXFAI-QGOAFFKASA-N 0 0 419.274 6.223 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(Cc3ccc(C)cc3)C2=O)c(C)cc1OC ZINC000409052468 558898489 /nfs/dbraw/zinc/89/84/89/558898489.db2.gz HVGCCTBVLKOPPJ-NDENLUEZSA-N 0 0 413.564 5.112 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000409052665 560669529 /nfs/dbraw/zinc/66/95/29/560669529.db2.gz HQGRHGVOIINIEN-XLNRJJMWSA-N 0 0 407.554 5.547 40 10 HKCBRN O=C1OC(c2ccc(Oc3ccccc3)cc2)=C/C1=C\c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000409053470 560669859 /nfs/dbraw/zinc/66/98/59/560669859.db2.gz YQHIJKSXPXOZKB-SFQUDFHCSA-N 0 0 419.820 6.022 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1\C=C(c2ccc(-c3ccccc3)cc2)OC1=O ZINC000409053565 560670170 /nfs/dbraw/zinc/67/01/70/560670170.db2.gz ZSDRFQMQJVZRKQ-HAVVHWLPSA-N 0 0 404.465 6.497 40 10 HKCBRN O=C1OC(c2cccs2)=C/C1=C\c1c(OCc2ccccc2)ccc2ccccc21 ZINC000409053627 558898610 /nfs/dbraw/zinc/89/86/10/558898610.db2.gz NRWOVKVPRKPBGO-HMMYKYKNSA-N 0 0 410.494 6.462 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)cc1[N+](=O)[O-] ZINC000409053761 560671177 /nfs/dbraw/zinc/67/11/77/560671177.db2.gz PBTAPUVCYCUPBX-QGOAFFKASA-N 0 0 415.401 5.377 40 10 HKCBRN O=C1OC(c2ccccc2)=C/C1=C\c1c(OCc2ccccc2)ccc2ccccc21 ZINC000409053882 560671247 /nfs/dbraw/zinc/67/12/47/560671247.db2.gz RPBSQGMCEYQXQY-HAVVHWLPSA-N 0 0 404.465 6.400 40 10 HKCBRN COc1ccc(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)c(OC)c1 ZINC000409053947 560671253 /nfs/dbraw/zinc/67/12/53/560671253.db2.gz DYFUDAUPJRZEDJ-XMHGGMMESA-N 0 0 400.430 5.477 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1\C=C(c2ccc(Oc3ccccc3)cc2)OC1=O ZINC000409054238 558898923 /nfs/dbraw/zinc/89/89/23/558898923.db2.gz TUMHNEOCSBWKFR-HEHNFIMWSA-N 0 0 420.464 6.622 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000409054527 560671360 /nfs/dbraw/zinc/67/13/60/560671360.db2.gz BFINJDWBMLXUNM-LGMDPLHJSA-N 0 0 420.336 5.557 40 10 HKCBRN CCOC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc(C)n(-c2ccccc2C)c1C ZINC000409054754 560671342 /nfs/dbraw/zinc/67/13/42/560671342.db2.gz BHRCPCUOYAULGE-HMAPJEAMSA-N 0 0 420.553 5.121 40 10 HKCBRN CCOC(=O)C1=C(C)N(CC(C)C)C(=O)/C1=C\c1cc(C)n(-c2cccc(C)c2)c1C ZINC000409054908 560671396 /nfs/dbraw/zinc/67/13/96/560671396.db2.gz OJOQCSMNTWKGIU-UCQKPKSFSA-N 0 0 420.553 5.121 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1c(Cl)cccc1Cl ZINC000409055105 560671418 /nfs/dbraw/zinc/67/14/18/560671418.db2.gz CMLMFXTTYDASNV-RAXLEYEMSA-N 0 0 422.695 5.524 40 10 HKCBRN Cc1ccc(C)c(C2=C/C(=C\c3ccc(OCc4ccccc4Cl)cc3)C(=O)O2)c1 ZINC000409055243 558899155 /nfs/dbraw/zinc/89/91/55/558899155.db2.gz XVZZIJMKCMKWDB-KGENOOAVSA-N 0 0 416.904 6.517 40 10 HKCBRN O=C1OC(c2ccc(Oc3ccccc3)cc2)=C/C1=C\c1c(O)ccc2ccccc21 ZINC000409055514 558899363 /nfs/dbraw/zinc/89/93/63/558899363.db2.gz JBBGWXCENCBJOE-CAPFRKAQSA-N 0 0 406.437 6.319 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(Cc3ccc(C)cc3)C2=O)cc(Cl)c1O ZINC000409055601 558899397 /nfs/dbraw/zinc/89/93/97/558899397.db2.gz ZWWODELAFMNVKP-YVLHZVERSA-N 0 0 419.955 5.154 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000409055684 560671617 /nfs/dbraw/zinc/67/16/17/560671617.db2.gz DAHGCGSFUWKCCH-JXAWBTAJSA-N 0 0 419.443 5.269 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccccc1C(F)(F)F ZINC000409056162 560670308 /nfs/dbraw/zinc/67/03/08/560670308.db2.gz MYOUAEAFLXEOSI-KAMYIIQDSA-N 0 0 421.802 5.236 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000409056518 558899687 /nfs/dbraw/zinc/89/96/87/558899687.db2.gz GXURWYOWDGDYNL-PDGQHHTCSA-N 0 0 420.336 5.557 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000409056819 558899777 /nfs/dbraw/zinc/89/97/77/558899777.db2.gz OCCUWPZHQNGODD-LCYFTJDESA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000409056868 560670398 /nfs/dbraw/zinc/67/03/98/560670398.db2.gz OVWCQDKLMCOIQK-LGMDPLHJSA-N 0 0 420.336 5.557 40 10 HKCBRN CCc1ccc(/C=C2\C(=O)N(c3cccc(C(F)(F)F)c3)C(C)=C2C(=O)OC)cc1 ZINC000409056961 560670474 /nfs/dbraw/zinc/67/04/74/560670474.db2.gz FRNNPVUUYFAKSX-UNOMPAQXSA-N 0 0 415.411 5.145 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1cccc2ccccc12 ZINC000409057163 560670545 /nfs/dbraw/zinc/67/05/45/560670545.db2.gz UOMBEBPKARQNMX-RGEXLXHISA-N 0 0 403.865 5.370 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000409058199 560670711 /nfs/dbraw/zinc/67/07/11/560670711.db2.gz JBFTWZSUXXDLTQ-QJOMJCCJSA-N 0 0 401.506 5.403 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1cccc(Cl)c1Cl ZINC000409059257 560670851 /nfs/dbraw/zinc/67/08/51/560670851.db2.gz MAKXYGDYRDUQPU-RAXLEYEMSA-N 0 0 422.695 5.524 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1ccc(Cl)c(Cl)c1 ZINC000409059416 560670985 /nfs/dbraw/zinc/67/09/85/560670985.db2.gz XETIFLDFUKZYMQ-ATVHPVEESA-N 0 0 420.336 5.557 40 10 HKCBRN CCc1ccc(/C=C2\C(=O)N(c3ccc(Cl)c(Cl)c3)C(C)=C2C(=O)OC)cc1 ZINC000409059881 560670987 /nfs/dbraw/zinc/67/09/87/560670987.db2.gz OYWLDDMWIMSDON-BOPFTXTBSA-N 0 0 416.304 5.433 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000409060203 558907440 /nfs/dbraw/zinc/90/74/40/558907440.db2.gz ZRMANYDUXNXDFO-JXAWBTAJSA-N 0 0 409.913 5.515 40 10 HKCBRN CCc1ccc(/C=C2\C(=O)N(c3cc(Cl)cc(Cl)c3)C(C)=C2C(=O)OC)cc1 ZINC000409060283 558907692 /nfs/dbraw/zinc/90/76/92/558907692.db2.gz PELUOYCRYCOCSX-OCKHKDLRSA-N 0 0 416.304 5.433 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1c(F)cccc1Cl ZINC000409061293 558900030 /nfs/dbraw/zinc/90/00/30/558900030.db2.gz CPSZEMCRPUHCRE-RAXLEYEMSA-N 0 0 406.240 5.010 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1c(F)cccc1Cl ZINC000409062018 558899966 /nfs/dbraw/zinc/89/99/66/558899966.db2.gz LVJACMYDUPNYKQ-LGMDPLHJSA-N 0 0 403.881 5.042 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1c(O)ccc2ccccc21 ZINC000409062042 560671806 /nfs/dbraw/zinc/67/18/06/560671806.db2.gz MICPKXHATMJBNV-AQTBWJFISA-N 0 0 419.864 5.076 40 10 HKCBRN COc1ccc(-n2c(C)cc(/C=C3\C(=O)N(c4ccccc4)N=C3C)c2C)cc1Cl ZINC000409063284 560671996 /nfs/dbraw/zinc/67/19/96/560671996.db2.gz JXYILPAVWVGZDS-BKUYFWCQSA-N 0 0 419.912 5.562 40 10 HKCBRN CCc1ccc(-n2c(C)cc(/C=C3/NC(=O)N(c4cccc(Cl)c4)C3=O)c2C)cc1 ZINC000409064435 558900522 /nfs/dbraw/zinc/90/05/22/558900522.db2.gz DKJGOKZJLFLQNF-LPYMAVHISA-N 0 0 419.912 5.407 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccccc2Cl)C(=O)/C1=C\c1ccc(Cl)cc1Cl ZINC000409064491 560672150 /nfs/dbraw/zinc/67/21/50/560672150.db2.gz CPZJHTCUWSISFB-ZROIWOOFSA-N 0 0 422.695 5.524 40 10 HKCBRN O=C1S/C(=C\c2ccc(N3CCCC3)c(F)c2)C(=O)N1Cc1ccc(Cl)cc1 ZINC000409065652 558901631 /nfs/dbraw/zinc/90/16/31/558901631.db2.gz IMSCBONMTLBNBF-UNOMPAQXSA-N 0 0 416.905 5.316 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000409068209 560672577 /nfs/dbraw/zinc/67/25/77/560672577.db2.gz HTFVKSHYCGBQHT-CIAFOILYSA-N 0 0 419.912 5.462 40 10 HKCBRN O=C1NC(=Cc2ccc(N3CCCC3)c3ccccc23)C(=O)N1c1cccc(Cl)c1 ZINC000409069730 558913875 /nfs/dbraw/zinc/91/38/75/558913875.db2.gz VWJFTNAFOWVNEO-KGENOOAVSA-N 0 0 417.896 5.191 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000409070464 558914110 /nfs/dbraw/zinc/91/41/10/558914110.db2.gz XZXKFSVYCPBMJF-WSDLNYQXSA-N 0 0 419.912 5.462 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1cccc(C)c1C ZINC000409070711 560673262 /nfs/dbraw/zinc/67/32/62/560673262.db2.gz GLIJJDXYPRDNIG-CIAFOILYSA-N 0 0 419.912 5.462 40 10 HKCBRN COC(=O)C1=C(C)N(CCC2=CCCCC2)C(=O)/C1=C\c1c(O)ccc2ccccc21 ZINC000409075173 560672829 /nfs/dbraw/zinc/67/28/29/560672829.db2.gz WZJMUMDESJISKQ-JWGURIENSA-N 0 0 417.505 5.109 40 10 HKCBRN CCN1C(=O)S/C(=C\c2cc(C)n(-c3ccc(-c4ccccc4)cc3)c2C)C1=O ZINC000409076125 560672955 /nfs/dbraw/zinc/67/29/55/560672955.db2.gz YBCYEDKJUJOPNL-JCMHNJIXSA-N 0 0 402.519 5.817 40 10 HKCBRN COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000409076522 558919058 /nfs/dbraw/zinc/91/90/58/558919058.db2.gz BEFLBHPQVQNPEJ-UYRXBGFRSA-N 0 0 423.299 5.837 40 10 HKCBRN CCCOc1ccc(Cl)cc1/C=C1\C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000409076677 558919244 /nfs/dbraw/zinc/91/92/44/558919244.db2.gz BSKUXDCOBUMPCU-XLNRJJMWSA-N 0 0 416.908 5.963 40 10 HKCBRN Cc1cc(/C=C2\NC(=S)N(C3CCCCC3)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000409078069 558917807 /nfs/dbraw/zinc/91/78/07/558917807.db2.gz GLIMJFXZMQXUJL-MOSHPQCFSA-N 0 0 413.974 5.138 40 10 HKCBRN CCCOc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1OC ZINC000409080260 558927983 /nfs/dbraw/zinc/92/79/83/558927983.db2.gz MMYQUQCORNPZCB-XLNRJJMWSA-N 0 0 412.489 5.319 40 10 HKCBRN COc1c(Cl)cc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1Cl ZINC000409081363 558926083 /nfs/dbraw/zinc/92/60/83/558926083.db2.gz NUVRLAJLQWMOEG-PDGQHHTCSA-N 0 0 423.299 5.837 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1\C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000409084957 558928980 /nfs/dbraw/zinc/92/89/80/558928980.db2.gz YLNZKQYPOSSFNN-MOHJPFBDSA-N 0 0 404.469 5.683 40 10 HKCBRN CCOc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1OCC ZINC000409085971 560674269 /nfs/dbraw/zinc/67/42/69/560674269.db2.gz PKKBLUYATDVBHQ-XLNRJJMWSA-N 0 0 412.489 5.319 40 10 HKCBRN CCOc1ccc(Cl)cc1/C=C1\C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000409087396 558929438 /nfs/dbraw/zinc/92/94/38/558929438.db2.gz CILSPPBDZWZORB-PGMHBOJBSA-N 0 0 402.881 5.573 40 10 HKCBRN CCOc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1Cl ZINC000409087511 560674872 /nfs/dbraw/zinc/67/48/72/560674872.db2.gz ZBMADBRETORIKA-HKWRFOASSA-N 0 0 402.881 5.573 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000409088721 558929704 /nfs/dbraw/zinc/92/97/04/558929704.db2.gz GRSMROUORIKILH-PLRJNAJWSA-N 0 0 418.496 6.073 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cccc(OCc2cccc(Cl)c2)c1 ZINC000409091670 560675384 /nfs/dbraw/zinc/67/53/84/560675384.db2.gz SWJDRNOXAGNYSK-HZHRSRAPSA-N 0 0 402.881 5.725 40 10 HKCBRN CCCOc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1Cl ZINC000409093186 558931287 /nfs/dbraw/zinc/93/12/87/558931287.db2.gz XYFBYPJKPNQZMT-PGMHBOJBSA-N 0 0 416.908 5.963 40 10 HKCBRN COc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc(Cl)c1OC ZINC000409093398 558931329 /nfs/dbraw/zinc/93/13/29/558931329.db2.gz ZOWPTANQBRVBLG-UYRXBGFRSA-N 0 0 418.880 5.192 40 10 HKCBRN CCOc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc(Cl)c1O ZINC000409093484 558931348 /nfs/dbraw/zinc/93/13/48/558931348.db2.gz ZUGSIKKLQGRQJF-UYRXBGFRSA-N 0 0 418.880 5.279 40 10 HKCBRN O=C1S/C(=C\c2ccc(N3CCCC3)c(F)c2)C(=O)N1Cc1ccccc1Cl ZINC000409096291 558931918 /nfs/dbraw/zinc/93/19/18/558931918.db2.gz KJCBVDDNYIQIPH-UNOMPAQXSA-N 0 0 416.905 5.316 40 10 HKCBRN Cc1cc(/C=C2\Sc3ccccc3NC2=O)c(C)n1-c1ccc(Cl)c(Cl)c1 ZINC000409097478 560676053 /nfs/dbraw/zinc/67/60/53/560676053.db2.gz MJXUBXSBGYVDJO-JMIUGGIZSA-N 0 0 415.345 6.486 40 10 HKCBRN Cc1cc(/C=C2\Sc3ccccc3NC2=O)c(C)n1-c1ccc(-c2ccccc2)cc1 ZINC000409100739 560677090 /nfs/dbraw/zinc/67/70/90/560677090.db2.gz WIWJYHBBPNFIIF-ONUIUJJFSA-N 0 0 422.553 6.846 40 10 HKCBRN CCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(Br)c(C)c3)c2C)C1=O ZINC000409102953 560677478 /nfs/dbraw/zinc/67/74/78/560677478.db2.gz WVMIXWIPZBINEY-LICLKQGHSA-N 0 0 419.344 5.221 40 10 HKCBRN CCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(Br)cc3F)c2C)C1=O ZINC000409104749 560675707 /nfs/dbraw/zinc/67/57/07/560675707.db2.gz HVERAZCAFSOJRK-LZYBPNLTSA-N 0 0 423.307 5.052 40 10 HKCBRN COC(=O)c1cccc(-n2c(C)cc(/C=C3/Sc4ccccc4NC3=O)c2C)c1C ZINC000409105623 558934176 /nfs/dbraw/zinc/93/41/76/558934176.db2.gz NOBIZECDRCZXJE-LPYMAVHISA-N 0 0 418.518 5.274 40 10 HKCBRN Cc1cc(/C=C2/c3ccccc3N(CC(C)C)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000409109875 560677783 /nfs/dbraw/zinc/67/77/83/560677783.db2.gz NBPZMNAPGJACIS-UCQKPKSFSA-N 0 0 404.941 6.291 40 10 HKCBRN CC(C)CN1C(=O)/C(=C\c2cn(Cc3cccc(F)c3)c3ccccc23)c2ccccc21 ZINC000409110416 560677830 /nfs/dbraw/zinc/67/78/30/560677830.db2.gz VYKKTCLFHXLNLM-MYYYXRDXSA-N 0 0 424.519 6.372 40 10 HKCBRN Cc1c(Cl)cccc1NCc1cc(Br)cc(Br)c1O ZINC000409113336 558938484 /nfs/dbraw/zinc/93/84/84/558938484.db2.gz FNVDXNCMQORBKG-UHFFFAOYSA-N 0 0 405.517 5.491 40 10 HKCBRN CCN1C(=O)/C(=C\c2cn(Cc3ccc([N+](=O)[O-])cc3)c3ccccc23)c2ccccc21 ZINC000409113337 558938415 /nfs/dbraw/zinc/93/84/15/558938415.db2.gz AJKRKTRDZIXKRI-HAHDFKILSA-N 0 0 423.472 5.505 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cc(C)n(-c3ccc([N+](=O)[O-])cc3)c2C)c2ccccc21 ZINC000409113987 558938981 /nfs/dbraw/zinc/93/89/81/558938981.db2.gz PCRUUZQUUBTJPV-JCMHNJIXSA-N 0 0 401.466 5.300 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cn(Cc3cccc(F)c3)c3ccccc23)c2ccccc21 ZINC000409114374 558939233 /nfs/dbraw/zinc/93/92/33/558939233.db2.gz HAZIJKPSNYSDBP-JLPGSUDCSA-N 0 0 410.492 6.126 40 10 HKCBRN Cc1ccc(NCc2cc(Br)cc(Br)c2O)cc1Cl ZINC000409114770 558939961 /nfs/dbraw/zinc/93/99/61/558939961.db2.gz LCAIIGGBFMANNH-UHFFFAOYSA-N 0 0 405.517 5.491 40 10 HKCBRN Cc1ccc(Cl)cc1NCc1cc(Br)cc(Br)c1O ZINC000409114949 558940311 /nfs/dbraw/zinc/94/03/11/558940311.db2.gz FNUJNWHDXIEWDB-UHFFFAOYSA-N 0 0 405.517 5.491 40 10 HKCBRN CCN1C(=O)/C(=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)c2ccccc21 ZINC000409115390 558941722 /nfs/dbraw/zinc/94/17/22/558941722.db2.gz JARCXEGOIGFLGJ-STZFKDTASA-N 0 0 421.338 5.764 40 10 HKCBRN CCN1C(=O)/C(=C\c2cc(C)n(-c3ccc(Cl)c(Cl)c3)c2C)c2ccccc21 ZINC000409116608 558943410 /nfs/dbraw/zinc/94/34/10/558943410.db2.gz KVWSELUZGZOJRB-UNOMPAQXSA-N 0 0 411.332 6.308 40 10 HKCBRN Cc1cc(/C=C2/c3ccccc3N(CC(C)C)C2=O)c(C)n1-c1ccc([N+](=O)[O-])cc1 ZINC000409120256 560679545 /nfs/dbraw/zinc/67/95/45/560679545.db2.gz SSMMBTOBZQJPSH-UCQKPKSFSA-N 0 0 415.493 5.546 40 10 HKCBRN CCOC(=O)c1ccc(-n2c(C)cc(/C=C3\Sc4ccccc4NC3=O)c2C)cc1 ZINC000409120482 558948931 /nfs/dbraw/zinc/94/89/31/558948931.db2.gz VXZWFABPCQMYHI-HMAPJEAMSA-N 0 0 418.518 5.356 40 10 HKCBRN CC(C)CN1C(=O)/C(=C\c2cn(Cc3ccccc3)c3ccccc23)c2ccccc21 ZINC000409122105 558951922 /nfs/dbraw/zinc/95/19/22/558951922.db2.gz ZDBIMRHBKZKGJJ-XYGWBWBKSA-N 0 0 406.529 6.233 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(Cc4ccc(OC)cc4)C3=O)c[nH]c21 ZINC000409122676 558955327 /nfs/dbraw/zinc/95/53/27/558955327.db2.gz ATVGKUFZAMPIOU-ODLFYWEKSA-N 0 0 408.548 5.140 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000409122728 558955215 /nfs/dbraw/zinc/95/52/15/558955215.db2.gz BBSYRQDLIFTJBF-OEAKJJBVSA-N 0 0 422.594 6.328 40 10 HKCBRN Cc1cc(N2CCCCC2)ccc1/C=C1/SC(=O)N(CCCc2ccccc2)C1=O ZINC000409124287 560680710 /nfs/dbraw/zinc/68/07/10/560680710.db2.gz ASXJMFAQWRFOTH-PTGBLXJZSA-N 0 0 420.578 5.654 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000409124305 558961546 /nfs/dbraw/zinc/96/15/46/558961546.db2.gz AVUSDKSOVLMAQJ-HYARGMPZSA-N 0 0 422.594 6.328 40 10 HKCBRN CCN1C(=O)/C(=C/c2cn(CCCOc3ccccc3)c3ccccc23)SC1=S ZINC000409125122 560680884 /nfs/dbraw/zinc/68/08/84/560680884.db2.gz CCSZCVQVSOBZOR-QNGOZBTKSA-N 0 0 422.575 5.332 40 10 HKCBRN COc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CC4CCCCC4)C3=O)c2C)cc1 ZINC000409125198 560680904 /nfs/dbraw/zinc/68/09/04/560680904.db2.gz MUMXBULROUXQKX-HYARGMPZSA-N 0 0 424.566 5.719 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)c(F)c2)C(=O)N1CCCc1ccccc1 ZINC000409125214 558965123 /nfs/dbraw/zinc/96/51/23/558965123.db2.gz LIGRYRNURFGZKN-OQKWZONESA-N 0 0 424.541 5.485 40 10 HKCBRN CCN1C(=O)C(=Cc2cc(C)n(-c3ccc(C4CCCCC4)cc3)c2C)NC1=S ZINC000409125442 558966497 /nfs/dbraw/zinc/96/64/97/558966497.db2.gz AJZCIKAIYHILAK-JCMHNJIXSA-N 0 0 407.583 5.219 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1cc(C)ccn1 ZINC000409125577 558967689 /nfs/dbraw/zinc/96/76/89/558967689.db2.gz BFCTVHBOXUBJPP-DEDYPNTBSA-N 0 0 409.555 5.414 40 10 HKCBRN Cc1ccc(OCCCn2cc(/C=C3\SC(=S)N(C)C3=O)c3ccccc32)cc1 ZINC000409125721 558967530 /nfs/dbraw/zinc/96/75/30/558967530.db2.gz AQLBXYYOEJPUPR-STZFKDTASA-N 0 0 422.575 5.250 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000409127022 558977126 /nfs/dbraw/zinc/97/71/26/558977126.db2.gz PYYMFVQMJKVPHF-FYJGNVAPSA-N 0 0 410.539 5.416 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(CC)C3=O)cn(Cc3ccccc3F)c21 ZINC000409127761 558979793 /nfs/dbraw/zinc/97/97/93/558979793.db2.gz JRZPOOLRZHTNEI-NDENLUEZSA-N 0 0 424.566 5.612 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(C4CCCCC4)cc3)c2C)N(C)C1=S ZINC000409128374 558982665 /nfs/dbraw/zinc/98/26/65/558982665.db2.gz IFHFZCVQIYGVSG-KQWNVCNZSA-N 0 0 421.610 5.562 40 10 HKCBRN CN(C)c1ccc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)cc1Br ZINC000409128479 558982958 /nfs/dbraw/zinc/98/29/58/558982958.db2.gz OZDCFTSRGYUDFQ-GZTJUZNOSA-N 0 0 423.376 5.132 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000409129432 560681499 /nfs/dbraw/zinc/68/14/99/560681499.db2.gz JPJHPGOQFZKTAU-OEAKJJBVSA-N 0 0 422.594 6.328 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1ccccc1F ZINC000409130022 560681637 /nfs/dbraw/zinc/68/16/37/560681637.db2.gz MZKPMJXHTHFFNC-FYJGNVAPSA-N 0 0 412.530 5.850 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(OC)c1 ZINC000409130507 558985057 /nfs/dbraw/zinc/98/50/57/558985057.db2.gz IFQDTPYABGAWST-DEDYPNTBSA-N 0 0 402.560 5.158 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)c(F)c2)C(=O)N1CC1CCCCC1 ZINC000409131113 560681848 /nfs/dbraw/zinc/68/18/48/560681848.db2.gz LXWXAKJYAPZEJY-XSFVSMFZSA-N 0 0 402.535 5.433 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)cc2)C(=O)N1CCCc1ccccc1 ZINC000409131406 560680428 /nfs/dbraw/zinc/68/04/28/560680428.db2.gz IYWGZEHBYZHWOO-RELWKKBWSA-N 0 0 406.551 5.346 40 10 HKCBRN O=C(NC1=NC(=O)/C(=C/c2ccc(-c3cccc(Cl)c3)o2)S1)c1ccccc1 ZINC000409131955 560680507 /nfs/dbraw/zinc/68/05/07/560680507.db2.gz