smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)(NCc1cccc2c1OCCO2)c1ccc(Cl)c(Cl)c1 ZINC000109618019 206061052 /nfs/dbraw/zinc/06/10/52/206061052.db2.gz SOJLSCRYQRJMGF-UHFFFAOYSA-N 0 1 352.261 4.790 20 0 FJADMN C[C@@H](N[C@@H](C)C(=O)Nc1cccc2ncccc21)c1cccc(Cl)c1 ZINC000115551467 206096075 /nfs/dbraw/zinc/09/60/75/206096075.db2.gz HFLUYXICAKBDLY-KGLIPLIRSA-N 0 1 353.853 4.566 20 0 FJADMN Cc1ccc2nc(S[C@H](C)C(=O)Nc3cccc4ncccc43)[nH]c2c1 ZINC000022734317 211361288 /nfs/dbraw/zinc/36/12/88/211361288.db2.gz IJZITKUXXUPFSS-CYBMUJFWSA-N 0 1 362.458 4.539 20 0 FJADMN COc1ccc(OC)c([C@H](C)N[C@H](C)c2ccc(Br)s2)c1 ZINC000038002884 211342637 /nfs/dbraw/zinc/34/26/37/211342637.db2.gz SLKCEOVULPABKO-WDEREUQCSA-N 0 1 370.312 4.940 20 0 FJADMN Fc1cccc(N2CCCC2)c1CNCc1cccc(C(F)(F)F)c1 ZINC000098078524 222226911 /nfs/dbraw/zinc/22/69/11/222226911.db2.gz UNFHUSFKAOOROV-UHFFFAOYSA-N 0 1 352.375 4.735 20 0 FJADMN COc1cc(CNC2c3ccccc3-c3ccccc32)cc(OC)c1OC ZINC000060842129 567855352 /nfs/dbraw/zinc/85/53/52/567855352.db2.gz IUGLHBDVSROCCR-UHFFFAOYSA-N 0 1 361.441 4.572 20 0 FJADMN COc1ccc([C@H](C)NCC(=O)Nc2ccc(C)cc2Cl)cc1Cl ZINC000602576750 567993178 /nfs/dbraw/zinc/99/31/78/567993178.db2.gz QFBXDZWVMJVYOU-LBPRGKRZSA-N 0 1 367.276 4.600 20 0 FJADMN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@@H](C)c2cc(F)ccc2F)cc1 ZINC000602570202 567996034 /nfs/dbraw/zinc/99/60/34/567996034.db2.gz ALTUOTXEXNJBTE-KGLIPLIRSA-N 0 1 361.436 4.907 20 0 FJADMN Cc1ccc(NC(=O)CN[C@@H](C)c2ccc(F)c(Cl)c2)c(Cl)c1 ZINC000602576662 567996773 /nfs/dbraw/zinc/99/67/73/567996773.db2.gz DMONGGWORXCVMH-NSHDSACASA-N 0 1 355.240 4.730 20 0 FJADMN CSC1CCN([C@@H](C)c2nnc(-c3ccc4ccccc4c3)o2)CC1 ZINC000602919637 568012941 /nfs/dbraw/zinc/01/29/41/568012941.db2.gz JALLXXJXVDLXIL-AWEZNQCLSA-N 0 1 353.491 4.778 20 0 FJADMN OC1(CNCc2csc(-c3ccc(Cl)cc3)n2)CCCCCC1 ZINC000522755293 568033163 /nfs/dbraw/zinc/03/31/63/568033163.db2.gz DNXFBTKZIOVROS-UHFFFAOYSA-N 0 1 350.915 4.638 20 0 FJADMN CN(C[C@H]1CCCO[C@H]1c1ccccc1)c1ccnc2cc(F)ccc21 ZINC000603493688 568107902 /nfs/dbraw/zinc/10/79/02/568107902.db2.gz BLHKNSJVCYIRQW-VGSWGCGISA-N 0 1 350.437 4.978 20 0 FJADMN CC(C)(C)n1cc(CN[C@@H]2CCOc3c(-c4ccccc4)cccc32)cn1 ZINC000603518266 568112057 /nfs/dbraw/zinc/11/20/57/568112057.db2.gz DMKRRWJBSWMQBX-OAQYLSRUSA-N 0 1 361.489 4.919 20 0 FJADMN Cc1cc(CNC(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)n[nH]1 ZINC000603572812 568120511 /nfs/dbraw/zinc/12/05/11/568120511.db2.gz RRIJWQDFZUFAQP-UHFFFAOYSA-N 0 1 372.881 4.844 20 0 FJADMN O=[S@](CCN1CC[C@@H](c2ccccc2)C1)c1cc(Cl)ccc1Cl ZINC000522775844 568131969 /nfs/dbraw/zinc/13/19/69/568131969.db2.gz CPZNOJODNJYUNH-IQMFZBJNSA-N 0 1 368.329 4.591 20 0 FJADMN O=[S@@](CCN1CC[C@H](c2ccccc2)C1)c1cc(Cl)ccc1Cl ZINC000522775846 568131977 /nfs/dbraw/zinc/13/19/77/568131977.db2.gz CPZNOJODNJYUNH-WNSKOXEYSA-N 0 1 368.329 4.591 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccccn3)[nH]c2c1)c1ccc(C(F)F)cc1 ZINC000603870906 568174115 /nfs/dbraw/zinc/17/41/15/568174115.db2.gz NKMZDVABOJYAAW-UHFFFAOYSA-N 0 1 364.355 4.815 20 0 FJADMN COC(=O)c1ccc([C@H](C)N2CC=C(c3c[nH]c4cc(F)ccc43)CC2)o1 ZINC000603880851 568176252 /nfs/dbraw/zinc/17/62/52/568176252.db2.gz JNRYIIGHDQLGTP-ZDUSSCGKSA-N 0 1 368.408 4.537 20 0 FJADMN COc1ccc(CNCc2cc(C)cc3c(C)c(C)[nH]c32)c(OC(F)F)c1 ZINC000604065779 568205444 /nfs/dbraw/zinc/20/54/44/568205444.db2.gz KYQRLIOOKAIYTH-UHFFFAOYSA-N 0 1 374.431 4.993 20 0 FJADMN COc1ccc([C@@H]2CCCCC[N@H+]2CCc2ccccc2C(=O)[O-])cc1 ZINC000516657169 568213158 /nfs/dbraw/zinc/21/31/58/568213158.db2.gz VTYPEYYRNSZGJY-NRFANRHFSA-N 0 1 353.462 4.553 20 0 FJADMN CC(=O)N(c1nc(CN[C@@H]2CCC[C@H](F)C2)cs1)c1ccc(C)cc1 ZINC000563121720 568222696 /nfs/dbraw/zinc/22/26/96/568222696.db2.gz CQMISOYZIAHJKJ-JKSUJKDBSA-N 0 1 361.486 4.506 20 0 FJADMN CC(C)c1c(C(=O)Nc2cccc(Cl)c2O)cnn1-c1ccc(F)cc1 ZINC000604266602 568241338 /nfs/dbraw/zinc/24/13/38/568241338.db2.gz DEBLNZPGVIAGMO-UHFFFAOYSA-N 0 1 373.815 4.746 20 0 FJADMN Cc1c(Br)cccc1NC(=O)c1cc(-c2ccc(F)cc2)n[nH]1 ZINC000303125808 568252269 /nfs/dbraw/zinc/25/22/69/568252269.db2.gz GWJCTCGEGPSQGM-UHFFFAOYSA-N 0 1 374.213 4.539 20 0 FJADMN COc1cc(CN[C@@H](c2ccccc2Cl)C(C)C)cc2c1OCCO2 ZINC000604417030 568275176 /nfs/dbraw/zinc/27/51/76/568275176.db2.gz ZFBNKNAIPDZDTK-LJQANCHMSA-N 0 1 361.869 4.607 20 0 FJADMN O=C(CSCc1ccc(F)cc1)Nc1ccc2nc(C3CCC3)[nH]c2c1 ZINC000604539499 568309323 /nfs/dbraw/zinc/30/93/23/568309323.db2.gz RAQNTUXSROSGMW-UHFFFAOYSA-N 0 1 369.465 4.841 20 0 FJADMN CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(CN3CCSCC3)cc2)CC1 ZINC000604716787 568355797 /nfs/dbraw/zinc/35/57/97/568355797.db2.gz POBOIQIOYQEQKO-HXUWFJFHSA-N 0 1 374.594 4.524 20 0 FJADMN CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1ccc(CN(CC)CC)o1 ZINC000604736249 568358798 /nfs/dbraw/zinc/35/87/98/568358798.db2.gz SGALJVGXJIPTOK-KRWDZBQOSA-N 0 1 362.901 4.526 20 0 FJADMN Cc1ccc(OC2CCN(Cc3cc(-c4ccc(F)cc4)no3)CC2)cc1 ZINC000604885551 568380754 /nfs/dbraw/zinc/38/07/54/568380754.db2.gz PVOFBNZZFIYOLX-UHFFFAOYSA-N 0 1 366.436 4.833 20 0 FJADMN Cc1[nH]c(SCc2cn3cc(Cl)ccc3n2)nc1Cc1ccccc1 ZINC000005312418 568382174 /nfs/dbraw/zinc/38/21/74/568382174.db2.gz OSHVYGSNUXUAAL-UHFFFAOYSA-N 0 1 368.893 4.902 20 0 FJADMN CCc1cccc2c(C3CCN(Cc4ccn(C(C)C)n4)CC3)c[nH]c21 ZINC000604884359 568384545 /nfs/dbraw/zinc/38/45/45/568384545.db2.gz LLMHJWVLWAFQAY-UHFFFAOYSA-N 0 1 350.510 4.887 20 0 FJADMN Cc1ccc(-c2n[nH]c(SCC(=O)C34CC5CC(CC(C5)C3)C4)n2)cc1 ZINC000005865903 568394254 /nfs/dbraw/zinc/39/42/54/568394254.db2.gz FHBCOTMCANAFOJ-UHFFFAOYSA-N 0 1 367.518 4.658 20 0 FJADMN c1sc(C2CCCCC2)nc1CSc1nc(-c2ccccn2)n[nH]1 ZINC000604932769 568395246 /nfs/dbraw/zinc/39/52/46/568395246.db2.gz LISGABFXZDHHGS-UHFFFAOYSA-N 0 1 357.508 4.663 20 0 FJADMN CC(C)(C)c1ccc(C(=O)CSc2nc(-c3ccccc3)n[nH]2)cc1 ZINC000006178352 568399511 /nfs/dbraw/zinc/39/95/11/568399511.db2.gz MBFPJEWZOJQSBG-UHFFFAOYSA-N 0 1 351.475 4.744 20 0 FJADMN CC(C)(C)c1ccc(NC(=O)CSc2nc(-c3ccccc3)n[nH]2)cc1 ZINC000006178788 568399569 /nfs/dbraw/zinc/39/95/69/568399569.db2.gz QKGKQUZIUAFLMC-UHFFFAOYSA-N 0 1 366.490 4.500 20 0 FJADMN CCc1c2cc(C)ccc2oc1[C@H](C)NCc1ccc([S@@](C)=O)cc1 ZINC000182006547 568400900 /nfs/dbraw/zinc/40/09/00/568400900.db2.gz QWUSGHWDAILYQK-ODCWNRFASA-N 0 1 355.503 4.892 20 0 FJADMN COc1ccc(-c2cc(CN3CCC[C@H](CC(F)(F)F)C3)on2)cc1 ZINC000643253833 568401295 /nfs/dbraw/zinc/40/12/95/568401295.db2.gz BJYMGJPBXHSJDQ-CYBMUJFWSA-N 0 1 354.372 4.515 20 0 FJADMN Cc1ccc2nc(SCC(=O)Nc3ccccc3C(C)(C)C)[nH]c2c1 ZINC000006516894 568403372 /nfs/dbraw/zinc/40/33/72/568403372.db2.gz YGAFSUOTHXQSFY-UHFFFAOYSA-N 0 1 353.491 4.900 20 0 FJADMN COc1ccc(F)cc1[C@H](C)N[C@@H]1CCc2c1cccc2Br ZINC000319743193 568414206 /nfs/dbraw/zinc/41/42/06/568414206.db2.gz RCDFUQDIIIBLJL-APPDUMDISA-N 0 1 364.258 4.935 20 0 FJADMN Cc1cc2c[nH]nc2c(C(=O)Nc2nc(C=Cc3ccccc3)cs2)c1 ZINC000604990274 568509366 /nfs/dbraw/zinc/50/93/66/568509366.db2.gz MSSFMHGXQGXGCD-BQYQJAHWSA-N 0 1 360.442 4.751 20 0 FJADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccc2c(cnn2C(C)C)c1 ZINC000604992532 568510346 /nfs/dbraw/zinc/51/03/46/568510346.db2.gz SILJNDATJYPKFS-UHFFFAOYSA-N 0 1 359.433 4.568 20 0 FJADMN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1nc(-c2ccccc2)n[nH]1 ZINC000007633493 568613241 /nfs/dbraw/zinc/61/32/41/568613241.db2.gz GCCJVLOIJBEUJN-GFCCVEGCSA-N 0 1 372.881 4.553 20 0 FJADMN Cc1sc2[nH]c([C@@H](C)Sc3nc4ccc(C)cc4[nH]3)nc(=O)c2c1C ZINC000006292216 210088854 /nfs/dbraw/zinc/08/88/54/210088854.db2.gz SCHWQWLBRLROPT-LLVKDONJSA-N 0 1 370.503 4.639 20 0 FJADMN CC(=O)c1ccc(NS(=O)(=O)c2c(C)c(Cl)cc(C)c2Cl)cc1 ZINC000007052399 204288043 /nfs/dbraw/zinc/28/80/43/204288043.db2.gz JPQKYHPHPUUMTM-UHFFFAOYSA-N 0 1 372.273 4.614 20 0 FJADMN O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cc2cc(Cl)ccc2o1 ZINC000023740755 211395293 /nfs/dbraw/zinc/39/52/93/211395293.db2.gz HUGBTNWOXGVRGM-GOSISDBHSA-N 0 1 368.864 4.653 20 0 FJADMN CC(C)c1ccccc1NS(=O)(=O)c1ccccc1OC(F)(F)F ZINC000105549980 222371232 /nfs/dbraw/zinc/37/12/32/222371232.db2.gz VQDIHYLTJUIDEN-UHFFFAOYSA-N 0 1 359.369 4.509 20 0 FJADMN CC(C)c1ccoc1C(=O)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000670817872 567829216 /nfs/dbraw/zinc/82/92/16/567829216.db2.gz HQVDKDUYMUULFF-MRXNPFEDSA-N 0 1 370.497 4.589 20 0 FJADMN C[C@H](c1ccc(Br)cc1)N1CCCO[C@H](c2ccccc2)C1 ZINC000602238744 567954831 /nfs/dbraw/zinc/95/48/31/567954831.db2.gz DCJVVJKARYNENJ-BEFAXECRSA-N 0 1 360.295 4.974 20 0 FJADMN CC(=O)N(c1nc(CNC(C)(C)CC2CCCCCC2)cs1)C1CC1 ZINC000186610593 567958664 /nfs/dbraw/zinc/95/86/64/567958664.db2.gz APKCXURAFWYMIS-UHFFFAOYSA-N 0 1 363.571 4.887 20 0 FJADMN Cc1noc(C)c1CNCc1cn(-c2ccccc2)nc1-c1ccccc1C ZINC000063550132 567980850 /nfs/dbraw/zinc/98/08/50/567980850.db2.gz IPYRQXFFBMPIHG-UHFFFAOYSA-N 0 1 372.472 4.742 20 0 FJADMN Cc1ccc(NC(=O)CN[C@H](C)c2ccc(C(F)(F)F)cc2)c(Cl)c1 ZINC000602576810 567993161 /nfs/dbraw/zinc/99/31/61/567993161.db2.gz WMLNBOLHAAACGD-GFCCVEGCSA-N 0 1 370.802 4.957 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN3C(=O)C3(C)CCC(F)(F)CC3)[nH]c2c1 ZINC000636756391 568035411 /nfs/dbraw/zinc/03/54/11/568035411.db2.gz UYNMPSPKTCJQCC-MRXNPFEDSA-N 0 1 361.436 4.750 20 0 FJADMN Cc1ccc(C[C@@H]2CCCN(Cc3nnc(-c4ccc(C)cc4)o3)C2)cc1 ZINC000065254140 568047375 /nfs/dbraw/zinc/04/73/75/568047375.db2.gz FGVJZMNHMHNDSF-FQEVSTJZSA-N 0 1 361.489 4.808 20 0 FJADMN CCOC(=O)c1ncc(CN[C@@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000602806087 568048645 /nfs/dbraw/zinc/04/86/45/568048645.db2.gz OOUQPRJEGAXMIB-ZDUSSCGKSA-N 0 1 364.536 4.671 20 0 FJADMN CCCCCOc1ccc(CN[C@H]2CCOc3c(OC)cccc32)cc1 ZINC000603519013 568109154 /nfs/dbraw/zinc/10/91/54/568109154.db2.gz UVNWLGHFKCRNEB-FQEVSTJZSA-N 0 1 355.478 4.878 20 0 FJADMN Cc1nc(-c2ccc(CNCc3ccc(Br)cn3)cc2)cs1 ZINC000603720137 568147666 /nfs/dbraw/zinc/14/76/66/568147666.db2.gz QVZNWJJEPXZCHR-UHFFFAOYSA-N 0 1 374.307 4.566 20 0 FJADMN CCc1cccc2c(C(=O)[C@H](NCCSC)c3ccccc3)c[nH]c21 ZINC000603743745 568148136 /nfs/dbraw/zinc/14/81/36/568148136.db2.gz LHBABSSILHFQQV-HXUWFJFHSA-N 0 1 352.503 4.607 20 0 FJADMN COC(=O)c1ccc([C@@H](C)N2CC=C(c3c[nH]c4cc(F)ccc43)CC2)o1 ZINC000603880850 568176240 /nfs/dbraw/zinc/17/62/40/568176240.db2.gz JNRYIIGHDQLGTP-CYBMUJFWSA-N 0 1 368.408 4.537 20 0 FJADMN C[C@@H](C(=O)Nc1cccc(-c2nnc[nH]2)c1)c1c(Cl)cccc1Cl ZINC000603903046 568180437 /nfs/dbraw/zinc/18/04/37/568180437.db2.gz FRQMFLBQQUHWOV-SNVBAGLBSA-N 0 1 361.232 4.521 20 0 FJADMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1ccc(Oc2ccc(F)cc2)cc1 ZINC000603905182 568180813 /nfs/dbraw/zinc/18/08/13/568180813.db2.gz KBWYHCQADKFQGW-UHFFFAOYSA-N 0 1 374.375 4.655 20 0 FJADMN COC(=O)c1ccc([C@H](C)Sc2nc3ccc(C(F)(F)F)cc3[nH]2)o1 ZINC000603938053 568184372 /nfs/dbraw/zinc/18/43/72/568184372.db2.gz IRZPSKGPSDZHDK-QMMMGPOBSA-N 0 1 370.352 4.815 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN(C(=O)[C@@H](C)CC4CCCC4)C3)[nH]c2c1 ZINC000603966292 568191203 /nfs/dbraw/zinc/19/12/03/568191203.db2.gz OPQKUROGKCDGFD-FUHWJXTLSA-N 0 1 353.510 4.794 20 0 FJADMN CC(=O)c1c(C)cc(C)c(C[N@@H+]2CCCN(Cc3ccccc3)CC2)c1C ZINC000028157164 568193281 /nfs/dbraw/zinc/19/32/81/568193281.db2.gz LSJPBKUWQDKVJI-UHFFFAOYSA-N 0 1 364.533 4.522 20 0 FJADMN O=C(c1cc(-c2cccs2)[nH]n1)N1CCC[C@H]1c1ccccc1Cl ZINC000617127784 568220552 /nfs/dbraw/zinc/22/05/52/568220552.db2.gz QVBIJDUYLMOIPC-INIZCTEOSA-N 0 1 357.866 4.769 20 0 FJADMN CC(=O)N(c1nc(CN[C@@H]2CCC[C@@H](F)C2)cs1)c1ccc(C)cc1 ZINC000563121719 568222761 /nfs/dbraw/zinc/22/27/61/568222761.db2.gz CQMISOYZIAHJKJ-HZPDHXFCSA-N 0 1 361.486 4.506 20 0 FJADMN COc1cccc(Cl)c1C(=O)N1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 ZINC000607813331 568227123 /nfs/dbraw/zinc/22/71/23/568227123.db2.gz NKTZXLBEETZTPB-INIZCTEOSA-N 0 1 369.852 4.511 20 0 FJADMN CN(CCC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccccc1F ZINC000024897421 568234100 /nfs/dbraw/zinc/23/41/00/568234100.db2.gz NHOTYWPFSVQEBW-UHFFFAOYSA-N 0 1 355.240 4.593 20 0 FJADMN Brc1cccc(CN(Cc2cccs2)C[C@@H]2CCCO2)c1 ZINC000302741732 568234179 /nfs/dbraw/zinc/23/41/79/568234179.db2.gz RDWVYWNILIRSFJ-INIZCTEOSA-N 0 1 366.324 4.692 20 0 FJADMN C[C@@H](c1ccccc1)N(C)CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1 ZINC000302737606 568236660 /nfs/dbraw/zinc/23/66/60/568236660.db2.gz KIAXCAZLVWYNPU-AWEZNQCLSA-N 0 1 365.304 4.645 20 0 FJADMN C(=Cc1ccccc1)c1n[nH]c(SCc2coc(-c3cccs3)n2)n1 ZINC000012835886 568241589 /nfs/dbraw/zinc/24/15/89/568241589.db2.gz SHLBWQJKGDAGKU-CMDGGOBGSA-N 0 1 366.471 4.984 20 0 FJADMN CCCN(CCSc1ccc(F)cc1)CC(=O)Nc1ccccc1C ZINC000007696429 568249197 /nfs/dbraw/zinc/24/91/97/568249197.db2.gz QUZRKSQDDTYYKY-UHFFFAOYSA-N 0 1 360.498 4.577 20 0 FJADMN Cc1n[nH]c(C(=O)N[C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)c1C ZINC000604328949 568250472 /nfs/dbraw/zinc/25/04/72/568250472.db2.gz FTQNBCVRUYBWBN-NSHDSACASA-N 0 1 374.897 4.603 20 0 FJADMN COc1ccccc1CC1CCN(Cc2coc(-c3ccccc3)n2)CC1 ZINC000303203065 568257294 /nfs/dbraw/zinc/25/72/94/568257294.db2.gz XVUKTUMLYIYYPS-UHFFFAOYSA-N 0 1 362.473 4.805 20 0 FJADMN CN(C)Cc1cc(CNC(=O)C23CC4C[C@@](C)(C2)C[C@](C)(C4)C3)ccc1F ZINC000604342538 568260034 /nfs/dbraw/zinc/26/00/34/568260034.db2.gz CYTQRJQJPPEFKI-SVIALIIXSA-N 0 1 372.528 4.500 20 0 FJADMN CCCCCOCC(=O)Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1 ZINC000303259577 568260257 /nfs/dbraw/zinc/26/02/57/568260257.db2.gz HNDXGVFYRDTVAN-UHFFFAOYSA-N 0 1 355.413 4.514 20 0 FJADMN CC(C)(NCc1ccc(-c2c(F)cccc2F)o1)C(=O)Nc1ccccc1 ZINC000604416652 568274953 /nfs/dbraw/zinc/27/49/53/568274953.db2.gz UTFGNAVOWXGIOW-UHFFFAOYSA-N 0 1 370.399 4.732 20 0 FJADMN C[C@@H](C(=O)Nc1cc(Cl)ccc1F)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000604393000 568283070 /nfs/dbraw/zinc/28/30/70/568283070.db2.gz QGDBBLCYUDPIPA-IJEWVQPXSA-N 0 1 360.860 4.684 20 0 FJADMN Fc1ccc(OC2CCN(Cc3cc(-c4ccccc4)no3)CC2)cc1 ZINC000604393973 568283745 /nfs/dbraw/zinc/28/37/45/568283745.db2.gz YGZUFOUPMIAPRF-UHFFFAOYSA-N 0 1 352.409 4.524 20 0 FJADMN CC(C)c1ccccc1NC(=O)CN(Cc1ccc(F)cc1)CC1CC1 ZINC000604396173 568295396 /nfs/dbraw/zinc/29/53/96/568295396.db2.gz MAMSVXTVFJCZDQ-UHFFFAOYSA-N 0 1 354.469 4.800 20 0 FJADMN O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(O)c(Cl)c1 ZINC000314185445 568332156 /nfs/dbraw/zinc/33/21/56/568332156.db2.gz XTCQVOZQHQFGEX-UHFFFAOYSA-N 0 1 350.123 4.970 20 0 FJADMN CC[C@@H](C)[C@@H](C(=O)NCc1nc2ccc(Cl)cc2[nH]1)c1ccccc1 ZINC000604867726 568380527 /nfs/dbraw/zinc/38/05/27/568380527.db2.gz GSRIQMFUPGNGPP-BFUOFWGJSA-N 0 1 355.869 4.662 20 0 FJADMN Cc1[nH]ncc1[C@@H]1Nc2ccccc2C(=O)N1c1ccc(Cl)c(Cl)c1 ZINC000604891798 568381933 /nfs/dbraw/zinc/38/19/33/568381933.db2.gz XOSBQIKKRMRKOU-QGZVFWFLSA-N 0 1 373.243 4.796 20 0 FJADMN Fc1ccc(CCN(Cc2nc3ccccc3n2C(F)F)C2CC2)cc1 ZINC000604903078 568385478 /nfs/dbraw/zinc/38/54/78/568385478.db2.gz HOWKNUBDNHIRRL-UHFFFAOYSA-N 0 1 359.395 4.778 20 0 FJADMN COc1ccc(F)cc1[C@@H](C)N[C@H]1CCc2c1cccc2Br ZINC000319743194 568414211 /nfs/dbraw/zinc/41/42/11/568414211.db2.gz RCDFUQDIIIBLJL-DIFFPNOSSA-N 0 1 364.258 4.935 20 0 FJADMN C[C@H](c1cccs1)N(C)CC[S@@](=O)c1cc(Cl)ccc1Cl ZINC000032937818 568428908 /nfs/dbraw/zinc/42/89/08/568428908.db2.gz MVWIZCFYQZCFCT-FIKIJFGZSA-N 0 1 362.347 4.856 20 0 FJADMN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(F)cc1Cl)c1cccc(Cl)c1 ZINC000007093152 568446126 /nfs/dbraw/zinc/44/61/26/568446126.db2.gz RZRIAXMDSMEAKT-MNOVXSKESA-N 0 1 355.240 4.810 20 0 FJADMN Cc1cc(OCc2ccccc2)ccc1NS(=O)(=O)c1ccccc1F ZINC000604972254 568464803 /nfs/dbraw/zinc/46/48/03/568464803.db2.gz JHFWQGDUOPAYFU-UHFFFAOYSA-N 0 1 371.433 4.514 20 0 FJADMN Brc1ccccc1-c1n[nH]c(SCCc2ccccc2)n1 ZINC000007252030 568486737 /nfs/dbraw/zinc/48/67/37/568486737.db2.gz WOIIMMOSLLVWRT-UHFFFAOYSA-N 0 1 360.280 4.569 20 0 FJADMN CCc1ccc(CN2CCCN(C(=O)Nc3cccc(Cl)c3)CC2)cc1 ZINC000604997593 568508141 /nfs/dbraw/zinc/50/81/41/568508141.db2.gz QAGRJSHBOANDJW-UHFFFAOYSA-N 0 1 371.912 4.642 20 0 FJADMN O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cc(F)cc2[nH]cnc21 ZINC000604991326 568509809 /nfs/dbraw/zinc/50/98/09/568509809.db2.gz YLHSLAPCUOTCHH-SREVYHEPSA-N 0 1 364.405 4.581 20 0 FJADMN Cc1csc(CN[C@H](c2ccc(Br)cc2)C2CCC2)n1 ZINC000605008410 568515849 /nfs/dbraw/zinc/51/58/49/568515849.db2.gz RMPRAISGCOGDMG-INIZCTEOSA-N 0 1 351.313 4.845 20 0 FJADMN Cc1cc(F)ccc1N1CCC[C@@H](NCc2csc(C(C)(C)C)n2)C1 ZINC000605008915 568516108 /nfs/dbraw/zinc/51/61/08/568516108.db2.gz DFQJUAGVEXDDLZ-MRXNPFEDSA-N 0 1 361.530 4.647 20 0 FJADMN O=C(N[C@@H](CN1CCCCC1)c1ccccc1)c1cc2cc(F)ccc2o1 ZINC000605125753 568579525 /nfs/dbraw/zinc/57/95/25/568579525.db2.gz PNYTUXFJXFJWIC-IBGZPJMESA-N 0 1 366.436 4.529 20 0 FJADMN Cc1cccc([C@@H]2CCCCCN2Cc2csc(-c3cnn(C)c3)n2)c1 ZINC000605157005 568588356 /nfs/dbraw/zinc/58/83/56/568588356.db2.gz DLBWJWGAMFEUAO-FQEVSTJZSA-N 0 1 366.534 4.969 20 0 FJADMN CCOc1cc(CN[C@H]2CSc3ccccc32)ccc1OC(F)F ZINC000605165908 568594004 /nfs/dbraw/zinc/59/40/04/568594004.db2.gz FRRDRQBMOCYBNJ-AWEZNQCLSA-N 0 1 351.418 4.623 20 0 FJADMN CC(C)c1ccccc1NC(=O)[C@H](C)Sc1nc(-c2ccccc2)n[nH]1 ZINC000007633449 568611412 /nfs/dbraw/zinc/61/14/12/568611412.db2.gz FXMRKHWIVIMXPU-AWEZNQCLSA-N 0 1 366.490 4.714 20 0 FJADMN CC(C)(C)CCC(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000606164896 568682981 /nfs/dbraw/zinc/68/29/81/568682981.db2.gz DNISRCWXPHVLNY-UHFFFAOYSA-N 0 1 370.459 4.566 20 0 FJADMN O=C(CC/C=C\c1ccccc1)Nc1cccc(CN2CCSCC2)c1 ZINC000606186422 568707965 /nfs/dbraw/zinc/70/79/65/568707965.db2.gz WCMPUHKYSYCEMQ-WTKPLQERSA-N 0 1 366.530 4.668 20 0 FJADMN Cn1c2ccccc2nc1CN1CCC(c2ccccc2C(F)(F)F)CC1 ZINC000045388121 205121751 /nfs/dbraw/zinc/12/17/51/205121751.db2.gz DGWBQMLESHGUBF-UHFFFAOYSA-N 0 1 373.422 4.972 20 0 FJADMN Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1 ZINC000109891946 206066664 /nfs/dbraw/zinc/06/66/64/206066664.db2.gz FVMUQJGBNUMVSY-UHFFFAOYSA-N 0 1 374.366 4.805 20 0 FJADMN Cc1nc2ccc(NC(=O)c3cc(Br)ccc3Cl)cc2[nH]1 ZINC000010657019 206281757 /nfs/dbraw/zinc/28/17/57/206281757.db2.gz WILZFJWSUPCGGL-UHFFFAOYSA-N 0 1 364.630 4.540 20 0 FJADMN COc1ccc([C@H](C)N[C@@H](C)c2ccc(Br)s2)c(OC)c1 ZINC000038002457 211343906 /nfs/dbraw/zinc/34/39/06/211343906.db2.gz VDAIZLSTTPWEON-QWRGUYRKSA-N 0 1 370.312 4.940 20 0 FJADMN O=C(Nc1ccccc1-c1nc(-c2ccccc2)n[nH]1)c1ccc(Cl)o1 ZINC000065156683 221173551 /nfs/dbraw/zinc/17/35/51/221173551.db2.gz HOALWKUGMRCTBB-UHFFFAOYSA-N 0 1 364.792 4.637 20 0 FJADMN O=C(N[C@@H](c1ccccc1)c1ccc2nc[nH]c2c1)c1cc2ccccc2[nH]1 ZINC000097038236 222154024 /nfs/dbraw/zinc/15/40/24/222154024.db2.gz CDIOBXJCPQRSBZ-QFIPXVFZSA-N 0 1 366.424 4.564 20 0 FJADMN O=C(Nc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1)c1cccs1 ZINC000109906902 222475236 /nfs/dbraw/zinc/47/52/36/222475236.db2.gz ROLPBKJIMHZNAS-UHFFFAOYSA-N 0 1 372.833 4.612 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N(C)[C@@H](c2ccccc2C)C(C)C)o1 ZINC000602028629 567904569 /nfs/dbraw/zinc/90/45/69/567904569.db2.gz HQYRSLDRZMOMJH-OAQYLSRUSA-N 0 1 356.510 4.899 20 0 FJADMN COc1ccc([C@H](C)NCc2ccc(C)cc2OCC2CC2)c(C)c1OC ZINC000521415648 567962704 /nfs/dbraw/zinc/96/27/04/567962704.db2.gz VWAVUHQBMDNDTP-KRWDZBQOSA-N 0 1 369.505 4.960 20 0 FJADMN CCc1c(NC(=O)c2coc(C)c2)[nH]nc1-c1ccc(Br)cc1 ZINC000186830583 567986583 /nfs/dbraw/zinc/98/65/83/567986583.db2.gz WUYFBSMIVZULPN-UHFFFAOYSA-N 0 1 374.238 4.555 20 0 FJADMN COc1cc(CNCc2cc(Br)ccc2F)ccc1SC ZINC000063912406 567991854 /nfs/dbraw/zinc/99/18/54/567991854.db2.gz GNLZKPDMKMQOOA-UHFFFAOYSA-N 0 1 370.287 4.609 20 0 FJADMN Cc1nc([C@@H](N[C@H](C)c2cccc(-c3ccncc3)c2)c2ccccc2)n[nH]1 ZINC000162662278 568002928 /nfs/dbraw/zinc/00/29/28/568002928.db2.gz PQBCJWXTJSRNBK-ZHRRBRCNSA-N 0 1 369.472 4.615 20 0 FJADMN CCOc1ccccc1NC(=O)CN1CCCCC[C@@H]1c1ccccc1 ZINC000521426052 568006248 /nfs/dbraw/zinc/00/62/48/568006248.db2.gz ZYSBDKXKRLROFY-HXUWFJFHSA-N 0 1 352.478 4.641 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN3C(=O)C3(C)CCC(F)(F)CC3)[nH]c2c1 ZINC000636756390 568035346 /nfs/dbraw/zinc/03/53/46/568035346.db2.gz UYNMPSPKTCJQCC-INIZCTEOSA-N 0 1 361.436 4.750 20 0 FJADMN C[C@@H](NC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)c1ccccc1 ZINC000522765381 568088110 /nfs/dbraw/zinc/08/81/10/568088110.db2.gz JIMWVRWDWXBBSD-OXQOHEQNSA-N 0 1 371.912 4.537 20 0 FJADMN C[C@@H](NC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)c1ccccc1 ZINC000522765382 568088143 /nfs/dbraw/zinc/08/81/43/568088143.db2.gz JIMWVRWDWXBBSD-UZLBHIALSA-N 0 1 371.912 4.537 20 0 FJADMN Cc1cc(CNC(=O)C2(c3ccc(C(C)(C)C)cc3)CCCCC2)n[nH]1 ZINC000603484948 568106012 /nfs/dbraw/zinc/10/60/12/568106012.db2.gz MWBKQCCATHOMPD-UHFFFAOYSA-N 0 1 353.510 4.534 20 0 FJADMN Cc1cc(CNC(=O)c2cccc(CSc3ccc(C)cc3C)c2)n[nH]1 ZINC000603485991 568106138 /nfs/dbraw/zinc/10/61/38/568106138.db2.gz OIBNNTIAOHJNBT-UHFFFAOYSA-N 0 1 365.502 4.557 20 0 FJADMN COc1cc(CN(C)c2ccnc3cc(F)ccc32)ccc1OC(F)F ZINC000603493094 568107669 /nfs/dbraw/zinc/10/76/69/568107669.db2.gz PMIHMMPCAADCAO-UHFFFAOYSA-N 0 1 362.351 4.620 20 0 FJADMN CC(C)(C)OCCNCc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000603513699 568111159 /nfs/dbraw/zinc/11/11/59/568111159.db2.gz WQOJJKOEQBDMCI-UHFFFAOYSA-N 0 1 358.429 4.734 20 0 FJADMN Cc1cc(CNC(=O)Nc2cc(Cl)ccc2Sc2ccccc2)n[nH]1 ZINC000603559831 568117412 /nfs/dbraw/zinc/11/74/12/568117412.db2.gz RXOUYNIUXCNLBZ-UHFFFAOYSA-N 0 1 372.881 4.844 20 0 FJADMN CC(C)(C)c1ccc(-c2n[nH]c(NC(=O)c3cccc4cccnc43)n2)cc1 ZINC000603563244 568118818 /nfs/dbraw/zinc/11/88/18/568118818.db2.gz HPEWJJNQJUTJHH-UHFFFAOYSA-N 0 1 371.444 4.570 20 0 FJADMN CSCc1ccc(C(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)cc1 ZINC000603939592 568184663 /nfs/dbraw/zinc/18/46/63/568184663.db2.gz WTTRNANCQPRQEK-UHFFFAOYSA-N 0 1 363.442 4.938 20 0 FJADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccc(C)c(OC(F)F)c1 ZINC000604033215 568201713 /nfs/dbraw/zinc/20/17/13/568201713.db2.gz GZMWYOGHEANZKN-UHFFFAOYSA-N 0 1 357.360 4.547 20 0 FJADMN CCCCN(C(=O)NCCCc1cn[nH]c1C)[C@H](CC)c1ccccc1 ZINC000604101461 568213063 /nfs/dbraw/zinc/21/30/63/568213063.db2.gz GZMLQTAGLIWRAU-HXUWFJFHSA-N 0 1 356.514 4.614 20 0 FJADMN CC(C)C[C@H](N)c1noc(Cn2c3ccccc3nc2C2CCCCC2)n1 ZINC000563121314 568222501 /nfs/dbraw/zinc/22/25/01/568222501.db2.gz MMXCYLUHQKHHAK-INIZCTEOSA-N 0 1 367.497 4.561 20 0 FJADMN CC(=O)N(c1nc(CN[C@H]2CCC[C@@H](F)C2)cs1)c1ccc(C)cc1 ZINC000563121717 568222727 /nfs/dbraw/zinc/22/27/27/568222727.db2.gz CQMISOYZIAHJKJ-CVEARBPZSA-N 0 1 361.486 4.506 20 0 FJADMN CN(CCC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1F ZINC000024897414 568234065 /nfs/dbraw/zinc/23/40/65/568234065.db2.gz RGUXKYQYSCIVKJ-UHFFFAOYSA-N 0 1 355.240 4.593 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)C1c2ccccc2Oc2ccccc21 ZINC000604266617 568241284 /nfs/dbraw/zinc/24/12/84/568241284.db2.gz WZFWUFPMODWFPT-UHFFFAOYSA-N 0 1 351.789 4.922 20 0 FJADMN CC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc(Cl)c3O)o2)cc1 ZINC000604266655 568241331 /nfs/dbraw/zinc/24/13/31/568241331.db2.gz ZNZSSDGCCICENB-UHFFFAOYSA-N 0 1 355.777 4.761 20 0 FJADMN Cc1nc(-c2cccs2)sc1C(=O)Nc1cccc(Cl)c1O ZINC000604267358 568241499 /nfs/dbraw/zinc/24/14/99/568241499.db2.gz OKDJLPFSXHZNRJ-UHFFFAOYSA-N 0 1 350.852 4.791 20 0 FJADMN Cc1n[nH]c(C(=O)N[C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)c1C ZINC000604328948 568250430 /nfs/dbraw/zinc/25/04/30/568250430.db2.gz FTQNBCVRUYBWBN-LLVKDONJSA-N 0 1 374.897 4.603 20 0 FJADMN C[C@@H](C(=O)Nc1ccccc1Cl)[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000303137031 568252936 /nfs/dbraw/zinc/25/29/36/568252936.db2.gz CZGKRHMBUBASOV-FUHWJXTLSA-N 0 1 356.897 4.937 20 0 FJADMN C[C@@H](C(=O)Nc1ccccc1Cl)N1CCC[C@@H](c2ccccc2)CC1 ZINC000303137031 568252937 /nfs/dbraw/zinc/25/29/37/568252937.db2.gz CZGKRHMBUBASOV-FUHWJXTLSA-N 0 1 356.897 4.937 20 0 FJADMN CC(C)Oc1ccc(CNCc2cccc3c2OCO3)c(C(F)(F)F)c1 ZINC000303116334 568254027 /nfs/dbraw/zinc/25/40/27/568254027.db2.gz HHUXQYKTPFQAIJ-UHFFFAOYSA-N 0 1 367.367 4.511 20 0 FJADMN COc1ccc(-c2nnc(CSc3nc4ccc(Cl)cc4[nH]3)o2)cc1 ZINC000018258188 568260183 /nfs/dbraw/zinc/26/01/83/568260183.db2.gz VMKITRNPROLJQV-UHFFFAOYSA-N 0 1 372.837 4.567 20 0 FJADMN Cc1ccc([C@@H](CNC(=O)CCCCCc2cccs2)N2CCCC2)o1 ZINC000518796598 568271003 /nfs/dbraw/zinc/27/10/03/568271003.db2.gz ODFXTHHEDQDRNZ-LJQANCHMSA-N 0 1 374.550 4.706 20 0 FJADMN Fc1ccc(-c2nc(CN[C@H]3CCCN(c4ccccc4)C3)cs2)cc1 ZINC000604416893 568275153 /nfs/dbraw/zinc/27/51/53/568275153.db2.gz NCIZKZHYNRXMHU-SFHVURJKSA-N 0 1 367.493 4.708 20 0 FJADMN Cc1cc(F)ccc1-c1ccc(CNCc2ccc(OCC3CC3)nc2)o1 ZINC000604415782 568281141 /nfs/dbraw/zinc/28/11/41/568281141.db2.gz TVYAPWQJRVEGJL-UHFFFAOYSA-N 0 1 366.436 4.868 20 0 FJADMN CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccccc2)C[C@H]1C ZINC000604394095 568283868 /nfs/dbraw/zinc/28/38/68/568283868.db2.gz AQNQTKMWEJOQKV-DYESRHJHSA-N 0 1 350.506 4.628 20 0 FJADMN CC(C)CCc1ccccc1NC(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000604619896 568330927 /nfs/dbraw/zinc/33/09/27/568330927.db2.gz NXYHDVBRWSBHGA-UHFFFAOYSA-N 0 1 371.500 4.798 20 0 FJADMN Fc1ccc(CCN(Cc2nnc(-c3cccc(Cl)c3)o2)C2CC2)cc1 ZINC000604903217 568385523 /nfs/dbraw/zinc/38/55/23/568385523.db2.gz ZOSBORPBMFJPSQ-UHFFFAOYSA-N 0 1 371.843 4.736 20 0 FJADMN Clc1ccc(CCN(Cc2noc(-c3ccsc3)n2)CC2CC2)cc1 ZINC000604903356 568385573 /nfs/dbraw/zinc/38/55/73/568385573.db2.gz KCIBEQULFKYCGT-UHFFFAOYSA-N 0 1 373.909 4.906 20 0 FJADMN CC[C@@H](C)N(Cc1ccccc1)C(=O)NC[C@H](c1ccco1)N(CC)CC ZINC000604916419 568389313 /nfs/dbraw/zinc/38/93/13/568389313.db2.gz JUBRNDWRSOFBNF-UYAOXDASSA-N 0 1 371.525 4.673 20 0 FJADMN Cc1cc(C)c(C(=O)CSc2nc(-c3ccccc3F)n[nH]2)c(C)c1 ZINC000005676733 568389382 /nfs/dbraw/zinc/38/93/82/568389382.db2.gz MKBFENOFVKUFDI-UHFFFAOYSA-N 0 1 355.438 4.511 20 0 FJADMN C[C@@H](Sc1nc(-c2ccccn2)n[nH]1)c1ccc(OC(F)(F)F)cc1 ZINC000604932806 568395291 /nfs/dbraw/zinc/39/52/91/568395291.db2.gz PJDIDXOGKQRFTJ-SNVBAGLBSA-N 0 1 366.368 4.619 20 0 FJADMN O=C(CSc1nc(-c2ccccn2)n[nH]1)c1ccc(-c2ccccc2)cc1 ZINC000604933214 568395466 /nfs/dbraw/zinc/39/54/66/568395466.db2.gz MRPCMAMBUNGUGR-UHFFFAOYSA-N 0 1 372.453 4.509 20 0 FJADMN Cc1ccc2nc(S[C@@H](C)C(=O)Nc3c(C)cc(C)cc3C)[nH]c2c1 ZINC000006292206 568401585 /nfs/dbraw/zinc/40/15/85/568401585.db2.gz RMPLILKEBVJHCH-HNNXBMFYSA-N 0 1 353.491 4.916 20 0 FJADMN C[C@@H](NCc1nc(=O)c2cc(-c3ccccc3)sc2[nH]1)c1ccccc1 ZINC000007285362 568489998 /nfs/dbraw/zinc/48/99/98/568489998.db2.gz TWVAPJFMIPKUIQ-CQSZACIVSA-N 0 1 361.470 4.502 20 0 FJADMN CC[C@@H]1CCCN(Cc2csc(-c3cccc(OC)c3OC)n2)CC1 ZINC000604999193 568512649 /nfs/dbraw/zinc/51/26/49/568512649.db2.gz UOIGXOKTJIIEGP-OAHLLOKOSA-N 0 1 360.523 4.839 20 0 FJADMN CNC(=O)c1cccc(CN2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000605000365 568513853 /nfs/dbraw/zinc/51/38/53/568513853.db2.gz LKFBOQUXCUMBHK-HXUWFJFHSA-N 0 1 356.897 4.817 20 0 FJADMN C[C@@H](c1ccccc1)N(C)C(=O)CNC(c1ccccc1)c1ccccc1 ZINC000007496928 568523054 /nfs/dbraw/zinc/52/30/54/568523054.db2.gz RJLWOZWTKFCVOG-IBGZPJMESA-N 0 1 358.485 4.585 20 0 FJADMN Cc1ccc([C@H](NCC(=O)N[C@H](C)c2cccs2)c2ccccc2)cc1 ZINC000007542207 568529934 /nfs/dbraw/zinc/52/99/34/568529934.db2.gz BOVLBFASBMDYHO-VGOFRKELSA-N 0 1 364.514 4.613 20 0 FJADMN Cc1[nH]ncc1CCCNC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000605043917 568537594 /nfs/dbraw/zinc/53/75/94/568537594.db2.gz FFMCGBXNANGQAT-LJQANCHMSA-N 0 1 374.916 4.631 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN3C(=O)C(C)(C)Cc3ccccc3)[nH]c2c1 ZINC000605088834 568567638 /nfs/dbraw/zinc/56/76/38/568567638.db2.gz XRXAAMSHIIBCLN-HXUWFJFHSA-N 0 1 361.489 4.804 20 0 FJADMN O=C(Nc1ccc(NC2CCCCC2)cc1)c1cc2[nH]cnc2cc1F ZINC000644855567 568578449 /nfs/dbraw/zinc/57/84/49/568578449.db2.gz ZLUZQZQUGRQGJE-UHFFFAOYSA-N 0 1 352.413 4.699 20 0 FJADMN CC[C@H](CC(=O)NC[C@H](c1ccco1)N1CCCCC1)c1ccc(C)cc1 ZINC000606161084 568680014 /nfs/dbraw/zinc/68/00/14/568680014.db2.gz CNRJTYOAJRDPEY-TZIWHRDSSA-N 0 1 368.521 4.815 20 0 FJADMN CC[C@@H](CC(=O)NC[C@H](c1ccco1)N1CCCCC1)c1ccc(C)cc1 ZINC000606161083 568680134 /nfs/dbraw/zinc/68/01/34/568680134.db2.gz CNRJTYOAJRDPEY-PZJWPPBQSA-N 0 1 368.521 4.815 20 0 FJADMN Cc1ccc(C(=O)Nc2ccccc2-c2nc(-c3ccccc3)n[nH]2)s1 ZINC000047371760 205146492 /nfs/dbraw/zinc/14/64/92/205146492.db2.gz NBBPLBPCTWYTKE-UHFFFAOYSA-N 0 1 360.442 4.761 20 0 FJADMN CN(C)[C@@H](CNC(=O)Nc1ccc(Cl)cc1Cl)c1cccc(F)c1 ZINC000057407013 205237926 /nfs/dbraw/zinc/23/79/26/205237926.db2.gz RQXNWSNICNFDRJ-INIZCTEOSA-N 0 1 370.255 4.557 20 0 FJADMN Cc1c2cccc(C)c2oc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000108819411 206040705 /nfs/dbraw/zinc/04/07/05/206040705.db2.gz AWPOSMHEOOVCLN-PKOBYXMFSA-N 0 1 362.473 4.615 20 0 FJADMN CC[C@@H](C)NC(=O)CCN[C@@H](C)c1ccc(Cl)c(Cl)c1Cl ZINC000038014147 211350748 /nfs/dbraw/zinc/35/07/48/211350748.db2.gz LSBCTEBTCJEMNH-ZJUUUORDSA-N 0 1 351.705 4.602 20 0 FJADMN CC(=O)c1ccccc1NC(=O)[C@H](C)Sc1nc2ccc(Cl)cc2[nH]1 ZINC000016827719 211170938 /nfs/dbraw/zinc/17/09/38/211170938.db2.gz RRKCOURYMCDZOO-NSHDSACASA-N 0 1 373.865 4.538 20 0 FJADMN CCN(CC)[C@H](CNC(=O)Nc1ccccc1F)c1ccccc1Cl ZINC000028801982 538554357 /nfs/dbraw/zinc/55/43/57/538554357.db2.gz MHEGWSHJTVTETE-GOSISDBHSA-N 0 1 363.864 4.684 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN(C(=O)c4csc(Cl)c4)C3)[nH]c2c1 ZINC000188516733 567848076 /nfs/dbraw/zinc/84/80/76/567848076.db2.gz HUKYZJWPAIAQKX-LBPRGKRZSA-N 0 1 359.882 4.606 20 0 FJADMN C[C@@H](CC(=O)Nc1ccc2nc(-c3ccco3)[nH]c2c1)C(=O)c1ccccc1 ZINC000602101286 567927202 /nfs/dbraw/zinc/92/72/02/567927202.db2.gz XOCOIRQJGBKNLK-AWEZNQCLSA-N 0 1 373.412 4.671 20 0 FJADMN C[C@@H](Nc1ccc(NC(=O)CN2CCCCCC2)cc1)c1ccc(F)cc1 ZINC000602567234 567995721 /nfs/dbraw/zinc/99/57/21/567995721.db2.gz LGTQCGUODWLKAL-QGZVFWFLSA-N 0 1 369.484 4.813 20 0 FJADMN CC(C)CC[N@H+]1Cc2cccc(NC(=O)CO[C@H]3CCC[C@@H](C)C3)c2C1 ZINC000602681864 568010304 /nfs/dbraw/zinc/01/03/04/568010304.db2.gz TXUFHDBIWNMTKW-MJGOQNOKSA-N 0 1 358.526 4.582 20 0 FJADMN CC(C)CCN1Cc2cccc(NC(=O)CO[C@H]3CCC[C@@H](C)C3)c2C1 ZINC000602681864 568010306 /nfs/dbraw/zinc/01/03/06/568010306.db2.gz TXUFHDBIWNMTKW-MJGOQNOKSA-N 0 1 358.526 4.582 20 0 FJADMN COc1cc(OC)c(OC)cc1CN[C@H]1CCSc2cc(C)c(C)cc21 ZINC000186936280 568017494 /nfs/dbraw/zinc/01/74/94/568017494.db2.gz LYDHXZCKMVVPIA-KRWDZBQOSA-N 0 1 373.518 4.656 20 0 FJADMN Cc1ccc([C@@H](NCc2ccccc2N2CCOCC2)c2ccccc2)cc1 ZINC000066969922 568072602 /nfs/dbraw/zinc/07/26/02/568072602.db2.gz NCHGDJHQABVTCE-VWLOTQADSA-N 0 1 372.512 4.711 20 0 FJADMN COc1cc([C@@H](C)NCc2ccc(Cl)cc2Cl)cc(OC)c1OC ZINC000067690621 568080808 /nfs/dbraw/zinc/08/08/08/568080808.db2.gz GHGGACZXJVJQRE-LLVKDONJSA-N 0 1 370.276 4.870 20 0 FJADMN COc1ccc(CNC2(c3ccc(Cl)cc3)CC2)cc1OC(F)F ZINC000069878759 568100440 /nfs/dbraw/zinc/10/04/40/568100440.db2.gz QYQUERJZLLUDIC-UHFFFAOYSA-N 0 1 353.796 4.729 20 0 FJADMN CCc1[nH]ncc1C(=O)Nc1ccc(Oc2ccnc3ccccc32)cc1 ZINC000603490499 568107095 /nfs/dbraw/zinc/10/70/95/568107095.db2.gz QURALRVQWHFOQE-UHFFFAOYSA-N 0 1 358.401 4.565 20 0 FJADMN CN(C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccnc2cc(F)ccc21 ZINC000603493684 568107881 /nfs/dbraw/zinc/10/78/81/568107881.db2.gz BLHKNSJVCYIRQW-VGOFRKELSA-N 0 1 350.437 4.978 20 0 FJADMN CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccnc2cc(F)ccc21 ZINC000603493677 568107894 /nfs/dbraw/zinc/10/78/94/568107894.db2.gz BLHKNSJVCYIRQW-HTAPYJJXSA-N 0 1 350.437 4.978 20 0 FJADMN CC(C)(C)n1cc(CN[C@H]2CCOc3c(-c4ccccc4)cccc32)cn1 ZINC000603518264 568112036 /nfs/dbraw/zinc/11/20/36/568112036.db2.gz DMKRRWJBSWMQBX-NRFANRHFSA-N 0 1 361.489 4.919 20 0 FJADMN Cc1cc(CNC(=O)Nc2ccc(Sc3cc(C)ccc3C)cc2)n[nH]1 ZINC000603559818 568117355 /nfs/dbraw/zinc/11/73/55/568117355.db2.gz HGQGBLPREATUEG-UHFFFAOYSA-N 0 1 366.490 4.808 20 0 FJADMN Cc1c2cccc(Cl)c2oc1C(=O)Nc1nc(-c2ccc(C)cc2)n[nH]1 ZINC000603628755 568127686 /nfs/dbraw/zinc/12/76/86/568127686.db2.gz PHPPAGKVOOTPOT-UHFFFAOYSA-N 0 1 366.808 4.740 20 0 FJADMN O=[S@@](CCN1CC[C@@H](c2ccccc2)C1)c1cc(Cl)ccc1Cl ZINC000522775843 568131955 /nfs/dbraw/zinc/13/19/55/568131955.db2.gz CPZNOJODNJYUNH-CMJOXMDJSA-N 0 1 368.329 4.591 20 0 FJADMN CC[C@@H](NC(=O)c1ccc(CN(CC)CC)o1)c1ccc(Cl)s1 ZINC000603835254 568159173 /nfs/dbraw/zinc/15/91/73/568159173.db2.gz SWCUVVBWXXZZEU-CYBMUJFWSA-N 0 1 354.903 4.717 20 0 FJADMN c1sc(-c2ccccc2)nc1CNC1(c2ccccc2)CCOCC1 ZINC000603938999 568184625 /nfs/dbraw/zinc/18/46/25/568184625.db2.gz