ZGFZBJHAVVRJPC-PDGQHHTCSA-N 0 0 408.866 5.000 40 10 HKCBRN Cc1cc(/C=C2\SC(=S)N(CCC3CCCC3)C2=O)c(C)n1C1CCCC1 ZINC000409132674 558986984 /nfs/dbraw/zinc/98/69/84/558986984.db2.gz LGHKQAQVTQJGGD-ZHZULCJRSA-N 0 0 402.629 6.002 40 10 HKCBRN Cc1ccccc1OCCCn1cc(/C=C2\SC(=S)N(C)C2=O)c2ccccc21 ZINC000409133729 558994424 /nfs/dbraw/zinc/99/44/24/558994424.db2.gz RBTQHJXEAUTBMS-STZFKDTASA-N 0 0 422.575 5.250 40 10 HKCBRN CCCCc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CCOC)C3=O)c2C)cc1 ZINC000409134263 560682171 /nfs/dbraw/zinc/68/21/71/560682171.db2.gz NYTCZHGQAKKNTP-RCCKNPSSSA-N 0 0 412.555 5.119 40 10 HKCBRN O=C(NC1=NC(=O)/C(=C/c2ccc(-c3ccc(Cl)cc3)o2)S1)c1ccccc1 ZINC000409134269 558862139 /nfs/dbraw/zinc/86/21/39/558862139.db2.gz OMJMVAHFGYQOEM-PDGQHHTCSA-N 0 0 408.866 5.000 40 10 HKCBRN Cc1cc(/C=C2/C(=O)N(C)C(=S)N2C)c(C)n1-c1ccc(C2CCCCC2)cc1 ZINC000409134766 560682210 /nfs/dbraw/zinc/68/22/10/560682210.db2.gz PQZCWTGESUUXNB-JCMHNJIXSA-N 0 0 407.583 5.171 40 10 HKCBRN CC(C)Cn1cc(/C=C2\SC(=S)N(Cc3cccnc3)C2=O)c2ccccc21 ZINC000409134897 558862948 /nfs/dbraw/zinc/86/29/48/558862948.db2.gz ORAPQGPNXWWWEV-JMIUGGIZSA-N 0 0 407.564 5.094 40 10 HKCBRN COCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(C(C)(C)C)cc3)c2C)C1=O ZINC000409135136 560682270 /nfs/dbraw/zinc/68/22/70/560682270.db2.gz USVWPZOKBVRPOC-XSFVSMFZSA-N 0 0 412.555 5.074 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(C(C)C)C2=O)c(C)n1-c1ccc(C2CCCCC2)cc1 ZINC000409135431 558863265 /nfs/dbraw/zinc/86/32/65/558863265.db2.gz QRWMCFKKAOUEGL-HAHDFKILSA-N 0 0 422.594 6.587 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(CCCc3ccccc3)C2=O)c(OC)c1 ZINC000409136236 560682522 /nfs/dbraw/zinc/68/25/22/560682522.db2.gz RYRIUPOOSXMSBW-CJLVFECKSA-N 0 0 424.566 5.211 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)c(F)c2)C(=O)N1CCCc1ccccc1 ZINC000409136500 560682499 /nfs/dbraw/zinc/68/24/99/560682499.db2.gz UWNBLJALMIKCND-LTGZKZEYSA-N 0 0 410.514 5.095 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1ccc(F)cc1 ZINC000409137342 558865797 /nfs/dbraw/zinc/86/57/97/558865797.db2.gz VWKCBHGVUVVQHI-FYJGNVAPSA-N 0 0 412.530 5.850 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3cc(C)n(C4CCCC4)c3C)N(C)C2=S)cc1 ZINC000409138031 558889686 /nfs/dbraw/zinc/88/96/86/558889686.db2.gz YZIAGNCDQDVWMU-JCMHNJIXSA-N 0 0 423.582 5.223 40 10 HKCBRN COc1cc(N2CCCCC2)ccc1/C=C1/SC(=O)N(CC2CCCCC2)C1=O ZINC000409138464 558889355 /nfs/dbraw/zinc/88/93/55/558889355.db2.gz CCNCFNRNABAUGY-KGENOOAVSA-N 0 0 414.571 5.302 40 10 HKCBRN CCN1C(=O)/C(=C/c2ccc(-c3ccc(Br)c(C)c3)o2)SC1=S ZINC000409139477 560683169 /nfs/dbraw/zinc/68/31/69/560683169.db2.gz AMBHQBHJOOJRJY-DHDCSXOGSA-N 0 0 408.342 5.239 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(C)C3=O)cn(Cc3ccc(F)cc3)c21 ZINC000409140847 558889850 /nfs/dbraw/zinc/88/98/50/558889850.db2.gz GGQZIOJECDEEMN-ODLFYWEKSA-N 0 0 410.539 5.222 40 10 HKCBRN COc1cccc(-n2c(C)cc(/C=C3\SC(=O)N(CC4CCCCC4)C3=O)c2C)c1 ZINC000409141308 560683514 /nfs/dbraw/zinc/68/35/14/560683514.db2.gz HOSSDMOCRCVJJA-XKZIYDEJSA-N 0 0 424.566 5.719 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1ccc(C)cc1 ZINC000409141591 558889845 /nfs/dbraw/zinc/88/98/45/558889845.db2.gz JCPVMUOZBCZHDC-HMAPJEAMSA-N 0 0 408.567 6.019 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(C)C3=O)cn(Cc3ccccc3F)c21 ZINC000409141696 560683469 /nfs/dbraw/zinc/68/34/69/560683469.db2.gz JPURATPWHJNTPZ-ODLFYWEKSA-N 0 0 410.539 5.222 40 10 HKCBRN Cc1cc(/C=C2\SC(=S)N(C)C2=O)c(C)n1-c1ccc(C2CCCCC2)cc1 ZINC000409141978 558889626 /nfs/dbraw/zinc/88/96/26/558889626.db2.gz KNSAGUSPPQOCSM-STZFKDTASA-N 0 0 410.608 5.973 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)c3ccccc23)C(=O)N1CC1CCCCC1 ZINC000409142803 558889826 /nfs/dbraw/zinc/88/98/26/558889826.db2.gz BIQSYIYGXBJQIA-XQNSMLJCSA-N 0 0 420.578 6.057 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)cc2F)C(=O)N1CC1CCCCC1 ZINC000409142914 560683582 /nfs/dbraw/zinc/68/35/82/560683582.db2.gz LSURAOBIGMQNKK-DEDYPNTBSA-N 0 0 402.535 5.433 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CCCc3ccccc3)C2=O)c(C)n1-c1ccccn1 ZINC000409143225 560684129 /nfs/dbraw/zinc/68/41/29/560684129.db2.gz MAOVGZPPCNLXNY-LTGZKZEYSA-N 0 0 417.534 5.158 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)cc2F)C(=O)N1CCCc1ccccc1 ZINC000409143230 560684166 /nfs/dbraw/zinc/68/41/66/560684166.db2.gz ZUTWUNRSTSIOKL-CJLVFECKSA-N 0 0 424.541 5.485 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1ccc(C)cn1 ZINC000409143359 560684234 /nfs/dbraw/zinc/68/42/34/560684234.db2.gz BTUGQKYTIXXFKI-UDWIEESQSA-N 0 0 409.555 5.414 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)cc2F)C(=O)N1CCCc1ccccc1 ZINC000409143504 560684242 /nfs/dbraw/zinc/68/42/42/560684242.db2.gz CHAOINMAUNXIOV-RCCKNPSSSA-N 0 0 410.514 5.095 40 10 HKCBRN CC(C)Cn1cc(/C=C2\SC(=S)N(CCC3CCCC3)C2=O)c2ccccc21 ZINC000409144091 558890452 /nfs/dbraw/zinc/89/04/52/558890452.db2.gz DNCSCIDDJQALEQ-BKUYFWCQSA-N 0 0 412.624 6.079 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(CCCc3ccccc3)C2=O)c(C)n1-c1ccccc1 ZINC000409144275 558890453 /nfs/dbraw/zinc/89/04/53/558890453.db2.gz OKSPKPPVUQVDDM-QJOMJCCJSA-N 0 0 416.546 5.763 40 10 HKCBRN Cc1cc(/C=C2\SC(=S)N(CCc3ccccc3)C2=O)c(C)n1C1CCCC1 ZINC000409144717 560684408 /nfs/dbraw/zinc/68/44/08/560684408.db2.gz GHPKCEDNJMPJKC-QNGOZBTKSA-N 0 0 410.608 5.664 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000409144949 558890844 /nfs/dbraw/zinc/89/08/44/558890844.db2.gz QQAFEYGVMKYMRG-OEAKJJBVSA-N 0 0 422.594 6.328 40 10 HKCBRN CCc1ccc(-n2c(C)cc(/C=C3/SC(=O)N(CC4CCCCC4)C3=O)c2C)cc1 ZINC000409145021 560684469 /nfs/dbraw/zinc/68/44/69/560684469.db2.gz HMDPZKGIFDXNNP-HZHRSRAPSA-N 0 0 422.594 6.273 40 10 HKCBRN Cc1cccc(COc2ccccc2C[C@@H]2SC(=S)N(Cc3ccco3)C2=O)c1 ZINC000409145338 558891148 /nfs/dbraw/zinc/89/11/48/558891148.db2.gz OLQGIRJGGSUOLS-NRFANRHFSA-N 0 0 423.559 5.139 40 10 HKCBRN Cc1cccc(COc2ccccc2C[C@H]2SC(=S)N(Cc3ccco3)C2=O)c1 ZINC000409145340 560684486 /nfs/dbraw/zinc/68/44/86/560684486.db2.gz OLQGIRJGGSUOLS-OAQYLSRUSA-N 0 0 423.559 5.139 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(CC)C3=O)cn(Cc3ccccc3)c21 ZINC000409146170 558891163 /nfs/dbraw/zinc/89/11/63/558891163.db2.gz KAJYDWKFWDXOAZ-MOSHPQCFSA-N 0 0 406.576 5.473 40 10 HKCBRN CCn1cc(/C=C2\SC(=S)N(Cc3ccc(OC)cc3)C2=O)c2ccccc21 ZINC000409148159 558891856 /nfs/dbraw/zinc/89/18/56/558891856.db2.gz XMQPEKSJIXARTK-NDENLUEZSA-N 0 0 408.548 5.071 40 10 HKCBRN CCCN1C(=O)S/C(=C\c2cc(C)n(-c3ccc(C4CCCCC4)cc3)c2C)C1=O ZINC000409148432 558891840 /nfs/dbraw/zinc/89/18/40/558891840.db2.gz PTBYTKRPWXMQPZ-KQWNVCNZSA-N 0 0 422.594 6.588 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1cccc(C)c1C ZINC000409148502 558892047 /nfs/dbraw/zinc/89/20/47/558892047.db2.gz QBUDTSQPGUYRTC-OEAKJJBVSA-N 0 0 422.594 6.328 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CC3CCCCC3)C2=O)c(C)n1-c1cccc(F)c1 ZINC000409149087 560683850 /nfs/dbraw/zinc/68/38/50/560683850.db2.gz XBRJCXLYFYZWFT-CIAFOILYSA-N 0 0 412.530 5.850 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1Br)N2 ZINC000409150491 558892724 /nfs/dbraw/zinc/89/27/24/558892724.db2.gz BZTZVRMQBZZXLI-AGKHESDQSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccccc1Br)N2 ZINC000409150492 558892760 /nfs/dbraw/zinc/89/27/60/558892760.db2.gz BZTZVRMQBZZXLI-CZIZLABSSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1Br)N2 ZINC000409150493 558892745 /nfs/dbraw/zinc/89/27/45/558892745.db2.gz BZTZVRMQBZZXLI-RLFDGXBXSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1Br)N2 ZINC000409150494 560684048 /nfs/dbraw/zinc/68/40/48/560684048.db2.gz BZTZVRMQBZZXLI-VGTOOOLASA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Br)c1)N2 ZINC000409150954 560684062 /nfs/dbraw/zinc/68/40/62/560684062.db2.gz FLRDUYJVJHVTAC-CKEIUWERSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(Br)c1)N2 ZINC000409150955 558892738 /nfs/dbraw/zinc/89/27/38/558892738.db2.gz FLRDUYJVJHVTAC-CPUCHLNUSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Br)c1)N2 ZINC000409150956 560684046 /nfs/dbraw/zinc/68/40/46/560684046.db2.gz FLRDUYJVJHVTAC-JKIFEVAISA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Br)c1)N2 ZINC000409150957 560684052 /nfs/dbraw/zinc/68/40/52/560684052.db2.gz FLRDUYJVJHVTAC-KEYYUXOJSA-N 0 0 405.679 5.837 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@@H]21 ZINC000409151241 558893042 /nfs/dbraw/zinc/89/30/42/558893042.db2.gz FUEKARHAJWFDSS-JQYIIUTOSA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@@H]21 ZINC000409151243 558893106 /nfs/dbraw/zinc/89/31/06/558893106.db2.gz FUEKARHAJWFDSS-MVERNJQCSA-N 0 0 401.550 7.253 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1Br)N2 ZINC000409151564 560684019 /nfs/dbraw/zinc/68/40/19/560684019.db2.gz HEIPQQXXFHDGGO-BWACUDIHSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1Br)N2 ZINC000409151567 558893079 /nfs/dbraw/zinc/89/30/79/558893079.db2.gz HEIPQQXXFHDGGO-PEBVRCNWSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1Br)N2 ZINC000409151571 558893062 /nfs/dbraw/zinc/89/30/62/558893062.db2.gz HEIPQQXXFHDGGO-PSTGCABASA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1Br)N2 ZINC000409151573 558893058 /nfs/dbraw/zinc/89/30/58/558893058.db2.gz HEIPQQXXFHDGGO-QFSBIZTOSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000409151851 558893033 /nfs/dbraw/zinc/89/30/33/558893033.db2.gz HVCCOCNNJFSXIS-BWACUDIHSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000409151853 558893108 /nfs/dbraw/zinc/89/31/08/558893108.db2.gz HVCCOCNNJFSXIS-PEBVRCNWSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000409151857 560684687 /nfs/dbraw/zinc/68/46/87/560684687.db2.gz HVCCOCNNJFSXIS-PSTGCABASA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000409151859 560684686 /nfs/dbraw/zinc/68/46/86/560684686.db2.gz HVCCOCNNJFSXIS-QFSBIZTOSA-N 0 0 406.225 5.636 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000409152303 558893907 /nfs/dbraw/zinc/89/39/07/558893907.db2.gz DWWQBBDHPWUBIR-SWYRRKHMSA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409152312 560685085 /nfs/dbraw/zinc/68/50/85/560685085.db2.gz DWWQBBDHPWUBIR-YPCDYVTLSA-N 0 0 418.005 7.767 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@@H]2C=CC[C@@H]21 ZINC000409153053 558894068 /nfs/dbraw/zinc/89/40/68/558894068.db2.gz KRYWZPHHEQEWMU-FHSNZYRGSA-N 0 0 424.260 6.303 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@@H]2C=CC[C@H]21 ZINC000409153064 560685129 /nfs/dbraw/zinc/68/51/29/560685129.db2.gz KRYWZPHHEQEWMU-SNUQEOBHSA-N 0 0 424.260 6.303 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@H]2C=CC[C@H]21 ZINC000409153070 558894081 /nfs/dbraw/zinc/89/40/81/558894081.db2.gz KRYWZPHHEQEWMU-VEVIJQCQSA-N 0 0 424.260 6.303 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@H]2C=CC[C@@H]21 ZINC000409153074 560685128 /nfs/dbraw/zinc/68/51/28/560685128.db2.gz KRYWZPHHEQEWMU-ZJNRKIDTSA-N 0 0 424.260 6.303 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409153201 558893873 /nfs/dbraw/zinc/89/38/73/558893873.db2.gz LSTWTIKCQXIELW-BWACUDIHSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409153202 558893850 /nfs/dbraw/zinc/89/38/50/558893850.db2.gz LSTWTIKCQXIELW-PEBVRCNWSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409153203 560685140 /nfs/dbraw/zinc/68/51/40/560685140.db2.gz LSTWTIKCQXIELW-PSTGCABASA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409153204 558893887 /nfs/dbraw/zinc/89/38/87/558893887.db2.gz LSTWTIKCQXIELW-QFSBIZTOSA-N 0 0 406.225 5.636 40 10 HKCBRN CCc1ccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409154128 558895583 /nfs/dbraw/zinc/89/55/83/558895583.db2.gz JVZNDOIMJDHZHN-HLIPFELVSA-N 0 0 401.291 5.680 40 10 HKCBRN CCc1ccc([C@@H]2Nc3ccc(I)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409154133 558895274 /nfs/dbraw/zinc/89/52/74/558895274.db2.gz JVZNDOIMJDHZHN-UWVAXJGDSA-N 0 0 401.291 5.680 40 10 HKCBRN COC(=O)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409154259 560685227 /nfs/dbraw/zinc/68/52/27/560685227.db2.gz OEGUCIMKOUDTTM-GLJUWKHASA-N 0 0 407.819 5.972 40 10 HKCBRN COC(=O)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@@H]3C=CC[C@H]32)cc1 ZINC000409154264 560685243 /nfs/dbraw/zinc/68/52/43/560685243.db2.gz OEGUCIMKOUDTTM-LBTNJELSSA-N 0 0 407.819 5.972 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1F)[C@H]1CC=C[C@@H]21 ZINC000409155207 558895852 /nfs/dbraw/zinc/89/58/52/558895852.db2.gz PZLDAQINPUZQOK-SWYRRKHMSA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccccc1F)[C@@H]1CC=C[C@@H]21 ZINC000409155210 560685352 /nfs/dbraw/zinc/68/53/52/560685352.db2.gz PZLDAQINPUZQOK-YPCDYVTLSA-N 0 0 401.550 7.253 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409155266 560685347 /nfs/dbraw/zinc/68/53/47/560685347.db2.gz QOKUQLCFMTXAGU-SIFCLUCFSA-N 0 0 406.784 7.771 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)cc(Cl)c(Cl)c3[C@@H]3C=CC[C@H]32)cc1 ZINC000409155271 558895848 /nfs/dbraw/zinc/89/58/48/558895848.db2.gz QOKUQLCFMTXAGU-SXGZJXTBSA-N 0 0 406.784 7.771 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@H]32)c1 ZINC000409155465 558895830 /nfs/dbraw/zinc/89/58/30/558895830.db2.gz PYYFMPCABSJYKK-CPUCHLNUSA-N 0 0 405.133 6.038 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409155468 560685357 /nfs/dbraw/zinc/68/53/57/560685357.db2.gz PYYFMPCABSJYKK-KEYYUXOJSA-N 0 0 405.133 6.038 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000409155755 560685351 /nfs/dbraw/zinc/68/53/51/560685351.db2.gz MTOYBERLNBHKHU-AGKHESDQSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@H]3C=CC[C@@H]32)ccc1Cl ZINC000409155757 558896453 /nfs/dbraw/zinc/89/64/53/558896453.db2.gz MTOYBERLNBHKHU-DINDLPBHSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000409155759 558896370 /nfs/dbraw/zinc/89/63/70/558896370.db2.gz MTOYBERLNBHKHU-RLFDGXBXSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@H]3C=CC[C@H]32)ccc1Cl ZINC000409155761 558896449 /nfs/dbraw/zinc/89/64/49/558896449.db2.gz MTOYBERLNBHKHU-RVPKQNPDSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(F)cc(Br)cc3[C@H]3C=CC[C@H]32)ccc1Cl ZINC000409155867 560685342 /nfs/dbraw/zinc/68/53/42/560685342.db2.gz DRNJKHXXTYJSSA-JKDFXYPNSA-N 0 0 423.669 5.976 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(F)cc(Br)cc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000409155869 560685343 /nfs/dbraw/zinc/68/53/43/560685343.db2.gz DRNJKHXXTYJSSA-PEBVRCNWSA-N 0 0 423.669 5.976 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(F)cc(Br)cc3[C@H]3C=CC[C@@H]32)ccc1Cl ZINC000409155871 558896534 /nfs/dbraw/zinc/89/65/34/558896534.db2.gz DRNJKHXXTYJSSA-PRXAMGSTSA-N 0 0 423.669 5.976 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(F)cc(Br)cc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000409155874 560685360 /nfs/dbraw/zinc/68/53/60/560685360.db2.gz DRNJKHXXTYJSSA-QFSBIZTOSA-N 0 0 423.669 5.976 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc(Cl)cc2[C@@H]2C=CC[C@@H]21 ZINC000409156290 560685422 /nfs/dbraw/zinc/68/54/22/560685422.db2.gz RSKCYQDLZYNWOI-QEEYODRMSA-N 0 0 404.735 6.246 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc(Cl)cc2[C@@H]2C=CC[C@H]21 ZINC000409156293 560685449 /nfs/dbraw/zinc/68/54/49/560685449.db2.gz RSKCYQDLZYNWOI-STXHMFSFSA-N 0 0 404.735 6.246 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409156665 560685443 /nfs/dbraw/zinc/68/54/43/560685443.db2.gz LOHXGVJBQOWZHN-GIWBLDEGSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409156666 558896656 /nfs/dbraw/zinc/89/66/56/558896656.db2.gz LOHXGVJBQOWZHN-XPNTWCBSSA-N 0 0 402.335 6.943 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@@H]21 ZINC000409156821 560685475 /nfs/dbraw/zinc/68/54/75/560685475.db2.gz TXLHJKMDAZCUPT-HBUWYVDXSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@@H]21 ZINC000409156828 560685429 /nfs/dbraw/zinc/68/54/29/560685429.db2.gz TXLHJKMDAZCUPT-QWQRMKEZSA-N 0 0 401.260 5.192 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Br)cc1)[C@@H]1CC=C[C@@H]21 ZINC000409157038 558896755 /nfs/dbraw/zinc/89/67/55/558896755.db2.gz OUSGSBONBZSZBZ-CKEIUWERSA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Br)cc1)[C@H]1CC=C[C@H]21 ZINC000409157050 558896705 /nfs/dbraw/zinc/89/67/05/558896705.db2.gz OUSGSBONBZSZBZ-GRDNDAEWSA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Br)cc1)[C@@H]1CC=C[C@H]21 ZINC000409157057 560685549 /nfs/dbraw/zinc/68/55/49/560685549.db2.gz OUSGSBONBZSZBZ-JJRVBVJISA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Br)cc1)[C@H]1CC=C[C@@H]21 ZINC000409157063 558896773 /nfs/dbraw/zinc/89/67/73/558896773.db2.gz OUSGSBONBZSZBZ-JKIFEVAISA-N 0 0 423.123 6.177 40 10 HKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)ccc(C(F)(F)F)c2[C@@H]2C=CC[C@H]21 ZINC000409157466 558896886 /nfs/dbraw/zinc/89/68/86/558896886.db2.gz QWEOHCABBWTBDN-CZIZLABSSA-N 0 0 417.780 7.204 40 10 HKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)ccc(C(F)(F)F)c2[C@H]2C=CC[C@@H]21 ZINC000409157479 560685569 /nfs/dbraw/zinc/68/55/69/560685569.db2.gz QWEOHCABBWTBDN-PSVSLLHZSA-N 0 0 417.780 7.204 40 10 HKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)ccc(C(F)(F)F)c2[C@@H]2C=CC[C@@H]21 ZINC000409157487 560685546 /nfs/dbraw/zinc/68/55/46/560685546.db2.gz QWEOHCABBWTBDN-VGTOOOLASA-N 0 0 417.780 7.204 40 10 HKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)ccc(C(F)(F)F)c2[C@H]2C=CC[C@H]21 ZINC000409157493 558896995 /nfs/dbraw/zinc/89/69/95/558896995.db2.gz QWEOHCABBWTBDN-WVQJBOLRSA-N 0 0 417.780 7.204 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(cccc2[N+](=O)[O-])[C@@H]2C=CC[C@H]21 ZINC000409157654 560685566 /nfs/dbraw/zinc/68/55/66/560685566.db2.gz WFJUBQUSIGATNH-SNUQEOBHSA-N 0 0 401.260 5.192 