YFDDAYSVBFNMNL-UHFFFAOYSA-N 0 1 350.487 4.606 20 0 FJADMN C[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000122163271 568200337 /nfs/dbraw/zinc/20/03/37/568200337.db2.gz MYMGYMNNCVCLRS-OLZOCXBDSA-N 0 1 371.424 4.521 20 0 FJADMN c1coc(-c2nc(CN3CCC[C@@H](c4nc5ccccc5o4)C3)cs2)c1 ZINC000604041491 568203140 /nfs/dbraw/zinc/20/31/40/568203140.db2.gz RMYXVJOMZLAURY-CQSZACIVSA-N 0 1 365.458 4.924 20 0 FJADMN Cc1cc(-c2noc([C@@H](C)NCC(C)(C)Oc3ccccc3)n2)ccc1F ZINC000604065285 568205340 /nfs/dbraw/zinc/20/53/40/568205340.db2.gz CXFSRNFOMGNOJN-OAHLLOKOSA-N 0 1 369.440 4.692 20 0 FJADMN Cc1ccc(CCC2CCN(Cc3nnc(-c4ccccc4)o3)CC2)cc1 ZINC000302928475 568217587 /nfs/dbraw/zinc/21/75/87/568217587.db2.gz DEXSEJMUDYILNA-UHFFFAOYSA-N 0 1 361.489 4.890 20 0 FJADMN Cc1cc(OC(C)C)ccc1NC(=O)c1cc(-c2ccc(F)cc2)n[nH]1 ZINC000617126568 568218424 /nfs/dbraw/zinc/21/84/24/568218424.db2.gz RAOGNBGCTBYZTB-UHFFFAOYSA-N 0 1 353.397 4.564 20 0 FJADMN COc1ccc([C@@H](Cc2ccccc2)NCc2ccc3c(n2)CCC3)cc1 ZINC000563118111 568223530 /nfs/dbraw/zinc/22/35/30/568223530.db2.gz XYMZJQLFNYWVLP-XMMPIXPASA-N 0 1 358.485 4.653 20 0 FJADMN O=C(CCC(=O)c1ccc2c(c1)CCCC2)Nc1cccc(Cl)c1O ZINC000604266436 568236868 /nfs/dbraw/zinc/23/68/68/568236868.db2.gz JIOHFTFDWKJTDJ-UHFFFAOYSA-N 0 1 357.837 4.526 20 0 FJADMN Cc1cc(C)c(C(=O)CCCC(=O)Nc2cccc(Cl)c2O)c(C)c1 ZINC000604266309 568238604 /nfs/dbraw/zinc/23/86/04/568238604.db2.gz AFEYDCRBJXPRLV-UHFFFAOYSA-N 0 1 359.853 4.963 20 0 FJADMN C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc(Cl)c1O ZINC000604266625 568241313 /nfs/dbraw/zinc/24/13/13/568241313.db2.gz XMGFCEFNNLQCOE-QMMMGPOBSA-N 0 1 360.624 4.758 20 0 FJADMN COc1ccc(Cl)cc1-c1n[nH]c(SCc2ccc3c(c2)CCC3)n1 ZINC000604270973 568241952 /nfs/dbraw/zinc/24/19/52/568241952.db2.gz PEGGFEGWNFNONG-UHFFFAOYSA-N 0 1 371.893 4.915 20 0 FJADMN C[C@@H](CC(=O)Nc1ccc2nc(-c3ccc(F)cc3)[nH]c2c1)c1cccnc1 ZINC000604314767 568245778 /nfs/dbraw/zinc/24/57/78/568245778.db2.gz XETFLCRSHRALEJ-AWEZNQCLSA-N 0 1 374.419 4.896 20 0 FJADMN Cc1n[nH]c(C(=O)N[C@@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)c1C ZINC000604329331 568250485 /nfs/dbraw/zinc/25/04/85/568250485.db2.gz UHOYEYZLUJNMHA-IBGZPJMESA-N 0 1 371.843 4.647 20 0 FJADMN CC(C)[C@@H](NCc1cc(Cl)ccc1Br)c1cccnc1 ZINC000563124130 568250584 /nfs/dbraw/zinc/25/05/84/568250584.db2.gz HUZUGBUODKHOPA-MRXNPFEDSA-N 0 1 353.691 4.984 20 0 FJADMN Cc1nc(C)c([C@H](C)N(C)Cc2ccc(F)c(Br)c2)s1 ZINC000303257920 568260262 /nfs/dbraw/zinc/26/02/62/568260262.db2.gz CIVWLPCVWRQSFM-JTQLQIEISA-N 0 1 357.292 4.855 20 0 FJADMN Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(OCC(F)(F)F)cc2)s1 ZINC000303286762 568264417 /nfs/dbraw/zinc/26/44/17/568264417.db2.gz KAJQCPYFPCPICV-LBPRGKRZSA-N 0 1 358.429 4.894 20 0 FJADMN Cc1nc(C)c([C@H](C)N(C)Cc2ccc(OCC(F)(F)F)cc2)s1 ZINC000303286762 568264418 /nfs/dbraw/zinc/26/44/18/568264418.db2.gz KAJQCPYFPCPICV-LBPRGKRZSA-N 0 1 358.429 4.894 20 0 FJADMN C[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2Oc2ccccc2)C[C@@H]1C(=O)[O-] ZINC000563133884 568269512 /nfs/dbraw/zinc/26/95/12/568269512.db2.gz PNQJIGKVJPDAGB-ZBFHGGJFSA-N 0 1 359.853 4.675 20 0 FJADMN Cc1ccc(-c2nc(CN[C@@H]3CCCN(c4ccccc4)C3)cs2)cc1 ZINC000604416962 568275210 /nfs/dbraw/zinc/27/52/10/568275210.db2.gz SRXSILLTJKIBPF-LJQANCHMSA-N 0 1 363.530 4.877 20 0 FJADMN Cc1ccc(-c2nc(CN[C@H]3CCCN(c4ccccc4)C3)cs2)cc1 ZINC000604416961 568275225 /nfs/dbraw/zinc/27/52/25/568275225.db2.gz SRXSILLTJKIBPF-IBGZPJMESA-N 0 1 363.530 4.877 20 0 FJADMN Cc1ccc(C[C@H](N[C@H](C)C(=O)Nc2cccc(C)c2)c2ccccn2)cc1 ZINC000604414098 568278724 /nfs/dbraw/zinc/27/87/24/568278724.db2.gz WXWDXOBPBZVRBC-XXBNENTESA-N 0 1 373.500 4.599 20 0 FJADMN Cc1cccc(C(C)C)c1NC(=O)CN1C[C@H](c2ccccc2)C[C@H]1C ZINC000604393207 568283275 /nfs/dbraw/zinc/28/32/75/568283275.db2.gz UVIYMFSPBAUCKW-UYAOXDASSA-N 0 1 350.506 4.935 20 0 FJADMN FC(F)(F)[C@@H]1C[C@H](C(F)(F)F)CN(Cc2ccc3c(c2)CCC3)C1 ZINC000604383707 568287457 /nfs/dbraw/zinc/28/74/57/568287457.db2.gz FOQVEELHNXRHIN-GASCZTMLSA-N 0 1 351.334 4.738 20 0 FJADMN CCc1ccc(CCN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 ZINC000604383736 568287461 /nfs/dbraw/zinc/28/74/61/568287461.db2.gz HFJKCWDNGQSCTH-GJZGRUSLSA-N 0 1 353.350 4.854 20 0 FJADMN Fc1ccccc1CSCCNCc1csc(-c2ccccc2)n1 ZINC000604479275 568300151 /nfs/dbraw/zinc/30/01/51/568300151.db2.gz KHLQEYYRGMVWLC-UHFFFAOYSA-N 0 1 358.507 4.972 20 0 FJADMN O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)[C@@H]1C[C@H]1c1c(F)cccc1F ZINC000604745677 568356200 /nfs/dbraw/zinc/35/62/00/568356200.db2.gz OBFYTFFZGYYQCC-ZIAGYGMSSA-N 0 1 367.399 4.851 20 0 FJADMN OC[C@H](NCc1ccc(Oc2cc(F)cc(F)c2)cc1)c1cccc(F)c1 ZINC000604768437 568362611 /nfs/dbraw/zinc/36/26/11/568362611.db2.gz BQOPYLCQJLJOFY-NRFANRHFSA-N 0 1 373.374 4.719 20 0 FJADMN CCN(CC(=O)Nc1ccccc1C(F)(F)F)C[C@H](C)c1ccccc1 ZINC000604884125 568384413 /nfs/dbraw/zinc/38/44/13/568384413.db2.gz XPYNFSBGSQHBCF-HNNXBMFYSA-N 0 1 364.411 4.770 20 0 FJADMN Cc1oc(-c2ccccc2)nc1CN(CCc1ccc(F)cc1)C1CC1 ZINC000604903134 568385488 /nfs/dbraw/zinc/38/54/88/568385488.db2.gz PBQZQWIFIYETOM-UHFFFAOYSA-N 0 1 350.437 4.996 20 0 FJADMN CCOc1ccc(C(C)=O)cc1CSc1nc(-c2ccc(C)cc2)n[nH]1 ZINC000005867174 568394320 /nfs/dbraw/zinc/39/43/20/568394320.db2.gz KQMGTLVWHZXSIT-UHFFFAOYSA-N 0 1 367.474 4.674 20 0 FJADMN Cc1c(Cl)c(CSc2nc(-c3ccccn3)n[nH]2)nc2ccccc12 ZINC000604932765 568395222 /nfs/dbraw/zinc/39/52/22/568395222.db2.gz KUJSBBMKLHNVFR-UHFFFAOYSA-N 0 1 367.865 4.669 20 0 FJADMN COc1ccc(F)cc1[C@H](C)N[C@H]1CCc2c1cccc2Br ZINC000319743195 568414204 /nfs/dbraw/zinc/41/42/04/568414204.db2.gz RCDFUQDIIIBLJL-GTNSWQLSSA-N 0 1 364.258 4.935 20 0 FJADMN Cc1cc(OCc2ccccc2)ccc1NC(=O)c1cc(-c2ccoc2)n[nH]1 ZINC000604978156 568499341 /nfs/dbraw/zinc/49/93/41/568499341.db2.gz FLSVUIBOSJXTJR-UHFFFAOYSA-N 0 1 373.412 4.809 20 0 FJADMN CC[C@@H]1CCCN(Cc2nnc(-c3c(C)onc3-c3ccccc3)o2)CC1 ZINC000604998767 568512308 /nfs/dbraw/zinc/51/23/08/568512308.db2.gz ACDXRIFLWQGWRW-MRXNPFEDSA-N 0 1 366.465 4.712 20 0 FJADMN C[C@H](c1ccccc1)N(C)C(=O)CNC(c1ccccc1)c1ccccc1 ZINC000007496933 568523046 /nfs/dbraw/zinc/52/30/46/568523046.db2.gz RJLWOZWTKFCVOG-LJQANCHMSA-N 0 1 358.485 4.585 20 0 FJADMN CC(C)(Cc1ccccc1)C(=O)Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1 ZINC000605087970 568567321 /nfs/dbraw/zinc/56/73/21/568567321.db2.gz IXNKSUARCZEHEI-LJQANCHMSA-N 0 1 363.461 4.622 20 0 FJADMN O=C(C[C@@H]1CCOc2ccccc21)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000605122910 568578681 /nfs/dbraw/zinc/57/86/81/568578681.db2.gz TWRVVGVRNSXTPP-AWEZNQCLSA-N 0 1 373.412 4.718 20 0 FJADMN Cc1cccc([C@H]2CCCCCN2Cc2csc(-c3cnn(C)c3)n2)c1 ZINC000605157006 568588563 /nfs/dbraw/zinc/58/85/63/568588563.db2.gz DLBWJWGAMFEUAO-HXUWFJFHSA-N 0 1 366.534 4.969 20 0 FJADMN CCOc1cc(CN[C@@H]2CSc3ccccc32)ccc1OC(F)F ZINC000605165909 568594350 /nfs/dbraw/zinc/59/43/50/568594350.db2.gz FRRDRQBMOCYBNJ-CQSZACIVSA-N 0 1 351.418 4.623 20 0 FJADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1cccc(NC2CCCC2)c1 ZINC000605180576 568605352 /nfs/dbraw/zinc/60/53/52/568605352.db2.gz YUPOJWWIZFWKLJ-UHFFFAOYSA-N 0 1 360.461 4.992 20 0 FJADMN CCc1ccc([C@@H](C)CC(=O)NC[C@H](c2ccco2)N2CCCCC2)cc1 ZINC000606161035 568679958 /nfs/dbraw/zinc/67/99/58/568679958.db2.gz AJARQDODJFRAKD-GHTZIAJQSA-N 0 1 368.521 4.679 20 0 FJADMN CCc1ccc([C@H](C)CC(=O)NC[C@H](c2ccco2)N2CCCCC2)cc1 ZINC000606161038 568680113 /nfs/dbraw/zinc/68/01/13/568680113.db2.gz AJARQDODJFRAKD-WIYYLYMNSA-N 0 1 368.521 4.679 20 0 FJADMN CCc1ccc([C@H](C)CC(=O)NC[C@@H](c2ccco2)N2CCCCC2)cc1 ZINC000606161036 568680128 /nfs/dbraw/zinc/68/01/28/568680128.db2.gz AJARQDODJFRAKD-NQIIRXRSSA-N 0 1 368.521 4.679 20 0 FJADMN COc1ccc2nc(S[C@H](C)C(=O)Nc3c(C)cc(C)cc3C)[nH]c2c1 ZINC000004273958 204129736 /nfs/dbraw/zinc/12/97/36/204129736.db2.gz UEVGZISZTRXOMN-CQSZACIVSA-N 0 1 369.490 4.616 20 0 FJADMN c1sc(-c2ccccc2)nc1CN1CCC2(CC1)OCc1ccccc12 ZINC000040379602 205067401 /nfs/dbraw/zinc/06/74/01/205067401.db2.gz ZMOCGHDTKYJBPC-UHFFFAOYSA-N 0 1 362.498 4.832 20 0 FJADMN Cc1cccc(C(=O)N[C@H](c2ccccc2)c2ccc3nc[nH]c3c2)c1C ZINC000097028462 205894634 /nfs/dbraw/zinc/89/46/34/205894634.db2.gz MZPOWQSZXXJWCQ-JOCHJYFZSA-N 0 1 355.441 4.699 20 0 FJADMN O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)c1ccc(F)cc1F ZINC000108041927 206026778 /nfs/dbraw/zinc/02/67/78/206026778.db2.gz RQKWRBDDXQHESO-UHFFFAOYSA-N 0 1 367.330 4.900 20 0 FJADMN CC(=O)Nc1cccc([C@@H](C)N[C@H](C)c2ccc(Br)s2)c1 ZINC000038002091 211344583 /nfs/dbraw/zinc/34/45/83/211344583.db2.gz JZZQTCXSNNYINX-GHMZBOCLSA-N 0 1 367.312 4.881 20 0 FJADMN COc1cccc2cc(CNCc3ccc(Br)s3)oc21 ZINC000037985189 211337568 /nfs/dbraw/zinc/33/75/68/211337568.db2.gz ZBWGCAYSJJFUOZ-UHFFFAOYSA-N 0 1 352.253 4.555 20 0 FJADMN Fc1ccc2c(c1)[C@H](NCc1cc(Br)cs1)CCS2 ZINC000035043811 210357599 /nfs/dbraw/zinc/35/75/99/210357599.db2.gz ZBWPTGDURGZQQR-CYBMUJFWSA-N 0 1 358.301 4.976 20 0 FJADMN Cc1ccc(F)cc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000097205963 222168233 /nfs/dbraw/zinc/16/82/33/222168233.db2.gz LIUUZJLQIFDNSH-STQMWFEESA-N 0 1 368.374 4.831 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN(C(=O)c4csc(Cl)c4)C3)[nH]c2c1 ZINC000188516708 567848148 /nfs/dbraw/zinc/84/81/48/567848148.db2.gz HUKYZJWPAIAQKX-GFCCVEGCSA-N 0 1 359.882 4.606 20 0 FJADMN c1nn(Cc2ccccc2)cc1CNC1c2ccccc2-c2ccccc21 ZINC000061556322 567867383 /nfs/dbraw/zinc/86/73/83/567867383.db2.gz PJGMOSOPIOCCEK-UHFFFAOYSA-N 0 1 351.453 4.791 20 0 FJADMN Cc1ccccc1[C@@H](C(C)C)N(C)Cc1csc(-c2ncccn2)n1 ZINC000602251754 567959821 /nfs/dbraw/zinc/95/98/21/567959821.db2.gz LNSBSTBPXNVLBI-GOSISDBHSA-N 0 1 352.507 4.738 20 0 FJADMN CC(C)(C)c1n[nH]c(SCCC(=O)Nc2cc(Cl)ccc2Cl)n1 ZINC000012260590 567980053 /nfs/dbraw/zinc/98/00/53/567980053.db2.gz IQSTZYJJXAXVNX-UHFFFAOYSA-N 0 1 373.309 4.530 20 0 FJADMN CC(C)(C)c1nc(SCCC(=O)Nc2cc(Cl)ccc2Cl)n[nH]1 ZINC000012260590 567980054 /nfs/dbraw/zinc/98/00/54/567980054.db2.gz IQSTZYJJXAXVNX-UHFFFAOYSA-N 0 1 373.309 4.530 20 0 FJADMN Cc1nc([C@@H](N[C@@H](C)c2cccc(-c3ccncc3)c2)c2ccccc2)n[nH]1 ZINC000162662067 568002739 /nfs/dbraw/zinc/00/27/39/568002739.db2.gz PQBCJWXTJSRNBK-AOMKIAJQSA-N 0 1 369.472 4.615 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccccc3Cl)[nH]c2c1)C1CCSCC1 ZINC000602663330 568012857 /nfs/dbraw/zinc/01/28/57/568012857.db2.gz NWQBNROOIDSMSD-UHFFFAOYSA-N 0 1 371.893 4.965 20 0 FJADMN Cc1c([C@@H](C)NCc2ccc(Oc3ccccc3F)c(F)c2)cnn1C ZINC000065890716 568063594 /nfs/dbraw/zinc/06/35/94/568063594.db2.gz NSLOFEFEQLWQCB-CYBMUJFWSA-N 0 1 357.404 4.650 20 0 FJADMN Clc1cnc2oc(CNc3ccccc3CN3CCSCC3)cc2c1 ZINC000648395391 568095528 /nfs/dbraw/zinc/09/55/28/568095528.db2.gz VZJHAJSFTLSJCX-UHFFFAOYSA-N 0 1 373.909 4.642 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N(C)c2cc(Cl)cc(Cl)c2)o1 ZINC000603453400 568099992 /nfs/dbraw/zinc/09/99/92/568099992.db2.gz IQQZRMICYAUXCW-UHFFFAOYSA-N 0 1 355.265 4.705 20 0 FJADMN Cc1cc(CNC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)n[nH]1 ZINC000603485928 568106205 /nfs/dbraw/zinc/10/62/05/568106205.db2.gz YSLWXFPKLOXGCJ-UHFFFAOYSA-N 0 1 366.273 4.683 20 0 FJADMN Cc1cc(CNC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)n[nH]1 ZINC000603487846 568106481 /nfs/dbraw/zinc/10/64/81/568106481.db2.gz ONGCUZKWUCGCCP-UHFFFAOYSA-N 0 1 366.273 4.683 20 0 FJADMN CCCCCOc1ccc(CN[C@@H]2CCOc3c(OC)cccc32)cc1 ZINC000603519014 568109165 /nfs/dbraw/zinc/10/91/65/568109165.db2.gz UVNWLGHFKCRNEB-HXUWFJFHSA-N 0 1 355.478 4.878 20 0 FJADMN CC[C@H](NCc1cc(OC)c(O)cc1Br)c1ccc(F)cc1 ZINC000603513694 568111215 /nfs/dbraw/zinc/11/12/15/568111215.db2.gz WGTLMUJVTNOOGS-HNNXBMFYSA-N 0 1 368.246 4.543 20 0 FJADMN CC[C@@H](NCc1cc(OC)c(O)cc1Br)c1ccc(F)cc1 ZINC000603513698 568111147 /nfs/dbraw/zinc/11/11/47/568111147.db2.gz WGTLMUJVTNOOGS-OAHLLOKOSA-N 0 1 368.246 4.543 20 0 FJADMN COc1cc(CN[C@@H]2C[C@@H](C)c3ccccc32)c(Br)cc1O ZINC000603513473 568111187 /nfs/dbraw/zinc/11/11/87/568111187.db2.gz QRJPENXEDHZGRS-BDJLRTHQSA-N 0 1 362.267 4.501 20 0 FJADMN c1nn2ccccc2c1CN[C@H]1CCOc2c(-c3ccccc3)cccc21 ZINC000603518673 568112131 /nfs/dbraw/zinc/11/21/31/568112131.db2.gz IQIIVUKNXGQCHF-NRFANRHFSA-N 0 1 355.441 4.615 20 0 FJADMN COc1cccc2c1OCC[C@@H]2NCc1ccc(OCCC(C)C)cc1 ZINC000603518897 568112849 /nfs/dbraw/zinc/11/28/49/568112849.db2.gz PDFBQFOISDSPRS-FQEVSTJZSA-N 0 1 355.478 4.734 20 0 FJADMN Clc1ccc2nc(CN[C@H](c3cccnc3)C3CCCCC3)cn2c1 ZINC000603556892 568116818 /nfs/dbraw/zinc/11/68/18/568116818.db2.gz HMVVOLZUXVXDRM-FQEVSTJZSA-N 0 1 354.885 4.794 20 0 FJADMN Cc1cc(CNC(=O)Nc2ccc(SC3CCCCC3)cc2C)n[nH]1 ZINC000603576222 568121262 /nfs/dbraw/zinc/12/12/62/568121262.db2.gz ILORPFWGTIRCKL-UHFFFAOYSA-N 0 1 358.511 4.773 20 0 FJADMN O=C(Cc1cc2ccccc2o1)Nc1ccc2nc(-c3ccccn3)[nH]c2c1 ZINC000603871885 568174379 /nfs/dbraw/zinc/17/43/79/568174379.db2.gz SGAVOYQPZBRLOM-UHFFFAOYSA-N 0 1 368.396 4.552 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN(C(=O)[C@H](C)CC4CCCC4)C3)[nH]c2c1 ZINC000603966293 568191236 /nfs/dbraw/zinc/19/12/36/568191236.db2.gz OPQKUROGKCDGFD-SJLPKXTDSA-N 0 1 353.510 4.794 20 0 FJADMN CCCCN(Cc1nc(-c2ccccn2)no1)[C@H](CC)c1ccccc1 ZINC000604052857 568206880 /nfs/dbraw/zinc/20/68/80/568206880.db2.gz SLFKFYAFGNXFGR-LJQANCHMSA-N 0 1 350.466 4.885 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN3C(=O)c3cc4cccc(F)c4o3)[nH]c2c1 ZINC000607813221 568227045 /nfs/dbraw/zinc/22/70/45/568227045.db2.gz BXCMURWBJZLSOG-QGZVFWFLSA-N 0 1 363.392 4.734 20 0 FJADMN CCOc1ccc(-c2nc(C(=O)Nc3cccc(Cl)c3O)cs2)cc1 ZINC000604266375 568238954 /nfs/dbraw/zinc/23/89/54/568238954.db2.gz DWYNWQVYYBYSJG-UHFFFAOYSA-N 0 1 374.849 4.820 20 0 FJADMN O=C(CCc1ccc(Br)cc1F)Nc1cccc(Cl)c1O ZINC000604267318 568241484 /nfs/dbraw/zinc/24/14/84/568241484.db2.gz MLQZQVQRRLNHMT-UHFFFAOYSA-N 0 1 372.621 4.519 20 0 FJADMN Cc1ccc2cccc(NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c2n1 ZINC000303165284 568254653 /nfs/dbraw/zinc/25/46/53/568254653.db2.gz IHEOAJDISSXHFJ-UHFFFAOYSA-N 0 1 367.257 4.651 20 0 FJADMN COc1ccccc1C[C@@H]1CCCN1Cc1csc(-c2ccoc2)n1 ZINC000303350999 568267631 /nfs/dbraw/zinc/26/76/31/568267631.db2.gz FCFXKRDQYWXZQB-SFHVURJKSA-N 0 1 354.475 4.619 20 0 FJADMN C[C@@H]1CC[N@@H+](Cc2c(Cl)cccc2Oc2ccccc2)C[C@H]1C(=O)[O-] ZINC000563133877 568269450 /nfs/dbraw/zinc/26/94/50/568269450.db2.gz PNQJIGKVJPDAGB-GDBMZVCRSA-N 0 1 359.853 4.675 20 0 FJADMN C[C@H]1CC[N@@H+](Cc2c(Cl)cccc2Oc2ccccc2)C[C@H]1C(=O)[O-] ZINC000563133882 568269543 /nfs/dbraw/zinc/26/95/43/568269543.db2.gz PNQJIGKVJPDAGB-GOEBONIOSA-N 0 1 359.853 4.675 20 0 FJADMN CCN(CC)[C@H](CNC(=O)c1sccc1C)c1ccccc1Cl ZINC000022681722 568269875 /nfs/dbraw/zinc/26/98/75/568269875.db2.gz LYQVARIKFPVNMQ-MRXNPFEDSA-N 0 1 350.915 4.523 20 0 FJADMN Cc1ccc(C[C@H](N[C@@H](C)C(=O)Nc2cccc(C)c2)c2ccccn2)cc1 ZINC000604414096 568278733 /nfs/dbraw/zinc/27/87/33/568278733.db2.gz WXWDXOBPBZVRBC-CVDCTZTESA-N 0 1 373.500 4.599 20 0 FJADMN Cc1c(F)cccc1-c1ccc(CNCc2ccccc2-n2ccnc2)o1 ZINC000604415198 568280304 /nfs/dbraw/zinc/28/03/04/568280304.db2.gz DGNAPVUFMKVGIN-UHFFFAOYSA-N 0 1 361.420 4.870 20 0 FJADMN CCc1cccc(CC)c1NC(=O)CN1C[C@@H](c2ccccc2)C[C@H]1C ZINC000604394097 568284037 /nfs/dbraw/zinc/28/40/37/568284037.db2.gz AQNQTKMWEJOQKV-UTKZUKDTSA-N 0 1 350.506 4.628 20 0 FJADMN O=C(CSc1ccc(F)cc1)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000617133078 568350768 /nfs/dbraw/zinc/35/07/68/568350768.db2.gz GHKCYJSWKJCGIA-UHFFFAOYSA-N 0 1 367.405 4.693 20 0 FJADMN CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(CN3CCSCC3)cc2)CC1 ZINC000604716786 568355808 /nfs/dbraw/zinc/35/58/08/568355808.db2.gz POBOIQIOYQEQKO-FQEVSTJZSA-N 0 1 374.594 4.524 20 0 FJADMN CC(C)[C@@H](CC1CCCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1 ZINC000604742354 568359838 /nfs/dbraw/zinc/35/98/38/568359838.db2.gz OQORAAKXPULDAB-JOCHJYFZSA-N 0 1 374.544 4.759 20 0 FJADMN COc1cc(CN2CCC(Oc3ccc(C)cc3)CC2)ccc1SC ZINC000604885299 568380828 /nfs/dbraw/zinc/38/08/28/568380828.db2.gz BBHCNAFGRRPWHB-UHFFFAOYSA-N 0 1 357.519 4.769 20 0 FJADMN CCCn1cc(CNCc2ccc(Oc3ccc(F)cc3)c(C)c2)cn1 ZINC000604891421 568381835 /nfs/dbraw/zinc/38/18/35/568381835.db2.gz HKBFPSRBVFDOAZ-UHFFFAOYSA-N 0 1 353.441 4.823 20 0 FJADMN Brc1ccc(/C=C\CCSc2nc(C3CC3)n[nH]2)cc1 ZINC000604931305 568394739 /nfs/dbraw/zinc/39/47/39/568394739.db2.gz VJCUXQOCPAWQNT-IWQZZHSRSA-N 0 1 350.285 4.640 20 0 FJADMN Brc1ccc(/C=C\CCSc2n[nH]c(C3CC3)n2)cc1 ZINC000604931305 568394740 /nfs/dbraw/zinc/39/47/40/568394740.db2.gz VJCUXQOCPAWQNT-IWQZZHSRSA-N 0 1 350.285 4.640 20 0 FJADMN CCc1c2cc(C)ccc2oc1[C@H](C)NCc1ccc([S@](C)=O)cc1 ZINC000182006506 568400881 /nfs/dbraw/zinc/40/08/81/568400881.db2.gz QWUSGHWDAILYQK-MQNRADLISA-N 0 1 355.503 4.892 20 0 FJADMN Cc1ccc2nc(SCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c2c1 ZINC000006292058 568401538 /nfs/dbraw/zinc/40/15/38/568401538.db2.gz IGUVIHQTUBWGCY-UHFFFAOYSA-N 0 1 356.838 4.867 20 0 FJADMN CC(C)[C@H]1CCCCN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000605000328 568513749 /nfs/dbraw/zinc/51/37/49/568513749.db2.gz JBDRWWSBHNLPJG-GFCCVEGCSA-N 0 1 370.316 4.571 20 0 FJADMN Cc1csc(CN[C@@H](c2ccc(Br)cc2)C2CCC2)n1 ZINC000605008411 568515837 /nfs/dbraw/zinc/51/58/37/568515837.db2.gz RMPRAISGCOGDMG-MRXNPFEDSA-N 0 1 351.313 4.845 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)c1cc2cc(F)ccc2o1 ZINC000605122656 568578551 /nfs/dbraw/zinc/57/85/51/568578551.db2.gz MDMPSVPMMRRFIY-UHFFFAOYSA-N 0 1 361.332 4.961 20 0 FJADMN COc1cc(CN[C@@H]2CSc3ccccc32)ccc1OCC(F)(F)F ZINC000605166158 568594288 /nfs/dbraw/zinc/59/42/88/568594288.db2.gz UGWWBSJMBPLOJK-CQSZACIVSA-N 0 1 369.408 4.573 20 0 FJADMN COc1cc(CN2CCS[C@@H](c3ccccc3)C2)ccc1OC(F)F ZINC000605187587 568615035 /nfs/dbraw/zinc/61/50/35/568615035.db2.gz FXVYVKQHKYMZHO-GOSISDBHSA-N 0 1 365.445 4.587 20 0 FJADMN CCN(CC)[C@H](CNC(=O)[C@H](C)c1ccsc1)c1ccccc1Cl ZINC000606162291 568681033 /nfs/dbraw/zinc/68/10/33/568681033.db2.gz XNUBMBPCELZBLG-RDTXWAMCSA-N 0 1 364.942 4.704 20 0 FJADMN CCc1ccc([C@@H](C)CC(=O)NC[C@@H](c2ccco2)N2CCCCC2)cc1 ZINC000606161037 568680049 /nfs/dbraw/zinc/68/00/49/568680049.db2.gz AJARQDODJFRAKD-RXVVDRJESA-N 0 1 368.521 4.679 20 0 FJADMN CCN(CC)[C@H](CNC(=O)[C@H](C)c1cccs1)c1ccccc1Cl ZINC000606162316 568681012 /nfs/dbraw/zinc/68/10/12/568681012.db2.gz YYMIFMRIPAWDBB-RHSMWYFYSA-N 0 1 364.942 4.704 20 0 FJADMN O=C(CCCN1CCC(C(=O)c2ccc(F)cc2)CC1)c1ccc(F)cc1 ZINC000000537887 210249804 /nfs/dbraw/zinc/24/98/04/210249804.db2.gz WCIBOXFOUGQLFC-UHFFFAOYSA-N 0 1 371.427 4.523 20 0 in-man FJADMN Cc1nc(C(C)C)sc1C(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1 ZINC000109888908 206065475 /nfs/dbraw/zinc/06/54/75/206065475.db2.gz IVTKDEHCUYTFBF-UHFFFAOYSA-N 0 1 354.479 4.971 20 0 FJADMN Cc1ccc(S(=O)(=O)Nc2ccc(Br)cc2C)c(Cl)c1 ZINC000022514025 211353010 /nfs/dbraw/zinc/35/30/10/211353010.db2.gz JKIGHRJQPINZKJ-UHFFFAOYSA-N 0 1 374.687 4.520 20 0 FJADMN FC(F)(F)Oc1ccccc1CNCc1ccc(Br)s1 ZINC000037979298 211328779 /nfs/dbraw/zinc/32/87/79/211328779.db2.gz QIRKCJBYEPIJDM-UHFFFAOYSA-N 0 1 366.202 4.699 20 0 FJADMN Fc1ccc2c(c1)[C@@H](NCc1cc(Br)cs1)CCS2 ZINC000035043814 210358005 /nfs/dbraw/zinc/35/80/05/210358005.db2.gz ZBWPTGDURGZQQR-ZDUSSCGKSA-N 0 1 358.301 4.976 20 0 FJADMN CN(C)[C@H](CNC(=O)Nc1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 ZINC000071943362 221389079 /nfs/dbraw/zinc/38/90/79/221389079.db2.gz ASPOTVLCKQCWJV-MRXNPFEDSA-N 0 1 370.255 4.557 20 0 FJADMN O=C(Nc1ncc(Cc2ccccc2Cl)s1)c1cccc2c[nH]nc21 ZINC000072012004 221396273 /nfs/dbraw/zinc/39/62/73/221396273.db2.gz KJSSJQFWSWHAJZ-UHFFFAOYSA-N 0 1 368.849 4.516 20 0 FJADMN CC(C)c1ccoc1C(=O)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 ZINC000670817871 567829358 /nfs/dbraw/zinc/82/93/58/567829358.db2.gz HQVDKDUYMUULFF-INIZCTEOSA-N 0 1 370.497 4.589 20 0 FJADMN FC(F)c1ccc(CNCc2cc(Br)cc3c2OCC3)cc1 ZINC000185464067 567844805 /nfs/dbraw/zinc/84/48/05/567844805.db2.gz DHMLDWCBHIAAAJ-UHFFFAOYSA-N 0 1 368.221 4.611 20 0 FJADMN Cc1ccc(-c2nc(CN3CC[C@H](COCc4ccccc4)C3)co2)cc1 ZINC000075864397 567897531 /nfs/dbraw/zinc/89/75/31/567897531.db2.gz WLKATACGUCSQJC-FQEVSTJZSA-N 0 1 362.473 4.689 20 0 FJADMN C[C@H](CC(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1)C(=O)c1ccccc1 ZINC000602123702 567938373 /nfs/dbraw/zinc/93/83/73/567938373.db2.gz DEYPFKHXOZEZSX-CQSZACIVSA-N 0 1 361.445 4.678 20 0 FJADMN COC(=O)c1c(CN2C3CCC2CC3)nc2ccccc2c1-c1ccccc1 ZINC000602152462 567943521 /nfs/dbraw/zinc/94/35/21/567943521.db2.gz VZGCFGJFISWCLC-UHFFFAOYSA-N 0 1 372.468 4.815 20 0 FJADMN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H](C)c2cc(F)ccc2F)cc1 ZINC000602570204 567996007 /nfs/dbraw/zinc/99/60/07/567996007.db2.gz ALTUOTXEXNJBTE-UONOGXRCSA-N 0 1 361.436 4.907 20 0 FJADMN Cc1ccc(OC2CCN(Cc3cnn(-c4ccccc4)c3)CC2)cc1C ZINC000521425760 568003660 /nfs/dbraw/zinc/00/36/60/568003660.db2.gz KWVRWSWQDQHBOI-UHFFFAOYSA-N 0 1 361.489 4.533 20 0 FJADMN COc1cc([C@H](C)NCc2ccc(Cl)cc2Cl)cc(OC)c1OC ZINC000067690619 568080770 /nfs/dbraw/zinc/08/07/70/568080770.db2.gz GHGGACZXJVJQRE-NSHDSACASA-N 0 1 370.276 4.870 20 0 FJADMN CC(C)(CNCc1csc(COc2ccccc2)n1)c1ccccc1 ZINC000603510104 568110405 /nfs/dbraw/zinc/11/04/05/568110405.db2.gz QSIICILNIRQPTM-UHFFFAOYSA-N 0 1 352.503 4.790 20 0 FJADMN Cc1ccc(OCc2nc(CN[C@@H](C)Cc3ccsc3)cs2)cc1 ZINC000603511937 568110791 /nfs/dbraw/zinc/11/07/91/568110791.db2.gz IPLUTCMESLKFMI-HNNXBMFYSA-N 0 1 358.532 4.813 20 0 FJADMN Cc1ccc(-c2nc(CNCCc3ccc4ccccc4n3)cs2)cc1 ZINC000603512357 568110838 /nfs/dbraw/zinc/11/08/38/568110838.db2.gz FENMIWKTQKJBNV-UHFFFAOYSA-N 0 1 359.498 4.999 20 0 FJADMN Clc1ccc(SCCOc2ccc(CNCc3cn[nH]c3)cc2)cc1 ZINC000603519381 568115183 /nfs/dbraw/zinc/11/51/83/568115183.db2.gz GUHSMEFBRJDHJH-UHFFFAOYSA-N 0 1 373.909 4.524 20 0 FJADMN Cc1cc(CNC(=O)Nc2cc(Cl)ccc2Oc2cccc(C)c2)n[nH]1 ZINC000603559830 568117382 /nfs/dbraw/zinc/11/73/82/568117382.db2.gz QRUXLWPEIUPRHF-UHFFFAOYSA-N 0 1 370.840 4.794 20 0 FJADMN Cc1cc(CNC(=O)Nc2ccc(Sc3ccccc3Cl)cc2)n[nH]1 ZINC000603574665 568121023 /nfs/dbraw/zinc/12/10/23/568121023.db2.gz LSUAGRFUNVCXGJ-UHFFFAOYSA-N 0 1 372.881 4.844 20 0 FJADMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1cc2c(cccc2Cl)s1 ZINC000603901599 568180102 /nfs/dbraw/zinc/18/01/02/568180102.db2.gz AHTZDZNZZTZAMA-UHFFFAOYSA-N 0 1 354.822 4.592 20 0 FJADMN CCc1noc([C@@H](C)NCC2(c3cccc(C(F)(F)F)c3)CCCC2)n1 ZINC000604061965 568204688 /nfs/dbraw/zinc/20/46/88/568204688.db2.gz NWPKQPPDACJUCI-CYBMUJFWSA-N 0 1 367.415 4.813 20 0 FJADMN CC(C)CCN1Cc2cccc(NC(=O)C3(c4cccc(F)c4)CC3)c2C1 ZINC000604229779 568233016 /nfs/dbraw/zinc/23/30/16/568233016.db2.gz XYPSAHYADDCBDJ-UHFFFAOYSA-N 0 1 366.480 4.858 20 0 FJADMN O=C(Cc1c[nH]c2ccc(F)cc12)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000604316483 568246060 /nfs/dbraw/zinc/24/60/60/568246060.db2.gz GCIQSUKYHPVEFH-UHFFFAOYSA-N 0 1 374.375 4.625 20 0 FJADMN C[C@H](CC(=O)Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)c1cccnc1 ZINC000604328045 568250393 /nfs/dbraw/zinc/25/03/93/568250393.db2.gz HEOYFEWLNSXTKG-CQSZACIVSA-N 0 1 374.419 4.896 20 0 FJADMN c1sc(-c2ccc3c(c2)OCO3)nc1CN1CCC[C@H]1c1ccccc1 ZINC000303181682 568256085 /nfs/dbraw/zinc/25/60/85/568256085.db2.gz SYFVLHLDQAYXBS-SFHVURJKSA-N 0 1 364.470 4.876 20 0 FJADMN Cc1cccc(Oc2ccc(NC(=O)Cc3n[nH]c4ccccc34)cn2)c1C ZINC000604362704 568270312 /nfs/dbraw/zinc/27/03/12/568270312.db2.gz QCFVVWTTZHYZNW-UHFFFAOYSA-N 0 1 372.428 4.548 20 0 FJADMN COc1cc(CN[C@H](c2ccccc2Cl)C(C)C)cc2c1OCCO2 ZINC000604417029 568275187 /nfs/dbraw/zinc/27/51/87/568275187.db2.gz ZFBNKNAIPDZDTK-IBGZPJMESA-N 0 1 361.869 4.607 20 0 FJADMN Cc1c(F)cccc1-c1ccc(CNCc2ccc3c(c2)OCCCO3)o1 ZINC000604415744 568281152 /nfs/dbraw/zinc/28/11/52/568281152.db2.gz QFIHGNLILDUFPC-UHFFFAOYSA-N 0 1 367.420 4.845 20 0 FJADMN CC[C@H](c1ccccc1)[C@H]1CCCN1Cc1noc(Cc2ccccc2)n1 ZINC000525796757 568286192 /nfs/dbraw/zinc/28/61/92/568286192.db2.gz HUYRGWMFLAADSS-NHCUHLMSSA-N 0 1 361.489 4.819 20 0 FJADMN FC(F)(F)[C@@H]1C[C@@H](C(F)(F)F)CN(Cc2ccc3c(c2)CCC3)C1 ZINC000604383710 568287438 /nfs/dbraw/zinc/28/74/38/568287438.db2.gz FOQVEELHNXRHIN-HUUCEWRRSA-N 0 1 351.334 4.738 20 0 FJADMN COc1ccc(-c2cc(CN(Cc3ccc(F)cc3)CC3CC3)on2)cc1 ZINC000604396144 568295266 /nfs/dbraw/zinc/29/52/66/568295266.db2.gz FSGLEAJOCXBNIM-UHFFFAOYSA-N 0 1 366.436 4.902 20 0 FJADMN CC(C)(C)[C@@H](CC1CCCCC1)NC(=O)c1c[nH]c2ccccc2c1=O ZINC000604606373 568325646 /nfs/dbraw/zinc/32/56/46/568325646.db2.gz SZLNCSNVIGZAFV-LJQANCHMSA-N 0 1 354.494 4.643 20 0 FJADMN O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)[C@H]1C[C@@H]1c1c(F)cccc1F ZINC000604745673 568356178 /nfs/dbraw/zinc/35/61/78/568356178.db2.gz OBFYTFFZGYYQCC-KBPBESRZSA-N 0 1 367.399 4.851 20 0 FJADMN O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)[C@H]1C[C@H]1c1c(F)cccc1F ZINC000604745674 568356228 /nfs/dbraw/zinc/35/62/28/568356228.db2.gz OBFYTFFZGYYQCC-KGLIPLIRSA-N 0 1 367.399 4.851 20 0 FJADMN CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1ccc(CN(CC)CC)o1 ZINC000604736254 568358774 /nfs/dbraw/zinc/35/87/74/568358774.db2.gz SGALJVGXJIPTOK-QGZVFWFLSA-N 0 1 362.901 4.526 20 0 FJADMN OC[C@@H](NCc1cccc(OCC2CCCCC2)c1)c1cccc(F)c1 ZINC000604768731 568362646 /nfs/dbraw/zinc/36/26/46/568362646.db2.gz MRUDVYQKAPSODQ-JOCHJYFZSA-N 0 1 357.469 4.608 20 0 FJADMN CCOc1ccc2nc(S[C@@H](C)c3nnc(-c4ccccc4)o3)[nH]c2c1 ZINC000005165171 568380107 /nfs/dbraw/zinc/38/01/07/568380107.db2.gz APUIWTDPCDVORV-LBPRGKRZSA-N 0 1 366.446 4.865 20 0 FJADMN Fc1ccc(CCN(Cc2coc(-c3ccc(F)cc3)n2)C2CC2)cc1 ZINC000604903129 568385438 /nfs/dbraw/zinc/38/54/38/568385438.db2.gz OGCDZZXNGYWVFE-UHFFFAOYSA-N 0 1 354.400 4.827 20 0 FJADMN CCOc1ccc2nc(SCC(=O)Nc3c(C)cccc3CC)[nH]c2c1 ZINC000005667710 568389260 /nfs/dbraw/zinc/38/92/60/568389260.db2.gz AZOQMKVBZVNCIJ-UHFFFAOYSA-N 0 1 369.490 4.563 20 0 FJADMN CCOc1ccc2nc(SCC(=O)Nc3ccccc3C(C)C)[nH]c2c1 ZINC000005691480 568389601 /nfs/dbraw/zinc/38/96/01/568389601.db2.gz KFARNPOBJDJPPL-UHFFFAOYSA-N 0 1 369.490 4.816 20 0 FJADMN CCOc1ccc2nc(S[C@@H](C)C(=O)Nc3c(C)cccc3C)[nH]c2c1 ZINC000007060503 568437389 /nfs/dbraw/zinc/43/73/89/568437389.db2.gz BDWPOMMZFJQCHG-AWEZNQCLSA-N 0 1 369.490 4.698 20 0 FJADMN CC(C)[C@@H]1CCCCN1Cc1nc(-c2ccc(Br)s2)no1 ZINC000605000339 568513850 /nfs/dbraw/zinc/51/38/50/568513850.db2.gz JLNOAELOKBNHLS-NSHDSACASA-N 0 1 370.316 4.571 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN3C(=O)c3cc4cc(F)ccc4o3)[nH]c2c1 ZINC000605088747 568567558 /nfs/dbraw/zinc/56/75/58/568567558.db2.gz OUHZNNBRZJFDLQ-QGZVFWFLSA-N 0 1 363.392 4.734 20 0 FJADMN FC(F)(F)[C@H]1C[C@H](C(F)(F)F)CN(CCSc2ccccc2)C1 ZINC000605150021 568587081 /nfs/dbraw/zinc/58/70/81/568587081.db2.gz FMPKVPKDEAMAEU-RYUDHWBXSA-N 0 1 357.363 4.841 20 0 FJADMN COc1ccc(-c2cc(CN3CCS[C@H](c4ccccc4)C3)on2)cc1 ZINC000605156063 568601570 /nfs/dbraw/zinc/60/15/70/568601570.db2.gz IWPRGUYATXVQHV-NRFANRHFSA-N 0 1 366.486 4.640 20 0 FJADMN CCOc1ccc(CN2CCS[C@H](c3ccccc3)C2)cc1OCC ZINC000605187675 568615384 /nfs/dbraw/zinc/61/53/84/568615384.db2.gz JPBGSYQVETVBBO-NRFANRHFSA-N 0 1 357.519 4.774 20 0 FJADMN Cc1nc(CN2CCCC23CCN(c2ccc(C(C)C)cn2)CC3)cs1 ZINC001164692763 719809898 /nfs/dbraw/zinc/80/98/98/719809898.db2.gz MJDFGVCSURHEGG-UHFFFAOYSA-N 0 1 370.566 4.605 20 0 FJADMN Fc1cccc(CN2CC[C@@]23CCCN(c2nccc4ccsc42)C3)c1 ZINC001164993276 722196827 /nfs/dbraw/zinc/19/68/27/722196827.db2.gz DZEGIHWNTLWAFS-OAQYLSRUSA-N 0 1 367.493 4.680 20 0 FJADMN CCSc1ccnc(N2CCC[C@@]3(CCN3Cc3cccc(F)c3)C2)c1 ZINC001164995877 722212288 /nfs/dbraw/zinc/21/22/88/722212288.db2.gz LDAFNGZCWYNFDQ-OAQYLSRUSA-N 0 1 371.525 4.578 20 0 FJADMN Cc1ccc(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)cn1 ZINC000059585528 212017248 /nfs/dbraw/zinc/01/72/48/212017248.db2.gz XAWUDMGIJYVRFH-UHFFFAOYSA-N 0 1 362.820 4.839 20 0 FJADMN CCc1cccc(CC)c1NC(=O)CN(C)[C@H]1CCCc2ccccc21 ZINC000008126515 204317484 /nfs/dbraw/zinc/31/74/84/204317484.db2.gz OSXHEOGDIFBSFF-NRFANRHFSA-N 0 1 350.506 4.759 20 0 FJADMN Brc1ccc(CNCc2ccccc2Br)cc1 ZINC000042238833 205093947 /nfs/dbraw/zinc/09/39/47/205093947.db2.gz SGIPNBCJUKHGIK-UHFFFAOYSA-N 0 1 355.073 4.501 20 0 FJADMN Cc1c2ccccc2oc1C(=O)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1 ZINC000109021476 206043117 /nfs/dbraw/zinc/04/31/17/206043117.db2.gz UIPMCRHCBCLRNL-SFHVURJKSA-N 0 1 361.401 4.721 20 0 FJADMN CC[C@@H](NCc1cc(F)ccc1Br)c1ccc(OC)cc1 ZINC000038038944 211366437 /nfs/dbraw/zinc/36/64/37/211366437.db2.gz KAMCEFVRDSFYGH-QGZVFWFLSA-N 0 1 352.247 4.838 20 0 FJADMN C[C@@H](c1ccc(Br)cc1)N1CCCO[C@H](c2ccccc2)C1 ZINC000602238747 567954867 /nfs/dbraw/zinc/95/48/67/567954867.db2.gz DCJVVJKARYNENJ-KXBFYZLASA-N 0 1 360.295 4.974 20 0 FJADMN COc1ccccc1-c1cc(CN[C@H]2CCCc3c(OC)cccc32)on1 ZINC000658358763 567960093 /nfs/dbraw/zinc/96/00/93/567960093.db2.gz YEJYBZMAIQIEOU-IBGZPJMESA-N 0 1 364.445 4.526 20 0 FJADMN CC[C@@H]1c2ccsc2CCN1C(=O)CN(CC)[C@H](C)c1ccc(F)cc1 ZINC000521415318 567960602 /nfs/dbraw/zinc/96/06/02/567960602.db2.gz FJXVNJXOUOCSNU-DNVCBOLYSA-N 0 1 374.525 4.806 20 0 FJADMN COc1ccccc1-c1cc(CN[C@@H]2CCCc3c(OC)cccc32)on1 ZINC000658358767 567960760 /nfs/dbraw/zinc/96/07/60/567960760.db2.gz YEJYBZMAIQIEOU-LJQANCHMSA-N 0 1 364.445 4.526 20 0 FJADMN Cc1c(Cl)cccc1NC(=O)CN[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000602550745 567990665 /nfs/dbraw/zinc/99/06/65/567990665.db2.gz YLFBHSGJHRFAPV-NSHDSACASA-N 0 1 355.240 4.730 20 0 FJADMN COc1cc([C@@H](C)N[C@@H](C)c2cc(F)ccc2F)ccc1OC(F)F ZINC000602562566 567991771 /nfs/dbraw/zinc/99/17/71/567991771.db2.gz ABWPGRSQWSWUAN-MNOVXSKESA-N 0 1 357.347 4.987 20 0 FJADMN COc1cc([C@@H](C)N[C@H](C)c2cc(F)ccc2F)ccc1OC(F)F ZINC000602562541 567991786 /nfs/dbraw/zinc/99/17/86/567991786.db2.gz ABWPGRSQWSWUAN-GHMZBOCLSA-N 0 1 357.347 4.987 20 0 FJADMN COc1cc([C@H](C)N[C@H](C)c2cc(F)ccc2F)ccc1OC(F)F ZINC000602562571 567991841 /nfs/dbraw/zinc/99/18/41/567991841.db2.gz ABWPGRSQWSWUAN-WDEREUQCSA-N 0 1 357.347 4.987 20 0 FJADMN C[C@@H](N[C@H](C)c1ccccc1Br)c1ccc2c(c1)CCC(=O)N2 ZINC000602567252 567995719 /nfs/dbraw/zinc/99/57/19/567995719.db2.gz MAURYOOQPMOLBY-CHWSQXEVSA-N 0 1 373.294 4.746 20 0 FJADMN C[C@H](Nc1ccc(NC(=O)CN2CCCCCC2)cc1)c1ccc(F)cc1 ZINC000602567232 567995752 /nfs/dbraw/zinc/99/57/52/567995752.db2.gz LGTQCGUODWLKAL-KRWDZBQOSA-N 0 1 369.484 4.813 20 0 FJADMN CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@H](C)c2cc(F)ccc2F)cc1 ZINC000602570205 567996026 /nfs/dbraw/zinc/99/60/26/567996026.db2.gz ALTUOTXEXNJBTE-ZIAGYGMSSA-N 0 1 361.436 4.907 20 0 FJADMN Cc1nc([C@H](N[C@@H](C)c2cccc(-c3ccncc3)c2)c2ccccc2)n[nH]1 ZINC000162661954 568002788 /nfs/dbraw/zinc/00/27/88/568002788.db2.gz PQBCJWXTJSRNBK-KSFYIVLOSA-N 0 1 369.472 4.615 20 0 FJADMN CCOc1ccccc1NC(=O)CN1CCCCC[C@H]1c1ccccc1 ZINC000521426051 568006260 /nfs/dbraw/zinc/00/62/60/568006260.db2.gz ZYSBDKXKRLROFY-FQEVSTJZSA-N 0 1 352.478 4.641 20 0 FJADMN CSC1CCN([C@@H](C)c2nnc(-c3ccc(Cl)c(Cl)c3)o2)CC1 ZINC000602920543 568013129 /nfs/dbraw/zinc/01/31/29/568013129.db2.gz PEUNWWHPUFXWOI-JTQLQIEISA-N 0 1 372.321 4.932 20 0 FJADMN COc1cc(OC)c(OC)cc1CN[C@@H]1CCSc2cc(C)c(C)cc21 ZINC000186936296 568017499 /nfs/dbraw/zinc/01/74/99/568017499.db2.gz LYDHXZCKMVVPIA-QGZVFWFLSA-N 0 1 373.518 4.656 20 0 FJADMN COC(=O)c1ccc(CN([C@@H](C)c2cccc(C(F)(F)F)c2)C2CC2)o1 ZINC000064932826 568025744 /nfs/dbraw/zinc/02/57/44/568025744.db2.gz NXCIXBYBDWXLDF-LBPRGKRZSA-N 0 1 367.367 4.811 20 0 FJADMN COc1ccc(CN[C@@H]2CCSc3cc(C)c(C)cc32)c(OC)c1OC ZINC000187026322 568049568 /nfs/dbraw/zinc/04/95/68/568049568.db2.gz JAEINVDLSRSXAX-QGZVFWFLSA-N 0 1 373.518 4.656 20 0 FJADMN COc1cccc(CNC(C)(C)c2cccc(C(F)(F)F)c2)c1OC ZINC000067011480 568073098 /nfs/dbraw/zinc/07/30/98/568073098.db2.gz KSPQFJRWAVMLPS-UHFFFAOYSA-N 0 1 353.384 4.748 20 0 FJADMN Fc1ccc2c(c1)nccc2NCc1cccc(OCc2ccccn2)c1 ZINC000603493217 568107687 /nfs/dbraw/zinc/10/76/87/568107687.db2.gz QSYAEOSOIUKTDT-UHFFFAOYSA-N 0 1 359.404 4.960 20 0 FJADMN COc1cccc2c1OCC[C@H]2NCc1ccc(OC(F)F)c(Cl)c1 ZINC000603518920 568112918 /nfs/dbraw/zinc/11/29/18/568112918.db2.gz QGHNOEOODZPTHR-CQSZACIVSA-N 0 1 369.795 4.563 20 0 FJADMN C[C@H](C(=O)Nc1ccccc1SCC(F)(F)F)N1CCCCCC1 ZINC000603793801 568164888 /nfs/dbraw/zinc/16/48/88/568164888.db2.gz QLLABDRMYVISNF-CYBMUJFWSA-N 0 1 360.445 4.544 20 0 FJADMN C[C@@H](C(=O)Nc1cccc(CN2CCSCC2)c1)c1cccc(Cl)c1 ZINC000607813461 568227307 /nfs/dbraw/zinc/22/73/07/568227307.db2.gz YHGKXSIUOBSIOD-OAHLLOKOSA-N 0 1 374.937 4.631 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N[C@H](c2ccccc2Cl)C(C)C)o1 ZINC000604234388 568231744 /nfs/dbraw/zinc/23/17/44/568231744.db2.gz