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CC=C[C@@H]21 ZINC000409157881 560684777 /nfs/dbraw/zinc/68/47/77/560684777.db2.gz QLXNZCCFGOZVSM-JQYIIUTOSA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21 ZINC000409157885 560684746 /nfs/dbraw/zinc/68/47/46/560684746.db2.gz QLXNZCCFGOZVSM-MVERNJQCSA-N 0 0 418.005 7.767 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@@H]21 ZINC000409158793 558932788 /nfs/dbraw/zinc/93/27/88/558932788.db2.gz LUAHFXPNLUDLMM-VBHSOAQHSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@@H]21 ZINC000409158796 558932757 /nfs/dbraw/zinc/93/27/57/558932757.db2.gz LUAHFXPNLUDLMM-VFVRVIDISA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc([N+](=O)[O-])cc2[C@@H]2C=CC[C@@H]21 ZINC000409158853 560684862 /nfs/dbraw/zinc/68/48/62/560684862.db2.gz LWOWFXJOFQMROI-QEEYODRMSA-N 0 0 415.287 5.501 40 10 HKCBRN COc1ccc(Br)cc1[C@@H]1Nc2c(C)cc([N+](=O)[O-])cc2[C@@H]2C=CC[C@H]21 ZINC000409158858 558932760 /nfs/dbraw/zinc/93/27/60/558932760.db2.gz LWOWFXJOFQMROI-STXHMFSFSA-N 0 0 415.287 5.501 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409160979 560685103 /nfs/dbraw/zinc/68/51/03/560685103.db2.gz RWLMXPSEKTWDHD-AGKHESDQSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409160980 560685065 /nfs/dbraw/zinc/68/50/65/560685065.db2.gz RWLMXPSEKTWDHD-CZIZLABSSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409160981 560685101 /nfs/dbraw/zinc/68/51/01/560685101.db2.gz RWLMXPSEKTWDHD-RLFDGXBXSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409160982 558985439 /nfs/dbraw/zinc/98/54/39/558985439.db2.gz RWLMXPSEKTWDHD-VGTOOOLASA-N 0 0 418.673 7.492 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 ZINC000409161165 560685113 /nfs/dbraw/zinc/68/51/13/560685113.db2.gz WZTOXFNPYVPJTK-FMTVUPSXSA-N 0 0 419.264 5.515 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 ZINC000409161168 558985430 /nfs/dbraw/zinc/98/54/30/558985430.db2.gz WZTOXFNPYVPJTK-FTLABTOESA-N 0 0 419.264 5.515 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1cc([N+](=O)[O-])ccc1Cl)N2 ZINC000409161170 558985361 /nfs/dbraw/zinc/98/53/61/558985361.db2.gz WZTOXFNPYVPJTK-SEDUGSJDSA-N 0 0 419.264 5.515 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 ZINC000409161424 560685557 /nfs/dbraw/zinc/68/55/57/560685557.db2.gz WZTOXFNPYVPJTK-SOZUMNATSA-N 0 0 419.264 5.515 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Br)c1)N2 ZINC000409162034 558986701 /nfs/dbraw/zinc/98/67/01/558986701.db2.gz CDTFPHKUXBFPHE-PBFPGSCMSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1cccc(Br)c1)N2 ZINC000409162036 558986700 /nfs/dbraw/zinc/98/67/00/558986700.db2.gz CDTFPHKUXBFPHE-XNJGSVPQSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@@H]3C=CC[C@H]32)c1 ZINC000409162633 560685875 /nfs/dbraw/zinc/68/58/75/560685875.db2.gz GNJQTNSUXBTVGQ-CZIZLABSSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@H]3C=CC[C@@H]32)c1 ZINC000409162634 558986802 /nfs/dbraw/zinc/98/68/02/558986802.db2.gz GNJQTNSUXBTVGQ-PSVSLLHZSA-N 0 0 406.225 5.636 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@H]3C=CC[C@H]32)c1 ZINC000409162636 558986878 /nfs/dbraw/zinc/98/68/78/558986878.db2.gz GNJQTNSUXBTVGQ-WVQJBOLRSA-N 0 0 406.225 5.636 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409164078 560685982 /nfs/dbraw/zinc/68/59/82/560685982.db2.gz CEWQOAQJWBYQCX-FTLABTOESA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409164079 560685953 /nfs/dbraw/zinc/68/59/53/560685953.db2.gz CEWQOAQJWBYQCX-SEDUGSJDSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000409164113 558987708 /nfs/dbraw/zinc/98/77/08/558987708.db2.gz CNVZCLZYBYIMIE-FMTVUPSXSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000409164114 560685974 /nfs/dbraw/zinc/68/59/74/560685974.db2.gz CNVZCLZYBYIMIE-SOZUMNATSA-N 0 0 408.712 6.260 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@H]21 ZINC000409164198 560685986 /nfs/dbraw/zinc/68/59/86/560685986.db2.gz DXFUYDXCGNHHQC-JKDFXYPNSA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@@H]21 ZINC000409164199 558987754 /nfs/dbraw/zinc/98/77/54/558987754.db2.gz DXFUYDXCGNHHQC-PEBVRCNWSA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@H]21 ZINC000409164200 558987733 /nfs/dbraw/zinc/98/77/33/558987733.db2.gz DXFUYDXCGNHHQC-PRXAMGSTSA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@@H]21 ZINC000409164201 558987762 /nfs/dbraw/zinc/98/77/62/558987762.db2.gz DXFUYDXCGNHHQC-QFSBIZTOSA-N 0 0 423.123 6.177 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(F)cc1)[C@@H]1CC=C[C@@H]21 ZINC000409164942 558988266 /nfs/dbraw/zinc/98/82/66/558988266.db2.gz PZQJZNKBJDNAGV-JQYIIUTOSA-N 0 0 401.550 7.253 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1ccc(F)cc1)[C@H]1CC=C[C@@H]21 ZINC000409164943 558988182 /nfs/dbraw/zinc/98/81/82/558988182.db2.gz PZQJZNKBJDNAGV-MVERNJQCSA-N 0 0 401.550 7.253 40 10 HKCBRN COc1cccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@@H]3C=CC[C@@H]32)c1OC ZINC000409164961 558988010 /nfs/dbraw/zinc/98/80/10/558988010.db2.gz QFPSIJRLMMMUTL-FTLABTOESA-N 0 0 409.835 6.203 40 10 HKCBRN COc1cccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@@H]3C=CC[C@H]32)c1OC ZINC000409164962 560686098 /nfs/dbraw/zinc/68/60/98/560686098.db2.gz QFPSIJRLMMMUTL-SEDUGSJDSA-N 0 0 409.835 6.203 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000409165010 558988277 /nfs/dbraw/zinc/98/82/77/558988277.db2.gz QYQDBLQEXUUZBO-MSYCTHLASA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000409165011 558988483 /nfs/dbraw/zinc/98/84/83/558988483.db2.gz QYQDBLQEXUUZBO-PWHSHALESA-N 0 0 402.881 6.742 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@@H]21 ZINC000409165056 558988471 /nfs/dbraw/zinc/98/84/71/558988471.db2.gz RUNARRDHWQJIEK-FMTVUPSXSA-N 0 0 401.260 5.192 40 10 HKCBRN COc1ccc([N+](=O)[O-])c2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@@H]21 ZINC000409165057 558988449 /nfs/dbraw/zinc/98/84/49/558988449.db2.gz RUNARRDHWQJIEK-SOZUMNATSA-N 0 0 401.260 5.192 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Br)cc1)N2 ZINC000409165434 558988395 /nfs/dbraw/zinc/98/83/95/558988395.db2.gz YFKQICZOLVNGRJ-PBFPGSCMSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000409165435 558988437 /nfs/dbraw/zinc/98/84/37/558988437.db2.gz YFKQICZOLVNGRJ-XNJGSVPQSA-N 0 0 405.679 5.837 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409165524 560686107 /nfs/dbraw/zinc/68/61/07/560686107.db2.gz ZCVZWMXVUVFYIZ-AGKHESDQSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@H]21 ZINC000409165525 558988562 /nfs/dbraw/zinc/98/85/62/558988562.db2.gz ZCVZWMXVUVFYIZ-DINDLPBHSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@@H]21 ZINC000409165526 558988611 /nfs/dbraw/zinc/98/86/11/558988611.db2.gz ZCVZWMXVUVFYIZ-RLFDGXBXSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@H]21 ZINC000409165527 558988574 /nfs/dbraw/zinc/98/85/74/558988574.db2.gz ZCVZWMXVUVFYIZ-RVPKQNPDSA-N 0 0 413.117 6.722 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@H]32)c1 ZINC000409165537 558988559 /nfs/dbraw/zinc/98/85/59/558988559.db2.gz ZGACXMVNYWOSNO-MFSJNOQSSA-N 0 0 402.881 6.742 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409165538 560686103 /nfs/dbraw/zinc/68/61/03/560686103.db2.gz ZGACXMVNYWOSNO-VAXXYWNWSA-N 0 0 402.881 6.742 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409166080 560686162 /nfs/dbraw/zinc/68/61/62/560686162.db2.gz CJINKZMNJHBIAR-GUXCAODWSA-N 0 0 405.891 7.483 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)ccc(C(F)(F)F)c3[C@@H]3C=CC[C@H]32)cc1 ZINC000409166085 558988583 /nfs/dbraw/zinc/98/85/83/558988583.db2.gz CJINKZMNJHBIAR-QINHECLXSA-N 0 0 405.891 7.483 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@@H]1CC=C[C@H]21 ZINC000409166864 560686165 /nfs/dbraw/zinc/68/61/65/560686165.db2.gz GWTUXWUFKLTHHX-JKDFXYPNSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@@H]21 ZINC000409166868 558989110 /nfs/dbraw/zinc/98/91/10/558989110.db2.gz GWTUXWUFKLTHHX-PEBVRCNWSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@H]21 ZINC000409166872 560686305 /nfs/dbraw/zinc/68/63/05/560686305.db2.gz GWTUXWUFKLTHHX-PRXAMGSTSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409166875 558989140 /nfs/dbraw/zinc/98/91/40/558989140.db2.gz GWTUXWUFKLTHHX-QFSBIZTOSA-N 0 0 413.117 6.722 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000409167577 560686319 /nfs/dbraw/zinc/68/63/19/560686319.db2.gz JGGXCQPVTJRDFE-AGKHESDQSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000409167580 560686332 /nfs/dbraw/zinc/68/63/32/560686332.db2.gz JGGXCQPVTJRDFE-CZIZLABSSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000409167584 560686327 /nfs/dbraw/zinc/68/63/27/560686327.db2.gz JGGXCQPVTJRDFE-RLFDGXBXSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000409167588 560686325 /nfs/dbraw/zinc/68/63/25/560686325.db2.gz JGGXCQPVTJRDFE-VGTOOOLASA-N 0 0 418.673 7.492 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@@H]2C=CC[C@@H]21 ZINC000409167670 560686362 /nfs/dbraw/zinc/68/63/62/560686362.db2.gz JGTGNIASKOASRP-BWACUDIHSA-N 0 0 405.133 6.038 40 10 HKCBRN Brc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@@H]2C=CC[C@H]21 ZINC000409167673 560686323 /nfs/dbraw/zinc/68/63/23/560686323.db2.gz JGTGNIASKOASRP-PSTGCABASA-N 0 0 405.133 6.038 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000409169003 558989269 /nfs/dbraw/zinc/98/92/69/558989269.db2.gz OQCGFTDIWBNWSH-JQYIIUTOSA-N 0 0 418.005 7.767 40 10 HKCBRN Cc1cc(CSc2ccccc2)cc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000409169005 558989293 /nfs/dbraw/zinc/98/92/93/558989293.db2.gz OQCGFTDIWBNWSH-MVERNJQCSA-N 0 0 418.005 7.767 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409169519 558990155 /nfs/dbraw/zinc/99/01/55/558990155.db2.gz RJMQTSXJQCSXGU-GIWBLDEGSA-N 0 0 402.335 6.943 40 10 HKCBRN Brc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@H]32)c1 ZINC000409169520 558990069 /nfs/dbraw/zinc/99/00/69/558990069.db2.gz RJMQTSXJQCSXGU-XPNTWCBSSA-N 0 0 402.335 6.943 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000409169583 560685609 /nfs/dbraw/zinc/68/56/09/560685609.db2.gz QBUFDABLMSWIOI-BWACUDIHSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000409169585 560685642 /nfs/dbraw/zinc/68/56/42/560685642.db2.gz QBUFDABLMSWIOI-NVGCLXPQSA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000409169588 560685632 /nfs/dbraw/zinc/68/56/32/560685632.db2.gz QBUFDABLMSWIOI-PSTGCABASA-N 0 0 413.117 6.722 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CC=C[C@H]21 ZINC000409169590 560685598 /nfs/dbraw/zinc/68/55/98/560685598.db2.gz QBUFDABLMSWIOI-XWCIJXRUSA-N 0 0 413.117 6.722 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Br)cc1)N2 ZINC000409170219 558990681 /nfs/dbraw/zinc/99/06/81/558990681.db2.gz UFJNMVQIFMKMES-CKEIUWERSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000409170221 558990679 /nfs/dbraw/zinc/99/06/79/558990679.db2.gz UFJNMVQIFMKMES-CPUCHLNUSA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Br)cc1)N2 ZINC000409170223 558990731 /nfs/dbraw/zinc/99/07/31/558990731.db2.gz UFJNMVQIFMKMES-JKIFEVAISA-N 0 0 405.679 5.837 40 10 HKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000409170227 558990695 /nfs/dbraw/zinc/99/06/95/558990695.db2.gz UFJNMVQIFMKMES-KEYYUXOJSA-N 0 0 405.679 5.837 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000409171229 558991749 /nfs/dbraw/zinc/99/17/49/558991749.db2.gz ZMOZBVJLWCHRFR-GPHJXTMHSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000409171231 558991727 /nfs/dbraw/zinc/99/17/27/558991727.db2.gz ZMOZBVJLWCHRFR-KEYDSSBGSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000409171233 558991784 /nfs/dbraw/zinc/99/17/84/558991784.db2.gz ZMOZBVJLWCHRFR-VHCOLVSPSA-N 0 0 418.673 7.492 40 10 HKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000409171235 558991765 /nfs/dbraw/zinc/99/17/65/558991765.db2.gz ZMOZBVJLWCHRFR-YHTYYEMMSA-N 0 0 418.673 7.492 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(F)cc(Br)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409172523 558993327 /nfs/dbraw/zinc/99/33/27/558993327.db2.gz JUTZAAZQBCHKAF-BWACUDIHSA-N 0 0 423.669 5.976 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(F)cc(Br)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000409172524 558993284 /nfs/dbraw/zinc/99/32/84/558993284.db2.gz JUTZAAZQBCHKAF-NVGCLXPQSA-N 0 0 423.669 5.976 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(F)cc(Br)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409172525 558993340 /nfs/dbraw/zinc/99/33/40/558993340.db2.gz JUTZAAZQBCHKAF-PSTGCABASA-N 0 0 423.669 5.976 40 10 HKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(F)cc(Br)cc3[C@H]3C=CC[C@H]32)c1 ZINC000409172526 558993352 /nfs/dbraw/zinc/99/33/52/558993352.db2.gz JUTZAAZQBCHKAF-XWCIJXRUSA-N 0 0 423.669 5.976 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@@H]21 ZINC000409174511 560686990 /nfs/dbraw/zinc/68/69/90/560686990.db2.gz MYYGPQWNURWQIX-CKEIUWERSA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@H]21 ZINC000409174512 560686984 /nfs/dbraw/zinc/68/69/84/560686984.db2.gz MYYGPQWNURWQIX-GRDNDAEWSA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@H]21 ZINC000409174513 560686999 /nfs/dbraw/zinc/68/69/99/560686999.db2.gz MYYGPQWNURWQIX-JJRVBVJISA-N 0 0 423.123 6.177 40 10 HKCBRN Fc1cc(Br)cc2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@@H]21 ZINC000409174514 560686991 /nfs/dbraw/zinc/68/69/91/560686991.db2.gz MYYGPQWNURWQIX-JKIFEVAISA-N 0 0 423.123 6.177 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(F)cc(Br)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409175794 560687106 /nfs/dbraw/zinc/68/71/06/560687106.db2.gz VAEWKPNFAOVJIQ-HLIPFELVSA-N 0 0 400.335 6.712 40 10 HKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(F)cc(Br)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409175795 558997266 /nfs/dbraw/zinc/99/72/66/558997266.db2.gz VAEWKPNFAOVJIQ-UWVAXJGDSA-N 0 0 400.335 6.712 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000409176050 558997848 /nfs/dbraw/zinc/99/78/48/558997848.db2.gz XOQFLVXELCSIFR-DDBGAENHSA-N 0 0 408.712 6.260 40 10 HKCBRN COC(=O)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000409176051 558997840 /nfs/dbraw/zinc/99/78/40/558997840.db2.gz XOQFLVXELCSIFR-YRUZYCQGSA-N 0 0 408.712 6.260 40 10 HKCBRN CC(C)Oc1ccc(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1 ZINC000409177051 560687277 /nfs/dbraw/zinc/68/72/77/560687277.db2.gz BTNQITPZLFTSQI-MFOYZWKCSA-N 0 0 407.919 5.672 40 10 HKCBRN O=C1/C(=C\c2ccc(O)c(Cl)c2)SC(=S)N1c1ccc(F)c(Cl)c1 ZINC000409177222 558999097 /nfs/dbraw/zinc/99/90/97/558999097.db2.gz DYFQHTQMWJHJLD-MKMNVTDBSA-N 0 0 400.283 5.244 40 10 HKCBRN Cc1c(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)c2ccccc2n1C ZINC000409178663 558999752 /nfs/dbraw/zinc/99/97/52/558999752.db2.gz MMMJSUPDLWXTBV-ZDLGFXPLSA-N 0 0 416.930 5.685 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1 ZINC000409178854 558999927 /nfs/dbraw/zinc/99/99/27/558999927.db2.gz NSLJTYWCXSXSHG-HIPMGEKLSA-N 0 0 421.946 6.062 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1 ZINC000409178856 558999945 /nfs/dbraw/zinc/99/99/45/558999945.db2.gz NSLJTYWCXSXSHG-XACIZNRCSA-N 0 0 421.946 6.062 40 10 HKCBRN O=C1/C(=C/c2ccc(C(F)(F)F)cc2)SC(=S)N1c1ccc(F)c(Cl)c1 ZINC000409179199 559000124 /nfs/dbraw/zinc/00/01/24/559000124.db2.gz KUGBYZFPXICNQQ-AUWJEWJLSA-N 0 0 417.836 5.904 40 10 HKCBRN CCn1cc(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)c2ccccc21 ZINC000409181290 559009985 /nfs/dbraw/zinc/00/99/85/559009985.db2.gz AQKKIMDHFGFTDC-NVMNQCDNSA-N 0 0 416.930 5.860 40 10 HKCBRN CCOc1c(/C=C2/SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cccc1OC ZINC000409181487 560688495 /nfs/dbraw/zinc/68/84/95/560688495.db2.gz BQFDETLCJBIRJL-CXUHLZMHSA-N 0 0 423.918 5.292 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(c4ccc(F)c(Cl)c4)C3=O)c[nH]c21 ZINC000409181853 559011078 /nfs/dbraw/zinc/01/10/78/559011078.db2.gz FZPQTLBETWPUDN-IUXPMGMMSA-N 0 0 416.930 5.929 40 10 HKCBRN CC(C)COc1ccc(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1 ZINC000409182237 559011063 /nfs/dbraw/zinc/01/10/63/559011063.db2.gz JUPVQTTWIUAJBD-NVMNQCDNSA-N 0 0 421.946 5.920 40 10 HKCBRN CCCCOc1ccc(/C=C2\SC(=S)N(c3ccc(F)c(Cl)c3)C2=O)cc1 ZINC000409182613 560688518 /nfs/dbraw/zinc/68/85/18/560688518.db2.gz NEWGWDXHJKFCIN-WQRHYEAKSA-N 0 0 421.946 6.064 40 10 HKCBRN COc1cc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc(Br)c1OC ZINC000409184848 560688927 /nfs/dbraw/zinc/68/89/27/560688927.db2.gz OLJIRWFMBPEWOK-TYILLQQXSA-N 0 0 420.734 5.946 40 10 HKCBRN COc1cc(N2CCCC2)ccc1/C=C1/SC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000409188159 560688159 /nfs/dbraw/zinc/68/81/59/560688159.db2.gz BMHZACVHQITQIY-XDHOZWIPSA-N 0 0 414.914 5.190 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(C)cn1 ZINC000409188624 559014474 /nfs/dbraw/zinc/01/44/74/559014474.db2.gz IEIPBNBQGOCNMI-YBFXNURJSA-N 0 0 423.925 5.692 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1cc(C)ccn1 ZINC000409189190 560690990 /nfs/dbraw/zinc/69/09/90/560690990.db2.gz FEFPWARGFSDAJB-XDHOZWIPSA-N 0 0 423.925 5.692 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000409189554 560690981 /nfs/dbraw/zinc/69/09/81/560690981.db2.gz HTVBGCUTFVLJDX-UDWIEESQSA-N 0 0 424.909 5.694 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)c(F)c2)C(=O)N1c1ccc(Cl)cc1 ZINC000409189904 559014711 /nfs/dbraw/zinc/01/47/11/559014711.db2.gz KIGNCEZVJZSXEU-LDADJPATSA-N 0 0 402.878 5.320 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)cc2F)C(=O)N1c1ccc(Cl)cc1 ZINC000409191058 560689228 /nfs/dbraw/zinc/68/92/28/560689228.db2.gz RVBKUFPEVCBXRU-XDHOZWIPSA-N 0 0 416.905 5.710 