PWNTWFZBHJMWDW-IBGZPJMESA-N 0 1 362.901 4.902 20 0 FJADMN Cc1n[nH]c(C(=O)N[C@@H](c2cccs2)c2ccc(C(C)C)cc2)c1C ZINC000604309073 568248005 /nfs/dbraw/zinc/24/80/05/568248005.db2.gz YLRLLXVMXVXESI-LJQANCHMSA-N 0 1 353.491 4.731 20 0 FJADMN C[C@@H](CC(=O)Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)c1cccnc1 ZINC000604328044 568250399 /nfs/dbraw/zinc/25/03/99/568250399.db2.gz HEOYFEWLNSXTKG-AWEZNQCLSA-N 0 1 374.419 4.896 20 0 FJADMN C[C@@H](c1ccc2ccccc2c1)N(CC(=O)N(C)Cc1ccco1)C1CC1 ZINC000303282209 568264281 /nfs/dbraw/zinc/26/42/81/568264281.db2.gz UUJPIYJPQSBQQZ-KRWDZBQOSA-N 0 1 362.473 4.617 20 0 FJADMN C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000604358366 568267537 /nfs/dbraw/zinc/26/75/37/568267537.db2.gz YAFDNDFJBUGXTD-GOEBONIOSA-N 0 1 365.864 4.748 20 0 FJADMN Cc1ccc(C[C@@H](N[C@H](C)C(=O)Nc2cccc(C)c2)c2ccccn2)cc1 ZINC000604414095 568278702 /nfs/dbraw/zinc/27/87/02/568278702.db2.gz WXWDXOBPBZVRBC-AUSIDOKSSA-N 0 1 373.500 4.599 20 0 FJADMN C[C@@H](NCc1ccc(-c2c(F)cccc2F)o1)c1ccc2c(c1)OCO2 ZINC000604414838 568279592 /nfs/dbraw/zinc/27/95/92/568279592.db2.gz CWIVXDFZSGBMFK-GFCCVEGCSA-N 0 1 357.356 4.804 20 0 FJADMN C[C@H](C(=O)Nc1cc(Cl)ccc1F)N1C[C@H](c2ccccc2)C[C@H]1C ZINC000604392999 568283111 /nfs/dbraw/zinc/28/31/11/568283111.db2.gz QGDBBLCYUDPIPA-IIAWOOMASA-N 0 1 360.860 4.684 20 0 FJADMN Cc1cccc(C(C)C)c1NC(=O)CN1C[C@@H](c2ccccc2)C[C@H]1C ZINC000604393206 568283259 /nfs/dbraw/zinc/28/32/59/568283259.db2.gz UVIYMFSPBAUCKW-QUCCMNQESA-N 0 1 350.506 4.935 20 0 FJADMN CC[C@@H](c1ccccc1)[C@H]1CCCN1Cc1noc(Cc2ccccc2)n1 ZINC000525796756 568286150 /nfs/dbraw/zinc/28/61/50/568286150.db2.gz HUYRGWMFLAADSS-LEWJYISDSA-N 0 1 361.489 4.819 20 0 FJADMN CC(C)c1c(NC(=O)c2cn[nH]c2C2CC2)cnn1-c1cccc(Cl)c1 ZINC000365211176 568323251 /nfs/dbraw/zinc/32/32/51/568323251.db2.gz APGPOQSLNZJCDI-UHFFFAOYSA-N 0 1 369.856 4.502 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)c1ccc(-c2cnco2)cc1 ZINC000617134821 568348120 /nfs/dbraw/zinc/34/81/20/568348120.db2.gz JGBLZPCGODWQMZ-UHFFFAOYSA-N 0 1 370.368 4.730 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)c1cncc2ccccc21 ZINC000617135204 568348461 /nfs/dbraw/zinc/34/84/61/568348461.db2.gz YFMULSLWFFVOEG-UHFFFAOYSA-N 0 1 354.369 4.623 20 0 FJADMN Fc1ccccc1-c1n[nH]c(SCc2ccccc2C(F)(F)F)n1 ZINC000004880395 568375699 /nfs/dbraw/zinc/37/56/99/568375699.db2.gz WLEDLYGZUIODPK-UHFFFAOYSA-N 0 1 353.344 4.922 20 0 FJADMN Cc1[nH]ncc1[C@H]1Nc2ccccc2C(=O)N1c1ccc(Cl)c(Cl)c1 ZINC000604891797 568381947 /nfs/dbraw/zinc/38/19/47/568381947.db2.gz XOSBQIKKRMRKOU-KRWDZBQOSA-N 0 1 373.243 4.796 20 0 FJADMN CCc1ccc(NC(=O)CSc2nc(Cc3ccccc3)c(C)[nH]2)cc1 ZINC000005312593 568382205 /nfs/dbraw/zinc/38/22/05/568382205.db2.gz BDERGPVOLYABPY-UHFFFAOYSA-N 0 1 365.502 4.602 20 0 FJADMN Fc1ccc(CCN(Cc2ncc(-c3ccc(F)cc3)o2)C2CC2)cc1 ZINC000604903109 568385453 /nfs/dbraw/zinc/38/54/53/568385453.db2.gz MMGHCUGONAJQDY-UHFFFAOYSA-N 0 1 354.400 4.827 20 0 FJADMN CCc1c2cc(C)ccc2oc1[C@@H](C)NCc1ccc([S@](C)=O)cc1 ZINC000182006490 568400863 /nfs/dbraw/zinc/40/08/63/568400863.db2.gz QWUSGHWDAILYQK-BZQUYTCOSA-N 0 1 355.503 4.892 20 0 FJADMN COc1ccc(-c2cc(CN3CCC[C@@H](CC(F)(F)F)C3)on2)cc1 ZINC000643253834 568401304 /nfs/dbraw/zinc/40/13/04/568401304.db2.gz BJYMGJPBXHSJDQ-ZDUSSCGKSA-N 0 1 354.372 4.515 20 0 FJADMN COc1ccc2nc(SCC(=O)Nc3ccccc3C(C)(C)C)[nH]c2c1 ZINC000006503528 568403309 /nfs/dbraw/zinc/40/33/09/568403309.db2.gz ZJBFWCFBPAYUDL-UHFFFAOYSA-N 0 1 369.490 4.600 20 0 FJADMN Cc1sc(NC(=O)c2ccc(O)c(Cl)c2)nc1-c1ccc(F)cc1 ZINC000006994169 568414130 /nfs/dbraw/zinc/41/41/30/568414130.db2.gz PZYAQHWAFUJNNL-UHFFFAOYSA-N 0 1 362.813 4.869 20 0 FJADMN O=C(c1ccc([O-])cc1)C1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000261369410 568454709 /nfs/dbraw/zinc/45/47/09/568454709.db2.gz OVUHVKPTQDIGHY-UHFFFAOYSA-N 0 1 363.379 4.506 20 0 FJADMN Cc1ccc(-c2cc(C(=O)Nc3ccc4c(cnn4C(C)C)c3)[nH]n2)cc1 ZINC000604993246 568504615 /nfs/dbraw/zinc/50/46/15/568504615.db2.gz XHRDQLVBTNHLEY-UHFFFAOYSA-N 0 1 359.433 4.568 20 0 FJADMN C[C@@H](NC(=O)CN1CCC[C@@H]1c1cccs1)c1cccc2ccccc21 ZINC000007443103 568511438 /nfs/dbraw/zinc/51/14/38/568511438.db2.gz IJYQCANADIUDFJ-OXQOHEQNSA-N 0 1 364.514 4.916 20 0 FJADMN CC[C@H]1CCCN(Cc2csc(-c3ccc(OC)cc3OC)n2)CC1 ZINC000604999083 568512419 /nfs/dbraw/zinc/51/24/19/568512419.db2.gz LMWDTECPXKYVRT-HNNXBMFYSA-N 0 1 360.523 4.839 20 0 FJADMN CC[C@@H]1CCCN(Cc2csc(-c3ccc(OC)cc3OC)n2)CC1 ZINC000604999084 568512563 /nfs/dbraw/zinc/51/25/63/568512563.db2.gz LMWDTECPXKYVRT-OAHLLOKOSA-N 0 1 360.523 4.839 20 0 FJADMN CC(C)[C@H]1CCCCN1Cc1nc(-c2ccc(Br)s2)no1 ZINC000605000338 568513799 /nfs/dbraw/zinc/51/37/99/568513799.db2.gz JLNOAELOKBNHLS-LLVKDONJSA-N 0 1 370.316 4.571 20 0 FJADMN Cc1cc(C)c(C(=O)[C@@H](C)Sc2nc(-c3ccccc3)n[nH]2)cc1C ZINC000007472063 568520893 /nfs/dbraw/zinc/52/08/93/568520893.db2.gz HYUVGYJTVXRXBZ-OAHLLOKOSA-N 0 1 351.475 4.760 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N2CCCc3cc(Cl)cc(C)c32)o1 ZINC000605095223 568563085 /nfs/dbraw/zinc/56/30/85/568563085.db2.gz KMTYYLHYTHPQNK-UHFFFAOYSA-N 0 1 360.885 4.676 20 0 FJADMN COc1cc(CN[C@H]2CSc3ccccc32)ccc1OCC(F)(F)F ZINC000605166157 568594258 /nfs/dbraw/zinc/59/42/58/568594258.db2.gz UGWWBSJMBPLOJK-AWEZNQCLSA-N 0 1 369.408 4.573 20 0 FJADMN c1nc2ccccc2n1-c1ccc(CN[C@H]2CSc3ccccc32)cc1 ZINC000605165931 568594298 /nfs/dbraw/zinc/59/42/98/568594298.db2.gz HIDCKLIMKSZLDE-FQEVSTJZSA-N 0 1 357.482 4.962 20 0 FJADMN COc1ccc(-c2cc(CN3CCS[C@@H](c4ccccc4)C3)on2)cc1 ZINC000605156064 568601638 /nfs/dbraw/zinc/60/16/38/568601638.db2.gz IWPRGUYATXVQHV-OAQYLSRUSA-N 0 1 366.486 4.640 20 0 FJADMN Cc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1nc(-c2ccccc2)n[nH]1 ZINC000007633494 568613316 /nfs/dbraw/zinc/61/33/16/568613316.db2.gz GCCJVLOIJBEUJN-LBPRGKRZSA-N 0 1 372.881 4.553 20 0 FJADMN O=C(CC/C=C/c1ccccc1)Nc1cccc(CN2CCSCC2)c1 ZINC000606186421 568708008 /nfs/dbraw/zinc/70/80/08/568708008.db2.gz WCMPUHKYSYCEMQ-RUDMXATFSA-N 0 1 366.530 4.668 20 0 FJADMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1sc2ccccc2c1Cl ZINC000078710528 210220715 /nfs/dbraw/zinc/22/07/15/210220715.db2.gz NCXNSPKCXYBXID-UHFFFAOYSA-N 0 1 354.822 4.592 20 0 FJADMN O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)c1cccc(Cl)c1 ZINC000007405719 210094968 /nfs/dbraw/zinc/09/49/68/210094968.db2.gz WYROYDAXPCAMQA-UHFFFAOYSA-N 0 1 370.179 4.813 20 0 FJADMN Cc1ccc2nc(S[C@@H](C)C(=O)Nc3cc(Cl)ccc3C)[nH]c2c1 ZINC000007061134 210091712 /nfs/dbraw/zinc/09/17/12/210091712.db2.gz PFEPKNQWYBCLPE-LBPRGKRZSA-N 0 1 359.882 4.952 20 0 FJADMN CC(C)(C)c1ccc(C(=O)CSc2nc(-c3ccccc3F)n[nH]2)cc1 ZINC000004877853 210080500 /nfs/dbraw/zinc/08/05/00/210080500.db2.gz HNROWAXWZBAMBQ-UHFFFAOYSA-N 0 1 369.465 4.883 20 0 FJADMN Cc1oc(-c2ccccc2)nc1CN1CCC([C@H](O)c2ccccc2)CC1 ZINC000105650710 206008818 /nfs/dbraw/zinc/00/88/18/206008818.db2.gz NYDHLLMAHAWNOS-JOCHJYFZSA-N 0 1 362.473 4.596 20 0 FJADMN Cc1cccc(C)c1NS(=O)(=O)c1ccc(Br)cc1Cl ZINC000016149058 206319515 /nfs/dbraw/zinc/31/95/15/206319515.db2.gz VZIJLQCLAPUYAH-UHFFFAOYSA-N 0 1 374.687 4.520 20 0 FJADMN Cc1cccc(C(C)C)c1NC(=O)CN1CCC(c2ccccc2)CC1 ZINC000105692541 222374297 /nfs/dbraw/zinc/37/42/97/222374297.db2.gz UXYOGSKKGPDQMZ-UHFFFAOYSA-N 0 1 350.506 4.937 20 0 FJADMN c1cc(-c2nc(CNCCNc3ccc4ccccc4n3)cs2)cs1 ZINC000079061166 526414855 /nfs/dbraw/zinc/41/48/55/526414855.db2.gz GRPZEXPCQFNKMF-UHFFFAOYSA-N 0 1 366.515 4.622 20 0 FJADMN Brc1ccc(CN2CCC[C@@H](c3cc4ccccc4[nH]3)C2)nc1 ZINC000601756635 567836634 /nfs/dbraw/zinc/83/66/34/567836634.db2.gz UNAWBLRWAOPOTA-OAHLLOKOSA-N 0 1 370.294 4.705 20 0 FJADMN CSc1cccc(NC(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)c1 ZINC000061733649 567876336 /nfs/dbraw/zinc/87/63/36/567876336.db2.gz ZDMKUGGKBHOYFZ-GOSISDBHSA-N 0 1 366.490 4.962 20 0 FJADMN CC[C@H](Cc1ccccc1)C(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000602106307 567928720 /nfs/dbraw/zinc/92/87/20/567928720.db2.gz YMKIGQXQJMFMHN-QGZVFWFLSA-N 0 1 362.477 4.803 20 0 FJADMN COc1ccc([C@H](C)NCc2cc(F)cc(F)c2)cc1Br ZINC000221875755 567931664 /nfs/dbraw/zinc/93/16/64/567931664.db2.gz ZRUKYTCCYHSZJX-JTQLQIEISA-N 0 1 356.210 4.587 20 0 FJADMN CC(C)(C)c1n[nH]c(SCc2ccc(C(=O)Nc3ccccc3)cc2)n1 ZINC000012260449 567980044 /nfs/dbraw/zinc/98/00/44/567980044.db2.gz QBRWFEDUSRGXOK-UHFFFAOYSA-N 0 1 366.490 4.647 20 0 FJADMN CC(C)(C)c1nc(SCc2ccc(C(=O)Nc3ccccc3)cc2)n[nH]1 ZINC000012260449 567980045 /nfs/dbraw/zinc/98/00/45/567980045.db2.gz QBRWFEDUSRGXOK-UHFFFAOYSA-N 0 1 366.490 4.647 20 0 FJADMN O=C(Nc1cccc(Oc2ccncc2)c1)c1c[nH]nc1-c1ccsc1 ZINC000186846241 567991848 /nfs/dbraw/zinc/99/18/48/567991848.db2.gz OERWLEJZZUPVHO-UHFFFAOYSA-N 0 1 362.414 4.578 20 0 FJADMN CC(C)CCN1Cc2cccc(NC(=O)CO[C@H]3CCC[C@H](C)C3)c2C1 ZINC000602681859 568010147 /nfs/dbraw/zinc/01/01/47/568010147.db2.gz TXUFHDBIWNMTKW-HKUYNNGSSA-N 0 1 358.526 4.582 20 0 FJADMN Cc1cc(CNC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)n[nH]1 ZINC000603488867 568106658 /nfs/dbraw/zinc/10/66/58/568106658.db2.gz XXQGLXCNOJBAQZ-UHFFFAOYSA-N 0 1 374.680 4.823 20 0 FJADMN Cc1ccc(OCc2nc(CNCCCOC3CCCCC3)cs2)cc1 ZINC000603509735 568110328 /nfs/dbraw/zinc/11/03/28/568110328.db2.gz MTVQEFXZOQQSOB-UHFFFAOYSA-N 0 1 374.550 4.860 20 0 FJADMN Cc1ccc(OCc2nc(CN[C@H](C)CCc3ccco3)cs2)cc1 ZINC000603509962 568110412 /nfs/dbraw/zinc/11/04/12/568110412.db2.gz PPOFYWGOFBYAOY-MRXNPFEDSA-N 0 1 356.491 4.734 20 0 FJADMN COc1cc(CN[C@H]2C[C@@H](C)c3ccccc32)c(Br)cc1O ZINC000603513474 568111151 /nfs/dbraw/zinc/11/11/51/568111151.db2.gz QRJPENXEDHZGRS-BZNIZROVSA-N 0 1 362.267 4.501 20 0 FJADMN Cc1cc(CNCc2cnn(C(C)C)c2)ccc1Oc1ccc(F)cc1 ZINC000603516548 568111724 /nfs/dbraw/zinc/11/17/24/568111724.db2.gz DYKLNLNRUFHHJF-UHFFFAOYSA-N 0 1 353.441 4.994 20 0 FJADMN CCCN(CCc1cccc(F)c1)Cc1nc(-c2ccccc2C)no1 ZINC000603499765 568112558 /nfs/dbraw/zinc/11/25/58/568112558.db2.gz TUTPUWQMZZLJFM-UHFFFAOYSA-N 0 1 353.441 4.639 20 0 FJADMN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1cccc(C(F)(F)F)c1 ZINC000122163530 568200334 /nfs/dbraw/zinc/20/03/34/568200334.db2.gz MYMGYMNNCVCLRS-QWHCGFSZSA-N 0 1 371.424 4.521 20 0 FJADMN CCSCc1ccc(C(=O)Nc2nc(-c3ccccc3Cl)n[nH]2)cc1 ZINC000604085136 568209569 /nfs/dbraw/zinc/20/95/69/568209569.db2.gz UFTGROKYTVLPFT-UHFFFAOYSA-N 0 1 372.881 4.631 20 0 FJADMN O=C(c1cc(-c2ccccc2)[nH]n1)N1CCC[C@@H]1c1ccccc1Cl ZINC000617127733 568220192 /nfs/dbraw/zinc/22/01/92/568220192.db2.gz NJSIZALKHAGRAM-LJQANCHMSA-N 0 1 351.837 4.707 20 0 FJADMN CC(C)C[C@@H](N)c1noc(Cn2c3ccccc3nc2C2CCCCC2)n1 ZINC000563121315 568222445 /nfs/dbraw/zinc/22/24/45/568222445.db2.gz MMXCYLUHQKHHAK-MRXNPFEDSA-N 0 1 367.497 4.561 20 0 FJADMN Fc1ccccc1-c1n[nH]c(SCc2ccc(OC(F)(F)F)cc2)n1 ZINC000024897654 568231114 /nfs/dbraw/zinc/23/11/14/568231114.db2.gz CUJZBTBOETVIBJ-UHFFFAOYSA-N 0 1 369.343 4.802 20 0 FJADMN CCCOc1c(Cl)cc(C(=O)Nc2cccc(Cl)c2O)cc1OC ZINC000604266640 568241302 /nfs/dbraw/zinc/24/13/02/568241302.db2.gz GCSDAVDANOANTP-UHFFFAOYSA-N 0 1 370.232 4.749 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)c1cccc(NC(=O)C2CCCCC2)c1 ZINC000604266614 568241316 /nfs/dbraw/zinc/24/13/16/568241316.db2.gz WXWWOAWECJTSDP-UHFFFAOYSA-N 0 1 372.852 4.817 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)c1cccnc1Sc1ccccc1 ZINC000604267314 568241491 /nfs/dbraw/zinc/24/14/91/568241491.db2.gz MESPZWJBDHVGNZ-UHFFFAOYSA-N 0 1 356.834 4.844 20 0 FJADMN C[C@H](CC(=O)Nc1ccc2nc(-c3ccc(F)cc3)[nH]c2c1)c1cccnc1 ZINC000604314768 568245794 /nfs/dbraw/zinc/24/57/94/568245794.db2.gz XETFLCRSHRALEJ-CQSZACIVSA-N 0 1 374.419 4.896 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)C1(c2cccc(F)c2)CC1 ZINC000604316446 568246067 /nfs/dbraw/zinc/24/60/67/568246067.db2.gz AYGJLFFSIQWHAB-UHFFFAOYSA-N 0 1 361.376 4.632 20 0 FJADMN Cc1c(Cl)cccc1NC(=O)[C@H](C)Sc1nc(-c2ccccc2)n[nH]1 ZINC000007633447 568247278 /nfs/dbraw/zinc/24/72/78/568247278.db2.gz BTYYNQDLGNLGCL-LBPRGKRZSA-N 0 1 372.881 4.553 20 0 FJADMN C[C@H](C(=O)Nc1ccccc1Cl)[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000303137030 568252951 /nfs/dbraw/zinc/25/29/51/568252951.db2.gz CZGKRHMBUBASOV-AEFFLSMTSA-N 0 1 356.897 4.937 20 0 FJADMN C[C@H](C(=O)Nc1ccccc1Cl)N1CCC[C@H](c2ccccc2)CC1 ZINC000303137030 568252952 /nfs/dbraw/zinc/25/29/52/568252952.db2.gz CZGKRHMBUBASOV-AEFFLSMTSA-N 0 1 356.897 4.937 20 0 FJADMN O=C(Cc1cccc(F)c1)Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1 ZINC000303240792 568262428 /nfs/dbraw/zinc/26/24/28/568262428.db2.gz BGVYIRZVYRSSHR-UHFFFAOYSA-N 0 1 363.367 4.689 20 0 FJADMN O=C(Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)c1cc(F)cc(F)c1 ZINC000303341122 568266895 /nfs/dbraw/zinc/26/68/95/568266895.db2.gz YXWUDIDVIPJDME-UHFFFAOYSA-N 0 1 367.330 4.900 20 0 FJADMN C[C@H]1CC[N@@H+](Cc2c(Cl)cccc2Oc2ccccc2)C[C@@H]1C(=O)[O-] ZINC000563133883 568269530 /nfs/dbraw/zinc/26/95/30/568269530.db2.gz PNQJIGKVJPDAGB-HOCLYGCPSA-N 0 1 359.853 4.675 20 0 FJADMN Cc1c(Cl)cccc1NC(=O)CN(Cc1ccc(F)cc1)CC1CC1 ZINC000303735394 568279875 /nfs/dbraw/zinc/27/98/75/568279875.db2.gz WKEQPTGPNIDZBF-UHFFFAOYSA-N 0 1 360.860 4.638 20 0 FJADMN CC(C)OC(=O)Cc1nc(CN2CCC[C@@H]2CC2CCCCC2)cs1 ZINC000604508733 568305818 /nfs/dbraw/zinc/30/58/18/568305818.db2.gz FLIISBRHHGOIIV-GOSISDBHSA-N 0 1 364.555 4.572 20 0 FJADMN CC[C@H](c1ccccc1)N(CC)C(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000604593082 568321429 /nfs/dbraw/zinc/32/14/29/568321429.db2.gz LJQSQRGPLNMVAO-OAQYLSRUSA-N 0 1 371.500 4.570 20 0 FJADMN CC(C)[C@H](CC1CCCC1)C(=O)NC1CCN(Cc2ccc(F)cc2)CC1 ZINC000604742356 568359776 /nfs/dbraw/zinc/35/97/76/568359776.db2.gz OQORAAKXPULDAB-QFIPXVFZSA-N 0 1 374.544 4.759 20 0 FJADMN Fc1ccc2c(c1)nccc2N[C@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000604883677 568384294 /nfs/dbraw/zinc/38/42/94/568384294.db2.gz ICSUWDSGQGXQQL-AWEZNQCLSA-N 0 1 373.378 4.666 20 0 FJADMN CC(C)n1ccc(CN(C)CCCCCc2cc(-c3ccccc3)no2)n1 ZINC000604884630 568384509 /nfs/dbraw/zinc/38/45/09/568384509.db2.gz XAHHWNHUXQYPTN-UHFFFAOYSA-N 0 1 366.509 4.964 20 0 FJADMN Cc1[nH]c2ccccc2c1C(=O)CSc1nc(-c2ccc(C)cc2)n[nH]1 ZINC000005866685 568394334 /nfs/dbraw/zinc/39/43/34/568394334.db2.gz IZHIUFKDQPARRG-UHFFFAOYSA-N 0 1 362.458 4.545 20 0 FJADMN COc1cccc(CN(C)Cc2ccc(C(=O)Nc3ccccc3)cc2)c1 ZINC000007017188 568424687 /nfs/dbraw/zinc/42/46/87/568424687.db2.gz BFRYSBHFIJWYOC-UHFFFAOYSA-N 0 1 360.457 4.580 20 0 FJADMN O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cc(-c2ccoc2)n[nH]1 ZINC000604990342 568509344 /nfs/dbraw/zinc/50/93/44/568509344.db2.gz QRCCTTQGBDRLST-VOTSOKGWSA-N 0 1 362.414 4.549 20 0 FJADMN O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cc(-c2ccoc2)n[nH]1 ZINC000604990341 568509395 /nfs/dbraw/zinc/50/93/95/568509395.db2.gz QRCCTTQGBDRLST-SREVYHEPSA-N 0 1 362.414 4.549 20 0 FJADMN CCN(CC)[C@H](C(=O)Nc1ccc2c(cnn2C(C)C)c1)c1ccccc1 ZINC000604991934 568509932 /nfs/dbraw/zinc/50/99/32/568509932.db2.gz SVMYEZARWFBZKG-NRFANRHFSA-N 0 1 364.493 4.639 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN3C(=O)C(C)(C)Cc3ccccc3)[nH]c2c1 ZINC000605088833 568567651 /nfs/dbraw/zinc/56/76/51/568567651.db2.gz XRXAAMSHIIBCLN-FQEVSTJZSA-N 0 1 361.489 4.804 20 0 FJADMN Fc1ccc(-c2cc(CN3CCS[C@H](c4ccccc4)C3)on2)cc1 ZINC000605154224 568598342 /nfs/dbraw/zinc/59/83/42/568598342.db2.gz LXFKZLKTAPZJAM-FQEVSTJZSA-N 0 1 354.450 4.771 20 0 FJADMN CCOc1ccc(CN2CCS[C@@H](c3ccccc3)C2)cc1OCC ZINC000605187676 568615414 /nfs/dbraw/zinc/61/54/14/568615414.db2.gz JPBGSYQVETVBBO-OAQYLSRUSA-N 0 1 357.519 4.774 20 0 FJADMN CC[C@@H](CC(=O)NC[C@@H](c1ccco1)N1CCCCC1)c1ccc(C)cc1 ZINC000606161082 568680142 /nfs/dbraw/zinc/68/01/42/568680142.db2.gz CNRJTYOAJRDPEY-FPOVZHCZSA-N 0 1 368.521 4.815 20 0 FJADMN CN(C)[C@@H](CNC(=O)Nc1cc(Cl)ccc1Cl)c1cccc(F)c1 ZINC000107503250 209275424 /nfs/dbraw/zinc/27/54/24/209275424.db2.gz IWYODGZTXYELLF-INIZCTEOSA-N 0 1 370.255 4.557 20 0 FJADMN Cc1oc(-c2ccccc2)nc1CN1CCC([C@@H](O)c2ccccc2)CC1 ZINC000105650713 209267460 /nfs/dbraw/zinc/26/74/60/209267460.db2.gz NYDHLLMAHAWNOS-QFIPXVFZSA-N 0 1 362.473 4.596 20 0 FJADMN C[C@@H](Sc1nc2ccc(Cl)cc2[nH]1)C(=O)Nc1ccc(F)c(F)c1 ZINC000016827691 220194892 /nfs/dbraw/zinc/19/48/92/220194892.db2.gz YUPHEZHJKRFWST-MRVPVSSYSA-N 0 1 367.808 4.614 20 0 FJADMN O=C(Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)c1cc(F)ccc1F