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)c(F)c2)C(=O)N1c1ccc(Cl)cc1 ZINC000409192615 560689654 /nfs/dbraw/zinc/68/96/54/560689654.db2.gz FKVXYYMNNQVONA-CPNJWEJPSA-N 0 0 416.905 5.710 40 10 HKCBRN Cc1cc(N2CCCCC2)ccc1/C=C1/SC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000409192619 560689636 /nfs/dbraw/zinc/68/96/36/560689636.db2.gz CWSNNFCLPBSIKA-XSFVSMFZSA-N 0 0 412.942 5.880 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccn1 ZINC000409192951 559014834 /nfs/dbraw/zinc/01/48/34/559014834.db2.gz HNOVCELXJQUGHP-LDADJPATSA-N 0 0 409.898 5.383 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc([N+](=O)[O-])cc3C)c2C)c2ccccc21 ZINC000409193589 559015125 /nfs/dbraw/zinc/01/51/25/559015125.db2.gz HINDHRNEHFVEHT-KGENOOAVSA-N 0 0 401.466 5.218 40 10 HKCBRN CN1C(=O)/C(=C/c2cn(CCOc3ccc(F)cc3)c3ccccc23)c2ccccc21 ZINC000409193595 560689890 /nfs/dbraw/zinc/68/98/90/560689890.db2.gz HKQGBTVWZBGDNS-XQNSMLJCSA-N 0 0 412.464 5.376 40 10 HKCBRN Cc1cc(/C=C2\c3ccccc3N(C)C2=O)c(C)n1-c1ccc(Br)cc1 ZINC000409194283 560690051 /nfs/dbraw/zinc/69/00/51/560690051.db2.gz JKUCEAAVMFPGKG-DEDYPNTBSA-N 0 0 407.311 5.374 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S ZINC000409194485 560690009 /nfs/dbraw/zinc/69/00/09/560690009.db2.gz MFQCDRBNVAFZNL-KGENOOAVSA-N 0 0 420.559 5.221 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)SC1=S ZINC000409194772 559015401 /nfs/dbraw/zinc/01/54/01/559015401.db2.gz MDPZFKRZJSLNNK-WOJGMQOQSA-N 0 0 414.939 5.556 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2cc(C)n(-c3ccccc3)c2C)SC1=S ZINC000409195078 560690089 /nfs/dbraw/zinc/69/00/89/560690089.db2.gz PCDGDLSNSYYEIU-DEDYPNTBSA-N 0 0 407.564 5.050 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)cc2F)C(=O)N1c1ccc(Cl)cc1 ZINC000409195289 560690247 /nfs/dbraw/zinc/69/02/47/560690247.db2.gz TYGMUCPVGOUYLT-WOJGMQOQSA-N 0 0 402.878 5.320 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2c3ccccc3cc3ccccc32)SC1=S ZINC000409195584 560690240 /nfs/dbraw/zinc/69/02/40/560690240.db2.gz JHLOPPMOUMANCD-HYARGMPZSA-N 0 0 414.555 5.949 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccc1 ZINC000409195995 560690354 /nfs/dbraw/zinc/69/03/54/560690354.db2.gz YAAJDLMQTOARNJ-MOSHPQCFSA-N 0 0 408.910 5.988 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C/c2ccc(Sc3ccccc3)o2)SC1=S ZINC000409196268 559015554 /nfs/dbraw/zinc/01/55/54/559015554.db2.gz VDCGDDJIFDWAPZ-ATVHPVEESA-N 0 0 412.561 5.387 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(n4c(C)ccc4C)C3=O)o2)cc1 ZINC000409196599 559015310 /nfs/dbraw/zinc/01/53/10/559015310.db2.gz WOXSVBXTZJQYGX-UDWIEESQSA-N 0 0 422.531 5.105 40 10 HKCBRN Cc1cc(/C=C2\c3ccccc3N(c3ccccc3)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000409196705 559015320 /nfs/dbraw/zinc/01/53/20/559015320.db2.gz YSFBNGZVYDJUNI-KOEQRZSOSA-N 0 0 424.931 6.966 40 10 HKCBRN CCN1C(=O)/C(=C/c2cn(CCOc3ccccc3C)c3ccccc23)c2ccccc21 ZINC000409197405 559016406 /nfs/dbraw/zinc/01/64/06/559016406.db2.gz DSSGZCHFGJFQMY-HKOYGPOVSA-N 0 0 422.528 5.936 40 10 HKCBRN CCN1C(=O)/C(=C/c2cn(Cc3ccccc3Cl)c3ccccc23)c2ccccc21 ZINC000409197461 559016397 /nfs/dbraw/zinc/01/63/97/559016397.db2.gz FZKVZPPPPRVHAQ-PXLXIMEGSA-N 0 0 412.920 6.250 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1\SC(=S)N(n2c(C)ccc2C)C1=O ZINC000409197548 559016417 /nfs/dbraw/zinc/01/64/17/559016417.db2.gz ILXDDYZUWBKYQG-STZFKDTASA-N 0 0 422.575 5.584 40 10 HKCBRN CCOC(=O)c1ccc(-n2c(C)cc(/C=C3\c4ccccc4N(CC)C3=O)c2C)cc1 ZINC000409197813 559015520 /nfs/dbraw/zinc/01/55/20/559015520.db2.gz PLDZNQKDTLTRRL-XQNSMLJCSA-N 0 0 414.505 5.178 40 10 HKCBRN CN1C(=O)/C(=C\c2cn(Cc3cccc4ccccc43)c3ccccc23)c2ccccc21 ZINC000409197903 560690796 /nfs/dbraw/zinc/69/07/96/560690796.db2.gz RQNZORDYHGTEAZ-YZSQISJMSA-N 0 0 414.508 6.360 40 10 HKCBRN CCOc1ccccc1/C=C1/SC(=S)N(c2cccc(Br)c2)C1=O ZINC000409198076 560690860 /nfs/dbraw/zinc/69/08/60/560690860.db2.gz WMBJKPKOYCZNRY-MHWRWJLKSA-N 0 0 420.353 5.254 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2c(OC(C)C)ccc3ccccc32)SC1=S ZINC000409198112 559015887 /nfs/dbraw/zinc/01/58/87/559015887.db2.gz XIBOUUBQOBYLAV-FYJGNVAPSA-N 0 0 422.575 5.583 40 10 HKCBRN Cc1ccc(OCCn2cc(/C=C3\c4ccccc4N(C)C3=O)c3ccccc32)cc1 ZINC000409198626 559016756 /nfs/dbraw/zinc/01/67/56/559016756.db2.gz CJCRWTXLTZWIEL-JJIBRWJFSA-N 0 0 408.501 5.546 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3cccc(Cl)c3Cl)c2C)c2ccccc21 ZINC000409198771 559016735 /nfs/dbraw/zinc/01/67/35/559016735.db2.gz FGESCQOLYXEJPB-QGOAFFKASA-N 0 0 411.332 6.308 40 10 HKCBRN COc1ccc(Oc2ccc(-n3c(C)cc(C(=S)N4CCCCC4)c3C)cc2)cc1 ZINC000409198821 559016686 /nfs/dbraw/zinc/01/66/86/559016686.db2.gz LKGJMAXQDGGZAU-UHFFFAOYSA-N 0 0 420.578 6.056 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2cccc(Oc3ccccc3)c2)SC1=S ZINC000409198837 560691000 /nfs/dbraw/zinc/69/10/00/560691000.db2.gz LQWUIUNZGZVWSI-XSFVSMFZSA-N 0 0 406.532 5.435 40 10 HKCBRN Cc1ccc(-c2ccc(/C=C3/SC(=S)N(c4ccccc4)C3=O)o2)c([N+](=O)[O-])c1 ZINC000409199027 559016740 /nfs/dbraw/zinc/01/67/40/559016740.db2.gz AYLDVBFXGZYBCJ-XDHOZWIPSA-N 0 0 422.487 5.569 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1/SC(=S)N(n2c(C)ccc2C)C1=O ZINC000409199028 560690973 /nfs/dbraw/zinc/69/09/73/560690973.db2.gz NGURHMOGMDHCRE-DEDYPNTBSA-N 0 0 408.548 5.194 40 10 HKCBRN CCN1C(=O)/C(=C/c2cn(CCOc3ccc(C)cc3)c3ccccc23)c2ccccc21 ZINC000409199055 560689701 /nfs/dbraw/zinc/68/97/01/560689701.db2.gz NMLWBWGEBJENLU-XIEYBQDHSA-N 0 0 422.528 5.936 40 10 HKCBRN Cc1ccc(C)c(OCCn2cc(/C=C3\c4ccccc4N(C)C3=O)c3ccccc32)c1 ZINC000409200292 559016970 /nfs/dbraw/zinc/01/69/70/559016970.db2.gz RFNBWGHKNQWCKT-JJIBRWJFSA-N 0 0 422.528 5.854 40 10 HKCBRN Cc1cc(N2CCCCC2)ccc1/C=C1/SC(=O)N(c2cccc(Cl)c2)C1=O ZINC000409201271 559017227 /nfs/dbraw/zinc/01/72/27/559017227.db2.gz LBXYBEUGEFDBTF-DEDYPNTBSA-N 0 0 412.942 5.880 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)cc2F)C(=O)N1c1cccc(Cl)c1 ZINC000409201532 560693033 /nfs/dbraw/zinc/69/30/33/560693033.db2.gz MATQFVBBNZHLPZ-YBFXNURJSA-N 0 0 416.905 5.710 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S ZINC000409201621 560692991 /nfs/dbraw/zinc/69/29/91/560692991.db2.gz WWFIBNUNUFDPEM-KGENOOAVSA-N 0 0 420.559 5.221 40 10 HKCBRN CN(C)c1ccc(/C=C2\c3ccccc3N(c3ccccc3)C2=O)cc1Br ZINC000409204372 559017576 /nfs/dbraw/zinc/01/75/76/559017576.db2.gz GDCMECYNPMMKCT-XMHGGMMESA-N 0 0 419.322 5.734 40 10 HKCBRN COc1ccccc1OCCn1cc(/C=C2\c3ccccc3N(C)C2=O)c2ccccc21 ZINC000409204474 559017587 /nfs/dbraw/zinc/01/75/87/559017587.db2.gz GXAAMGNVADNDBG-OQKWZONESA-N 0 0 424.500 5.246 40 10 HKCBRN CN1C(=O)/C(=C/c2cn(CCOc3ccccc3F)c3ccccc23)c2ccccc21 ZINC000409204761 559017550 /nfs/dbraw/zinc/01/75/50/559017550.db2.gz KADQKKQFLYUDAE-LTGZKZEYSA-N 0 0 412.464 5.376 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3cccc(Br)c3)C2=O)ccc1C ZINC000409204850 559017624 /nfs/dbraw/zinc/01/76/24/559017624.db2.gz KJQFVWWZDBSGIU-CXUHLZMHSA-N 0 0 420.353 5.172 40 10 HKCBRN Cc1cc(C(=S)N2CCCCC2)c(C)n1-c1cc(C)c(Br)c(C)c1 ZINC000409204946 559017622 /nfs/dbraw/zinc/01/76/22/559017622.db2.gz DONJOSNZKSEVMX-UHFFFAOYSA-N 0 0 405.405 5.635 40 10 HKCBRN Cc1cc(/C=C2/C(=O)Nc3ccccc32)c(C)n1-c1cc(C)c(Br)c(C)c1 ZINC000409205283 560694230 /nfs/dbraw/zinc/69/42/30/560694230.db2.gz GXTPIZQWDSOZIW-UDWIEESQSA-N 0 0 421.338 5.966 40 10 HKCBRN CCN1C(=O)/C(=C/c2cn(Cc3ccc(Cl)cc3)c3ccccc23)c2ccccc21 ZINC000409205400 560694247 /nfs/dbraw/zinc/69/42/47/560694247.db2.gz CBYWLJXIMDAJKC-HZHRSRAPSA-N 0 0 412.920 6.250 40 10 HKCBRN COC(=O)c1c(C)c(C)sc1-n1c(C)cc(/C=C2/C(=O)Nc3ccccc32)c1C ZINC000409206160 559017742 /nfs/dbraw/zinc/01/77/42/559017742.db2.gz HYWVESGVIZFGMA-WOJGMQOQSA-N 0 0 406.507 5.052 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3cc(Cl)cc(Cl)c3)c2C)c2ccccc21 ZINC000409206247 559017735 /nfs/dbraw/zinc/01/77/35/559017735.db2.gz IQIJTNXDGRAHNE-UFFVCSGVSA-N 0 0 411.332 6.308 40 10 HKCBRN Cc1cc(/C=C2\c3ccccc3N(C)C2=O)c(C)n1-c1ccc(Br)c(C)c1 ZINC000409206280 560694319 /nfs/dbraw/zinc/69/43/19/560694319.db2.gz SRHNZKYVAJNXKK-DEDYPNTBSA-N 0 0 421.338 5.682 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccc(C4CCCCC4)cc3)c2C)c2ccccc21 ZINC000409206641 559017819 /nfs/dbraw/zinc/01/78/19/559017819.db2.gz ZDOGDWMBCGCZKL-ZXVVBBHZSA-N 0 0 424.588 7.049 40 10 HKCBRN COC(=O)c1c(C)c(C)sc1-n1c(C)cc(/C=C2\c3ccccc3N(C)C2=O)c1C ZINC000409206751 560691213 /nfs/dbraw/zinc/69/12/13/560691213.db2.gz XCVUVMGXVXFTHY-XDHOZWIPSA-N 0 0 420.534 5.076 40 10 HKCBRN Cc1ccc(C)n1N1C(=O)/C(=C\c2ccccc2OCc2ccccc2)SC1=S ZINC000409206830 559017835 /nfs/dbraw/zinc/01/78/35/559017835.db2.gz LWFAYCJXZMOIGR-KGENOOAVSA-N 0 0 420.559 5.221 40 10 HKCBRN COc1ccc(OCCn2cc(/C=C3\c4ccccc4N(C)C3=O)c3ccccc32)cc1 ZINC000409207050 560691160 /nfs/dbraw/zinc/69/11/60/560691160.db2.gz ZNBJDRKZQXOBAZ-JJIBRWJFSA-N 0 0 424.500 5.246 40 10 HKCBRN Cc1ccccc1OCCn1cc(/C=C2\c3ccccc3N(C)C2=O)c2ccccc21 ZINC000409207314 560691407 /nfs/dbraw/zinc/69/14/07/560691407.db2.gz VFDQMGVYAGICAU-HAVVHWLPSA-N 0 0 408.501 5.546 40 10 HKCBRN COc1cc(N2CCCC2)ccc1/C=C1/SC(=O)N(c2cccc(Cl)c2)C1=O ZINC000409207893 560691613 /nfs/dbraw/zinc/69/16/13/560691613.db2.gz CDVSYBHWORTFJG-YBFXNURJSA-N 0 0 414.914 5.190 40 10 HKCBRN CCCCCN1C(=O)S/C(=C\c2cc(C)n(-c3ccc([N+](=O)[O-])cc3)c2C)C1=O ZINC000409208379 560691863 /nfs/dbraw/zinc/69/18/63/560691863.db2.gz FOXFXCYIKZLZHO-UYRXBGFRSA-N 0 0 413.499 5.229 40 10 HKCBRN O=C1NC(=S)S/C1=C/c1cn(Cc2ccc3ccccc3c2)c2ccccc12 ZINC000409208991 559019331 /nfs/dbraw/zinc/01/93/31/559019331.db2.gz BKDSQHPUIDRMBM-CIAFOILYSA-N 0 0 400.528 5.332 40 10 HKCBRN CN1C(=O)/C(=C\c2cn(Cc3ccc4ccccc4c3)c3ccccc23)SC1=S ZINC000409209439 559019222 /nfs/dbraw/zinc/01/92/22/559019222.db2.gz BPGSYRQBDPCEHJ-LPYMAVHISA-N 0 0 414.555 5.674 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000409209540 559019343 /nfs/dbraw/zinc/01/93/43/559019343.db2.gz CGSOZCLBXCSNOM-RGVLZGJSSA-N 0 0 424.909 5.694 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(CCc3ccccc3)C2=O)c(C)n1-c1ccccc1 ZINC000409210628 559019526 /nfs/dbraw/zinc/01/95/26/559019526.db2.gz JVIZLIUUWGHOBK-CJLVFECKSA-N 0 0 402.519 5.373 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccc(C)cc1 ZINC000409210949 559020370 /nfs/dbraw/zinc/02/03/70/559020370.db2.gz LVOGSYKSNNVQIB-MTJSOVHGSA-N 0 0 422.937 6.297 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cn(CCOc3ccccc3)c3ccccc23)SC1=S ZINC000409211815 559020950 /nfs/dbraw/zinc/02/09/50/559020950.db2.gz OQRQBLXSVRVDHM-RCCKNPSSSA-N 0 0 422.575 5.332 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1cc(C)ccn1 ZINC000409212400 560695676 /nfs/dbraw/zinc/69/56/76/560695676.db2.gz LWDSQHWGXUUGKH-YBFXNURJSA-N 0 0 423.925 5.692 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)c(F)c2)C(=O)N1c1cccc(Cl)c1 ZINC000409213426 559021182 /nfs/dbraw/zinc/02/11/82/559021182.db2.gz UWWRSLLYSLBSGE-WOJGMQOQSA-N 0 0 402.878 5.320 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccc(C)cn1 ZINC000409213648 559021405 /nfs/dbraw/zinc/02/14/05/559021405.db2.gz QDHXQWZDHMIASM-VXLYETTFSA-N 0 0 423.925 5.692 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCCC3)c(F)c2)C(=O)N1c1cccc(Cl)c1 ZINC000409214811 560696696 /nfs/dbraw/zinc/69/66/96/560696696.db2.gz ZBFGMPXVPRVPHQ-XDHOZWIPSA-N 0 0 416.905 5.710 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccccn1 ZINC000409214912 559021607 /nfs/dbraw/zinc/02/16/07/559021607.db2.gz VFIJBACBVMGYGE-WOJGMQOQSA-N 0 0 409.898 5.383 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(c3cccc(Cl)c3)C2=O)c(C)n1-c1ccccc1 ZINC000409218183 559022809 /nfs/dbraw/zinc/02/28/09/559022809.db2.gz ZBXRUCDKLWEBIW-NDENLUEZSA-N 0 0 408.910 5.988 40 10 HKCBRN CCCCCN1C(=O)S/C(=C\c2cc(C)n(-c3ccc(Cl)cc3)c2C)C1=O ZINC000409218368 560697770 /nfs/dbraw/zinc/69/77/70/560697770.db2.gz IKJFGIMNUIODHV-UYRXBGFRSA-N 0 0 402.947 5.974 40 10 HKCBRN Cc1cc(C=C2SC(=O)N(CC(=O)c3ccccc3)C2=O)c(C)n1-c1ccccc1 ZINC000409218511 559022905 /nfs/dbraw/zinc/02/29/05/559022905.db2.gz JGRRQTINXORFSI-HYARGMPZSA-N 0 0 416.502 5.013 40 10 HKCBRN O=C1S/C(=C/c2ccc(N3CCCC3)cc2F)C(=O)N1c1cccc(Cl)c1 ZINC000409219420 559023076 /nfs/dbraw/zinc/02/30/76/559023076.db2.gz QIRKRHRZCFVYNL-VCHYOVAHSA-N 0 0 402.878 5.320 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1c(C)cc(C)cc1C ZINC000409220490 560698581 /nfs/dbraw/zinc/69/85/81/560698581.db2.gz AOKJTRFMYVWYLA-OEAKJJBVSA-N 0 0 413.521 5.112 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1cccc2ccccc21 ZINC000409229077 559035551 /nfs/dbraw/zinc/03/55/51/559035551.db2.gz JKMPTROQTHVAAV-LFVJCYFKSA-N 0 0 421.500 5.340 40 10 HKCBRN CCc1ccc(-n2c(C)cc(/C=C3/NC(=O)N(Cc4ccc(C)cc4)C3=O)c2C)cc1 ZINC000409229259 560698413 /nfs/dbraw/zinc/69/84/13/560698413.db2.gz MGALTMRSYYUYSJ-BUVRLJJBSA-N 0 0 413.521 5.058 40 10 HKCBRN COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3cccc(Cl)c3C)c2C)C1=O ZINC000409229301 560698411 /nfs/dbraw/zinc/69/84/11/560698411.db2.gz MWNHJKYWESJGAU-XDHOZWIPSA-N 0 0 418.946 5.129 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(Cc3cccc(C)c3)C2=O)c(C)n1-c1ccccn1 ZINC000409229764 559035839 /nfs/dbraw/zinc/03/58/39/559035839.db2.gz USYXAEHMSJYDNA-MOSHPQCFSA-N 0 0 403.507 5.034 40 10 HKCBRN Cc1c(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c2ccccc2n1Cc1ccccc1 ZINC000409230770 560700359 /nfs/dbraw/zinc/70/03/59/560700359.db2.gz GIGVSUYDIFMKIW-LFVJCYFKSA-N 0 0 421.500 5.091 40 10 HKCBRN Cc1ccc(Sc2ccc(/C=C3\SC(=S)N(c4ccccc4)C3=O)cc2)cc1 ZINC000409230946 559036311 /nfs/dbraw/zinc/03/63/11/559036311.db2.gz AFFMOPPFDHDZMB-QNGOZBTKSA-N 0 0 419.596 6.552 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1cc(Cl)ccc1C ZINC000409231063 559036330 /nfs/dbraw/zinc/03/63/30/559036330.db2.gz IADVSRLIGVQOGO-CIAFOILYSA-N 0 0 419.912 5.149 40 10 HKCBRN COc1cc(N2CCCCC2)ccc1/C=C1\SC(=O)N(Cc2cccc(C)c2)C1=O ZINC000409231096 559036314 /nfs/dbraw/zinc/03/63/14/559036314.db2.gz BKABVMZYQMEZEU-HMAPJEAMSA-N 0 0 422.550 5.230 40 10 HKCBRN CCCN1C(=O)S/C(=C/c2cc(C)n(-c3cccc(Br)c3)c2C)C1=O ZINC000409231548 559036936 /nfs/dbraw/zinc/03/69/36/559036936.db2.gz JTCBXGGKOSEABH-LICLKQGHSA-N 0 0 419.344 5.303 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1cc(C)cc(C)c1 ZINC000409234876 559049191 /nfs/dbraw/zinc/04/91/91/559049191.db2.gz NORJPJICOLQETA-ZVHZXABRSA-N 0 0 413.521 5.112 40 10 HKCBRN COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3cccc4ccccc43)c2C)C1=O ZINC000409235274 559049182 /nfs/dbraw/zinc/04/91/82/559049182.db2.gz OMOXVZPMDOIKOR-PXLXIMEGSA-N 0 0 420.534 5.320 40 10 HKCBRN COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3cc(Cl)ccc3C)c2C)C1=O ZINC000409236752 560699168 /nfs/dbraw/zinc/69/91/68/560699168.db2.gz HAMJXIWCJUFELR-YBFXNURJSA-N 0 0 418.946 5.129 40 10 HKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C\c1ccc2c(ccn2Cc2cccc(F)c2)c1 ZINC000409237113 559049932 /nfs/dbraw/zinc/04/99/32/559049932.db2.gz JBWSZZOASPPWPK-JLPGSUDCSA-N 0 0 409.464 5.635 40 10 HKCBRN CCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccccc3Br)c2C)C1=O ZINC000409238515 559049921 /nfs/dbraw/zinc/04/99/21/559049921.db2.gz DSNYNRNFZWELFL-GZTJUZNOSA-N 0 0 419.344 5.303 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000409238970 559049951 /nfs/dbraw/zinc/04/99/51/559049951.db2.gz XTCADDNDIOHCOS-FYJGNVAPSA-N 0 0 419.912 5.462 40 10 HKCBRN CCCN1C(=O)S/C(=C\c2cc(C)n(-c3ccc(Br)cc3)c2C)C1=O ZINC000409239519 559049971 /nfs/dbraw/zinc/04/99/71/559049971.db2.gz NOKQTHKVIVKUEP-BOPFTXTBSA-N 0 0 419.344 5.303 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1ccccc1Cl ZINC000409239924 559049916 /nfs/dbraw/zinc/04/99/16/559049916.db2.gz OLVGJWWJXUAUNY-FYJGNVAPSA-N 0 0 419.912 5.149 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000409240285 560699960 /nfs/dbraw/zinc/69/99/60/560699960.db2.gz PJDZIXDNRFDRHL-ZVHZXABRSA-N 0 0 413.521 5.112 40 10 HKCBRN Cc1cc(/C=C2/SC(=O)N(Cc3ccc(Cl)cc3)C2=O)c(C)n1-c1ccccn1 ZINC000409241637 559049995 /nfs/dbraw/zinc/04/99/95/559049995.db2.gz KUYJJTMTIVALCJ-XDHOZWIPSA-N 0 0 423.925 5.379 40 10 HKCBRN Cc1cc(/C=C2\NC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1ccc(Cl)cc1 ZINC000409242099 559050135 /nfs/dbraw/zinc/05/01/35/559050135.db2.gz LUSDZCZBELCJCK-XKZIYDEJSA-N 0 0 419.912 5.149 40 10 HKCBRN COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3c(C)cc(C)cc3C)c2C)C1=O ZINC000409242778 559050155 /nfs/dbraw/zinc/05/01/55/559050155.db2.gz SZOSDCYRUSTDFJ-DEDYPNTBSA-N 0 0 412.555 5.092 40 10 HKCBRN COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc4ccccc4c3)c2C)C1=O ZINC000409244140 559050176 /nfs/dbraw/zinc/05/01/76/559050176.db2.gz YLNMZXBQLAPQCG-PXLXIMEGSA-N 0 0 420.534 5.320 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(Cc3ccccc3Cl)C2=O)c(C)n1-c1ccccn1 ZINC000409244504 560701166 /nfs/dbraw/zinc/70/11/66/560701166.db2.gz DRJDWYKSYBUJNB-UNOMPAQXSA-N 0 0 423.925 5.379 40 10 HKCBRN COc1cc(N2CCCCC2)ccc1/C=C1\SC(=S)N(c2ccccc2)C1=O ZINC000409245634 559050263 /nfs/dbraw/zinc/05/02/63/559050263.db2.gz WUCGHJCWPCXBHH-ZHZULCJRSA-N 0 0 410.564 5.091 40 10 HKCBRN COc1cc(N2CCCCC2)ccc1/C=C1\SC(=O)N(Cc2ccc(C)cc2)C1=O ZINC000409245761 559050270 /nfs/dbraw/zinc/05/02/70/559050270.db2.gz YUSAFCCPQLMHMJ-HMAPJEAMSA-N 0 0 422.550 5.230 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1cccc(Cl)c1C ZINC000409246516 560701515 /nfs/dbraw/zinc/70/15/15/560701515.db2.gz CEODMGMCPMNJEM-FYJGNVAPSA-N 0 0 419.912 5.149 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1c(C)cccc1C ZINC000409247400 560701790 /nfs/dbraw/zinc/70/17/90/560701790.db2.gz HBDSIHCRVXEWAY-OEAKJJBVSA-N 0 0 413.521 5.112 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(C)c(C)c1 ZINC000409247585 559050347 /nfs/dbraw/zinc/05/03/47/559050347.db2.gz DKRHBQPUIYOWAO-LPYMAVHISA-N 0 0 419.912 5.462 40 10 