ZINC000078557220 208928822 /nfs/dbraw/zinc/92/88/22/208928822.db2.gz DGSFEYCDBUPHCL-UHFFFAOYSA-N 0 1 367.330 4.900 20 0 FJADMN O=C(Nc1cccc(OCCc2ccccc2)c1)c1cc(Cl)ccc1O ZINC000090485027 221745279 /nfs/dbraw/zinc/74/52/79/221745279.db2.gz WEISGSNVZIZMNU-UHFFFAOYSA-N 0 1 367.832 4.919 20 0 FJADMN Cc1oc(-c2ccsc2)nc1CN1CCC(OCc2ccccc2)CC1 ZINC000020407008 526750715 /nfs/dbraw/zinc/75/07/15/526750715.db2.gz DRSAETNQBGDDMG-UHFFFAOYSA-N 0 1 368.502 4.893 20 0 FJADMN CC[C@H]1c2ccccc2CCN1Cc1cnc(-c2ccccc2OC)nc1 ZINC000644832579 567840209 /nfs/dbraw/zinc/84/02/09/567840209.db2.gz ZWUNEFBEPOUVBY-NRFANRHFSA-N 0 1 359.473 4.662 20 0 FJADMN COc1cccc(C[N@H+](Cc2ccc(Br)cn2)CC(C)C)c1 ZINC000601835855 567855588 /nfs/dbraw/zinc/85/55/88/567855588.db2.gz FCQXCNXFWJIFMA-UHFFFAOYSA-N 0 1 363.299 4.511 20 0 FJADMN CCN(CC)[C@@H](CNC(=O)Nc1cccc2ccccc21)c1ccco1 ZINC000521483766 567919194 /nfs/dbraw/zinc/91/91/94/567919194.db2.gz BWCQMWQHYKVKLM-IBGZPJMESA-N 0 1 351.450 4.637 20 0 FJADMN COc1ccc([C@@H](C)NCc2ccc(C)cc2OCC2CC2)c(C)c1OC ZINC000521415649 567962725 /nfs/dbraw/zinc/96/27/25/567962725.db2.gz VWAVUHQBMDNDTP-QGZVFWFLSA-N 0 1 369.505 4.960 20 0 FJADMN COCCCOc1cccc(CNC(c2ccccc2)c2ccccc2)c1 ZINC000063902048 567991887 /nfs/dbraw/zinc/99/18/87/567991887.db2.gz IXDQPEHYNGVSSP-UHFFFAOYSA-N 0 1 361.485 4.981 20 0 FJADMN Cc1ccc(OC2CCN(Cc3nc4ccccc4nc3C)CC2)cc1C ZINC000521425820 568004000 /nfs/dbraw/zinc/00/40/00/568004000.db2.gz MWSHANGIONAQLU-UHFFFAOYSA-N 0 1 361.489 4.598 20 0 FJADMN COc1ccccc1OCCCNCc1c(Cl)cccc1OC(F)F ZINC000602910169 568011014 /nfs/dbraw/zinc/01/10/14/568011014.db2.gz MRDMGNJWQCSSJX-UHFFFAOYSA-N 0 1 371.811 4.509 20 0 FJADMN c1coc(CN(CCCOc2ccc3c(c2)OCO3)Cc2cccs2)c1 ZINC000521427997 568024361 /nfs/dbraw/zinc/02/43/61/568024361.db2.gz KVSJALLWLRXSFC-UHFFFAOYSA-N 0 1 371.458 4.541 20 0 FJADMN COc1cc(CNC2(c3ccc(Cl)cc3)CC2)cc(Cl)c1OC ZINC000069878376 568097974 /nfs/dbraw/zinc/09/79/74/568097974.db2.gz PRWVWYHYPTTYLK-UHFFFAOYSA-N 0 1 352.261 4.790 20 0 FJADMN CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1cc(-c2ccoc2)[nH]n1 ZINC000603474764 568103899 /nfs/dbraw/zinc/10/38/99/568103899.db2.gz CAMYKRPHYYGRRT-GOSISDBHSA-N 0 1 357.841 4.792 20 0 FJADMN Cc1cc(CNC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)n[nH]1 ZINC000603486081 568106203 /nfs/dbraw/zinc/10/62/03/568106203.db2.gz OXBAUBSCIQNUSY-UHFFFAOYSA-N 0 1 371.893 4.594 20 0 FJADMN c1sc(COc2ccccc2)nc1CNCCCCc1ccccc1 ZINC000603509730 568110261 /nfs/dbraw/zinc/11/02/61/568110261.db2.gz MGROHXLFBDWCOV-UHFFFAOYSA-N 0 1 352.503 4.835 20 0 FJADMN COc1ccc(OCc2nc(CN[C@@H](C)Cc3ccsc3)cs2)cc1 ZINC000603511869 568110746 /nfs/dbraw/zinc/11/07/46/568110746.db2.gz CKOFAVPDJZNABU-AWEZNQCLSA-N 0 1 374.531 4.513 20 0 FJADMN COc1ccccc1OCCCNCc1csc(-c2ccc(C)cc2)n1 ZINC000603513241 568111045 /nfs/dbraw/zinc/11/10/45/568111045.db2.gz RESKCBRSZHRBEO-UHFFFAOYSA-N 0 1 368.502 4.686 20 0 FJADMN c1cc(-c2cc(-c3nc(-c4cccnc4Oc4ccccc4)no3)[nH]n2)co1 ZINC000603635429 568131447 /nfs/dbraw/zinc/13/14/47/568131447.db2.gz ADXGGTBHCJSBIS-UHFFFAOYSA-N 0 1 371.356 4.574 20 0 FJADMN CCc1cccc2c(C(=O)[C@@H](NCCSC)c3ccccc3)c[nH]c21 ZINC000603743743 568148206 /nfs/dbraw/zinc/14/82/06/568148206.db2.gz LHBABSSILHFQQV-FQEVSTJZSA-N 0 1 352.503 4.607 20 0 FJADMN COC(=O)c1ccc([C@@H](C)Sc2nc3ccc(C(F)(F)F)cc3[nH]2)o1 ZINC000603938052 568184367 /nfs/dbraw/zinc/18/43/67/568184367.db2.gz IRZPSKGPSDZHDK-MRVPVSSYSA-N 0 1 370.352 4.815 20 0 FJADMN COc1ccc(CNCc2ccc(OC(C)(C)C)cc2)c(OC(F)F)c1 ZINC000604066334 568205541 /nfs/dbraw/zinc/20/55/41/568205541.db2.gz VCWPTQKTYVZCKO-UHFFFAOYSA-N 0 1 365.420 4.764 20 0 FJADMN O=C(c1cc(-c2cccs2)[nH]n1)N1CCC[C@@H]1c1ccccc1Cl ZINC000617127785 568220610 /nfs/dbraw/zinc/22/06/10/568220610.db2.gz QVBIJDUYLMOIPC-MRXNPFEDSA-N 0 1 357.866 4.769 20 0 FJADMN Brc1cccc(CN(Cc2cccs2)C[C@H]2CCCO2)c1 ZINC000302741733 568234210 /nfs/dbraw/zinc/23/42/10/568234210.db2.gz RDWVYWNILIRSFJ-MRXNPFEDSA-N 0 1 366.324 4.692 20 0 FJADMN CC(C)[C@H](NCc1cc(Cl)ccc1Br)c1cccnc1 ZINC000563124118 568250537 /nfs/dbraw/zinc/25/05/37/568250537.db2.gz HUZUGBUODKHOPA-INIZCTEOSA-N 0 1 353.691 4.984 20 0 FJADMN Cc1nc(C)c([C@@H](C)[N@@H+](C)Cc2ccc(OCC(F)(F)F)cc2)s1 ZINC000303286761 568264386 /nfs/dbraw/zinc/26/43/86/568264386.db2.gz KAJQCPYFPCPICV-GFCCVEGCSA-N 0 1 358.429 4.894 20 0 FJADMN Cc1nc(C)c([C@@H](C)N(C)Cc2ccc(OCC(F)(F)F)cc2)s1 ZINC000303286761 568264387 /nfs/dbraw/zinc/26/43/87/568264387.db2.gz KAJQCPYFPCPICV-GFCCVEGCSA-N 0 1 358.429 4.894 20 0 FJADMN Cc1c(F)cccc1-c1ccc(CNC(C)(C)C(=O)Nc2ccccc2)o1 ZINC000604416589 568274689 /nfs/dbraw/zinc/27/46/89/568274689.db2.gz LKIWLXYCGZDVBP-UHFFFAOYSA-N 0 1 366.436 4.901 20 0 FJADMN Cc1cc(F)ccc1-c1ccc(CNC(C)(C)C(=O)Nc2ccccc2)o1 ZINC000604416615 568274707 /nfs/dbraw/zinc/27/47/07/568274707.db2.gz PLRYNDIAYNMNGR-UHFFFAOYSA-N 0 1 366.436 4.901 20 0 FJADMN Cc1ccc(C[C@@H](N[C@@H](C)C(=O)Nc2cccc(C)c2)c2ccccn2)cc1 ZINC000604414097 568278658 /nfs/dbraw/zinc/27/86/58/568278658.db2.gz WXWDXOBPBZVRBC-WMZHIEFXSA-N 0 1 373.500 4.599 20 0 FJADMN C[C@@H](C(=O)Nc1cc(Cl)ccc1F)N1C[C@@H](c2ccccc2)C[C@H]1C ZINC000604393001 568283092 /nfs/dbraw/zinc/28/30/92/568283092.db2.gz QGDBBLCYUDPIPA-YCPHGPKFSA-N 0 1 360.860 4.684 20 0 FJADMN CC[C@@H](c1ccccc1)N(CC)C(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000604593081 568321454 /nfs/dbraw/zinc/32/14/54/568321454.db2.gz LJQSQRGPLNMVAO-NRFANRHFSA-N 0 1 371.500 4.570 20 0 FJADMN CC(C)(C)[C@H](CC1CCCCC1)NC(=O)c1c[nH]c2ccccc2c1=O ZINC000604606372 568325657 /nfs/dbraw/zinc/32/56/57/568325657.db2.gz SZLNCSNVIGZAFV-IBGZPJMESA-N 0 1 354.494 4.643 20 0 FJADMN COC(=O)c1ccc([C@@H](C)Sc2nc(Cc3ccccc3)c(C)[nH]2)o1 ZINC000031839767 568341851 /nfs/dbraw/zinc/34/18/51/568341851.db2.gz WEJBGPJLCYOPEH-CYBMUJFWSA-N 0 1 356.447 4.542 20 0 FJADMN OC[C@@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1cccc(F)c1 ZINC000604768705 568362584 /nfs/dbraw/zinc/36/25/84/568362584.db2.gz KKVZPNRJSWLQIU-HSZRJFAPSA-N 0 1 374.459 4.652 20 0 FJADMN Cc1ccc(COc2ccc(CN[C@H](CO)c3cccc(F)c3)cc2)cc1 ZINC000604768984 568362629 /nfs/dbraw/zinc/36/26/29/568362629.db2.gz XCPZSVPTZSUAOZ-HSZRJFAPSA-N 0 1 365.448 4.536 20 0 FJADMN Cc1ccc(F)c(CNCc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c1 ZINC000604891759 568381935 /nfs/dbraw/zinc/38/19/35/568381935.db2.gz UMTJWYSWKIJMFZ-UHFFFAOYSA-N 0 1 363.358 4.628 20 0 FJADMN CC[C@H](C)N(Cc1ccccc1)C(=O)NC[C@@H](c1ccco1)N(CC)CC ZINC000604916417 568389288 /nfs/dbraw/zinc/38/92/88/568389288.db2.gz JUBRNDWRSOFBNF-ICSRJNTNSA-N 0 1 371.525 4.673 20 0 FJADMN CCc1c2cc(C)ccc2oc1[C@@H](C)NCc1ccc([S@@](C)=O)cc1 ZINC000182006528 568400854 /nfs/dbraw/zinc/40/08/54/568400854.db2.gz QWUSGHWDAILYQK-SGANQWHYSA-N 0 1 355.503 4.892 20 0 FJADMN CCOc1ccc2nc(S[C@H](C)C(=O)Nc3c(C)cccc3C)[nH]c2c1 ZINC000007060508 568437350 /nfs/dbraw/zinc/43/73/50/568437350.db2.gz BDWPOMMZFJQCHG-CQSZACIVSA-N 0 1 369.490 4.698 20 0 FJADMN CCCCc1oc2ccccc2c1[C@@H]1NC(=N)Nc2nc3ccccc3n21 ZINC000007127946 568453228 /nfs/dbraw/zinc/45/32/28/568453228.db2.gz BWSYFKCBEKPMAO-LJQANCHMSA-N 0 1 359.433 4.622 20 0 FJADMN C[C@H](NC(=O)CN1CCC[C@@H]1c1cccs1)c1cccc2ccccc21 ZINC000007443099 568511415 /nfs/dbraw/zinc/51/14/15/568511415.db2.gz IJYQCANADIUDFJ-OXJNMPFZSA-N 0 1 364.514 4.916 20 0 FJADMN Cc1ccc(OCCCN2CCC(C(F)(F)F)(C(F)(F)F)C2)cc1C ZINC000605000896 568514579 /nfs/dbraw/zinc/51/45/79/568514579.db2.gz ZSQFDJUCPBAOAB-UHFFFAOYSA-N 0 1 369.349 4.889 20 0 FJADMN CCN(CC)[C@@H](CNC(=O)[C@@H](C)c1ccsc1)c1ccccc1Cl ZINC000606162290 568681038 /nfs/dbraw/zinc/68/10/38/568681038.db2.gz XNUBMBPCELZBLG-KSSFIOAISA-N 0 1 364.942 4.704 20 0 FJADMN CCCc1ccc([C@@H](N[C@@H](C)c2nc3ccccc3c(=O)[nH]2)C(C)C)cc1 ZINC000034872609 208112704 /nfs/dbraw/zinc/11/27/04/208112704.db2.gz YAXFUYLGAVQFNT-KKSFZXQISA-N 0 1 363.505 4.924 20 0 FJADMN CN(C)[C@H](CNC(=O)Nc1cc(Cl)ccc1Cl)c1ccc(F)cc1 ZINC000071943367 221388864 /nfs/dbraw/zinc/38/88/64/221388864.db2.gz MFMHJAGLUIZPKK-MRXNPFEDSA-N 0 1 370.255 4.557 20 0 FJADMN C[C@@H](N[C@@H](C)c1ccccc1Br)c1ccc2c(c1)CCC(=O)N2 ZINC000602567256 567995743 /nfs/dbraw/zinc/99/57/43/567995743.db2.gz MAURYOOQPMOLBY-OLZOCXBDSA-N 0 1 373.294 4.746 20 0 FJADMN COc1ccc(-c2nnc(CN3CCCCC[C@H]3c3ccccc3)o2)cc1 ZINC000521425783 568003795 /nfs/dbraw/zinc/00/37/95/568003795.db2.gz MDTDXSWJAGVLFB-FQEVSTJZSA-N 0 1 363.461 4.863 20 0 FJADMN CSC1CCN([C@H](C)c2nnc(-c3ccc(Cl)c(Cl)c3)o2)CC1 ZINC000602920552 568013142 /nfs/dbraw/zinc/01/31/42/568013142.db2.gz PEUNWWHPUFXWOI-SNVBAGLBSA-N 0 1 372.321 4.932 20 0 FJADMN Cc1cc(CNC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)n[nH]1 ZINC000603487086 568106460 /nfs/dbraw/zinc/10/64/60/568106460.db2.gz SNBDLXRBIBZHMA-GOSISDBHSA-N 0 1 371.893 4.521 20 0 FJADMN Cc1cc(CNC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)n[nH]1 ZINC000603487978 568106490 /nfs/dbraw/zinc/10/64/90/568106490.db2.gz LPHCQWAEKQAGHN-UHFFFAOYSA-N 0 1 373.787 4.535 20 0 FJADMN Cc1[nH]nc2ncc(CN[C@@H]3CCOc4c(-c5ccccc5)cccc43)cc12 ZINC000603518291 568112068 /nfs/dbraw/zinc/11/20/68/568112068.db2.gz DYVWYYMPIJGUQB-OAQYLSRUSA-N 0 1 370.456 4.547 20 0 FJADMN COc1cccc2c1OCC[C@H]2NCc1ccc(OCCC(C)C)cc1 ZINC000603518898 568112836 /nfs/dbraw/zinc/11/28/36/568112836.db2.gz PDFBQFOISDSPRS-HXUWFJFHSA-N 0 1 355.478 4.734 20 0 FJADMN Brc1ccc(C2(NCc3ccc4c(n3)CCC4)CCC2)cc1 ZINC000563099317 568167297 /nfs/dbraw/zinc/16/72/97/568167297.db2.gz UNSYUPIUFPABES-UHFFFAOYSA-N 0 1 357.295 4.502 20 0 FJADMN Cc1cccc2sc(C(=O)Nc3cccc(-c4nnc[nH]4)c3)c(Cl)c21 ZINC000603906286 568178088 /nfs/dbraw/zinc/17/80/88/568178088.db2.gz PBTBEMSMNJEHPF-UHFFFAOYSA-N 0 1 368.849 4.901 20 0 FJADMN Cc1cccc2c1CCCN2C(=O)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000603926030 568182407 /nfs/dbraw/zinc/18/24/07/568182407.db2.gz AFFZFUCAOAKRRG-UHFFFAOYSA-N 0 1 351.837 4.632 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN(C(=O)[C@H](C)CC4CCCC4)C3)[nH]c2c1 ZINC000603966287 568191256 /nfs/dbraw/zinc/19/12/56/568191256.db2.gz OPQKUROGKCDGFD-AEFFLSMTSA-N 0 1 353.510 4.794 20 0 FJADMN CCC(CC)CN(CC)Cc1nc2cc(C(F)(F)F)ccc2c(=O)[nH]1 ZINC000604049411 568201291 /nfs/dbraw/zinc/20/12/91/568201291.db2.gz VPSRBOFXSDDSST-UHFFFAOYSA-N 0 1 355.404 4.612 20 0 FJADMN CCc1noc([C@H](C)NCC2(c3cccc(C(F)(F)F)c3)CCCC2)n1 ZINC000604061966 568204706 /nfs/dbraw/zinc/20/47/06/568204706.db2.gz NWPKQPPDACJUCI-ZDUSSCGKSA-N 0 1 367.415 4.813 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN3C(=O)[C@@H](C)c3ccc(F)c(F)c3)[nH]c2c1 ZINC000607813450 568227248 /nfs/dbraw/zinc/22/72/48/568227248.db2.gz YAXKLMCGIOOVGP-ORAYPTAESA-N 0 1 369.415 4.617 20 0 FJADMN CCCCc1nc2ccc(NC(=O)Cc3c[nH]c4ccc(F)cc34)cc2[nH]1 ZINC000604225227 568229230 /nfs/dbraw/zinc/22/92/30/568229230.db2.gz OCODEWLQZFAPJN-UHFFFAOYSA-N 0 1 364.424 4.707 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000604266486 568237251 /nfs/dbraw/zinc/23/72/51/568237251.db2.gz MWOAGGRWHBLLQV-VXGBXAGGSA-N 0 1 366.642 4.550 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000604266485 568237298 /nfs/dbraw/zinc/23/72/98/568237298.db2.gz MWOAGGRWHBLLQV-RYUDHWBXSA-N 0 1 366.642 4.550 20 0 FJADMN Cc1n[nH]c(C(=O)N[C@H](c2cccs2)c2ccc(C(C)C)cc2)c1C ZINC000604309072 568247991 /nfs/dbraw/zinc/24/79/91/568247991.db2.gz YLRLLXVMXVXESI-IBGZPJMESA-N 0 1 353.491 4.731 20 0 FJADMN O=C(Cc1c[nH]c2ccc(F)cc12)Nc1ccc2nc(C3CCC3)[nH]c2c1 ZINC000604322178 568249107 /nfs/dbraw/zinc/24/91/07/568249107.db2.gz FJKMJTQXXGZULS-UHFFFAOYSA-N 0 1 362.408 4.632 20 0 FJADMN Cc1nc(C)c([C@@H](C)N(C)Cc2ccc(F)c(Br)c2)s1 ZINC000303257922 568260235 /nfs/dbraw/zinc/26/02/35/568260235.db2.gz CIVWLPCVWRQSFM-SNVBAGLBSA-N 0 1 357.292 4.855 20 0 FJADMN COc1ccc(C(=O)Nc2ccc(-c3nc4ccc(F)cc4[nH]3)cc2)cc1 ZINC000303248660 568262729 /nfs/dbraw/zinc/26/27/29/568262729.db2.gz FAPCGGIOJZIBQY-UHFFFAOYSA-N 0 1 361.376 4.630 20 0 FJADMN CCc1[nH]ncc1C(=O)Nc1cccc(Oc2ccnc3ccccc32)c1 ZINC000604353771 568266204 /nfs/dbraw/zinc/26/62/04/568266204.db2.gz GVYUZFYZZCPPNQ-UHFFFAOYSA-N 0 1 358.401 4.565 20 0 FJADMN C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000604358367 568267555 /nfs/dbraw/zinc/26/75/55/568267555.db2.gz YAFDNDFJBUGXTD-HOCLYGCPSA-N 0 1 365.864 4.748 20 0 FJADMN COc1ccccc1C[C@H]1CCCN1Cc1csc(-c2ccoc2)n1 ZINC000303350996 568267642 /nfs/dbraw/zinc/26/76/42/568267642.db2.gz FCFXKRDQYWXZQB-GOSISDBHSA-N 0 1 354.475 4.619 20 0 FJADMN C[C@H](NCc1ccc(-c2c(F)cccc2F)o1)c1ccc2c(c1)OCO2 ZINC000604414839 568279522 /nfs/dbraw/zinc/27/95/22/568279522.db2.gz CWIVXDFZSGBMFK-LBPRGKRZSA-N 0 1 357.356 4.804 20 0 FJADMN CCN(CC)c1ccc(CNCc2ccc(-c3ccc(F)cc3C)o2)cn1 ZINC000604415195 568280362 /nfs/dbraw/zinc/28/03/62/568280362.db2.gz CNJDXWUFZCXZBX-UHFFFAOYSA-N 0 1 367.468 4.925 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN(C(=O)CC4CCC(C)CC4)C3)[nH]c2c1 ZINC000604601468 568323539 /nfs/dbraw/zinc/32/35/39/568323539.db2.gz MPTVSVORLZLDSM-VMWRSERWSA-N 0 1 353.510 4.794 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)c1ccc(F)cc1Cl ZINC000617134055 568347439 /nfs/dbraw/zinc/34/74/39/568347439.db2.gz YVIZFYYNJCCXNI-UHFFFAOYSA-N 0 1 355.756 4.868 20 0 FJADMN COc1ccc(Cl)cc1C(=O)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000617133064 568350759 /nfs/dbraw/zinc/35/07/59/568350759.db2.gz FDPHTXCXEKTOAI-UHFFFAOYSA-N 0 1 367.792 4.737 20 0 FJADMN Cc1[nH]c(SCC(=O)Nc2ccc(C)cc2C)nc1Cc1ccccc1 ZINC000004492622 568374753 /nfs/dbraw/zinc/37/47/53/568374753.db2.gz DSDKSRQLMLSFAT-UHFFFAOYSA-N 0 1 365.502 4.657 20 0 FJADMN CC[C@@H](C)N(Cc1ccccc1)C(=O)NC[C@@H](c1ccco1)N(CC)CC ZINC000604916418 568389278 /nfs/dbraw/zinc/38/92/78/568389278.db2.gz JUBRNDWRSOFBNF-QUCCMNQESA-N 0 1 371.525 4.673 20 0 FJADMN C[C@H](Sc1nc(-c2ccccn2)n[nH]1)C(=O)c1ccc(C(C)(C)C)cc1 ZINC000604933075 568395233 /nfs/dbraw/zinc/39/52/33/568395233.db2.gz WCSJDIRWXQLQIE-ZDUSSCGKSA-N 0 1 366.490 4.528 20 0 FJADMN COc1ccc2nc(SCc3nc(-c4ccc(Cl)cc4)no3)[nH]c2c1 ZINC000006972482 568407675 /nfs/dbraw/zinc/40/76/75/568407675.db2.gz JLAFCQHVICXKOU-UHFFFAOYSA-N 0 1 372.837 4.567 20 0 FJADMN C[C@@H](N[C@H](C)c1cccc(Cl)c1)C(=O)Nc1ccc(F)cc1Cl ZINC000007093155 568446108 /nfs/dbraw/zinc/44/61/08/568446108.db2.gz RZRIAXMDSMEAKT-GHMZBOCLSA-N 0 1 355.240 4.810 20 0 FJADMN O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cc(-c2ccco2)n[nH]1 ZINC000604990223 568509286 /nfs/dbraw/zinc/50/92/86/568509286.db2.gz JBVQKAJCFGUKGQ-CMDGGOBGSA-N 0 1 362.414 4.549 20 0 FJADMN Cc1cc2c[nH]nc2c(C(=O)Nc2nc(C=Cc3ccccc3)cs2)c1 ZINC000604990275 568509397 /nfs/dbraw/zinc/50/93/97/568509397.db2.gz MSSFMHGXQGXGCD-FPLPWBNLSA-N 0 1 360.442 4.751 20 0 FJADMN Cc1cc(F)ccc1N1CCC[C@H](NCc2csc(C(C)(C)C)n2)C1 ZINC000605008914 568516075 /nfs/dbraw/zinc/51/60/75/568516075.db2.gz DFQJUAGVEXDDLZ-INIZCTEOSA-N 0 1 361.530 4.647 20 0 FJADMN Cc1ccc([C@@H](NCC(=O)N[C@@H](C)c2cccs2)c2ccccc2)cc1 ZINC000007542201 568529901 /nfs/dbraw/zinc/52/99/01/568529901.db2.gz BOVLBFASBMDYHO-JTSKRJEESA-N 0 1 364.514 4.613 20 0 FJADMN CSc1ccc(F)cc1CNCc1ccccc1OCc1cccnc1 ZINC000525802504 568541887 /nfs/dbraw/zinc/54/18/87/568541887.db2.gz ZMNGOCJJRXAHPN-UHFFFAOYSA-N 0 1 368.477 4.811 20 0 FJADMN CC(C)(Cc1ccccc1)C(=O)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1 ZINC000605087969 568567327 /nfs/dbraw/zinc/56/73/27/568567327.db2.gz IXNKSUARCZEHEI-IBGZPJMESA-N 0 1 363.461 4.622 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N[C@@H](C)c2cccc(Cl)c2Cl)o1 ZINC000605113637 568571609 /nfs/dbraw/zinc/57/16/09/568571609.db2.gz QNDYQXVRJWWBPD-LBPRGKRZSA-N 0 1 369.292 4.919 20 0 FJADMN CCN(CC)[C@H](CNC(=O)[C@@H](C)c1cccs1)c1ccccc1Cl ZINC000606162317 568681020 /nfs/dbraw/zinc/68/10/20/568681020.db2.gz YYMIFMRIPAWDBB-WMLDXEAASA-N 0 1 364.942 4.704 20 0 FJADMN CC[C@@H](Sc1nc(C=Cc2ccc(C)o2)n[nH]1)C(=O)c1ccccc1 ZINC000606152452 568688676 /nfs/dbraw/zinc/68/86/76/568688676.db2.gz IAORTWWGCXNZCQ-LPQFERQCSA-N 0 1 353.447 4.630 20 0 FJADMN Fc1cccc(CN2CC[C@]23CCCN(c2nccc4ccsc42)C3)c1 ZINC001164993275 722196879 /nfs/dbraw/zinc/19/68/79/722196879.db2.gz DZEGIHWNTLWAFS-NRFANRHFSA-N 0 1 367.493 4.680 20 0 FJADMN Fc1cccc2c1SCC[C@H]2NCc1ccc(Br)s1 ZINC000030910423 209845599 /nfs/dbraw/zinc/84/55/99/209845599.db2.gz PVNZDWVIRKRSBV-GFCCVEGCSA-N 0 1 358.301 4.976 20 0 FJADMN Cc1ccc2nc(S[C@H](C)C(=O)Nc3cccc(Cl)c3C)[nH]c2c1 ZINC000007060932 219790878 /nfs/dbraw/zinc/79/08/78/219790878.db2.gz