HKCBRN COCCCN1C(=O)S/C(=C/c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)C1=O ZINC000409249159 560702032 /nfs/dbraw/zinc/70/20/32/560702032.db2.gz MSTLRMQFSSDANH-KGENOOAVSA-N 0 0 412.555 5.290 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1ccc(C)cc1C ZINC000409249635 559050408 /nfs/dbraw/zinc/05/04/08/559050408.db2.gz NSINDGBOSKWHDL-OEAKJJBVSA-N 0 0 413.521 5.112 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccccc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 ZINC000409249766 559050370 /nfs/dbraw/zinc/05/03/70/559050370.db2.gz OMXKLSOVAYLNAN-BUVRLJJBSA-N 0 0 413.521 5.310 40 10 HKCBRN Cc1cc(/C=C2\SC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1ccccn1 ZINC000409250826 560702204 /nfs/dbraw/zinc/70/22/04/560702204.db2.gz OCWPBGMTPBRXDD-MOSHPQCFSA-N 0 0 403.507 5.034 40 10 HKCBRN Cc1cc(/C=C2/NC(=O)N(Cc3ccc(C)cc3)C2=O)c(C)n1-c1cccc(C)c1C ZINC000409255120 559050607 /nfs/dbraw/zinc/05/06/07/559050607.db2.gz YADXNEIVJPMUTM-OEAKJJBVSA-N 0 0 413.521 5.112 40 10 HKCBRN O=C1C=CC(=NNc2cccc(C(F)(F)F)c2)C=C1c1nc2ccccc2c(=O)[nH]1 ZINC000409258415 559050627 /nfs/dbraw/zinc/05/06/27/559050627.db2.gz XMBMRPNWYIUDRN-DQSJHHFOSA-N 0 0 410.355 6.142 40 10 HKCBRN O=C1C=CC(=NNc2ccc(Cl)cc2Cl)C=C1c1nc2ccccc2c(=O)[nH]1 ZINC000409265029 559049836 /nfs/dbraw/zinc/04/98/36/559049836.db2.gz NJSFSXVTXASSTQ-QPLCGJKRSA-N 0 0 411.248 6.430 40 10 HKCBRN O=C1C=CC(=NNc2ccc(Cl)cc2Cl)C=C1c1nc2ccccc2s1 ZINC000409266870 559050642 /nfs/dbraw/zinc/05/06/42/559050642.db2.gz YTXIEHTYNLQAMY-VHXPQNKSSA-N 0 0 400.290 7.391 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(F)c(Cl)c2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000409315175 559059582 /nfs/dbraw/zinc/05/95/82/559059582.db2.gz NMOYMMOZPAVGDQ-UNOMPAQXSA-N 0 0 421.855 5.510 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccccc2OCc2ccccc2Cl)SC1=S ZINC000409326324 559060870 /nfs/dbraw/zinc/06/08/70/559060870.db2.gz AFMRXGHDZKKZHS-PDGQHHTCSA-N 0 0 403.956 5.530 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)ccc1OCC(C)C ZINC000409326329 560710912 /nfs/dbraw/zinc/71/09/12/560710912.db2.gz AIJVEWVUDQSVHC-XDHOZWIPSA-N 0 0 405.585 5.264 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)cc1OC ZINC000409326344 559060816 /nfs/dbraw/zinc/06/08/16/559060816.db2.gz APFQXUVIQMPNIC-STZFKDTASA-N 0 0 421.543 5.653 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(c4ccccc4F)C3=O)o2)cc1 ZINC000409326364 560710902 /nfs/dbraw/zinc/71/09/02/560710902.db2.gz AYJUNXGSUJNJHB-NDENLUEZSA-N 0 0 423.490 5.694 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)cc(Cl)c1O ZINC000409326433 560710917 /nfs/dbraw/zinc/71/09/17/560710917.db2.gz BSFKSAGZPMVJCG-CXUHLZMHSA-N 0 0 405.928 5.077 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(c2cccc(F)c2)C1=O ZINC000409326648 559060838 /nfs/dbraw/zinc/06/08/38/559060838.db2.gz CYXQYTMJDJVICX-KGENOOAVSA-N 0 0 423.534 6.174 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)cc1OC ZINC000409326668 560709596 /nfs/dbraw/zinc/70/95/96/560709596.db2.gz DCVXZRJIGJAFON-DEDYPNTBSA-N 0 0 413.564 5.507 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 ZINC000409326714 559060804 /nfs/dbraw/zinc/06/08/04/559060804.db2.gz DTYHIYIHZPYRFY-QGOAFFKASA-N 0 0 414.508 5.180 40 10 HKCBRN O=C1/C(=C\c2cccc(Cl)c2Cl)SC(=S)N1c1ccc2c(c1)OCO2 ZINC000409326883 560709608 /nfs/dbraw/zinc/70/96/08/560709608.db2.gz FWZUAYKURIGANK-MKMNVTDBSA-N 0 0 410.303 5.128 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3c(C)n(C)c4ccccc34)SC2=S)cc1 ZINC000409327123 560709569 /nfs/dbraw/zinc/70/95/69/560709569.db2.gz IFUMWZYDAXZVIW-MOSHPQCFSA-N 0 0 408.548 5.291 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccccc2F)C1=O ZINC000409327323 560709562 /nfs/dbraw/zinc/70/95/62/560709562.db2.gz JCRYVGVYHAFRFA-MOSHPQCFSA-N 0 0 409.507 5.783 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(C3CCCCC3)C2=O)ccc1OC(C)C ZINC000409327346 560709619 /nfs/dbraw/zinc/70/96/19/560709619.db2.gz JEMJUOOELZOVFH-UYRXBGFRSA-N 0 0 405.585 5.406 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3cccc(Cl)c3Cl)SC2=S)c1 ZINC000409327500 559060836 /nfs/dbraw/zinc/06/08/36/559060836.db2.gz KGHWQQFKLFUMPY-RIYZIHGNSA-N 0 0 412.388 6.121 40 10 HKCBRN CCCOc1ccc(/C=C2\SC(=S)N(c3ccc(C)c(C)c3)C2=O)cc1OC ZINC000409327577 559060864 /nfs/dbraw/zinc/06/08/64/559060864.db2.gz KXFDLFYFXHGRKJ-MOSHPQCFSA-N 0 0 413.564 5.507 40 10 HKCBRN CCCN1C(=O)/C(=C/c2c(OCc3ccccc3)ccc3ccccc32)SC1=S ZINC000409327608 559060901 /nfs/dbraw/zinc/06/09/01/559060901.db2.gz LLWKFZDQPLTXDM-JCMHNJIXSA-N 0 0 419.571 6.030 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3ccc(O[C@@H](C)CC)cc3)SC2=S)cc1 ZINC000409327736 559060900 /nfs/dbraw/zinc/06/09/00/559060900.db2.gz MDUFLSUYUBLIAM-CPOQMQJTSA-N 0 0 413.564 5.668 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3ccc(O[C@H](C)CC)cc3)SC2=S)cc1 ZINC000409327737 559060884 /nfs/dbraw/zinc/06/08/84/559060884.db2.gz MDUFLSUYUBLIAM-KWPCUBQOSA-N 0 0 413.564 5.668 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)cc1OCC ZINC000409327805 560709747 /nfs/dbraw/zinc/70/97/47/560709747.db2.gz NFMRZAYJBANGHM-XDHOZWIPSA-N 0 0 417.527 5.419 40 10 HKCBRN CCOc1ccccc1/C=C1\SC(=S)N(c2ccc(Cl)cc2Cl)C1=O ZINC000409327976 559060902 /nfs/dbraw/zinc/06/09/02/559060902.db2.gz OOGPRPKDXIXSSH-SXGWCWSVSA-N 0 0 410.347 5.798 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2cccc(F)c2)C1=O ZINC000409328005 560709738 /nfs/dbraw/zinc/70/97/38/560709738.db2.gz PAQKZRLFQKFGLR-MOSHPQCFSA-N 0 0 409.507 5.783 40 10 HKCBRN CCCOc1ccc(/C=C2\SC(=S)N(c3cccc(SC)c3)C2=O)cc1 ZINC000409328260 560709775 /nfs/dbraw/zinc/70/97/75/560709775.db2.gz QVEWECCFDOWEMR-PDGQHHTCSA-N 0 0 401.578 5.603 40 10 HKCBRN CCn1cc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)c2ccccc21 ZINC000409328386 559060879 /nfs/dbraw/zinc/06/08/79/559060879.db2.gz UDFQDRXPIIPBCG-HYARGMPZSA-N 0 0 414.555 6.220 40 10 HKCBRN Cc1ccccc1/C=C1/SC(=S)N(c2ccc(Br)c(Cl)c2)C1=O ZINC000409328406 560709797 /nfs/dbraw/zinc/70/97/97/560709797.db2.gz UNRFFZBDDOMHOG-OVCLIPMQSA-N 0 0 424.772 5.817 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000409328416 559060896 /nfs/dbraw/zinc/06/08/96/559060896.db2.gz UVGSKHDCOJRIRV-FHXOWUIVSA-N 0 0 414.508 5.178 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000409328417 560709812 /nfs/dbraw/zinc/70/98/12/560709812.db2.gz UVGSKHDCOJRIRV-VBEHJTROSA-N 0 0 414.508 5.178 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccc(C)cc2)C1=O ZINC000409328487 559060833 /nfs/dbraw/zinc/06/08/33/559060833.db2.gz WFFUFGRAYDCVSZ-PXLXIMEGSA-N 0 0 419.571 6.343 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)c1 ZINC000409328565 560709806 /nfs/dbraw/zinc/70/98/06/560709806.db2.gz XSBPQQURSDBQHI-NVNXTCNLSA-N 0 0 422.940 5.376 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)cc1OC ZINC000409328581 560709926 /nfs/dbraw/zinc/70/99/26/560709926.db2.gz XXTHVVSIRQRTRJ-WOJGMQOQSA-N 0 0 403.500 5.029 40 10 HKCBRN O=C1/C(=C/c2ccc(N3CCCC3)cc2)SC(=S)N1c1cccc2ccccc21 ZINC000409328598 559060810 /nfs/dbraw/zinc/06/08/10/559060810.db2.gz YJGYLRPQCGAFAJ-JWGURIENSA-N 0 0 416.571 5.846 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(-c3cc(C)c(C)cc3[N+](=O)[O-])o2)SC1=S ZINC000409328609 559060848 /nfs/dbraw/zinc/06/08/48/559060848.db2.gz YREAEEROKSCLAI-LICLKQGHSA-N 0 0 402.497 5.083 40 10 HKCBRN O=C1/C(=C/c2ccc(O)c(Cl)c2)SC(=S)N1c1cccc(C(F)(F)F)c1 ZINC000409328622 560709945 /nfs/dbraw/zinc/70/99/45/560709945.db2.gz ZAZIGWNLWCQTFT-AUWJEWJLSA-N 0 0 415.845 5.470 40 10 HKCBRN CCc1cccc2c(/C=C3/SC(=S)N(c4ccc([N+](=O)[O-])cc4)C3=O)c[nH]c21 ZINC000409328638 559060850 /nfs/dbraw/zinc/06/08/50/559060850.db2.gz ZFOKZBUEHYRIHJ-LICLKQGHSA-N 0 0 409.492 5.044 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(F)c(Br)c3)SC2=S)cc1 ZINC000409328667 560709878 /nfs/dbraw/zinc/70/98/78/560709878.db2.gz ZQXVWKBHWTXXDO-DHDCSXOGSA-N 0 0 408.317 5.302 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc(Cl)c1O ZINC000409328668 559060825 /nfs/dbraw/zinc/06/08/25/559060825.db2.gz ZRBGSKZMEJPCTF-RIYZIHGNSA-N 0 0 412.319 5.113 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3c(Cl)cccc3Cl)SC2=S)c1 ZINC000409328754 560709896 /nfs/dbraw/zinc/70/98/96/560709896.db2.gz ATDNUDJUPJKXSM-OQLLNIDSSA-N 0 0 412.388 6.121 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)ccc1C ZINC000409328762 559060971 /nfs/dbraw/zinc/06/09/71/559060971.db2.gz AMMMWUPUYWZEQM-SXGWCWSVSA-N 0 0 409.454 5.428 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)cc1 ZINC000409328849 560709898 /nfs/dbraw/zinc/70/98/98/560709898.db2.gz BKYAZKIRJLXQSL-LICLKQGHSA-N 0 0 424.374 6.188 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3ccc(OCC(C)C)cc3)SC2=S)c1 ZINC000409328884 559060878 /nfs/dbraw/zinc/06/08/78/559060878.db2.gz BURVRYFCWIOFGD-ODLFYWEKSA-N 0 0 415.605 5.849 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(c4cccc(C)c4)C3=O)o2)cc1 ZINC000409329000 559060882 /nfs/dbraw/zinc/06/08/82/559060882.db2.gz BUNMYVPOLUMFOR-BKUYFWCQSA-N 0 0 419.527 5.863 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1OC ZINC000409329018 559060890 /nfs/dbraw/zinc/06/08/90/559060890.db2.gz CFSCXGPZOXIWKQ-XSFVSMFZSA-N 0 0 413.564 5.276 40 10 HKCBRN CN1C(=O)/C(=C/c2cc(Cl)ccc2OCc2cccc(Cl)c2)SC1=S ZINC000409329086 559060895 /nfs/dbraw/zinc/06/08/95/559060895.db2.gz CMJHMHUOMQLANJ-SXGWCWSVSA-N 0 0 410.347 5.403 40 10 HKCBRN O=C1/C(=C\c2c[nH]c3ccc(Br)cc23)SC(=S)N1C1CCCCC1 ZINC000409329100 560710017 /nfs/dbraw/zinc/71/00/17/560710017.db2.gz CQRPBFLAAIBKNF-LZYBPNLTSA-N 0 0 421.385 5.464 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(c4cccc(F)c4)C3=O)o2)cc1 ZINC000409329115 560709965 /nfs/dbraw/zinc/70/99/65/560709965.db2.gz CTEXMRZPMBNBLV-NDENLUEZSA-N 0 0 423.490 5.694 40 10 HKCBRN CCCn1cc(/C=C2\SC(=S)N(c3ccc4c(c3)OCO4)C2=O)c2ccccc21 ZINC000409329180 559060880 /nfs/dbraw/zinc/06/08/80/559060880.db2.gz DOKJUFBBPWPZPE-JMIUGGIZSA-N 0 0 422.531 5.186 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3cc([N+](=O)[O-])ccc3Cl)SC2=S)c1 ZINC000409329181 560710000 /nfs/dbraw/zinc/71/00/00/560710000.db2.gz DOLDQGCOIGIKFA-NVNXTCNLSA-N 0 0 422.940 5.376 40 10 HKCBRN COc1ccc(/C=C2/SC(=S)N(c3cccc(SC)c3)C2=O)c2ccccc12 ZINC000409329218 560710019 /nfs/dbraw/zinc/71/00/19/560710019.db2.gz CHUCVPZNKGXULJ-UDWIEESQSA-N 0 0 423.584 5.976 40 10 HKCBRN CC(=O)Nc1ccc(/C=C2/SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000409329220 559060887 /nfs/dbraw/zinc/06/08/87/559060887.db2.gz CIHGWISZURAMHK-CXUHLZMHSA-N 0 0 422.453 5.070 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)ccc1OCC(C)C ZINC000409329271 560710007 /nfs/dbraw/zinc/71/00/07/560710007.db2.gz DAQJJMRLLITWDD-YBFXNURJSA-N 0 0 417.527 5.275 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)cc1OC ZINC000409329275 559060889 /nfs/dbraw/zinc/06/08/89/559060889.db2.gz DCQSHBRNFSZFEP-NPRIEWAGSA-N 0 0 413.564 5.587 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)cc1OC ZINC000409329276 559060894 /nfs/dbraw/zinc/06/08/94/559060894.db2.gz DCQSHBRNFSZFEP-OOWUWCJESA-N 0 0 413.564 5.587 40 10 HKCBRN CC(C)Oc1ccc2ccccc2c1/C=C1\SC(=S)N(c2cccc(F)c2)C1=O ZINC000409329392 559060903 /nfs/dbraw/zinc/06/09/03/559060903.db2.gz FOKWJPLEBPRPTF-BKUYFWCQSA-N 0 0 423.534 6.172 40 10 HKCBRN CC(C)COc1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 ZINC000409329454 559060881 /nfs/dbraw/zinc/06/08/81/559060881.db2.gz FSXOKYBDFAIZEU-WOJGMQOQSA-N 0 0 414.508 5.035 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(N4CCCC4)cc3)SC2=S)cc1 ZINC000409329703 560710159 /nfs/dbraw/zinc/71/01/59/560710159.db2.gz HPKMNBLWGJISQW-HMMYKYKNSA-N 0 0 410.564 5.091 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccc(C)cc2)C1=O ZINC000409329743 559060986 /nfs/dbraw/zinc/06/09/86/559060986.db2.gz HPLFPLHRMDKLRG-STZFKDTASA-N 0 0 405.544 5.953 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3c[nH]c4c3cccc4CC)SC2=S)cc1 ZINC000409329779 560710143 /nfs/dbraw/zinc/71/01/43/560710143.db2.gz HWSZOFFSOWOIAZ-UNOMPAQXSA-N 0 0 408.548 5.535 40 10 HKCBRN COc1ccc(/C=C2/SC(=S)N(c3ccc(N(C)C)cc3)C2=O)c2ccccc12 ZINC000409329794 559061016 /nfs/dbraw/zinc/06/10/16/559061016.db2.gz IITXZQLADNIOFX-KGENOOAVSA-N 0 0 420.559 5.320 40 10 HKCBRN CCCOc1ccc(/C=C2\SC(=S)N(c3ccc(OC)c(Cl)c3)C2=O)cc1 ZINC000409329795 559061004 /nfs/dbraw/zinc/06/10/04/559061004.db2.gz IJGBNHMUXPDLCB-WQRHYEAKSA-N 0 0 419.955 5.543 40 10 HKCBRN CCCN1C(=O)/C(=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)SC1=S ZINC000409329832 560710156 /nfs/dbraw/zinc/71/01/56/560710156.db2.gz HGGHJCSNYHPBDL-LICLKQGHSA-N 0 0 424.513 5.724 40 10 HKCBRN CCOc1ccc(Cl)cc1/C=C1/SC(=S)N(c2ccc(N(C)C)cc2)C1=O ZINC000409329920 560710132 /nfs/dbraw/zinc/71/01/32/560710132.db2.gz HZYLQGUKWVBDME-LDADJPATSA-N 0 0 418.971 5.211 40 10 HKCBRN CCOc1ccccc1/C=C1/SC(=S)N(c2ccc(OC)c(Cl)c2)C1=O ZINC000409329925 560710125 /nfs/dbraw/zinc/71/01/25/560710125.db2.gz IBNCYJMVFIJKGU-LICLKQGHSA-N 0 0 405.928 5.153 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)SC2=S)cc1Cl ZINC000409329960 560710222 /nfs/dbraw/zinc/71/02/22/560710222.db2.gz JDEJXPTUZIZCLU-ZDLGFXPLSA-N 0 0 419.955 5.542 40 10 HKCBRN CCOc1ccc(C23CC4CC(CC(C4)C2)C3)cc1/C=C1\SC(=S)N(C)C1=O ZINC000409329994 559060980 /nfs/dbraw/zinc/06/09/80/559060980.db2.gz IRCRNDVOUXGJMS-JMIUGGIZSA-N 0 0 413.608 5.384 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccccc2F)C1=O ZINC000409330038 560710188 /nfs/dbraw/zinc/71/01/88/560710188.db2.gz JTJUIHOWMMUHIB-KGENOOAVSA-N 0 0 423.534 6.174 40 10 HKCBRN CC(=O)Nc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000409330119 559060955 /nfs/dbraw/zinc/06/09/55/559060955.db2.gz IYTHCRXFWZJBCV-LZYBPNLTSA-N 0 0 423.346 5.358 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1/SC(=S)N(c2cccc(SC)c2)C1=O ZINC000409330210 559061019 /nfs/dbraw/zinc/06/10/19/559061019.db2.gz JTATXWKNEDHPOG-DEDYPNTBSA-N 0 0 423.584 5.976 40 10 HKCBRN CC[C@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2cccc(Cl)c2)C1=O ZINC000409330227 559060952 /nfs/dbraw/zinc/06/09/52/559060952.db2.gz JZTJQRDHCQHZPJ-FHNWIRHTSA-N 0 0 403.956 5.923 40 10 HKCBRN CC[C@@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2cccc(Cl)c2)C1=O ZINC000409330228 559061001 /nfs/dbraw/zinc/06/10/01/559061001.db2.gz JZTJQRDHCQHZPJ-NCUBORBFSA-N 0 0 403.956 5.923 40 10 HKCBRN Cc1c(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)c2ccccc2n1C ZINC000409330249 559060973 /nfs/dbraw/zinc/06/09/73/559060973.db2.gz KFABSVHOCSPDLY-HYARGMPZSA-N 0 0 414.555 6.046 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)cc1OC ZINC000409330274 560710215 /nfs/dbraw/zinc/71/02/15/560710215.db2.gz KLBVKMOWMYDZER-CTFRJJSNSA-N 0 0 413.564 5.587 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)cc1OC ZINC000409330276 559060968 /nfs/dbraw/zinc/06/09/68/559060968.db2.gz KLBVKMOWMYDZER-HYTQYMIGSA-N 0 0 413.564 5.587 40 10 HKCBRN O=C1/C(=C\c2c(F)cccc2Cl)SC(=S)N1c1ccc(Cl)cc1Cl ZINC000409330323 560710202 /nfs/dbraw/zinc/71/02/02/560710202.db2.gz KSNVRCSHHZNNFA-VGOFMYFVSA-N 0 0 418.729 6.192 40 10 HKCBRN CCN1C(=O)/C(=C\c2ccccc2OCc2ccc3ccccc3c2)SC1=S ZINC000409330381 559060957 /nfs/dbraw/zinc/06/09/57/559060957.db2.gz LQJXKINWZUGFRM-KGENOOAVSA-N 0 0 405.544 5.640 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3c(OC)ccc4ccccc43)SC2=S)cc1 ZINC000409330384 560710240 /nfs/dbraw/zinc/71/02/40/560710240.db2.gz LQUIYKSBQVIFQX-KGENOOAVSA-N 0 0 421.543 5.653 40 10 HKCBRN O=C1/C(=C/c2ccc(N3CCCC3)cc2)SC(=S)N1c1ccc(Cl)cc1 ZINC000409330640 559061108 /nfs/dbraw/zinc/06/11/08/559061108.db2.gz LGIYUDXUWWWMOH-AQTBWJFISA-N 0 0 400.956 5.346 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(Cc2ccccc2)C1=O ZINC000409330711 560710328 /nfs/dbraw/zinc/71/03/28/560710328.db2.gz LIRVQPPIFGALMU-STZFKDTASA-N 0 0 405.544 5.640 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(c4cccc(SC)c4)C3=O)c[nH]c21 ZINC000409330716 559061089 /nfs/dbraw/zinc/06/10/89/559061089.db2.gz LLTUTBQRQNTFNA-ZDLGFXPLSA-N 0 0 410.589 5.858 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(c2cccc(C)c2)C1=O ZINC000409330728 560710238 /nfs/dbraw/zinc/71/02/38/560710238.db2.gz LZJOYINPTLHHCX-PXLXIMEGSA-N 0 0 419.571 6.343 40 10 HKCBRN O=C1/C(=C/c2ccc(O)c(Cl)c2)SC(=S)N1c1ccc(Cl)cc1Cl ZINC000409330737 560710354 /nfs/dbraw/zinc/71/03/54/560710354.db2.gz LTHUMRUEZRWKMR-NSIKDUERSA-N 0 0 416.738 5.758 40 10 HKCBRN COc1ccc(/C=C2/SC(=S)N(c3ccccc3OC)C2=O)c2ccccc12 ZINC000409330834 560710344 /nfs/dbraw/zinc/71/03/44/560710344.db2.gz MFEFXAYBMKQXKW-DEDYPNTBSA-N 0 0 407.516 5.263 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3O[C@@H](C)CC)SC2=S)cc1 ZINC000409330916 559061082 /nfs/dbraw/zinc/06/10/82/559061082.db2.gz MOWMAGDAZMAQHM-AUQXIXNCSA-N 0 0 413.564 5.668 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccccc3O[C@H](C)CC)SC2=S)cc1 ZINC000409330920 559061111 /nfs/dbraw/zinc/06/11/11/559061111.db2.gz MOWMAGDAZMAQHM-NPQOUYBPSA-N 0 0 413.564 5.668 40 10 HKCBRN O=C1/C(=C/c2ccc(O)c(Cl)c2)SC(=S)N1c1ccc(Cl)c(Cl)c1 ZINC000409331184 560710357 /nfs/dbraw/zinc/71/03/57/560710357.db2.gz MKNFOUWZPFWGDO-NSIKDUERSA-N 0 0 416.738 5.758 40 10 HKCBRN Cn1cc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)c2ccccc21 ZINC000409331189 559061439 /nfs/dbraw/zinc/06/14/39/559061439.db2.gz MMWBMTTWEVKPNZ-BKUYFWCQSA-N 0 0 400.528 5.737 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccccc2C)C1=O ZINC000409331292 560710342 /nfs/dbraw/zinc/71/03/42/560710342.db2.gz NUXZZFWKWWHISX-KGENOOAVSA-N 0 0 405.544 5.953 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3cccc(Cl)c3)C2=O)cc1OCC ZINC000409331446 559061354 /nfs/dbraw/zinc/06/13/54/559061354.db2.gz NASUDPFEFXDJHH-WQRHYEAKSA-N 0 0 419.955 5.543 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=S)N(c3cccc(SC)c3)C2=O)cc1 ZINC000409331579 560710403 /nfs/dbraw/zinc/71/04/03/560710403.db2.gz NVOHQTOOORIABG-CPNJWEJPSA-N 0 0 414.621 5.661 40 10 HKCBRN COc1ccccc1N1C(=O)/C(=C\c2cn(C(C)C)c3ccccc23)SC1=S ZINC000409331583 559061332 /nfs/dbraw/zinc/06/13/32/559061332.db2.gz OOBIBBQWIDDYMB-UDWIEESQSA-N 0 0 408.548 5.637 40 10 HKCBRN CC(C)Oc1ccc(/C=C2/SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000409331655 560710384 /nfs/dbraw/zinc/71/03/84/560710384.db2.gz OCUMJOMYERRRSA-LICLKQGHSA-N 0 0 423.481 5.898 40 10 HKCBRN COc1ccccc1N1C(=O)/C(=C\c2ccc(N3CCCC3)cc2C)SC1=S ZINC000409331692 560710378 /nfs/dbraw/zinc/71/03/78/560710378.db2.gz OKHPZBBUZKHWMM-XSFVSMFZSA-N 0 0 410.564 5.010 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3cccc(C(F)(F)F)c3)SC2=S)c1 ZINC000409331737 560710377 /nfs/dbraw/zinc/71/03/77/560710377.db2.gz PGHFUTRHUKXQOD-OQLLNIDSSA-N 0 0 411.495 5.833 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3cccc(Br)c3)SC2=S)c1 ZINC000409332122 560710428 /nfs/dbraw/zinc/71/04/28/560710428.db2.gz PMOLNYWEQIQMAX-OQLLNIDSSA-N 0 0 422.394 5.577 40 10 HKCBRN CC(C)n1cc(/C=C2\SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)c2ccccc21 ZINC000409332175 560710414 /nfs/dbraw/zinc/71/04/14/560710414.db2.gz PRCIBMOPWQNHHD-ODLFYWEKSA-N 0 0 423.519 5.536 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(OCc3ccccc3Cl)cc2)SC1=S ZINC000409332247 559061498 /nfs/dbraw/zinc/06/14/98/559061498.db2.gz PXLMEBMMCYSRSW-PDGQHHTCSA-N 0 0 403.956 5.530 40 10 HKCBRN Cc1ccccc1N1C(=O)/C(=C\c2cccc(Oc3ccccc3)c2)SC1=S ZINC000409332314 559061491 /nfs/dbraw/zinc/06/14/91/559061491.db2.gz QROVTLJAXGWHSQ-RCCKNPSSSA-N 0 0 403.528 6.193 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)cc1OC ZINC000409332386 560710527 /nfs/dbraw/zinc/71/05/27/560710527.db2.gz QLNYFQXYSFOBTQ-XDHOZWIPSA-N 0 0 417.527 5.419 40 10 HKCBRN O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1c1ccc(Cl)c(Cl)c1 ZINC000409332403 559061554 /nfs/dbraw/zinc/06/15/54/559061554.db2.gz RGBXUWTZBLBNCV-AUWJEWJLSA-N 0 0 411.291 5.307 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C/c3c(OC(C)C)ccc4ccccc43)SC2=S)c1 ZINC000409332426 559061530 /nfs/dbraw/zinc/06/15/30/559061530.db2.gz RLHIGONKFJOFBS-HMAPJEAMSA-N 0 0 419.571 6.341 40 10 HKCBRN CC(C)Oc1ccccc1/C=C1/SC(=S)N(c2ccc(Cl)cc2Cl)C1=O ZINC000409332432 560710540 /nfs/dbraw/zinc/71/05/40/560710540.db2.gz QOPLQJZENAAZFL-RQZCQDPDSA-N 0 0 424.374 6.186 40 10 HKCBRN O=C1/C(=C\c2ccc(C(F)(F)F)cc2)SC(=S)N1c1cccc([N+](=O)[O-])c1 ZINC000409332433 559061550 /nfs/dbraw/zinc/06/15/50/559061550.db2.gz RLMDXZFEOAUAQC-RIYZIHGNSA-N 0 0 410.398 5.019 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)cc(OC)c1 ZINC000409332844 559061563 /nfs/dbraw/zinc/06/15/63/559061563.db2.gz SBMRJDCZZVKABL-NDENLUEZSA-N 0 0 407.516 5.263 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)ccc1OCC(C)C ZINC000409332962 559061573 /nfs/dbraw/zinc/06/15/73/559061573.db2.gz TXQLDLNVJCZZIT-VXLYETTFSA-N 0 0 417.527 5.275 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)ccc1OCC(C)C ZINC000409332998 559061561 /nfs/dbraw/zinc/06/15/61/559061561.db2.gz UJBVADWWQLWCMP-NDENLUEZSA-N 0 0 413.564 5.444 40 10 HKCBRN CCOc1cccc(/C=C2/SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)c1 ZINC000409333733 560710695 /nfs/dbraw/zinc/71/06/95/560710695.db2.gz VLDNOGMFWXNMPC-CXUHLZMHSA-N 0 0 410.347 5.798 40 10 HKCBRN CC(C)Oc1ccccc1/C=C1/SC(=S)N(c2cccc3ccccc32)C1=O ZINC000409333762 560710626 /nfs/dbraw/zinc/71/06/26/560710626.db2.gz VPNBNASKRWCTDO-KGENOOAVSA-N 0 0 405.544 6.033 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)c2ccccc12 ZINC000409333773 559061507 /nfs/dbraw/zinc/06/15/07/559061507.db2.gz VRNUKOKEFKEXNN-UNOMPAQXSA-N 0 0 422.487 5.162 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)cc1 ZINC000409333779 559061567 /nfs/dbraw/zinc/06/15/67/559061567.db2.gz VVQCPAYYFQHKFI-SXGWCWSVSA-N 0 0 410.347 5.798 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccccc3C)C2=O)ccc1OC(C)C ZINC000409333782 560710684 /nfs/dbraw/zinc/71/06/84/560710684.db2.gz VWZIAQNANHTROM-DEDYPNTBSA-N 0 0 413.564 5.587 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)SC2=S)c1 ZINC000409334069 560710765 /nfs/dbraw/zinc/71/07/65/560710765.db2.gz SXMMTMNJUMBCIW-WQRHYEAKSA-N 0 0 401.578 5.602 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc(Cl)c3Cl)SC2=S)cc1 ZINC000409334135 560710767 /nfs/dbraw/zinc/71/07/67/560710767.db2.gz UHOYQOHTEMNKDJ-XNTDXEJSSA-N 0 0 410.347 5.798 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(C4CCCCC4)C3=O)o2)cc1 ZINC000409334306 559061517 /nfs/dbraw/zinc/06/15/17/559061517.db2.gz WSWOHIRGDJBWMT-MOSHPQCFSA-N 0 0 411.548 5.683 40 10 HKCBRN COC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000409334424 560710725 /nfs/dbraw/zinc/71/07/25/560710725.db2.gz XSLGXQDXBOBWPA-NVNXTCNLSA-N 0 0 424.330 5.186 40 10 HKCBRN CC(C)n1cc(/C=C2/SC(=S)N(c3ccc4c(c3)OCO4)C2=O)c2ccccc21 ZINC000409334823 559061642 /nfs/dbraw/zinc/06/16/42/559061642.db2.gz WJKUOIMCLPUNCR-AWQFTUOYSA-N 0 0 422.531 5.357 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccc(OC)cc2)C1=O ZINC000409334951 559061523 /nfs/dbraw/zinc/06/15/23/559061523.db2.gz YDRLVTJZEICJET-STZFKDTASA-N 0 0 421.543 5.653 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)cc1[N+](=O)[O-] ZINC000409335160 560712331 /nfs/dbraw/zinc/71/23/31/560712331.db2.gz ZBGJCKLOAVULIU-UNOMPAQXSA-N 0 0 422.487 5.162 40 10 HKCBRN O=C1/C(=C/c2ccc(F)c(Br)c2)SC(=S)N1c1ccccc1F ZINC000409335222 560712337 /nfs/dbraw/zinc/71/23/37/560712337.db2.gz ZMUSEBURMCVUHC-ZSOIEALJSA-N 0 0 412.280 5.133 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)ccc1C ZINC000409335258 559061668 /nfs/dbraw/zinc/06/16/68/559061668.db2.gz ZVOSHHXVNOTSMZ-PXNMLYILSA-N 0 0 410.347 5.716 40 10 HKCBRN O=C1/C(=C\c2cc([N+](=O)[O-])ccc2Cl)SC(=S)N1c1ccc(Cl)cc1 ZINC000409335355 559061694 /nfs/dbraw/zinc/06/16/94/559061694.db2.gz ZETPSBRQKBISPK-RIYZIHGNSA-N 0 0 411.291 5.307 40 10 HKCBRN CC(C)Oc1ccc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000409335379 559061698 /nfs/dbraw/zinc/06/16/98/559061698.db2.gz ZKZOHRFLUHKZHE-KGENOOAVSA-N 0 0 405.544 6.033 40 10 HKCBRN CC(C)COc1ccc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000409335643 559061684 /nfs/dbraw/zinc/06/16/84/559061684.db2.gz XYPOKYXWJHPEPX-VCHYOVAHSA-N 0 0 414.508 5.035 40 10 HKCBRN CCOc1c(/C=C2\SC(=S)N(c3cccc(Cl)c3)C2=O)cccc1OC ZINC000409335686 560712323 /nfs/dbraw/zinc/71/23/23/560712323.db2.gz YMWGXMCCEKYHPO-YBEGLDIGSA-N 0 0 405.928 5.153 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1OC ZINC000409335946 559061795 /nfs/dbraw/zinc/06/17/95/559061795.db2.gz ZVMJGZXCPPZGPS-NPRIEWAGSA-N 0 0 413.564 5.274 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1OC ZINC000409335948 559061816 /nfs/dbraw/zinc/06/18/16/559061816.db2.gz ZVMJGZXCPPZGPS-OOWUWCJESA-N 0 0 413.564 5.274 40 10 HKCBRN CCOc1cccc(/C=C2\SC(=S)N(c3ccc(Br)cc3)C2=O)c1 ZINC000409337973 560712411 /nfs/dbraw/zinc/71/24/11/560712411.db2.gz AMRIGIGMSJCNKL-WJDWOHSUSA-N 0 0 420.353 5.254 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3cccc(SC)c3)C2=O)ccc1OC ZINC000409337985 559062365 /nfs/dbraw/zinc/06/23/65/559062365.db2.gz ASVLCSREXRUSIG-WOJGMQOQSA-N 0 0 417.577 5.222 40 10 HKCBRN CC(C)COc1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000409338068 559062295 /nfs/dbraw/zinc/06/22/95/559062295.db2.gz CJKXLEOFIIAOFX-VCHYOVAHSA-N 0 0 403.956 5.781 40 10 HKCBRN CC(C)Oc1ccc2ccccc2c1/C=C1\SC(=S)N(C2CCCCC2)C1=O ZINC000409338171 559062338 /nfs/dbraw/zinc/06/23/38/559062338.db2.gz FETXLTUAZTWHKE-STZFKDTASA-N 0 0 411.592 6.161 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\c3ccc(O)c(Cl)c3)SC2=S)cc1Cl ZINC000409338230 560712461 /nfs/dbraw/zinc/71/24/61/560712461.db2.gz GDYLGHBOSUHNRP-VIZOYTHASA-N 0 0 412.319 5.113 40 10 HKCBRN Cc1cc(N2CCCC2)ccc1/C=C1\SC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000409338252 559062483 /nfs/dbraw/zinc/06/24/83/559062483.db2.gz GPZPQGSHEJTHSA-UYRXBGFRSA-N 0 0 414.983 5.654 40 10 HKCBRN O=C1/C(=C/c2cccc(Oc3ccccc3)c2)SC(=S)N1c1cccc(F)c1 ZINC000409338269 560712515 /nfs/dbraw/zinc/71/25/15/560712515.db2.gz GXFQKWFNWXJGMK-MOSHPQCFSA-N 0 0 407.491 6.024 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)cc1 ZINC000409338334 560712519 /nfs/dbraw/zinc/71/25/19/560712519.db2.gz IAAUSVCMQWMWPA-CPOQMQJTSA-N 0 0 412.580 5.336 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)cc1 ZINC000409338335 560712533 /nfs/dbraw/zinc/71/25/33/560712533.db2.gz IAAUSVCMQWMWPA-KWPCUBQOSA-N 0 0 412.580 5.336 40 10 HKCBRN Cc1ccc(/C=C2/SC(=S)N(c3ccc(Br)c(Cl)c3)C2=O)o1 ZINC000409338432 560712514 /nfs/dbraw/zinc/71/25/14/560712514.db2.gz JTADCRIQOHXQLB-NTUHNPAUSA-N 0 0 414.733 5.410 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)cc1OCC ZINC000409338463 559062486 /nfs/dbraw/zinc/06/24/86/559062486.db2.gz KLKHMHUKDLEYSQ-WQRHYEAKSA-N 0 0 403.500 5.029 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)ccc1OCC(C)C ZINC000409338711 559062648 /nfs/dbraw/zinc/06/26/48/559062648.db2.gz OUHKCSXROSXRDG-DEDYPNTBSA-N 0 0 419.612 5.654 40 10 HKCBRN CCOc1ccc(Cl)cc1/C=C1/SC(=S)N(c2cccc(SC)c2)C1=O ZINC000409338759 560712686 /nfs/dbraw/zinc/71/26/86/560712686.db2.gz AIHXXOGTZFPTJG-LICLKQGHSA-N 0 0 421.996 5.866 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccccc3OC(C)C)SC2=S)cc1Cl ZINC000409338765 559062677 /nfs/dbraw/zinc/06/26/77/559062677.db2.gz AMKSLVICNRQJAD-ZDLGFXPLSA-N 0 0 419.955 5.542 40 10 HKCBRN CCc1cccc2c(/C=C3\SC(=S)N(c4ccc(N(C)C)cc4)C3=O)c[nH]c21 ZINC000409338906 559062638 /nfs/dbraw/zinc/06/26/38/559062638.db2.gz QOBGEOJMRLBEEC-UNOMPAQXSA-N 0 0 407.564 5.202 40 10 HKCBRN CCOc1c(/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)cccc1OC ZINC000409339017 559062602 /nfs/dbraw/zinc/06/26/02/559062602.db2.gz DHEDBZHVUASSCO-WJDWOHSUSA-N 0 0 405.928 5.153 40 10 HKCBRN O=C1/C(=C\c2ccco2)SC(=S)N1c1ccc(Br)c(Cl)c1 ZINC000409339032 560712709 /nfs/dbraw/zinc/71/27/09/560712709.db2.gz DMGVOUVLDIYTQY-KPKJPENVSA-N 0 0 400.706 5.101 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000409339143 559062757 /nfs/dbraw/zinc/06/27/57/559062757.db2.gz FFXPYIJKHZVSAR-HTMJNSLASA-N 0 0 403.956 5.923 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000409339145 560712735 /nfs/dbraw/zinc/71/27/35/560712735.db2.gz FFXPYIJKHZVSAR-RNEAKCBISA-N 0 0 403.956 5.923 40 10 HKCBRN Cc1cc(N2CCCC2)ccc1/C=C1\SC(=S)N(c2cccc(Cl)c2)C1=O ZINC000409339244 559062863 /nfs/dbraw/zinc/06/28/63/559062863.db2.gz GBTRMEVBEKIFBT-UNOMPAQXSA-N 0 0 414.983 5.654 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000409339260 560712746 /nfs/dbraw/zinc/71/27/46/560712746.db2.gz GGQSEFDNHXVAHV-RCCKNPSSSA-N 0 0 405.544 6.034 40 10 HKCBRN CCOc1ccc(Cl)cc1/C=C1\SC(=S)N(c2ccc(OC)cc2)C1=O ZINC000409339475 559063003 /nfs/dbraw/zinc/06/30/03/559063003.db2.gz IRGFWYFFOFUTBG-BOPFTXTBSA-N 0 0 405.928 5.153 40 10 HKCBRN O=C1/C(=C\c2ccc(C(F)(F)F)cc2)SC(=S)N1c1cccc2ccccc21 ZINC000409339493 559063067 /nfs/dbraw/zinc/06/30/67/559063067.db2.gz JAWGAMAJHORUCK-LDADJPATSA-N 0 0 415.461 6.264 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cccc(C(F)(F)F)c3)SC2=S)cc1 ZINC000409339537 560710911 /nfs/dbraw/zinc/71/09/11/560710911.db2.gz JWCUTLOYHCRYQK-LFIBNONCSA-N 0 0 409.454 5.510 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)o3)SC2=S)c1 ZINC000409339672 559063017 /nfs/dbraw/zinc/06/30/17/559063017.db2.gz KKFFPFNFOHHMSG-UYRXBGFRSA-N 0 0 409.557 6.074 40 10 HKCBRN CC(C)COc1ccc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)cc1 ZINC000409339718 559063011 /nfs/dbraw/zinc/06/30/11/559063011.db2.gz LEQZAXUAEFDTTM-MOSHPQCFSA-N 0 0 412.580 5.193 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3ccc(C)cc3C)C2=O)cc1OCC ZINC000409339764 559063040 /nfs/dbraw/zinc/06/30/40/559063040.db2.gz XZSDZIBVYUAEMV-MOSHPQCFSA-N 0 0 413.564 5.507 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1OC ZINC000409339766 560710961 /nfs/dbraw/zinc/71/09/61/560710961.db2.gz YAIFCMDJMSOSCM-ITRAFESCSA-N 0 0 405.585 5.406 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1OC ZINC000409339767 560710958 /nfs/dbraw/zinc/71/09/58/560710958.db2.gz YAIFCMDJMSOSCM-NFECSFHCSA-N 0 0 405.585 5.406 40 10 HKCBRN CCN1C(=O)/C(=C\c2ccc(OCc3ccc4ccccc4c3)cc2)SC1=S ZINC000409339816 560710993 /nfs/dbraw/zinc/71/09/93/560710993.db2.gz YXGUGRKZVYLASM-KGENOOAVSA-N 0 0 405.544 5.640 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3ccc(C)cc3C)C2=O)c2ccccc12 ZINC000409339848 559063222 /nfs/dbraw/zinc/06/32/22/559063222.db2.gz LOYZVFYSXUGGBP-BKUYFWCQSA-N 0 0 405.544 5.871 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3cn(C(C)C)c4ccccc34)SC2=S)cc1 ZINC000409339895 560710967 /nfs/dbraw/zinc/71/09/67/560710967.db2.gz MOBUMXXRPFLXQC-FYJGNVAPSA-N 0 0 422.575 6.027 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(C2CCCCC2)C1=O ZINC000409339925 559063299 /nfs/dbraw/zinc/06/32/99/559063299.db2.gz MUZPNDGHHPJNAV-RCCKNPSSSA-N 0 0 411.592 6.163 40 10 HKCBRN CC(C)COc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000409339961 559063328 /nfs/dbraw/zinc/06/33/28/559063328.db2.gz NMVMMARBFCRRHN-WOJGMQOQSA-N 0 0 403.956 5.781 40 10 HKCBRN O=C1/C(=C\c2ccccc2)SC(=S)N1c1ccc(Br)c(Cl)c1 ZINC000409340096 560711091 /nfs/dbraw/zinc/71/10/91/560711091.db2.gz QIKVTDFZTGZZRY-RIYZIHGNSA-N 0 0 410.745 5.508 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(Cc3ccccc3)C2=O)ccc1OC(C)C ZINC000409340129 560711103 /nfs/dbraw/zinc/71/11/03/560711103.db2.gz QWLOFNIQLYRGBE-MOSHPQCFSA-N 0 0 413.564 5.274 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3ccc(C(F)(F)F)cc3)SC2=S)c1 ZINC000409340131 560711088 /nfs/dbraw/zinc/71/10/88/560711088.db2.gz QXPROMIDHYVPLK-DHDCSXOGSA-N 0 0 411.495 5.833 40 10 HKCBRN CC(C)Oc1ccccc1/C=C1\SC(=S)N(c2ccc(F)c(Cl)c2)C1=O ZINC000409340154 560711113 /nfs/dbraw/zinc/71/11/13/560711113.db2.gz RHXLPCKWTXOQLE-MFOYZWKCSA-N 0 0 407.919 5.672 40 10 HKCBRN O=C1/C(=C/c2ccc(-c3ccccc3)o2)SC(=S)N1c1ccc2c(c1)OCO2 ZINC000409340262 560711106 /nfs/dbraw/zinc/71/11/06/560711106.db2.gz SZPYPHXNJPVXAP-ODLFYWEKSA-N 0 0 407.472 5.081 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 ZINC000409340433 560711231 /nfs/dbraw/zinc/71/12/31/560711231.db2.gz XBUORJRSOZLKJL-HTMJNSLASA-N 0 0 414.508 5.178 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 ZINC000409340434 559063595 /nfs/dbraw/zinc/06/35/95/559063595.db2.gz XBUORJRSOZLKJL-RNEAKCBISA-N 0 0 414.508 5.178 40 10 HKCBRN CCOc1c(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)cccc1OC ZINC000409340507 560711233 /nfs/dbraw/zinc/71/12/33/560711233.db2.gz YGPONHLLBOZRMT-ZHZULCJRSA-N 0 0 421.543 5.653 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccccc2)C1=O ZINC000409340548 559063594 /nfs/dbraw/zinc/06/35/94/559063594.db2.gz ZADMUFOMMICUDR-QNGOZBTKSA-N 0 0 405.544 6.034 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(N4CCCC4)cc3C)SC2=S)c(C)c1 ZINC000409341266 559064092 /nfs/dbraw/zinc/06/40/92/559064092.db2.gz ATOCFLZQFNGEBN-STZFKDTASA-N 0 0 408.592 5.618 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)cc1OC ZINC000409341350 560711451 /nfs/dbraw/zinc/71/14/51/560711451.db2.gz BFLWNYYKDIQUKP-HCZVKUGISA-N 0 0 417.527 5.417 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3cn(CC)c4ccccc34)SC2=S)cc1 ZINC000409341352 560711458 /nfs/dbraw/zinc/71/14/58/560711458.db2.gz ACRRYYOEJLVJKH-MOSHPQCFSA-N 0 0 408.548 5.466 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)cc1OC ZINC000409341353 559064293 /nfs/dbraw/zinc/06/42/93/559064293.db2.gz BFLWNYYKDIQUKP-KZKLBEMASA-N 0 0 417.527 5.417 40 10 HKCBRN COc1ccc([N+](=O)[O-])cc1/C=C1\SC(=S)N(c2cccc3ccccc32)C1=O ZINC000409341441 559064355 /nfs/dbraw/zinc/06/43/55/559064355.db2.gz ATKYQJYRKAXZRZ-UNOMPAQXSA-N 0 0 422.487 5.162 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(C3CCCCC3)C2=O)ccc1O[C@@H](C)CC ZINC000409341467 559064405 /nfs/dbraw/zinc/06/44/05/559064405.db2.gz BCRPBACUTDWFLV-CPOQMQJTSA-N 0 0 419.612 5.797 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(C3CCCCC3)C2=O)ccc1O[C@H](C)CC ZINC000409341468 559064344 /nfs/dbraw/zinc/06/43/44/559064344.db2.gz BCRPBACUTDWFLV-KWPCUBQOSA-N 0 0 419.612 5.797 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc(Cl)c1O ZINC000409341945 559064543 /nfs/dbraw/zinc/06/45/43/559064543.db2.gz APVJQEJVAZXIPR-MHWRWJLKSA-N 0 0 405.928 5.159 40 10 HKCBRN CC[C@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000409341992 559064538 /nfs/dbraw/zinc/06/45/38/559064538.db2.gz DFPRPPBHDVTLOJ-FHNWIRHTSA-N 0 0 414.508 5.178 40 10 HKCBRN CC[C@@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000409341994 559064568 /nfs/dbraw/zinc/06/45/68/559064568.db2.gz DFPRPPBHDVTLOJ-NCUBORBFSA-N 0 0 414.508 5.178 40 10 HKCBRN CCCCOc1ccc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)cc1OC ZINC000409342028 560711618 /nfs/dbraw/zinc/71/16/18/560711618.db2.gz BDMSJCXIVXCHCM-ZHZULCJRSA-N 0 0 413.564 5.588 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3cccc(Oc4ccccc4)c3)SC2=S)c(C)c1 ZINC000409342049 560711642 /nfs/dbraw/zinc/71/16/42/560711642.db2.gz CZIYMGWZDMCOTQ-JCMHNJIXSA-N 0 0 417.555 6.502 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)ccc1C ZINC000409342055 559064449 /nfs/dbraw/zinc/06/44/49/559064449.db2.gz BGERVVAFYGKHNL-PXNMLYILSA-N 0 0 410.347 5.716 40 10 HKCBRN CCOc1cccc(/C=C2\SC(=S)N(c3ccc(OC)c(Cl)c3)C2=O)c1 ZINC000409342119 559064546 /nfs/dbraw/zinc/06/45/46/559064546.db2.gz BQGHBTIHAXWKPU-YVLHZVERSA-N 0 0 405.928 5.153 40 10 HKCBRN CCOc1cccc(/C=C2/SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)c1 ZINC000409342247 559064526 /nfs/dbraw/zinc/06/45/26/559064526.db2.gz AYYLXRLXIKGYDC-MHWRWJLKSA-N 0 0 409.454 5.510 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3ccc(C)c(C)c3)C2=O)ccc1OC(F)F ZINC000409342334 559064559 /nfs/dbraw/zinc/06/45/59/559064559.db2.gz