RPRSSCWKTULGRZ-GFCCVEGCSA-N 0 1 359.882 4.952 20 0 FJADMN Cc1c2cc(Cl)ccc2oc1C(=O)NC[C@H](c1ccc(F)cc1)N(C)C ZINC000108553093 209290017 /nfs/dbraw/zinc/29/00/17/209290017.db2.gz PBOGLZHUYHYZOP-QGZVFWFLSA-N 0 1 374.843 4.566 20 0 FJADMN Cc1ccc2nc(S[C@@H](C)C(=O)Nc3ccc(F)cc3Cl)[nH]c2c1 ZINC000005357083 207095580 /nfs/dbraw/zinc/09/55/80/207095580.db2.gz QMOYWBSBGVTLDA-JTQLQIEISA-N 0 1 363.845 4.783 20 0 FJADMN O=C(c1ccccc1)C1CCN(Cc2ccc(Cl)c3cccnc23)CC1 ZINC000052412017 221038011 /nfs/dbraw/zinc/03/80/11/221038011.db2.gz SSZXVMUJZJJVJH-UHFFFAOYSA-N 0 1 364.876 4.983 20 0 FJADMN O=C(c1ccccc1)C1CCN(Cc2c(Cl)ccc3cccnc32)CC1 ZINC000052412020 221038172 /nfs/dbraw/zinc/03/81/72/221038172.db2.gz FOGYATISULNXDW-UHFFFAOYSA-N 0 1 364.876 4.983 20 0 FJADMN Cc1ccc2nc(SCc3nc4c5ccccc5oc4c(=O)[nH]3)[nH]c2c1 ZINC000061125014 221133565 /nfs/dbraw/zinc/13/35/65/221133565.db2.gz LDFRTYMRBQCJTR-UHFFFAOYSA-N 0 1 362.414 4.559 20 0 FJADMN CCN(C(C)=O)c1nc(CNC(C)(C)CC2CCCCCC2)cs1 ZINC000186610311 567957353 /nfs/dbraw/zinc/95/73/53/567957353.db2.gz BYXSOPYLQPTTRJ-UHFFFAOYSA-N 0 1 351.560 4.745 20 0 FJADMN CC[C@H]1c2ccsc2CCN1C(=O)CN(CC)[C@H](C)c1ccc(F)cc1 ZINC000521415317 567960576 /nfs/dbraw/zinc/96/05/76/567960576.db2.gz FJXVNJXOUOCSNU-BEFAXECRSA-N 0 1 374.525 4.806 20 0 FJADMN CC[C@@H]1c2ccsc2CCN1C(=O)CN(CC)[C@@H](C)c1ccc(F)cc1 ZINC000521415320 567960655 /nfs/dbraw/zinc/96/06/55/567960655.db2.gz FJXVNJXOUOCSNU-HNAYVOBHSA-N 0 1 374.525 4.806 20 0 FJADMN CC(C)CCN1Cc2cccc(NC(=O)CO[C@@H]3CCC[C@@H](C)C3)c2C1 ZINC000602681863 568010174 /nfs/dbraw/zinc/01/01/74/568010174.db2.gz TXUFHDBIWNMTKW-IEBWSBKVSA-N 0 1 358.526 4.582 20 0 FJADMN CSC1CCN([C@@H](C)c2nnc(-c3ccc(Cl)cc3Cl)o2)CC1 ZINC000602921455 568013314 /nfs/dbraw/zinc/01/33/14/568013314.db2.gz ZRNBOZIPMCGUBP-JTQLQIEISA-N 0 1 372.321 4.932 20 0 FJADMN CCOC(=O)c1ncc(CN[C@H](C)c2ccc(SC(C)C)cc2)s1 ZINC000602806084 568048587 /nfs/dbraw/zinc/04/85/87/568048587.db2.gz OOUQPRJEGAXMIB-CYBMUJFWSA-N 0 1 364.536 4.671 20 0 FJADMN COc1ccc(CN[C@H]2CCSc3cc(C)c(C)cc32)c(OC)c1OC ZINC000187026306 568049576 /nfs/dbraw/zinc/04/95/76/568049576.db2.gz JAEINVDLSRSXAX-KRWDZBQOSA-N 0 1 373.518 4.656 20 0 FJADMN Cc1ccc([C@H](NCc2ccccc2N2CCOCC2)c2ccccc2)cc1 ZINC000066969921 568072626 /nfs/dbraw/zinc/07/26/26/568072626.db2.gz NCHGDJHQABVTCE-RUZDIDTESA-N 0 1 372.512 4.711 20 0 FJADMN CC(C)[C@@H]1CCCN1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000063618809 568104957 /nfs/dbraw/zinc/10/49/57/568104957.db2.gz DQPYEMYJBUICDR-KRWDZBQOSA-N 0 1 350.915 4.996 20 0 FJADMN CN(C[C@@H]1CCCO[C@H]1c1ccccc1)c1ccnc2cc(F)ccc21 ZINC000603493680 568107853 /nfs/dbraw/zinc/10/78/53/568107853.db2.gz BLHKNSJVCYIRQW-JTSKRJEESA-N 0 1 350.437 4.978 20 0 FJADMN Fc1ccc2c(c1)nccc2NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000603493880 568107925 /nfs/dbraw/zinc/10/79/25/568107925.db2.gz MESCRDHBHCXJTF-CYBMUJFWSA-N 0 1 357.379 4.591 20 0 FJADMN Fc1ccc2c(c1)nccc2NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000603493885 568107955 /nfs/dbraw/zinc/10/79/55/568107955.db2.gz MESCRDHBHCXJTF-ZDUSSCGKSA-N 0 1 357.379 4.591 20 0 FJADMN Cc1cc(CNc2ncnc3cc(-c4ccc(Cl)cc4)sc32)n[nH]1 ZINC000603494628 568108052 /nfs/dbraw/zinc/10/80/52/568108052.db2.gz AVMRGRGPXHHVHS-UHFFFAOYSA-N 0 1 355.854 4.655 20 0 FJADMN COc1ccc(OCc2nc(CN[C@H](C)Cc3ccsc3)cs2)cc1 ZINC000603511870 568110723 /nfs/dbraw/zinc/11/07/23/568110723.db2.gz CKOFAVPDJZNABU-CQSZACIVSA-N 0 1 374.531 4.513 20 0 FJADMN CC[C@@H](NCc1csc(N(C(C)=O)c2ccc(F)cc2)n1)C(C)(C)C ZINC000603513330 568111110 /nfs/dbraw/zinc/11/11/10/568111110.db2.gz FAUWPRHXKDQACG-QGZVFWFLSA-N 0 1 363.502 4.881 20 0 FJADMN O=C(CCNCc1c(Cl)ccc(Cl)c1Cl)Nc1ccccc1 ZINC000603516779 568111784 /nfs/dbraw/zinc/11/17/84/568111784.db2.gz IWSYLQMFQFJSGF-UHFFFAOYSA-N 0 1 357.668 4.765 20 0 FJADMN Cc1cc(CNC(=O)Nc2ccc(Sc3ccc(C)c(C)c3)cc2)n[nH]1 ZINC000603559820 568117366 /nfs/dbraw/zinc/11/73/66/568117366.db2.gz IVWLSDNXPWMELQ-UHFFFAOYSA-N 0 1 366.490 4.808 20 0 FJADMN O=C(Nc1cccc(Sc2ccccc2)c1)N1CCN(C2CCC2)CC1 ZINC000603579904 568121974 /nfs/dbraw/zinc/12/19/74/568121974.db2.gz CMOSTKLIXUFWNQ-UHFFFAOYSA-N 0 1 367.518 4.540 20 0 FJADMN O=C(c1cc(F)ccc1F)C1CCN(CCSc2ccccc2)CC1 ZINC000522778164 568137698 /nfs/dbraw/zinc/13/76/98/568137698.db2.gz DDBMTCYEUIHHJV-UHFFFAOYSA-N 0 1 361.457 4.652 20 0 FJADMN C[C@H](NCc1ccccc1Cl)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000603723781 568142370 /nfs/dbraw/zinc/14/23/70/568142370.db2.gz PGXMXXMGQAYTED-HNNXBMFYSA-N 0 1 365.864 4.838 20 0 FJADMN CCCCN(C(=O)NCCCc1cn[nH]c1C)[C@@H](CC)c1ccccc1 ZINC000604101459 568213112 /nfs/dbraw/zinc/21/31/12/568213112.db2.gz GZMLQTAGLIWRAU-FQEVSTJZSA-N 0 1 356.514 4.614 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN3C(=O)c3cc4cccc(F)c4o3)[nH]c2c1 ZINC000607813220 568227054 /nfs/dbraw/zinc/22/70/54/568227054.db2.gz BXCMURWBJZLSOG-KRWDZBQOSA-N 0 1 363.392 4.734 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)[C@@H]1C[C@H]1c1cccc(Br)c1 ZINC000604266484 568237256 /nfs/dbraw/zinc/23/72/56/568237256.db2.gz MWOAGGRWHBLLQV-NWDGAFQWSA-N 0 1 366.642 4.550 20 0 FJADMN C[C@H](C(=O)Nc1ccccc1Cl)[N@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000303137032 568252976 /nfs/dbraw/zinc/25/29/76/568252976.db2.gz CZGKRHMBUBASOV-SJLPKXTDSA-N 0 1 356.897 4.937 20 0 FJADMN C[C@H](C(=O)Nc1ccccc1Cl)N1CCC[C@@H](c2ccccc2)CC1 ZINC000303137032 568252977 /nfs/dbraw/zinc/25/29/77/568252977.db2.gz CZGKRHMBUBASOV-SJLPKXTDSA-N 0 1 356.897 4.937 20 0 FJADMN C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000604358365 568267535 /nfs/dbraw/zinc/26/75/35/568267535.db2.gz YAFDNDFJBUGXTD-GDBMZVCRSA-N 0 1 365.864 4.748 20 0 FJADMN Cc1ccc(-c2n[nH]c(NC(=O)C(c3ccccc3)c3ccccc3)n2)cc1 ZINC000008117039 568273600 /nfs/dbraw/zinc/27/36/00/568273600.db2.gz CXQAOWIDFITKRC-UHFFFAOYSA-N 0 1 368.440 4.551 20 0 FJADMN Cc1ccc([C@H](CNC(=O)CCCCCc2cccs2)N2CCCC2)o1 ZINC000518796596 568274525 /nfs/dbraw/zinc/27/45/25/568274525.db2.gz ODFXTHHEDQDRNZ-IBGZPJMESA-N 0 1 374.550 4.706 20 0 FJADMN CC(C)(C)Oc1ccccc1NC(=O)c1cc(-c2ccc(F)cc2)n[nH]1 ZINC000604377805 568280386 /nfs/dbraw/zinc/28/03/86/568280386.db2.gz KIHANBDCOOMZBB-UHFFFAOYSA-N 0 1 353.397 4.645 20 0 FJADMN Cc1cc(F)ccc1-c1ccc(CNCc2ccc3c(c2)OCCCO3)o1 ZINC000604415816 568281172 /nfs/dbraw/zinc/28/11/72/568281172.db2.gz XHEJCNVZXJLJMC-UHFFFAOYSA-N 0 1 367.420 4.845 20 0 FJADMN CCc1cccc(CC)c1NC(=O)CN1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000604394098 568284057 /nfs/dbraw/zinc/28/40/57/568284057.db2.gz AQNQTKMWEJOQKV-UWJYYQICSA-N 0 1 350.506 4.628 20 0 FJADMN CC[C@H](c1ccccc1)[C@@H]1CCCN1Cc1noc(Cc2ccccc2)n1 ZINC000525796758 568286080 /nfs/dbraw/zinc/28/60/80/568286080.db2.gz HUYRGWMFLAADSS-RTWAWAEBSA-N 0 1 361.489 4.819 20 0 FJADMN CCc1ccc(CCN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 ZINC000604383737 568287531 /nfs/dbraw/zinc/28/75/31/568287531.db2.gz HFJKCWDNGQSCTH-HUUCEWRRSA-N 0 1 353.350 4.854 20 0 FJADMN CN(C)Cc1cc(CNC(=O)Nc2cc(Cl)cc(Cl)c2)ccc1F ZINC000604608978 568326545 /nfs/dbraw/zinc/32/65/45/568326545.db2.gz ITWSRFXVVKXKOZ-UHFFFAOYSA-N 0 1 370.255 4.516 20 0 FJADMN COC(=O)c1ccc([C@H](C)Sc2nc(Cc3ccccc3)c(C)[nH]2)o1 ZINC000031839768 568341805 /nfs/dbraw/zinc/34/18/05/568341805.db2.gz WEJBGPJLCYOPEH-ZDUSSCGKSA-N 0 1 356.447 4.542 20 0 FJADMN OC[C@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1cccc(F)c1 ZINC000604768706 568362568 /nfs/dbraw/zinc/36/25/68/568362568.db2.gz KKVZPNRJSWLQIU-QHCPKHFHSA-N 0 1 374.459 4.652 20 0 FJADMN OC[C@H](NCc1cccc(OCC2CCCCC2)c1)c1cccc(F)c1 ZINC000604768732 568362625 /nfs/dbraw/zinc/36/26/25/568362625.db2.gz MRUDVYQKAPSODQ-QFIPXVFZSA-N 0 1 357.469 4.608 20 0 FJADMN CSc1ccc(NS(=O)(=O)c2ccc3oc4ccccc4c3c2)nc1 ZINC000604839262 568375467 /nfs/dbraw/zinc/37/54/67/568375467.db2.gz CGPNRPRSBMEXTK-UHFFFAOYSA-N 0 1 370.455 4.504 20 0 FJADMN CC[C@H](C)[C@@H](C(=O)NCc1nc2ccc(Cl)cc2[nH]1)c1ccccc1 ZINC000604867728 568380569 /nfs/dbraw/zinc/38/05/69/568380569.db2.gz GSRIQMFUPGNGPP-ORAYPTAESA-N 0 1 355.869 4.662 20 0 FJADMN Fc1ccc2c(c1)nccc2N[C@@H]1CCN(c2ccccc2OC(F)F)C1 ZINC000604883678 568384312 /nfs/dbraw/zinc/38/43/12/568384312.db2.gz ICSUWDSGQGXQQL-CQSZACIVSA-N 0 1 373.378 4.666 20 0 FJADMN Fc1ccc(CCN(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)cc1 ZINC000604903318 568385493 /nfs/dbraw/zinc/38/54/93/568385493.db2.gz HIJUOGHLFWPEMA-UHFFFAOYSA-N 0 1 371.843 4.736 20 0 FJADMN Fc1ccc(CCN(Cc2nc(-c3cccc(Cl)c3)no2)C2CC2)cc1 ZINC000604903183 568385508 /nfs/dbraw/zinc/38/55/08/568385508.db2.gz UFDKWKSQFZVMDM-UHFFFAOYSA-N 0 1 371.843 4.736 20 0 FJADMN COc1ccc(-c2nc(CN(CCc3ccc(F)cc3)C3CC3)co2)cc1 ZINC000604903488 568385590 /nfs/dbraw/zinc/38/55/90/568385590.db2.gz UPCYMVWIKAGIQZ-UHFFFAOYSA-N 0 1 366.436 4.696 20 0 FJADMN Cc1ccc(-c2n[nH]c(SCC(=O)c3c(C)cc(C)cc3C)n2)cc1 ZINC000005866018 568394283 /nfs/dbraw/zinc/39/42/83/568394283.db2.gz HFWNQRCECOSSBL-UHFFFAOYSA-N 0 1 351.475 4.680 20 0 FJADMN C[C@H](Sc1nc(-c2ccccn2)n[nH]1)c1ccc(OC(F)(F)F)cc1 ZINC000604932805 568395288 /nfs/dbraw/zinc/39/52/88/568395288.db2.gz PJDIDXOGKQRFTJ-JTQLQIEISA-N 0 1 366.368 4.619 20 0 FJADMN Cc1ccc2nc(S[C@H](C)C(=O)Nc3c(C)cc(C)cc3C)[nH]c2c1 ZINC000006292207 568401536 /nfs/dbraw/zinc/40/15/36/568401536.db2.gz RMPLILKEBVJHCH-OAHLLOKOSA-N 0 1 353.491 4.916 20 0 FJADMN C[C@@H](c1cccs1)N(C)CC[S@@](=O)c1cc(Cl)ccc1Cl ZINC000032937820 568428899 /nfs/dbraw/zinc/42/88/99/568428899.db2.gz MVWIZCFYQZCFCT-MQJDWESPSA-N 0 1 362.347 4.856 20 0 FJADMN Cc1[nH]c(S[C@@H](C)C(=O)Nc2cccc(F)c2)nc1Cc1ccccc1 ZINC000007099084 568448303 /nfs/dbraw/zinc/44/83/03/568448303.db2.gz BIAAEYULKBFBID-AWEZNQCLSA-N 0 1 369.465 4.567 20 0 FJADMN Fc1cccc(CSc2nc(-c3ccccc3Br)n[nH]2)c1 ZINC000007251870 568486773 /nfs/dbraw/zinc/48/67/73/568486773.db2.gz ZRBODUBGMXFQGU-UHFFFAOYSA-N 0 1 364.243 4.666 20 0 FJADMN O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cc(F)cc2[nH]cnc21 ZINC000604991327 568509807 /nfs/dbraw/zinc/50/98/07/568509807.db2.gz YLHSLAPCUOTCHH-VOTSOKGWSA-N 0 1 364.405 4.581 20 0 FJADMN CC[C@H]1CCCN(Cc2nnc(-c3c(C)onc3-c3ccccc3)o2)CC1 ZINC000604998766 568512284 /nfs/dbraw/zinc/51/22/84/568512284.db2.gz ACDXRIFLWQGWRW-INIZCTEOSA-N 0 1 366.465 4.712 20 0 FJADMN CCN(CC)[C@H](CNC(=O)[C@@H](C)c1ccsc1)c1ccccc1Cl ZINC000606162288 568681058 /nfs/dbraw/zinc/68/10/58/568681058.db2.gz XNUBMBPCELZBLG-KBXCAEBGSA-N 0 1 364.942 4.704 20 0 FJADMN CC[C@H](Sc1nc(-c2ccc(Cl)cc2)n[nH]1)C(=O)c1ccccc1 ZINC000606151141 568687179 /nfs/dbraw/zinc/68/71/79/568687179.db2.gz FEUZYEOTDNZSKX-HNNXBMFYSA-N 0 1 357.866 4.879 20 0 FJADMN COc1ccc(C)cc1NC(=O)CN1CCC[C@@H]1c1cccc2ccccc21 ZINC000108982518 209295275 /nfs/dbraw/zinc/29/52/75/209295275.db2.gz AIJYYLDEZGSBFM-JOCHJYFZSA-N 0 1 374.484 4.932 20 0 FJADMN CCSc1cc(C(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)ccn1 ZINC000108834080 209293563 /nfs/dbraw/zinc/29/35/63/209293563.db2.gz GVZZDFZYWVPURT-UHFFFAOYSA-N 0 1 364.430 4.582 20 0 FJADMN Cc1cccc(C(=O)N[C@@H](c2ccccc2)c2ccc3nc[nH]c3c2)c1C ZINC000097028461 209167184 /nfs/dbraw/zinc/16/71/84/209167184.db2.gz MZPOWQSZXXJWCQ-QFIPXVFZSA-N 0 1 355.441 4.699 20 0 FJADMN Fc1ccccc1-c1n[nH]c(SCc2ccccc2Br)n1 ZINC000004879916 207058971 /nfs/dbraw/zinc/05/89/71/207058971.db2.gz HBIBIFXCXLQMDG-UHFFFAOYSA-N 0 1 364.243 4.666 20 0 FJADMN CC(C)c1nnc(-c2ccccc2NC(=O)c2ccc3c(c2)CCCC3)[nH]1 ZINC000072012577 221395896 /nfs/dbraw/zinc/39/58/96/221395896.db2.gz RKCZLTHXVXRXSO-UHFFFAOYSA-N 0 1 360.461 4.726 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN3C(=O)C(C)(C)c3ccccc3C)[nH]c2c1 ZINC000061227934 567868697 /nfs/dbraw/zinc/86/86/97/567868697.db2.gz QQOWPAQDQTZQGU-HXUWFJFHSA-N 0 1 361.489 4.821 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N(C)[C@H](c2ccccc2C)C(C)C)o1 ZINC000602028627 567904561 /nfs/dbraw/zinc/90/45/61/567904561.db2.gz HQYRSLDRZMOMJH-NRFANRHFSA-N 0 1 356.510 4.899 20 0 FJADMN C[C@H](CC(=O)Nc1cccc(CN2CCCCC2)c1)C(=O)c1ccccc1 ZINC000602089295 567922303 /nfs/dbraw/zinc/92/23/03/567922303.db2.gz COQSMRMILUNLFI-GOSISDBHSA-N 0 1 364.489 4.520 20 0 FJADMN FC(F)(F)Oc1cccc(CNCc2sccc2Br)c1 ZINC000222065917 567936698 /nfs/dbraw/zinc/93/66/98/567936698.db2.gz XHXNNCYFBMYAMY-UHFFFAOYSA-N 0 1 366.202 4.699 20 0 FJADMN C[C@@H](CC(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1)C(=O)c1ccccc1 ZINC000602123701 567938319 /nfs/dbraw/zinc/93/83/19/567938319.db2.gz DEYPFKHXOZEZSX-AWEZNQCLSA-N 0 1 361.445 4.678 20 0 FJADMN CCCC[N@@H+](C)CCNC(=O)c1sc2cccc(Cl)c2c1Cl ZINC000602176764 567942021 /nfs/dbraw/zinc/94/20/21/567942021.db2.gz IXMCCDQQOSVFAB-UHFFFAOYSA-N 0 1 359.322 4.670 20 0 FJADMN Cc1c(Cl)cccc1NC(=O)CN[C@H](C)c1ccc(F)c(Cl)c1 ZINC000602550744 567990732 /nfs/dbraw/zinc/99/07/32/567990732.db2.gz YLFBHSGJHRFAPV-LLVKDONJSA-N 0 1 355.240 4.730 20 0 FJADMN C[C@@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccccc1Br ZINC000602567259 567995758 /nfs/dbraw/zinc/99/57/58/567995758.db2.gz MAURYOOQPMOLBY-QWHCGFSZSA-N 0 1 373.294 4.746 20 0 FJADMN CC(C)CC[N@H+]1Cc2cccc(NC(=O)CO[C@@H]3CCC[C@H](C)C3)c2C1 ZINC000602681866 568010271 /nfs/dbraw/zinc/01/02/71/568010271.db2.gz TXUFHDBIWNMTKW-PKOBYXMFSA-N 0 1 358.526 4.582 20 0 FJADMN CC(C)CCN1Cc2cccc(NC(=O)CO[C@@H]3CCC[C@H](C)C3)c2C1 ZINC000602681866 568010273 /nfs/dbraw/zinc/01/02/73/568010273.db2.gz TXUFHDBIWNMTKW-PKOBYXMFSA-N 0 1 358.526 4.582 20 0 FJADMN CC(C)(CCCc1ccccc1)C(=O)NCc1nc2ccc(Cl)cc2[nH]1 ZINC000602769011 568027478 /nfs/dbraw/zinc/02/74/78/568027478.db2.gz UBYXALUMTNVYML-UHFFFAOYSA-N 0 1 369.896 4.882 20 0 FJADMN CC(F)(F)c1cccc(NC(=O)N2CCCN(Cc3ccccc3)CC2)c1 ZINC000186981430 568034803 /nfs/dbraw/zinc/03/48/03/568034803.db2.gz RZHBVOWOZNUMQM-UHFFFAOYSA-N 0 1 373.447 4.538 20 0 FJADMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)c1ccc2ncccc2c1 ZINC000522759914 568062942 /nfs/dbraw/zinc/06/29/42/568062942.db2.gz NJCVMZWGRFCJPP-UHFFFAOYSA-N 0 1 354.369 4.623 20 0 FJADMN COc1cc(CNC2(c3ccc(Cl)cc3)CC2)ccc1OC(F)F ZINC000069878747 568100454 /nfs/dbraw/zinc/10/04/54/568100454.db2.gz VXJMFNOIHYPCDL-UHFFFAOYSA-N 0 1 353.796 4.729 20 0 FJADMN CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1cc(-c2ccoc2)[nH]n1 ZINC000603474765 568103902 /nfs/dbraw/zinc/10/39/02/568103902.db2.gz CAMYKRPHYYGRRT-SFHVURJKSA-N 0 1 357.841 4.792 20 0 FJADMN Cc1ccc(OCc2nc(CN[C@@H](C)CCc3ccco3)cs2)cc1 ZINC000603509961 568110382 /nfs/dbraw/zinc/11/03/82/568110382.db2.gz PPOFYWGOFBYAOY-INIZCTEOSA-N 0 1 356.491 4.734 20 0 FJADMN COC(=O)c1cc(CSc2nc3ccc(C(F)(F)F)cc3[nH]2)oc1C ZINC000603938027 568184410 /nfs/dbraw/zinc/18/44/10/568184410.db2.gz HPMCCRQZHSHLPO-UHFFFAOYSA-N 0 1 370.352 4.562 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN(C(=O)[C@@H](C)CC4CCCC4)C3)[nH]c2c1 ZINC000603966294 568191196 /nfs/dbraw/zinc/19/11/96/568191196.db2.gz OPQKUROGKCDGFD-WMZOPIPTSA-N 0 1 353.510 4.794 20 0 FJADMN CC(=O)N(c1nc(CN[C@H]2CCC[C@H](F)C2)cs1)c1ccc(C)cc1 ZINC000563121718 568222689 /nfs/dbraw/zinc/22/26/89/568222689.db2.gz CQMISOYZIAHJKJ-HOTGVXAUSA-N 0 1 361.486 4.506 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN3C(=O)[C@H](C)c3ccc(F)c(F)c3)[nH]c2c1 ZINC000607813448 568227264 /nfs/dbraw/zinc/22/72/64/568227264.db2.gz YAXKLMCGIOOVGP-BFUOFWGJSA-N 0 1 369.415 4.617 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN3C(=O)[C@@H](C)c3ccc(F)c(F)c3)[nH]c2c1 ZINC000607813449 568227276 /nfs/dbraw/zinc/22/72/76/568227276.db2.gz YAXKLMCGIOOVGP-DJJJIMSYSA-N 0 1 369.415 4.617 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N[C@@H](c2ccccc2Cl)C(C)C)o1 ZINC000604234389 568231725 /nfs/dbraw/zinc/23/17/25/568231725.db2.gz PWNTWFZBHJMWDW-LJQANCHMSA-N 0 1 362.901 4.902 20 0 FJADMN C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc(Cl)c1O ZINC000604266624 568241287 /nfs/dbraw/zinc/24/12/87/568241287.db2.gz XMGFCEFNNLQCOE-MRVPVSSYSA-N 0 1 360.624 4.758 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000604266664 568241344 /nfs/dbraw/zinc/24/13/44/568241344.db2.gz JNAGKJYJIOJHBP-UHFFFAOYSA-N 0 1 355.743 4.735 20 0 FJADMN Cc1c(Cl)cccc1NC(=O)[C@@H](C)Sc1nc(-c2ccccc2)n[nH]1 ZINC000007633446 568247302 /nfs/dbraw/zinc/24/73/02/568247302.db2.gz BTYYNQDLGNLGCL-GFCCVEGCSA-N 0 1 372.881 4.553 20 0 FJADMN Cc1n[nH]c(C(=O)N[C@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)c1C ZINC000604329332 568250517 /nfs/dbraw/zinc/25/05/17/568250517.db2.gz UHOYEYZLUJNMHA-LJQANCHMSA-N 