BHKAZHRJDYLSRL-YVLHZVERSA-N 0 0 421.490 5.319 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3ccc(N4CCCC4)cc3C)SC2=S)cc1 ZINC000409342413 559064549 /nfs/dbraw/zinc/06/45/49/559064549.db2.gz DSECAEISVSWILU-ZHZULCJRSA-N 0 0 410.564 5.010 40 10 HKCBRN CCCn1cc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)c2ccccc21 ZINC000409342425 560711653 /nfs/dbraw/zinc/71/16/53/560711653.db2.gz DWBHSWZIXKSIFH-FYJGNVAPSA-N 0 0 406.576 6.074 40 10 HKCBRN Cc1c(/C=C2/SC(=S)N(C)C2=O)c2ccccc2n1Cc1ccccc1Cl ZINC000409342455 559064611 /nfs/dbraw/zinc/06/46/11/559064611.db2.gz FDNBFJALZVIRME-YBFXNURJSA-N 0 0 412.967 5.482 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)c2ccccc12 ZINC000409342518 559064628 /nfs/dbraw/zinc/06/46/28/559064628.db2.gz DRGOWOSZMVWQQJ-UNOMPAQXSA-N 0 0 411.935 5.908 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc1OC ZINC000409342581 559064649 /nfs/dbraw/zinc/06/46/49/559064649.db2.gz BTWPGOZHGNSBIJ-NPRIEWAGSA-N 0 0 413.564 5.587 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc1OC ZINC000409342586 559064624 /nfs/dbraw/zinc/06/46/24/559064624.db2.gz BTWPGOZHGNSBIJ-OOWUWCJESA-N 0 0 413.564 5.587 40 10 HKCBRN CC(C)Oc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000409342603 559064613 /nfs/dbraw/zinc/06/46/13/559064613.db2.gz FTSHHCUFLQEMQZ-RQZCQDPDSA-N 0 0 424.374 6.186 40 10 HKCBRN O=C1/C(=C/c2cccc(Oc3ccccc3)c2)SC(=S)N1c1ccccc1F ZINC000409342615 560711708 /nfs/dbraw/zinc/71/17/08/560711708.db2.gz DTCGUSLLFXZZQR-ZHZULCJRSA-N 0 0 407.491 6.024 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)cc1OC ZINC000409342697 559064616 /nfs/dbraw/zinc/06/46/16/559064616.db2.gz GCEGJTLILRRLER-LDADJPATSA-N 0 0 403.500 5.029 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1/SC(=S)N(c2ccc(C)c(C)c2)C1=O ZINC000409342717 560711715 /nfs/dbraw/zinc/71/17/15/560711715.db2.gz CIPSGEYLYKGFJB-HYARGMPZSA-N 0 0 419.571 6.261 40 10 HKCBRN CC(C)Oc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccccc2F)C1=O ZINC000409342872 560711826 /nfs/dbraw/zinc/71/18/26/560711826.db2.gz FRLNPKATVFBHMV-BKUYFWCQSA-N 0 0 423.534 6.172 40 10 HKCBRN CC(C)Oc1ccccc1/C=C1/SC(=S)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000409342921 560711849 /nfs/dbraw/zinc/71/18/49/560711849.db2.gz FXRNPOKNZHSGJI-RQZCQDPDSA-N 0 0 424.374 6.186 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2\SC(=S)N(c3cccc(SC)c3)C2=O)cc1 ZINC000409342969 559064634 /nfs/dbraw/zinc/06/46/34/559064634.db2.gz CCONFDNMKNCXAG-VCRXTVNUSA-N 0 0 415.605 5.992 40 10 HKCBRN O=C1/C(=C/c2ccc(F)c(Br)c2)SC(=S)N1c1cccc(F)c1 ZINC000409342971 559064639 /nfs/dbraw/zinc/06/46/39/559064639.db2.gz DBSZBGQGIVTFGT-AUWJEWJLSA-N 0 0 412.280 5.133 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2\SC(=S)N(c3cccc(SC)c3)C2=O)cc1 ZINC000409342976 559064618 /nfs/dbraw/zinc/06/46/18/559064618.db2.gz CCONFDNMKNCXAG-YQNUULROSA-N 0 0 415.605 5.992 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1OCC ZINC000409342978 560711819 /nfs/dbraw/zinc/71/18/19/560711819.db2.gz GDHBENUEEJBJFN-XMHGGMMESA-N 0 0 405.585 5.408 40 10 HKCBRN Cc1ccc(Sc2ccc(/C=C3/SC(=S)N(C4CCCCC4)C3=O)o2)cc1 ZINC000409342997 559064621 /nfs/dbraw/zinc/06/46/21/559064621.db2.gz CFKOWEWDPREDCO-QGOAFFKASA-N 0 0 415.605 6.273 40 10 HKCBRN CC(C)n1cc(/C=C2\SC(=S)N(c3cccc(Cl)c3)C2=O)c2ccccc21 ZINC000409343134 559064784 /nfs/dbraw/zinc/06/47/84/559064784.db2.gz CPKQOQBINZUNBL-GRSHGNNSSA-N 0 0 412.967 6.281 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)cc(Cl)c1O ZINC000409343169 559064788 /nfs/dbraw/zinc/06/47/88/559064788.db2.gz CQTSODMROYJZKQ-YBEGLDIGSA-N 0 0 405.928 5.159 40 10 HKCBRN CCCN1C(=O)/C(=C\c2c(C)n(Cc3ccccc3)c3ccccc23)SC1=S ZINC000409343462 560711948 /nfs/dbraw/zinc/71/19/48/560711948.db2.gz HPXBKWORDWCMEV-KGENOOAVSA-N 0 0 406.576 5.609 40 10 HKCBRN CCc1cccc2c(/C=C3/SC(=S)N(c4cccc5ccccc54)C3=O)c[nH]c21 ZINC000409343528 559065323 /nfs/dbraw/zinc/06/53/23/559065323.db2.gz DSIMYGYMLWBQPM-FYJGNVAPSA-N 0 0 414.555 6.289 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc(Cl)c1OC ZINC000409343573 560711946 /nfs/dbraw/zinc/71/19/46/560711946.db2.gz HKPZUZCSTMLBKQ-MHWRWJLKSA-N 0 0 405.928 5.071 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C/c3cn(C(C)C)c4ccccc34)SC2=S)cc1 ZINC000409343733 559064977 /nfs/dbraw/zinc/06/49/77/559064977.db2.gz GDMHMLLRKINEDR-NDENLUEZSA-N 0 0 408.548 5.637 40 10 HKCBRN CCOc1c(/C=C2/SC(=S)N(c3cccc(SC)c3)C2=O)cccc1OC ZINC000409343775 559065095 /nfs/dbraw/zinc/06/50/95/559065095.db2.gz GKIFIHUFDAYJBQ-GZTJUZNOSA-N 0 0 417.577 5.222 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)cc1OCC ZINC000409343813 559065128 /nfs/dbraw/zinc/06/51/28/559065128.db2.gz DNXMSWUDKCSCDY-XSFVSMFZSA-N 0 0 413.564 5.588 40 10 HKCBRN CCCOc1ccc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)cc1OCC ZINC000409343832 560711940 /nfs/dbraw/zinc/71/19/40/560711940.db2.gz DOXFUUGJEYKNLM-ZHZULCJRSA-N 0 0 413.564 5.588 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3cccc(SC)c3)C2=O)cc(Cl)c1O ZINC000409344139 559065085 /nfs/dbraw/zinc/06/50/85/559065085.db2.gz FPZWUKXBWSAXCY-NVNXTCNLSA-N 0 0 423.968 5.182 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(c4ccc(C)cc4)C3=O)o2)cc1 ZINC000409344226 559065374 /nfs/dbraw/zinc/06/53/74/559065374.db2.gz IGVQVQJCDILHAB-BKUYFWCQSA-N 0 0 419.527 5.863 40 10 HKCBRN CCOc1ccc(/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)cc1OCC ZINC000409344230 559065380 /nfs/dbraw/zinc/06/53/80/559065380.db2.gz IGKHVPAVJIBURK-PDGQHHTCSA-N 0 0 419.955 5.543 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C/c3ccc(F)c(Br)c3)SC2=S)c1 ZINC000409344268 560712013 /nfs/dbraw/zinc/71/20/13/560712013.db2.gz IOSGBJWZGCFWPS-DHDCSXOGSA-N 0 0 408.317 5.302 40 10 HKCBRN CCOc1cccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)c1 ZINC000409344276 559065418 /nfs/dbraw/zinc/06/54/18/559065418.db2.gz ILSRPPMYQSIECY-CXUHLZMHSA-N 0 0 410.347 5.798 40 10 HKCBRN CCN1C(=O)/C(=C\c2c(C)n(Cc3ccccc3F)c3ccccc23)SC1=S ZINC000409344283 560712135 /nfs/dbraw/zinc/71/21/35/560712135.db2.gz IMMYNRQBOYMSAZ-UDWIEESQSA-N 0 0 410.539 5.358 40 10 HKCBRN CCn1cc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)c2ccccc21 ZINC000409344312 559065364 /nfs/dbraw/zinc/06/53/64/559065364.db2.gz IOFRMXCZRYJPPG-MOSHPQCFSA-N 0 0 407.564 5.133 40 10 HKCBRN O=C1/C(=C/c2cccc(Cl)c2Cl)SC(=S)N1c1cccc([N+](=O)[O-])c1 ZINC000409344374 559065479 /nfs/dbraw/zinc/06/54/79/559065479.db2.gz JFDOSFNHMCPBOR-QPEQYQDCSA-N 0 0 411.291 5.307 40 10 HKCBRN COC(=O)c1ccc(/C=C2\SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)cc1 ZINC000409344396 559065478 /nfs/dbraw/zinc/06/54/78/559065478.db2.gz JBOMIGBSXBPRLD-NVNXTCNLSA-N 0 0 424.330 5.186 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccccc2OCc2cccc3ccccc32)SC1=S ZINC000409344445 560712113 /nfs/dbraw/zinc/71/21/13/560712113.db2.gz JGUAJFOLTPVQSH-PXLXIMEGSA-N 0 0 419.571 6.030 40 10 HKCBRN O=C1/C(=C\c2ccc(Sc3ccccc3)o2)SC(=S)N1C1CCCCC1 ZINC000409344484 559065311 /nfs/dbraw/zinc/06/53/11/559065311.db2.gz JLYAFXCQXDSDRH-GHRIWEEISA-N 0 0 401.578 5.965 40 10 HKCBRN CCCCOc1ccc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)cc1 ZINC000409344488 559065319 /nfs/dbraw/zinc/06/53/19/559065319.db2.gz JSPOHBOUJMRBCO-HKWRFOASSA-N 0 0 412.580 5.337 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)cc1OC ZINC000409344521 560712177 /nfs/dbraw/zinc/71/21/77/560712177.db2.gz GWRQIFVBEZCMEV-CPNJWEJPSA-N 0 0 417.527 5.419 40 10 HKCBRN CCCn1cc(/C=C2/SC(=S)N(c3ccc([N+](=O)[O-])cc3)C2=O)c2ccccc21 ZINC000409344645 559065533 /nfs/dbraw/zinc/06/55/33/559065533.db2.gz HWJOTAGHTBYLPP-XDHOZWIPSA-N 0 0 423.519 5.365 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1 ZINC000409344652 560712201 /nfs/dbraw/zinc/71/22/01/560712201.db2.gz HXSIUOHWVDHIKZ-LICLKQGHSA-N 0 0 424.374 6.188 40 10 HKCBRN CCCCOc1ccc(/C=C2\SC(=S)N(c3cccc(SC)c3)C2=O)cc1 ZINC000409345061 559066112 /nfs/dbraw/zinc/06/61/12/559066112.db2.gz KAERUKUDAFHTSV-UYRXBGFRSA-N 0 0 415.605 5.993 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)cc1OCC ZINC000409345070 559066129 /nfs/dbraw/zinc/06/61/29/559066129.db2.gz KBZKQWIHTJGBQT-HMMYKYKNSA-N 0 0 419.612 5.798 40 10 HKCBRN O=C1/C(=C\c2cccs2)SC(=S)N1c1ccc(Br)c(Cl)c1 ZINC000409345146 560712238 /nfs/dbraw/zinc/71/22/38/560712238.db2.gz JYVVBALDUASUDR-KPKJPENVSA-N 0 0 416.774 5.570 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(c4ccccc4C)C3=O)o2)cc1 ZINC000409345171 559066177 /nfs/dbraw/zinc/06/61/77/559066177.db2.gz KDOKWFABFDMBOR-FYJGNVAPSA-N 0 0 419.527 5.863 40 10 HKCBRN CCCn1cc(/C=C2\SC(=S)N(c3ccc(OCC)cc3)C2=O)c2ccccc21 ZINC000409345192 559066147 /nfs/dbraw/zinc/06/61/47/559066147.db2.gz KFERDQDBQKVFDY-STZFKDTASA-N 0 0 422.575 5.856 40 10 HKCBRN CCCCOc1ccc(/C=C2\SC(=S)N(c3ccc4c(c3)OCO4)C2=O)cc1 ZINC000409345198 560714599 /nfs/dbraw/zinc/71/45/99/560714599.db2.gz KFFXHZDDEPKBJM-ODLFYWEKSA-N 0 0 413.520 5.000 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2cccc(C)c2)C1=O ZINC000409345322 559066189 /nfs/dbraw/zinc/06/61/89/559066189.db2.gz LCOKJLCATRCOFX-STZFKDTASA-N 0 0 405.544 5.953 40 10 HKCBRN CC(C)Oc1ccc2ccccc2c1/C=C1\SC(=S)N(Cc2ccccc2)C1=O ZINC000409345385 560714607 /nfs/dbraw/zinc/71/46/07/560714607.db2.gz LTNOHTNNTGSVSA-HMAPJEAMSA-N 0 0 419.571 6.028 40 10 HKCBRN Cc1cccc(N2C(=O)/C(=C/c3cccc(Oc4ccccc4)c3)SC2=S)c1 ZINC000409345453 560714668 /nfs/dbraw/zinc/71/46/68/560714668.db2.gz IMWYFLSRCUFKDA-QNGOZBTKSA-N 0 0 403.528 6.193 40 10 HKCBRN O=C1/C(=C/c2c(Cl)cccc2Cl)SC(=S)N1c1cccc2ccccc21 ZINC000409345463 559066150 /nfs/dbraw/zinc/06/61/50/559066150.db2.gz IOOGHJBCRLJYGR-WQRHYEAKSA-N 0 0 416.354 6.552 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)cc(Cl)c1O ZINC000409345512 559066067 /nfs/dbraw/zinc/06/60/67/559066067.db2.gz JAGXUEBVEOXWHL-LICLKQGHSA-N 0 0 419.955 5.467 40 10 HKCBRN CC[C@H](C)Oc1ccccc1/C=C1/SC(=S)N(c2ccc(N(C)C)cc2)C1=O ZINC000409345519 560714605 /nfs/dbraw/zinc/71/46/05/560714605.db2.gz JCIHTEXYGIMVNS-AUQXIXNCSA-N 0 0 412.580 5.336 40 10 HKCBRN CC[C@@H](C)Oc1ccccc1/C=C1/SC(=S)N(c2ccc(N(C)C)cc2)C1=O ZINC000409345522 559066116 /nfs/dbraw/zinc/06/61/16/559066116.db2.gz JCIHTEXYGIMVNS-NPQOUYBPSA-N 0 0 412.580 5.336 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3c(OC(C)C)ccc4ccccc43)SC2=S)cc1 ZINC000409345615 559066160 /nfs/dbraw/zinc/06/61/60/559066160.db2.gz JPWCJHYMKLRRSJ-HMAPJEAMSA-N 0 0 419.571 6.341 40 10 HKCBRN CCn1cc(/C=C2\SC(=S)N(c3cccc(SC)c3)C2=O)c2ccccc21 ZINC000409345618 559066131 /nfs/dbraw/zinc/06/61/31/559066131.db2.gz JQVWNCFKLIKKAB-ODLFYWEKSA-N 0 0 410.589 5.789 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccc(OCc3ccc4ccccc4c3)cc2)SC1=S ZINC000409345636 560714710 /nfs/dbraw/zinc/71/47/10/560714710.db2.gz JTWSUKCYLVAIAS-PXLXIMEGSA-N 0 0 419.571 6.030 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000409345639 560714695 /nfs/dbraw/zinc/71/46/95/560714695.db2.gz INCDHGVAEBNFKX-CJLVFECKSA-N 0 0 419.571 6.425 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc1OCC ZINC000409345698 559066409 /nfs/dbraw/zinc/06/64/09/559066409.db2.gz IYNFATDKDBVSIG-XSFVSMFZSA-N 0 0 413.564 5.588 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3cn(C(C)C)c4ccccc34)SC2=S)c1 ZINC000409345703 559066383 /nfs/dbraw/zinc/06/63/83/559066383.db2.gz IZLHZVXODAMJDG-RGVLZGJSSA-N 0 0 424.616 6.350 40 10 HKCBRN CC(C)n1cc(/C=C2/SC(=S)N(c3ccc(N(C)C)cc3)C2=O)c2ccccc21 ZINC000409345738 560714730 /nfs/dbraw/zinc/71/47/30/560714730.db2.gz JHNMHWXIYOBNEO-FYJGNVAPSA-N 0 0 421.591 5.694 40 10 HKCBRN CCCOc1ccc2ccccc2c1/C=C1/SC(=S)N(Cc2ccccc2)C1=O ZINC000409345810 559066174 /nfs/dbraw/zinc/06/61/74/559066174.db2.gz MEJHPJVPXKOBNH-PXLXIMEGSA-N 0 0 419.571 6.030 40 10 HKCBRN COc1ccc(/C=C2/SC(=S)N(c3ccc(C)c(C)c3)C2=O)c2ccccc12 ZINC000409345825 560714676 /nfs/dbraw/zinc/71/46/76/560714676.db2.gz MIVPLFDGRJPLDY-FYJGNVAPSA-N 0 0 405.544 5.871 40 10 HKCBRN CC[C@H](C)Oc1ccccc1/C=C1/SC(=S)N(c2cccc(SC)c2)C1=O ZINC000409345941 560714712 /nfs/dbraw/zinc/71/47/12/560714712.db2.gz LVZJLIZFBHZDMV-BXUJETTOSA-N 0 0 415.605 5.992 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)cc1 ZINC000409345942 559066455 /nfs/dbraw/zinc/06/64/55/559066455.db2.gz MESJTMGXJOVEFW-LDADJPATSA-N 0 0 414.508 5.180 40 10 HKCBRN CC[C@@H](C)Oc1ccccc1/C=C1/SC(=S)N(c2cccc(SC)c2)C1=O ZINC000409345944 559066434 /nfs/dbraw/zinc/06/64/34/559066434.db2.gz LVZJLIZFBHZDMV-ONDHQXCVSA-N 0 0 415.605 5.992 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3ccc(OCC(C)C)cc3)SC2=S)cc1 ZINC000409346073 559066378 /nfs/dbraw/zinc/06/63/78/559066378.db2.gz NASIADVDROYJGM-MOSHPQCFSA-N 0 0 413.564 5.526 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccc(C)cc3)C2=O)ccc1OC(C)C ZINC000409346109 559066357 /nfs/dbraw/zinc/06/63/57/559066357.db2.gz NHXNZMSPRJXTIL-MOSHPQCFSA-N 0 0 413.564 5.587 40 10 HKCBRN CCCn1cc(/C=C2\SC(=S)N(c3ccccc3OC)C2=O)c2ccccc21 ZINC000409346417 559066657 /nfs/dbraw/zinc/06/66/57/559066657.db2.gz KMDJRLVOYCSJMS-MOSHPQCFSA-N 0 0 408.548 5.466 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccc(C)c(C)c3)C2=O)cc(Cl)c1O ZINC000409346553 559066646 /nfs/dbraw/zinc/06/66/46/559066646.db2.gz NUFULRNSKZXTNU-YVLHZVERSA-N 0 0 419.955 5.467 40 10 HKCBRN CN1C(=O)/C(=C\c2cn(Cc3ccc(F)cc3Cl)c3ccccc23)SC1=S ZINC000409346554 560712946 /nfs/dbraw/zinc/71/29/46/560712946.db2.gz KMZABCACQABJTO-QGMBQPNBSA-N 0 0 416.930 5.313 40 10 HKCBRN CC(C)COc1ccc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000409346608 559066636 /nfs/dbraw/zinc/06/66/36/559066636.db2.gz NTNPLDJYCAYPMT-HYARGMPZSA-N 0 0 419.571 6.280 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(Br)cc3)C2=O)ccc1C ZINC000409346647 559066626 /nfs/dbraw/zinc/06/66/26/559066626.db2.gz KWNQCUNNWHVXSA-MHWRWJLKSA-N 0 0 420.353 5.172 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)ccc1OCC(C)C ZINC000409346741 560713054 /nfs/dbraw/zinc/71/30/54/560713054.db2.gz NVJNXSGRGKOCGW-MOSHPQCFSA-N 0 0 413.564 5.526 40 10 HKCBRN CCCn1cc(/C=C2/SC(=S)N(c3ccc(OC)cc3)C2=O)c2ccccc21 ZINC000409346789 559066654 /nfs/dbraw/zinc/06/66/54/559066654.db2.gz NZXCSUHJQBCTHE-DEDYPNTBSA-N 0 0 408.548 5.466 40 10 HKCBRN CC[C@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2cccc3ccccc32)C1=O ZINC000409346810 559066611 /nfs/dbraw/zinc/06/66/11/559066611.db2.gz LKNVWLGDONGGPY-AABCQZNVSA-N 0 0 419.571 6.423 40 10 HKCBRN CC[C@@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2cccc3ccccc32)C1=O ZINC000409346818 559066630 /nfs/dbraw/zinc/06/66/30/559066630.db2.gz LKNVWLGDONGGPY-GRVPHDJPSA-N 0 0 419.571 6.423 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)cc1OC ZINC000409346819 559066628 /nfs/dbraw/zinc/06/66/28/559066628.db2.gz OCZHGTBVSSXJCX-XSFVSMFZSA-N 0 0 413.564 5.588 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)ccc1OC ZINC000409346854 560713061 /nfs/dbraw/zinc/71/30/61/560713061.db2.gz OOWDFSIMAXMQKY-BOPFTXTBSA-N 0 0 405.928 5.153 40 10 HKCBRN CCOc1ccc(Cl)cc1/C=C1\SC(=S)N(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000409346886 559066652 /nfs/dbraw/zinc/06/66/52/559066652.db2.gz OPWQDWYMOPTAFK-YBEGLDIGSA-N 0 0 420.899 5.053 40 10 HKCBRN CC(C)Oc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)cc1 ZINC000409346908 560713058 /nfs/dbraw/zinc/71/30/58/560713058.db2.gz OQVSRFZWDKYZDQ-RQZCQDPDSA-N 0 0 424.374 6.186 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(-c3cc(C)c(C)c([N+](=O)[O-])c3)o2)SC1=S ZINC000409347402 560713152 /nfs/dbraw/zinc/71/31/52/560713152.db2.gz PTJCERNJXCVRJU-YVLHZVERSA-N 0 0 402.497 5.083 40 10 HKCBRN CC(C)n1cc(/C=C2\SC(=S)N(c3ccc(Cl)cc3)C2=O)c2ccccc21 ZINC000409347419 560713154 /nfs/dbraw/zinc/71/31/54/560713154.db2.gz PVFDQMKBSGQXIE-ODLFYWEKSA-N 0 0 412.967 6.281 40 10 HKCBRN CC(C)Oc1ccccc1/C=C1/SC(=S)N(c2cccc(C(F)(F)F)c2)C1=O ZINC000409347465 559066839 /nfs/dbraw/zinc/06/68/39/559066839.db2.gz MIJMXGKKQWNSOO-LICLKQGHSA-N 0 0 423.481 5.898 40 10 HKCBRN COc1ccccc1N1C(=O)/C(=C/c2ccc(-c3ccc(F)cc3)o2)SC1=S ZINC000409347471 559066849 /nfs/dbraw/zinc/06/68/49/559066849.db2.gz PZHHJPAYAACKMW-UNOMPAQXSA-N 0 0 411.479 5.500 40 10 HKCBRN CC(=O)Nc1ccc(/C=C2/SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)cc1 ZINC000409347476 559066793 /nfs/dbraw/zinc/06/67/93/559066793.db2.gz QDPCHANRKKUAGT-LZYBPNLTSA-N 0 0 423.346 5.358 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3ccc(Cl)cc3Cl)SC2=S)c1 ZINC000409347604 559066838 /nfs/dbraw/zinc/06/68/38/559066838.db2.gz MHRGVPVAPKALBB-VIZOYTHASA-N 0 0 412.388 6.121 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C34CC5CC(CC(C5)C3)C4)ccc2OC)SC1=S ZINC000409347628 560713096 /nfs/dbraw/zinc/71/30/96/560713096.db2.gz QPCUILBISQJJIX-JMIUGGIZSA-N 0 0 413.608 5.384 40 10 HKCBRN O=C1/C(=C/c2c(Cl)cccc2Cl)SC(=S)N1c1cccc([N+](=O)[O-])c1 ZINC000409347666 560713150 /nfs/dbraw/zinc/71/31/50/560713150.db2.gz MLKRWECACPNHDX-ZSOIEALJSA-N 0 0 411.291 5.307 40 10 HKCBRN CCc1cccc2c(/C=C3/SC(=S)N(c4cccc([N+](=O)[O-])c4)C3=O)c[nH]c21 ZINC000409347705 559066835 /nfs/dbraw/zinc/06/68/35/559066835.db2.gz NCUOLTISDYXJBB-RQZCQDPDSA-N 0 0 409.492 5.044 40 10 HKCBRN CCCn1cc(/C=C2/SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)c2ccccc21 ZINC000409347758 559066808 /nfs/dbraw/zinc/06/68/08/559066808.db2.gz MRBPSCGRLXNZMJ-YBFXNURJSA-N 0 0 423.519 5.365 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccccc3F)C2=O)ccc1OC(C)C ZINC000409347765 559066845 /nfs/dbraw/zinc/06/68/45/559066845.db2.gz QYMFPZQUSJEPMG-UNOMPAQXSA-N 0 0 417.527 5.417 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3ccc(OC(C)C)cc3)SC2=S)c1 ZINC000409347804 559066842 /nfs/dbraw/zinc/06/68/42/559066842.db2.gz RFPBOJHWBJQQCJ-WQRHYEAKSA-N 0 0 401.578 5.602 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)ccc1OCC(C)C ZINC000409347878 559066834 /nfs/dbraw/zinc/06/68/34/559066834.db2.gz NGWJJZMAIADAEQ-UDWIEESQSA-N 0 0 413.564 5.444 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)ccc1OC(F)F ZINC000409347940 559066848 /nfs/dbraw/zinc/06/68/48/559066848.db2.gz PDCOBPALPRLIHI-MHWRWJLKSA-N 0 0 407.463 5.011 40 10 HKCBRN COc1cc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)ccc1OC(F)F ZINC000409347979 559066837 /nfs/dbraw/zinc/06/68/37/559066837.db2.gz PJPYDWZZVPXCLR-YBEGLDIGSA-N 0 0 407.463 5.011 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000409348110 559066867 /nfs/dbraw/zinc/06/68/67/559066867.db2.gz RFRDTVSGOPOYRT-PZBNQXIHSA-N 0 0 419.571 6.423 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000409348111 560713228 /nfs/dbraw/zinc/71/32/28/560713228.db2.gz RFRDTVSGOPOYRT-QFNCUCFLSA-N 0 0 419.571 6.423 40 10 HKCBRN CCOc1ccc(/C=C2/SC(=S)N(c3cccc(SC)c3)C2=O)cc1OC ZINC000409348119 559066905 /nfs/dbraw/zinc/06/69/05/559066905.db2.gz RJTBSQVRQFVQSN-WOJGMQOQSA-N 0 0 417.577 5.222 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(OCc3ccc(Cl)cc3)cc2)SC1=S ZINC000409348137 559066896 /nfs/dbraw/zinc/06/68/96/559066896.db2.gz RQOMGLFTMRKXPS-PDGQHHTCSA-N 0 0 403.956 5.530 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(OC)c(Cl)c3)C2=O)ccc1C ZINC000409348212 560713258 /nfs/dbraw/zinc/71/32/58/560713258.db2.gz SAKXDNAQQYRJKA-RQZCQDPDSA-N 0 0 405.928 5.071 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)ccc1O[C@@H](C)CC ZINC000409348249 559066881 /nfs/dbraw/zinc/06/68/81/559066881.db2.gz RUAHGHJCYJAHEN-AUQXIXNCSA-N 0 0 413.564 5.668 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)ccc1O[C@H](C)CC ZINC000409348252 560713231 /nfs/dbraw/zinc/71/32/31/560713231.db2.gz RUAHGHJCYJAHEN-NPQOUYBPSA-N 0 0 413.564 5.668 40 10 HKCBRN O=C1/C(=C/c2ccc(N3CCCC3)cc2)SC(=S)N1c1cccc(Cl)c1 ZINC000409348289 560713234 /nfs/dbraw/zinc/71/32/34/560713234.db2.gz RZSIEPJRLKUUIG-PDGQHHTCSA-N 0 0 400.956 5.346 40 10 HKCBRN CCCOc1ccc(/C=C2/SC(=S)N(c3ccccc3F)C2=O)cc1OCC ZINC000409348472 559067152 /nfs/dbraw/zinc/06/71/52/559067152.db2.gz NPIMMZNHLBKSDP-CPNJWEJPSA-N 0 0 417.527 5.419 40 10 HKCBRN Cc1cccc(COc2ccc(/C=C3\SC(=S)N(C4CCCCC4)C3=O)cc2)c1 ZINC000409348508 559067141 /nfs/dbraw/zinc/06/71/41/559067141.db2.gz SZOQFGRMJUUFRO-JCMHNJIXSA-N 0 0 423.603 6.108 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000409348522 559067163 /nfs/dbraw/zinc/06/71/63/559067163.db2.gz OCUAGEBEVIBFIM-FHXOWUIVSA-N 0 0 403.956 5.923 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000409348524 559067134 /nfs/dbraw/zinc/06/71/34/559067134.db2.gz OCUAGEBEVIBFIM-VBEHJTROSA-N 0 0 403.956 5.923 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(Cl)ccc2OCc2cccc(Cl)c2)SC1=S ZINC000409348533 560713403 /nfs/dbraw/zinc/71/34/03/560713403.db2.gz OFLNPHJQJBSJRA-YVLHZVERSA-N 0 0 424.374 5.794 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3cccc(F)c3)C2=O)ccc1OC(C)C ZINC000409348536 559067143 /nfs/dbraw/zinc/06/71/43/559067143.db2.gz OGPBVXMMUZMLPD-ODLFYWEKSA-N 0 0 417.527 5.417 40 10 HKCBRN CCCn1cc(/C=C2\SC(=S)N(c3ccc(N(C)C)cc3)C2=O)c2ccccc21 ZINC000409348538 559067112 /nfs/dbraw/zinc/06/71/12/559067112.db2.gz OHIXBKVEHGPWDX-STZFKDTASA-N 0 0 421.591 5.523 40 10 HKCBRN CC[C@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000409348825 559066888 /nfs/dbraw/zinc/06/68/88/559066888.db2.gz SRIOMTFNRJGTJS-CYUIRQCWSA-N 0 0 403.956 5.923 40 10 HKCBRN CC[C@@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000409348828 559066925 /nfs/dbraw/zinc/06/69/25/559066925.db2.gz SRIOMTFNRJGTJS-FDIDITGRSA-N 0 0 403.956 5.923 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C\c3cc([N+](=O)[O-])ccc3Cl)SC2=S)c(C)c1 ZINC000409348865 559066917 /nfs/dbraw/zinc/06/69/17/559066917.db2.gz SWEFPSGXBOKTBF-CXUHLZMHSA-N 0 0 404.900 5.271 40 10 HKCBRN O=C1/C(=C/c2cccc(Cl)c2Cl)SC(=S)N1c1cccc2ccccc21 ZINC000409348915 559066878 /nfs/dbraw/zinc/06/68/78/559066878.db2.gz UBAWIZHUYBQAFB-BOPFTXTBSA-N 0 0 416.354 6.552 40 10 HKCBRN CCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccc(C)cc2C)C1=O ZINC000409348976 560713402 /nfs/dbraw/zinc/71/34/02/560713402.db2.gz UDFMJWIEZKAUDU-HMAPJEAMSA-N 0 0 419.571 6.261 40 10 HKCBRN CCOc1ccc(Cl)cc1/C=C1\SC(=S)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000409349001 560713374 /nfs/dbraw/zinc/71/33/74/560713374.db2.gz ULFQIIOWQROEKP-SXGWCWSVSA-N 0 0 420.899 5.053 40 10 HKCBRN COc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccc(C)cc2C)C1=O ZINC000409349046 560713358 /nfs/dbraw/zinc/71/33/58/560713358.db2.gz UFQLOYQOFNZUEF-BKUYFWCQSA-N 0 0 405.544 5.871 40 10 HKCBRN CN(C)c1ccc(N2C(=O)/C(=C/c3ccc(C(F)(F)F)cc3)SC2=S)cc1 ZINC000409349092 560713454 /nfs/dbraw/zinc/71/34/54/560713454.db2.gz UKDXPGLRCKJXKL-WJDWOHSUSA-N 0 0 408.470 5.177 40 10 HKCBRN CCCn1cc(/C=C2/SC(=S)N(c3cccc(Cl)c3)C2=O)c2ccccc21 ZINC000409349201 559067021 /nfs/dbraw/zinc/06/70/21/559067021.db2.gz UWVWOOXBHYTZHJ-YBFXNURJSA-N 0 0 412.967 6.111 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(OC)c4ccccc34)SC2=S)cc1 ZINC000409349225 559066999 /nfs/dbraw/zinc/06/69/99/559066999.db2.gz UYIPZCVSQXERAH-KGENOOAVSA-N 0 0 421.543 5.653 40 10 HKCBRN CC(=O)c1ccc(-c2ccc(C=C3SC(=S)N(Cc4ccccc4)C3=O)o2)cc1 ZINC000409349409 559067023 /nfs/dbraw/zinc/06/70/23/559067023.db2.gz PSKLTYMHPHZWHV-BKUYFWCQSA-N 0 0 419.527 5.551 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)ccc1OCC(C)C ZINC000409349531 560713456 /nfs/dbraw/zinc/71/34/56/560713456.db2.gz PWNAXFAKRNJYTL-UDWIEESQSA-N 0 0 413.564 5.131 40 10 HKCBRN O=C1/C(=C/c2cccc(C(F)(F)F)c2)SC(=S)N1c1cccc2ccccc21 ZINC000409349683 560713424 /nfs/dbraw/zinc/71/34/24/560713424.db2.gz QLTMPNODSIRDRW-PDGQHHTCSA-N 0 0 415.461 6.264 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccccc2OCc2ccc(Cl)cc2)SC1=S ZINC000409349735 559067139 /nfs/dbraw/zinc/06/71/39/559067139.db2.gz WARQSDZWJJNCMX-PDGQHHTCSA-N 0 0 403.956 5.530 40 10 HKCBRN COc1ccc(OC)c(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)c1 ZINC000409349813 559067387 /nfs/dbraw/zinc/06/73/87/559067387.db2.gz QXISZGYHQMKQOV-MOSHPQCFSA-N 0 0 407.516 5.263 40 10 HKCBRN Cc1ccc(/C=C2/SC(=S)N(c3ccc(Br)c(Cl)c3)C2=O)cc1 ZINC000409349815 560713470 /nfs/dbraw/zinc/71/34/70/560713470.db2.gz WGGTXYRPVDUKET-OVCLIPMQSA-N 0 0 424.772 5.817 40 10 HKCBRN CCN1C(=O)/C(=C/c2c(OCc3ccccc3)ccc3ccccc32)SC1=S ZINC000409349923 560713577 /nfs/dbraw/zinc/71/35/77/560713577.db2.gz WMCUXHXTOGHZFN-STZFKDTASA-N 0 0 405.544 5.640 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3cccc(C)c3)C2=O)ccc1OC(C)C ZINC000409350017 559067094 /nfs/dbraw/zinc/06/70/94/559067094.db2.gz WVZNWPBKDTZVBY-MOSHPQCFSA-N 0 0 413.564 5.587 40 10 HKCBRN COc1ccc(/C=C2\SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)c2ccccc12 ZINC000409350092 559067210 /nfs/dbraw/zinc/06/72/10/559067210.db2.gz XDLWWJQTHGKONI-ODLFYWEKSA-N 0 0 422.487 5.162 40 10 HKCBRN CCCCOc1ccc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)cc1OC ZINC000409350247 559067199 /nfs/dbraw/zinc/06/71/99/559067199.db2.gz XCVXNQCMGMQWDI-XSFVSMFZSA-N 0 0 413.564 5.588 40 10 HKCBRN CCCn1cc(/C=C2\SC(=S)N(c3ccc(C)c(C)c3)C2=O)c2ccccc21 ZINC000409350277 560713576 /nfs/dbraw/zinc/71/35/76/560713576.db2.gz XTYFPCFNZMJOPN-BKUYFWCQSA-N 0 0 406.576 6.074 40 10 HKCBRN CC(=O)Oc1ccc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)cc1 ZINC000409350360 559067185 /nfs/dbraw/zinc/06/71/85/559067185.db2.gz YCIQQHLEUFQWIC-MOSHPQCFSA-N 0 0 405.500 5.171 40 10 HKCBRN CCCN1C(=O)/C(=C\c2ccccc2OCc2ccc3ccccc3c2)SC1=S ZINC000409350426 559067203 /nfs/dbraw/zinc/06/72/03/559067203.db2.gz YHIWWSAODAXWTN-PXLXIMEGSA-N 0 0 419.571 6.030 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C/c3c(C)n(C)c4ccccc34)SC2=S)c1 ZINC000409350427 560713697 /nfs/dbraw/zinc/71/36/97/560713697.db2.gz RNZALQURDCXNRG-UNOMPAQXSA-N 0 0 410.589 5.614 40 10 HKCBRN O=C1/C(=C/c2cc3ccccc3oc2=O)SC(=S)N1c1cccc2ccccc21 ZINC000409350490 560713706 /nfs/dbraw/zinc/71/37/06/560713706.db2.gz YKLSSYAQHCRSJB-MOSHPQCFSA-N 0 0 415.495 5.352 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3ccc(N4CCCC4)cc3)SC2=S)c1 ZINC000409350654 559067183 /nfs/dbraw/zinc/06/71/83/559067183.db2.gz YQYSYPXYFLTCSD-CPNJWEJPSA-N 0 0 412.605 5.415 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C/c3ccc(Cl)c([N+](=O)[O-])c3)SC2=S)cc1 ZINC000409350655 559067226 /nfs/dbraw/zinc/06/72/26/559067226.db2.gz SDVBOLUJBNCDKJ-YBEGLDIGSA-N 0 0 420.899 5.053 40 10 HKCBRN Cn1cc(/C=C2\SC(=S)N(c3ccc(Cl)cc3Cl)C2=O)c2ccccc21 ZINC000409350715 559067232 /nfs/dbraw/zinc/06/72/32/559067232.db2.gz YMXWDTMNYUIFSD-IUXPMGMMSA-N 0 0 419.358 5.891 40 10 HKCBRN CCCN1C(=O)/C(=C\c2c(C)n(Cc3ccccc3F)c3ccccc23)SC1=S ZINC000409350760 560713688 /nfs/dbraw/zinc/71/36/88/560713688.db2.gz YYTBOEIGWYJUDG-FYJGNVAPSA-N 0 0 424.566 5.748 40 10 HKCBRN CCOc1ccc(N2C(=O)/C(=C\c3ccc(N4CCCC4)cc3C)SC2=S)cc1 ZINC000409350806 559067223 /nfs/dbraw/zinc/06/72/23/559067223.db2.gz YTEMDUGQPIDMGY-RCCKNPSSSA-N 0 0 424.591 5.400 40 10 HKCBRN COc1ccccc1N1C(=O)/C(=C\c2cccc(Oc3ccccc3)c2)SC1=S ZINC000409350810 559067212 /nfs/dbraw/zinc/06/72/12/559067212.db2.gz SIGCHRWAAGCACA-RCCKNPSSSA-N 0 0 419.527 5.893 40 10 HKCBRN Cc1cccc(COc2ccccc2/C=C2\SC(=S)N(C3CCCCC3)C2=O)c1 ZINC000409351106 560713785 /nfs/dbraw/zinc/71/37/85/560713785.db2.gz ZKSYBYMZVODXLK-JCMHNJIXSA-N 0 0 423.603 6.108 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3cn(C(C)C)c4ccccc34)SC2=S)c(C)c1 ZINC000409351137 559067356 /nfs/dbraw/zinc/06/73/56/559067356.db2.gz ZRDHIFQUBOAHTG-MTJSOVHGSA-N 0 0 406.576 6.245 40 10 HKCBRN CCCCOc1ccc(/C=C2\SC(=S)N(c3ccccc3)C2=O)cc1OCC ZINC000409351209 560713763 /nfs/dbraw/zinc/71/37/63/560713763.db2.gz ZHPHMKMRKDELNQ-HKWRFOASSA-N 0 0 413.564 5.670 40 10 HKCBRN COc1ccc(N2C(=O)/C(=C\C(C)=C\c3ccccc3)SC2=S)cc1Cl ZINC000409351399 560713767 /nfs/dbraw/zinc/71/37/67/560713767.db2.gz UNXBONLKCBDSAP-HWVXOFFASA-N 0 0 401.940 5.701 40 10 HKCBRN CC[C@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000409351491 559067294 /nfs/dbraw/zinc/06/72/94/559067294.db2.gz UPBZXAIHYYPITQ-CYUIRQCWSA-N 0 0 414.508 5.178 40 10 HKCBRN CC[C@@H](C)Oc1ccccc1/C=C1\SC(=S)N(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000409351494 559067368 /nfs/dbraw/zinc/06/73/68/559067368.db2.gz UPBZXAIHYYPITQ-FDIDITGRSA-N 0 0 414.508 5.178 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3ccc(F)c(Br)c3)SC2=S)c(C)c1 ZINC000409351560 560713938 /nfs/dbraw/zinc/71/39/38/560713938.db2.gz VCXFDPVXDOMMKG-SXGWCWSVSA-N 0 0 422.344 5.611 40 10 HKCBRN CSc1cccc(N2C(=O)/C(=C\c3ccc(Br)cc3)SC2=S)c1 ZINC000409351594 559067340 /nfs/dbraw/zinc/06/73/40/559067340.db2.gz VAAMNKVOULMUHO-OQLLNIDSSA-N 0 0 422.394 5.577 40 10 HKCBRN CC(=C\c1ccccc1)/C=C1\SC(=S)N(c2ccc(Cl)cc2Cl)C1=O ZINC000409351993 559067384 /nfs/dbraw/zinc/06/73/84/559067384.db2.gz VKAJOPNKCNDDSB-YZXVBUGESA-N 0 0 406.359 6.346 40 10 HKCBRN Cc1ccc(N2C(=O)/C(=C/c3cccc(Oc4ccccc4)c3)SC2=S)cc1 ZINC000409352049 560714017 /nfs/dbraw/zinc/71/40/17/560714017.db2.gz VVKFGWVYGGDGFU-QNGOZBTKSA-N 0 0 403.528 6.193 40 10 HKCBRN CC(C)n1cc(/C=C2\SC(=S)N(c3cccc([N+](=O)[O-])c3)C2=O)c2ccccc21 ZINC000409352092 559067536 /nfs/dbraw/zinc/06/75/36/559067536.db2.gz WFGHVTPUAYCEOW-GRSHGNNSSA-N 0 0 423.519 5.536 40 10 HKCBRN CCCn1cc(/C=C2\SC(=S)N(c3cccc(SC)c3)C2=O)c2ccccc21 ZINC000409352269 559067540 /nfs/dbraw/zinc/06/75/40/559067540.db2.gz XAMIONYIFWIYQX-NDENLUEZSA-N 0 0 424.616 6.179 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)ccc1OCC(C)C ZINC000409352596 560714021 /nfs/dbraw/zinc/71/40/21/560714021.db2.gz XMUJXRKTXLHXBY-UDWIEESQSA-N 0 0 413.564 5.444 40 10 HKCBRN CN(C)c1ccc(N2C(=O)/C(=C/c3ccc(-c4ccccc4)o3)SC2=S)cc1 ZINC000409352634 559068063 /nfs/dbraw/zinc/06/80/63/559068063.db2.gz XMVMQRWRQCOUPY-ZHZULCJRSA-N 0 0 406.532 5.418 40 10 HKCBRN CN(C)c1ccc(N2C(=O)/C(=C/c3ccc(-c4ccc(F)cc4)o3)SC2=S)cc1 ZINC000409352720 559068095 /nfs/dbraw/zinc/06/80/95/559068095.db2.gz YGEKMPBVJDSLMO-MOSHPQCFSA-N 0 0 424.522 5.558 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)SC1=S ZINC000409352734 559068117 /nfs/dbraw/zinc/06/81/17/559068117.db2.gz YYDFNGLTNOXWFK-DHDCSXOGSA-N 0 0 408.888 5.119 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3cccc4ccccc43)C2=O)ccc1OC ZINC000409352743 560714111 /nfs/dbraw/zinc/71/41/11/560714111.db2.gz YZOIWYHZGQKQBT-STZFKDTASA-N 0 0 421.543 5.653 40 10 HKCBRN CC[C@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)cc1OC ZINC000409352786 560714118 /nfs/dbraw/zinc/71/41/18/560714118.db2.gz YVTOOKWDYSICGC-MDBUFAAASA-N 0 0 417.527 5.417 40 10 HKCBRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=S)N(c3cccc(F)c3)C2=O)cc1OC ZINC000409352787 560714108 /nfs/dbraw/zinc/71/41/08/560714108.db2.gz YVTOOKWDYSICGC-OTGIAGGSSA-N 0 0 417.527 5.417 40 10 HKCBRN CCCN1C(=O)/C(=C/c2ccc(OCc3ccccc3)c(OCC)c2)SC1=S ZINC000409352790 559068128 /nfs/dbraw/zinc/06/81/28/559068128.db2.gz ZIHXRFYFSZQVIQ-ZHZULCJRSA-N 0 0 413.564 5.276 40 10 HKCBRN CCCn1cc(/C=C2/SC(=S)N(c3ccc(Cl)cc3)C2=O)c2ccccc21 ZINC000409352876 560714115 /nfs/dbraw/zinc/71/41/15/560714115.db2.gz ZDSDHRQVIWCXSN-XDHOZWIPSA-N 0 0 412.967 6.111 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)cc(Cl)c1OC ZINC000409352910 560714126 /nfs/dbraw/zinc/71/41/26/560714126.db2.gz ZKEUTCPGFMYNJJ-LICLKQGHSA-N 0 0 419.955 5.380 40 10 HKCBRN CCCCOc1ccc2ccccc2c1/C=C1\SC(=S)N(c2ccccc2)C1=O ZINC000409352969 559068226 /nfs/dbraw/zinc/06/82/26/559068226.db2.gz ZTYWMLPBIVMPDX-JWGURIENSA-N 0 0 419.571 6.425 40 10 HKCBRN COc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3C)C2=O)ccc1OC(F)F ZINC000409353232 560714133 /nfs/dbraw/zinc/71/41/33/560714133.db2.gz ZHDGURTZAYISEU-LICLKQGHSA-N 0 0 421.490 5.319 40 10 HKCBRN CCCN1C(=O)S/C(=C/c2ccc(N(CC)CC)cc2OCc2ccccc2)C1=O ZINC000409355622 560714479 /nfs/dbraw/zinc/71/44/79/560714479.db2.gz CTTYYAAJOLADPM-PXLXIMEGSA-N 0 0 424.566 5.558 40 10 HKCBRN CCCN1C(=O)S/C(=C\c2cc(C)n(-c3cccc(C(F)(F)F)c3)c2C)C1=O ZINC000409356595 559069601 /nfs/dbraw/zinc/06/96/01/559069601.db2.gz IDMZOWMZKPYLIR-YVLHZVERSA-N 0 0 408.445 5.559 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3ccc(C)cc3)C2=O)ccc1OC(F)F ZINC000409357283 560715602 /nfs/dbraw/zinc/71/56/02/560715602.db2.gz PTERYTJHUSKXBO-GZTJUZNOSA-N 0 0 421.490 5.401 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(Cc3ccccc3)C2=O)ccc1OC(F)F ZINC000409357337 559069716 /nfs/dbraw/zinc/06/97/16/559069716.db2.gz PYVLTPHJWKVWRM-GZTJUZNOSA-N 0 0 421.490 5.088 40 10 HKCBRN CCN(CC)c1ccc(/C=C2/SC(=O)N(CC)C2=O)c(OCc2ccccc2)c1 ZINC000409358013 560715771 /nfs/dbraw/zinc/71/57/71/560715771.db2.gz JPJRSTPPAKLBFB-KGENOOAVSA-N 0 0 410.539 5.168 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)ccc1OC(F)F ZINC000409358631 560715801 /nfs/dbraw/zinc/71/58/01/560715801.db2.gz MNHSRQRNRZPFQI-LFIBNONCSA-N 0 0 413.511 5.221 40 10 HKCBRN CCOc1cc(/C=C2\SC(=S)N(c3ccccc3C)C2=O)ccc1OC(F)F ZINC000409363239 559069817 /nfs/dbraw/zinc/06/98/17/559069817.db2.gz VDAPDHWGBNNDPN-BOPFTXTBSA-N 0 0 421.490 5.401 40 10 HKCBRN CCOc1cc(/C=C2/SC(=S)N(c3cccc(C)c3)C2=O)ccc1OC(F)F ZINC000409364406 560715247 /nfs/dbraw/zinc/71/52/47/560715247.db2.gz XTPIRFIJJQXZBT-GZTJUZNOSA-N 0 0 421.490 5.401 40 10 HKCBRN CCN1C(=O)/C(=C\c2cc(C)n(-c3ccc(-c4ccccc4)cc3)c2C)SC1=S ZINC000409369557 559069943 /nfs/dbraw/zinc/06/99/43/559069943.db2.gz CVSOURJSNNUJIB-PXLXIMEGSA-N 0 0 418.587 5.982 40 10 HKCBRN CCN1C(=O)/C(=C/c2c(OCc3ccc(C)cc3)ccc3ccccc32)SC1=S ZINC000409369643 560716622 /nfs/dbraw/zinc/71/66/22/560716622.db2.gz DJKIYOOMZDWIFV-HMAPJEAMSA-N 0 0 419.571 5.948 40 10 HKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccccc3Br)c2C)SC1=S ZINC000409369895 559069941 /nfs/dbraw/zinc/06/99/41/559069941.db2.gz HEXZSOFNHJXGKB-YBEGLDIGSA-N 0 0 421.385 5.078 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(SC)c2)C(=O)/C1=C\c1ccc(C(C)(C)C)cc1 ZINC000409369983 560716603 /nfs/dbraw/zinc/71/66/03/560716603.db2.gz ITNXPHNIZSSCHU-STZFKDTASA-N 0 0 421.562 5.583 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc3ccccc32)C(=O)/C1=C\c1ccc(Cl)cc1 ZINC000409370456 559069993 /nfs/dbraw/zinc/06/99/93/559069993.db2.gz RFDPVLVZIVAQLU-ZHZULCJRSA-N 0 0 403.865 5.370 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc3ccccc32)C(=O)/C1=C\c1ccccc1Cl ZINC000409372453 560716896 /nfs/dbraw/zinc/71/68/96/560716896.db2.gz ZGHIOLVMZPHRTB-RGEXLXHISA-N 0 0 403.865 5.370 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(SC)c2)C(=O)/C1=C\c1ccc(SC)cc1 ZINC000409374862 560717137 /nfs/dbraw/zinc/71/71/37/560717137.db2.gz ARDGZOCSOUDXRK-UNOMPAQXSA-N 0 0 411.548 5.008 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(C(C)=O)c2)C(=O)C1=Cc1ccc(C(C)(C)C)cc1 ZINC000409374993 559070104 /nfs/dbraw/zinc/07/01/04/559070104.db2.gz CROAYIGMZQVJKM-HMAPJEAMSA-N 0 0 417.505 5.064 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(SC)c2)C(=O)/C1=C\c1cccc2ccccc12 ZINC000409375304 559070107 /nfs/dbraw/zinc/07/01/07/559070107.db2.gz ISYRGVRIBUILLM-HMAPJEAMSA-N 0 0 415.514 5.439 40 10 HKCBRN CCOc1ccccc1/C=C1\C(=O)N(c2cccc3ccccc32)C(C)=C1C(=O)OC ZINC000409375386 559070113 /nfs/dbraw/zinc/07/01/13/559070113.db2.gz KBLXAOMIVWZADD-PGMHBOJBSA-N 0 0 413.473 5.116 40 10 HKCBRN CCN1C(=O)/C(=C/c2c(OCc3ccc(F)cc3)ccc3ccccc32)SC1=S ZINC000409376510 559070157 /nfs/dbraw/zinc/07/01/57/559070157.db2.gz BKRBYHVOBYANGC-BKUYFWCQSA-N 0 0 423.534 5.779 40 10 HKCBRN COC(=O)C1=C(C)N(c2cccc(SC)c2)C(=O)/C1=C\c1c(F)cccc1Cl ZINC000409378322 559070666 /nfs/dbraw/zinc/07/06/66/559070666.db2.gz NVOXVKLHSKIWEK-WJDWOHSUSA-N 0 0 417.889 5.078 40 10 HKCBRN O=C1/C(=C\c2coc3ccccc3c2=O)SC(=S)N1c1cccc2ccccc21 ZINC000409379710 560718610 /nfs/dbraw/zinc/71/86/10/560718610.db2.gz ZPNAJRDXWPHYAE-UDWIEESQSA-N 0 0 415.495 5.352 40 10 HKCBRN COC(=O)C1=C(C)N(c2ccc(C(F)(F)F)cc2)C(=O)/C1=C\c1ccc(Cl)cc1 ZINC000409385664 559071389 /nfs/dbraw/zinc/07/13/89/559071389.db2.gz IYEUPIGUMXVXNV-BOPFTXTBSA-N 0 0 421.802 5.236 40 10 HKCBRN