0 1 371.843 4.647 20 0 FJADMN c1sc(-c2ccc3c(c2)OCO3)nc1CN1CCC[C@@H]1c1ccccc1 ZINC000303181680 568256092 /nfs/dbraw/zinc/25/60/92/568256092.db2.gz SYFVLHLDQAYXBS-GOSISDBHSA-N 0 1 364.470 4.876 20 0 FJADMN Cc1ccc(-c2ncc(CNC(C)(C)C(=O)Nc3ccccc3)s2)cc1 ZINC000604416557 568274790 /nfs/dbraw/zinc/27/47/90/568274790.db2.gz GMXBNXNEIDQGFC-UHFFFAOYSA-N 0 1 365.502 4.625 20 0 FJADMN COCCOc1ccc(CNCc2ccc(-c3cccc(F)c3C)o2)cc1 ZINC000604415019 568279989 /nfs/dbraw/zinc/27/99/89/568279989.db2.gz BWVWNQUGVSQKME-UHFFFAOYSA-N 0 1 369.436 4.709 20 0 FJADMN Fc1ccc(-c2cnc(CN(CCc3cccc(F)c3)C3CC3)o2)cc1 ZINC000303577418 568293171 /nfs/dbraw/zinc/29/31/71/568293171.db2.gz JWBIMIZIZPUKEG-UHFFFAOYSA-N 0 1 354.400 4.827 20 0 FJADMN Cc1ccc(OCc2nc(CNCCc3c(F)cccc3F)cs2)cc1 ZINC000303598297 568294180 /nfs/dbraw/zinc/29/41/80/568294180.db2.gz NKCXBCDLYBLFLT-UHFFFAOYSA-N 0 1 374.456 4.641 20 0 FJADMN CC(C)OC(=O)Cc1nc(CN(C)C2CCC(C(C)(C)C)CC2)cs1 ZINC000604492633 568303572 /nfs/dbraw/zinc/30/35/72/568303572.db2.gz TYTWKHHPBTWCLN-UHFFFAOYSA-N 0 1 366.571 4.674 20 0 FJADMN CCCc1nc(C)c(C(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)s1 ZINC000617135170 568348512 /nfs/dbraw/zinc/34/85/12/568348512.db2.gz VJSNLJPYXHTREA-UHFFFAOYSA-N 0 1 366.446 4.793 20 0 FJADMN Cc1cc(NC(=O)c2c[nH]nc2-c2ccsc2)ccc1C(F)(F)F ZINC000647746147 568355280 /nfs/dbraw/zinc/35/52/80/568355280.db2.gz MQCWARBYRFVQNX-UHFFFAOYSA-N 0 1 351.353 4.718 20 0 FJADMN Clc1cccc(Cl)c1-c1nnc(CN2CCc3ccccc3CC2)o1 ZINC000604759278 568360285 /nfs/dbraw/zinc/36/02/85/568360285.db2.gz GPQQCRNPFCEVER-UHFFFAOYSA-N 0 1 374.271 4.644 20 0 FJADMN C[C@@H](Sc1nc(-c2ccccn2)n[nH]1)C(=O)c1ccc(C(C)(C)C)cc1 ZINC000604933074 568395261 /nfs/dbraw/zinc/39/52/61/568395261.db2.gz WCSJDIRWXQLQIE-CYBMUJFWSA-N 0 1 366.490 4.528 20 0 FJADMN Cc1ccnc(NS(=O)(=O)c2ccc(Oc3ccccc3Cl)cc2)c1 ZINC000604929689 568397912 /nfs/dbraw/zinc/39/79/12/568397912.db2.gz NQMGXXFLMPCCQH-UHFFFAOYSA-N 0 1 374.849 4.637 20 0 FJADMN COc1cc(CSc2nc3ccc(C)cc3[nH]2)ccc1OC(F)F ZINC000007131916 568457559 /nfs/dbraw/zinc/45/75/59/568457559.db2.gz CMBWOADFUSVXHX-UHFFFAOYSA-N 0 1 350.390 4.774 20 0 FJADMN CCn1nccc1C1CCN(c2ccnc3cc(C(F)(F)F)ccc32)CC1 ZINC000432919967 568478640 /nfs/dbraw/zinc/47/86/40/568478640.db2.gz WJMJJBHPQTXFPL-UHFFFAOYSA-N 0 1 374.410 4.854 20 0 FJADMN Cc1csc(CNC2(c3ccc(Br)cc3)CCCC2)n1 ZINC000605008445 568515822 /nfs/dbraw/zinc/51/58/22/568515822.db2.gz JPCVYGXKGPKSDE-UHFFFAOYSA-N 0 1 351.313 4.773 20 0 FJADMN Cc1cc(C)c(C(=O)[C@H](C)Sc2nc(-c3ccccc3)n[nH]2)cc1C ZINC000007472067 568520882 /nfs/dbraw/zinc/52/08/82/568520882.db2.gz HYUVGYJTVXRXBZ-HNNXBMFYSA-N 0 1 351.475 4.760 20 0 FJADMN Cc1ccc([C@@H](NCC(=O)N[C@H](C)c2cccs2)c2ccccc2)cc1 ZINC000007542213 568529873 /nfs/dbraw/zinc/52/98/73/568529873.db2.gz BOVLBFASBMDYHO-VGSWGCGISA-N 0 1 364.514 4.613 20 0 FJADMN Cc1ccc([C@H](NCC(=O)N[C@@H](C)c2cccs2)c2ccccc2)cc1 ZINC000007542191 568529919 /nfs/dbraw/zinc/52/99/19/568529919.db2.gz BOVLBFASBMDYHO-HTAPYJJXSA-N 0 1 364.514 4.613 20 0 FJADMN Clc1ccc(Cl)c(-c2csc(CN3CC[C@@H]4OCC[C@@H]4C3)n2)c1 ZINC000563159214 568552125 /nfs/dbraw/zinc/55/21/25/568552125.db2.gz ZEXYLPNILWAPBT-BZNIZROVSA-N 0 1 369.317 4.728 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN3C(=O)c3cc4cc(F)ccc4o3)[nH]c2c1 ZINC000605088746 568567548 /nfs/dbraw/zinc/56/75/48/568567548.db2.gz OUHZNNBRZJFDLQ-KRWDZBQOSA-N 0 1 363.392 4.734 20 0 FJADMN Brc1ccc2c(c1)C=C(CN[C@H]1CSc3ccccc31)CO2 ZINC000605165873 568593997 /nfs/dbraw/zinc/59/39/97/568593997.db2.gz CSZCCXPVOZZFNJ-INIZCTEOSA-N 0 1 374.303 4.662 20 0 FJADMN Cc1ccc(-c2cc(CN3CCS[C@@H](c4ccccc4)C3)on2)cc1 ZINC000605156191 568601821 /nfs/dbraw/zinc/60/18/21/568601821.db2.gz MPOVFBUWAGHPNC-OAQYLSRUSA-N 0 1 350.487 4.940 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)Nc2cccc(NC3CCCC3)c2)o1 ZINC000605180325 568605177 /nfs/dbraw/zinc/60/51/77/568605177.db2.gz DLEYLHIKEBAUMK-UHFFFAOYSA-N 0 1 355.482 4.728 20 0 FJADMN CCN(CC)[C@@H](CNC(=O)[C@H](C)c1cccs1)c1ccccc1Cl ZINC000606162315 568680985 /nfs/dbraw/zinc/68/09/85/568680985.db2.gz YYMIFMRIPAWDBB-PBHICJAKSA-N 0 1 364.942 4.704 20 0 FJADMN CC[C@H](Sc1nc(C=Cc2ccc(C)o2)n[nH]1)C(=O)c1ccccc1 ZINC000606152451 568688549 /nfs/dbraw/zinc/68/85/49/568688549.db2.gz IAORTWWGCXNZCQ-JNSOCZORSA-N 0 1 353.447 4.630 20 0 FJADMN CC[C@H](Sc1nc(C=Cc2ccc(C)o2)n[nH]1)C(=O)c1ccccc1 ZINC000606152453 568688620 /nfs/dbraw/zinc/68/86/20/568688620.db2.gz IAORTWWGCXNZCQ-PCUGXKRQSA-N 0 1 353.447 4.630 20 0 FJADMN CCSc1ccnc(N2CCC[C@]3(CCN3Cc3cccc(F)c3)C2)c1 ZINC001164995876 722211974 /nfs/dbraw/zinc/21/19/74/722211974.db2.gz LDAFNGZCWYNFDQ-NRFANRHFSA-N 0 1 371.525 4.578 20 0 FJADMN O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1ccc2ccccc2c1 ZINC000109021686 209295907 /nfs/dbraw/zinc/29/59/07/209295907.db2.gz RKGOENXDGGOBCZ-HXUWFJFHSA-N 0 1 357.413 4.820 20 0 FJADMN CN(CC(=O)Nc1ccccc1C(F)(F)F)[C@H]1CCCc2ccccc21 ZINC000018935251 220234013 /nfs/dbraw/zinc/23/40/13/220234013.db2.gz BXZFHBAYWKNMTL-SFHVURJKSA-N 0 1 362.395 4.653 20 0 FJADMN CN(CC(=O)Nc1ccccc1C(F)(F)F)[C@@H]1CCCc2ccccc21 ZINC000018935250 220234138 /nfs/dbraw/zinc/23/41/38/220234138.db2.gz BXZFHBAYWKNMTL-GOSISDBHSA-N 0 1 362.395 4.653 20 0 FJADMN COc1ccccc1S(=O)(=O)Nc1ccccc1Nc1ccc(C)cc1 ZINC000057434752 221088204 /nfs/dbraw/zinc/08/82/04/221088204.db2.gz ATABJKBTVKHMJB-UHFFFAOYSA-N 0 1 368.458 4.548 20 0 FJADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1cccc(Oc2ccncc2)c1 ZINC000601735338 567821456 /nfs/dbraw/zinc/82/14/56/567821456.db2.gz XZNZZBOEUXTZGC-UHFFFAOYSA-N 0 1 370.412 4.825 20 0 FJADMN CC[C@@H]1c2ccccc2CCN1Cc1cnc(-c2ccccc2OC)nc1 ZINC000644832580 567840215 /nfs/dbraw/zinc/84/02/15/567840215.db2.gz ZWUNEFBEPOUVBY-OAQYLSRUSA-N 0 1 359.473 4.662 20 0 FJADMN CCOc1cc(CN[C@@H](C)c2ccc(F)cc2F)ccc1OC(F)F ZINC000060833378 567855310 /nfs/dbraw/zinc/85/53/10/567855310.db2.gz AJSQKTJFKUBXCV-NSHDSACASA-N 0 1 357.347 4.816 20 0 FJADMN CCCCOc1ncccc1CNCc1cccc(OC2CCCC2)c1 ZINC000063579223 567878275 /nfs/dbraw/zinc/87/82/75/567878275.db2.gz IOBSIYMKLZXARY-UHFFFAOYSA-N 0 1 354.494 4.872 20 0 FJADMN C[C@@H](c1ccc(Br)cc1)N1CCCO[C@@H](c2ccccc2)C1 ZINC000602238746 567954925 /nfs/dbraw/zinc/95/49/25/567954925.db2.gz DCJVVJKARYNENJ-HNAYVOBHSA-N 0 1 360.295 4.974 20 0 FJADMN Cc1ccccc1[C@H](C(C)C)N(C)Cc1csc(-c2ncccn2)n1 ZINC000602251761 567959858 /nfs/dbraw/zinc/95/98/58/567959858.db2.gz LNSBSTBPXNVLBI-SFHVURJKSA-N 0 1 352.507 4.738 20 0 FJADMN Cc1n[nH]c(C(C)C)c1C(=O)Nc1ncc(-c2ccc(Cl)cc2)s1 ZINC000461106933 567984106 /nfs/dbraw/zinc/98/41/06/567984106.db2.gz HVNOUEWGYWSJFQ-UHFFFAOYSA-N 0 1 360.870 4.871 20 0 FJADMN Cc1ccc(NC(=O)CN[C@H](C)c2ccc(F)c(Cl)c2)c(Cl)c1 ZINC000602576661 567996788 /nfs/dbraw/zinc/99/67/88/567996788.db2.gz DMONGGWORXCVMH-LLVKDONJSA-N 0 1 355.240 4.730 20 0 FJADMN CCCNC(=O)c1cccc(CN[C@@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000187017582 567999793 /nfs/dbraw/zinc/99/97/93/567999793.db2.gz ZVJAFAMBNFLIJD-HXUWFJFHSA-N 0 1 368.546 4.770 20 0 FJADMN CCCNC(=O)c1cccc(CN[C@H]2CCSc3cc(C)c(C)cc32)c1 ZINC000187017603 567999885 /nfs/dbraw/zinc/99/98/85/567999885.db2.gz ZVJAFAMBNFLIJD-FQEVSTJZSA-N 0 1 368.546 4.770 20 0 FJADMN COc1ccc(OC(F)F)c(CNCc2ccc(OC(C)(C)C)cc2)c1 ZINC000602910118 568011060 /nfs/dbraw/zinc/01/10/60/568011060.db2.gz ISMOWIWTGBEYAX-UHFFFAOYSA-N 0 1 365.420 4.764 20 0 FJADMN Cc1[nH]nc2ncc(CN[C@H]3CCOc4c(-c5ccccc5)cccc43)cc12 ZINC000603518288 568112034 /nfs/dbraw/zinc/11/20/34/568112034.db2.gz DYVWYYMPIJGUQB-NRFANRHFSA-N 0 1 370.456 4.547 20 0 FJADMN Clc1ccc2nc(CN[C@@H](c3cccnc3)C3CCCCC3)cn2c1 ZINC000603556893 568116784 /nfs/dbraw/zinc/11/67/84/568116784.db2.gz HMVVOLZUXVXDRM-HXUWFJFHSA-N 0 1 354.885 4.794 20 0 FJADMN O=[S@](CCN1CC[C@H](c2ccccc2)C1)c1cc(Cl)ccc1Cl ZINC000522775845 568131935 /nfs/dbraw/zinc/13/19/35/568131935.db2.gz CPZNOJODNJYUNH-NPMXOYFQSA-N 0 1 368.329 4.591 20 0 FJADMN Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccc(Oc2ccccn2)cc1 ZINC000603697251 568138549 /nfs/dbraw/zinc/13/85/49/568138549.db2.gz BXRPIGYNEIOMCR-UHFFFAOYSA-N 0 1 370.412 4.825 20 0 FJADMN C[C@@H](C(=O)Nc1ccccc1SCC(F)(F)F)N1CCCCCC1 ZINC000603793802 568164968 /nfs/dbraw/zinc/16/49/68/568164968.db2.gz QLLABDRMYVISNF-ZDUSSCGKSA-N 0 1 360.445 4.544 20 0 FJADMN C[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000122163718 568200438 /nfs/dbraw/zinc/20/04/38/568200438.db2.gz MYMGYMNNCVCLRS-CHWSQXEVSA-N 0 1 371.424 4.521 20 0 FJADMN Cc1ccc2nc([C@@H]3CCCN3C(=O)[C@H](C)c3ccc(F)c(F)c3)[nH]c2c1 ZINC000607813451 568227245 /nfs/dbraw/zinc/22/72/45/568227245.db2.gz YAXKLMCGIOOVGP-YJYMSZOUSA-N 0 1 369.415 4.617 20 0 FJADMN O=C(CCc1ccc(OC(F)(F)F)cc1)Nc1cccc(Cl)c1O ZINC000604266634 568241300 /nfs/dbraw/zinc/24/13/00/568241300.db2.gz YGHFAKDCRUQNDY-UHFFFAOYSA-N 0 1 359.731 4.516 20 0 FJADMN O=C(CCCOc1cccc2ccccc21)Nc1cccc(Cl)c1O ZINC000604267150 568241486 /nfs/dbraw/zinc/24/14/86/568241486.db2.gz CYQQOZOADXCSMI-UHFFFAOYSA-N 0 1 355.821 4.997 20 0 FJADMN Cc1n[nH]c(C(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c1C ZINC000604315552 568245940 /nfs/dbraw/zinc/24/59/40/568245940.db2.gz GAHFVPHCKPUJRX-UHFFFAOYSA-N 0 1 374.271 4.853 20 0 FJADMN Cc1cccc(C(C)C)c1NC(=O)CN1C[C@H](c2ccccc2)C[C@@H]1C ZINC000604393204 568283256 /nfs/dbraw/zinc/28/32/56/568283256.db2.gz UVIYMFSPBAUCKW-AZUAARDMSA-N 0 1 350.506 4.935 20 0 FJADMN CCc1cccc(C)c1NC(=O)CN(Cc1ccc(F)cc1)CC1CC1 ZINC000604395288 568284949 /nfs/dbraw/zinc/28/49/49/568284949.db2.gz JKTIVEOHRWYQAA-UHFFFAOYSA-N 0 1 354.469 4.547 20 0 FJADMN FC(F)(F)[C@H]1C[C@H](C(F)(F)F)CN(Cc2ccc3c(c2)CCC3)C1 ZINC000604383708 568287434 /nfs/dbraw/zinc/28/74/34/568287434.db2.gz FOQVEELHNXRHIN-GJZGRUSLSA-N 0 1 351.334 4.738 20 0 FJADMN O=C(Nc1ccc(OC2CCCCC2)cc1)c1cc(F)cc2[nH]cnc21 ZINC000604747729 568356486 /nfs/dbraw/zinc/35/64/86/568356486.db2.gz KERLFMXAAGWJHB-UHFFFAOYSA-N 0 1 353.397 4.666 20 0 FJADMN CC(C)c1ccc(CN[C@@](C)(CO)c2cccc(C(F)(F)F)c2)cc1 ZINC000604767460 568362348 /nfs/dbraw/zinc/36/23/48/568362348.db2.gz LGWGOEDJSZIMDJ-IBGZPJMESA-N 0 1 351.412 4.826 20 0 FJADMN Cc1ccc(COc2ccc(CN[C@@H](CO)c3cccc(F)c3)cc2)cc1 ZINC000604768985 568362651 /nfs/dbraw/zinc/36/26/51/568362651.db2.gz XCPZSVPTZSUAOZ-QHCPKHFHSA-N 0 1 365.448 4.536 20 0 FJADMN CC[C@H](C)[C@H](C(=O)NCc1nc2ccc(Cl)cc2[nH]1)c1ccccc1 ZINC000604867727 568380509 /nfs/dbraw/zinc/38/05/09/568380509.db2.gz GSRIQMFUPGNGPP-DJJJIMSYSA-N 0 1 355.869 4.662 20 0 FJADMN CC[C@@H](C)[C@H](C(=O)NCc1nc2ccc(Cl)cc2[nH]1)c1ccccc1 ZINC000604867729 568380530 /nfs/dbraw/zinc/38/05/30/568380530.db2.gz GSRIQMFUPGNGPP-YJYMSZOUSA-N 0 1 355.869 4.662 20 0 FJADMN CC(C)n1ccc(CN(C)CCCCCc2cc(-c3ccccc3)n[nH]2)n1 ZINC000604885194 568380690 /nfs/dbraw/zinc/38/06/90/568380690.db2.gz HJBNUGFFYFKDHG-UHFFFAOYSA-N 0 1 365.525 4.699 20 0 FJADMN Fc1ccc(CCN(Cc2coc(-c3ccc(F)c(F)c3)n2)C2CC2)cc1 ZINC000604903189 568385505 /nfs/dbraw/zinc/38/55/05/568385505.db2.gz WJKZXUHOXBRQBV-UHFFFAOYSA-N 0 1 372.390 4.966 20 0 FJADMN Brc1ccc(/C=C/CCSc2nc(C3CC3)n[nH]2)cc1 ZINC000604931304 568394754 /nfs/dbraw/zinc/39/47/54/568394754.db2.gz VJCUXQOCPAWQNT-HNQUOIGGSA-N 0 1 350.285 4.640 20 0 FJADMN Brc1ccc(/C=C/CCSc2n[nH]c(C3CC3)n2)cc1 ZINC000604931304 568394755 /nfs/dbraw/zinc/39/47/55/568394755.db2.gz VJCUXQOCPAWQNT-HNQUOIGGSA-N 0 1 350.285 4.640 20 0 FJADMN O=C(CC1CCOCC1)Nc1ccc2nc(-c3ccccc3Cl)[nH]c2c1 ZINC000604940382 568405010 /nfs/dbraw/zinc/40/50/10/568405010.db2.gz JKLIVBOFFSHKBA-UHFFFAOYSA-N 0 1 369.852 4.639 20 0 FJADMN Cc1[nH]c(S[C@H](C)C(=O)Nc2cccc(F)c2)nc1Cc1ccccc1 ZINC000007099091 568448274 /nfs/dbraw/zinc/44/82/74/568448274.db2.gz BIAAEYULKBFBID-CQSZACIVSA-N 0 1 369.465 4.567 20 0 FJADMN CC[C@H]1CCCN(Cc2csc(-c3cccc(OC)c3OC)n2)CC1 ZINC000604999192 568512606 /nfs/dbraw/zinc/51/26/06/568512606.db2.gz UOIGXOKTJIIEGP-HNNXBMFYSA-N 0 1 360.523 4.839 20 0 FJADMN Cc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2C)c(Br)c1 ZINC000028197192 568539316 /nfs/dbraw/zinc/53/93/16/568539316.db2.gz JMZXKODABHMYAY-UHFFFAOYSA-N 0 1 374.687 4.520 20 0 FJADMN CC(C)c1ccccc1NC(=O)[C@@H](C)Sc1nc(-c2ccccc2)n[nH]1 ZINC000007633448 568611398 /nfs/dbraw/zinc/61/13/98/568611398.db2.gz FXMRKHWIVIMXPU-CQSZACIVSA-N 0 1 366.490 4.714 20 0 FJADMN Cc1cccc(C)c1NC(=O)[C@H](C)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000110303166 209322044 /nfs/dbraw/zinc/32/20/44/209322044.db2.gz RAPXUOVXRITZMX-SFHVURJKSA-N 0 1 368.496 4.724 20 0 FJADMN O=C(CCc1c[nH]c2ccccc12)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000108228920 209285211 /nfs/dbraw/zinc/28/52/11/209285211.db2.gz JUUAQXUOUZITEE-UHFFFAOYSA-N 0 1 370.412 4.876 20 0 FJADMN O=C(Nc1nc2c(s1)CCCCC2)c1cn[nH]c1-c1ccc(Cl)cc1 ZINC000012830066 220035137 /nfs/dbraw/zinc/03/51/37/220035137.db2.gz OXDYNZXUTVQZNE-UHFFFAOYSA-N 0 1 372.881 4.708 20 0 FJADMN COc1ccc2nc(S[C@@H](C)C(=O)Nc3c(C)cc(C)cc3C)[nH]c2c1 ZINC000004273962 207011253 /nfs/dbraw/zinc/01/12/53/207011253.db2.gz UEVGZISZTRXOMN-AWEZNQCLSA-N 0 1 369.490 4.616 20 0 FJADMN Brc1csc(CNCc2ccc(Br)s2)c1 ZINC000037985188 220845416 /nfs/dbraw/zinc/84/54/16/220845416.db2.gz UHWVOYLSSMJSLQ-UHFFFAOYSA-N 0 1 367.131 4.624 20 0 FJADMN CC(C)Oc1ccc(NC(=O)c2cn[nH]c2-c2ccc(Cl)cc2)cc1 ZINC000059419386 221126094 /nfs/dbraw/zinc/12/60/94/221126094.db2.gz AWBVPZQACZDVMH-UHFFFAOYSA-N 0 1 355.825 4.770 20 0 FJADMN CC(C)(C)c1n[nH]c(SCCC(=O)Nc2c(Cl)cccc2Cl)n1 ZINC000012260584 567980119 /nfs/dbraw/zinc/98/01/19/567980119.db2.gz FRPVLFDXJJBUOX-UHFFFAOYSA-N 0 1 373.309 4.530 20 0 FJADMN CC(C)(C)c1nc(SCCC(=O)Nc2c(Cl)cccc2Cl)n[nH]1 ZINC000012260584 567980120 /nfs/dbraw/zinc/98/01/20/567980120.db2.gz FRPVLFDXJJBUOX-UHFFFAOYSA-N 0 1 373.309 4.530 20 0 FJADMN COc1cc([C@H](C)N[C@@H](C)c2cc(F)ccc2F)ccc1OC(F)F ZINC000602562568 567991892 /nfs/dbraw/zinc/99/18/92/567991892.db2.gz ABWPGRSQWSWUAN-QWRGUYRKSA-N 0 1 357.347 4.987 20 0 FJADMN C[C@H](N[C@@H](C)c1ccccc1Br)c1ccc2c(c1)CCC(=O)N2 ZINC000602567261 567995763 /nfs/dbraw/zinc/99/57/63/567995763.db2.gz MAURYOOQPMOLBY-STQMWFEESA-N 0 1 373.294 4.746 20 0 FJADMN CSC1CCN([C@H](C)c2nnc(-c3ccc4ccccc4c3)o2)CC1 ZINC000602919638 568013013 /nfs/dbraw/zinc/01/30/13/568013013.db2.gz JALLXXJXVDLXIL-CQSZACIVSA-N 0 1 353.491 4.778 20 0 FJADMN CSC1CCN([C@H](C)c2nnc(-c3ccc(Cl)cc3Cl)o2)CC1 ZINC000602921456 568013241 /nfs/dbraw/zinc/01/32/41/568013241.db2.gz ZRNBOZIPMCGUBP-SNVBAGLBSA-N 0 1 372.321 4.932 20 0 FJADMN Cc1cc(CNC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)n[nH]1 ZINC000603487087 568106416 /nfs/dbraw/zinc/10/64/16/568106416.db2.gz SNBDLXRBIBZHMA-SFHVURJKSA-N 0 1 371.893 4.521 20 0 FJADMN Cc1ccc(OCc2nc(CNCCc3cccc(F)c3F)cs2)cc1 ZINC000603513901 568111316 /nfs/dbraw/zinc/11/13/16/568111316.db2.gz MSDFKDRYRQBQBC-UHFFFAOYSA-N 0 1 374.456 4.641 20 0 FJADMN c1nn2ccccc2c1CN[C@@H]1CCOc2c(-c3ccccc3)cccc21 ZINC000603518674 568112084 /nfs/dbraw/zinc/11/20/84/568112084.db2.gz IQIIVUKNXGQCHF-OAQYLSRUSA-N 0 1 355.441 4.615 20 0 FJADMN C[C@@H](NCc1ccccc1Cl)c1ccc(NC(=O)c2ccncc2)cc1 ZINC000603723782 568142386 /nfs/dbraw/zinc/14/23/86/568142386.db2.gz PGXMXXMGQAYTED-OAHLLOKOSA-N 0 1 365.864 4.838 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)Nc2ccnc(Oc3ccccc3)c2)o1 ZINC000603883953 568176769 /nfs/dbraw/zinc/17/67/69/568176769.db2.gz MEXWFPIYBHZPKU-UHFFFAOYSA-N 0 1 365.433 4.561 20 0 FJADMN Cc1ccc2c(Cl)c(C(=O)Nc3cccc(-c4nnc[nH]4)c3)sc2c1 ZINC000603905173 568180817 /nfs/dbraw/zinc/18/08/17/568180817.db2.gz DVXHAAUDUHYEKR-UHFFFAOYSA-N 0 1 368.849 4.901 20 0 FJADMN Cc1cc(-c2noc([C@H](C)NCC(C)(C)Oc3ccccc3)n2)ccc1F ZINC000604065284 568205390 /nfs/dbraw/zinc/20/53/90/568205390.db2.gz CXFSRNFOMGNOJN-HNNXBMFYSA-N 0 1 369.440 4.692 20 0 FJADMN CCCCN(Cc1nc(-c2ccccn2)no1)[C@@H](CC)c1ccccc1 ZINC000604052856 568206905 /nfs/dbraw/zinc/20/69/05/568206905.db2.gz SLFKFYAFGNXFGR-IBGZPJMESA-N 0 1 350.466 4.885 20 0 FJADMN C[C@H](c1ccccc1)N(C)CC(=O)N(Cc1ccco1)Cc1ccccc1 ZINC000302746117 568234230 /nfs/dbraw/zinc/23/42/30/568234230.db2.gz YJJDJZMFKMZRDT-LJQANCHMSA-N 0 1 362.473 4.501 20 0 FJADMN CC1CCC(CC(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)CC1 ZINC000604308188 568247803 /nfs/dbraw/zinc/24/78/03/568247803.db2.gz RCGPGNQJPKVYJQ-UHFFFAOYSA-N 0 1 362.945 4.637 20 0 FJADMN Cc1nc(-c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2)cs1 ZINC000007726322 568254353 /nfs/dbraw/zinc/25/43/53/568254353.db2.gz BOZOVPZTOJJHSS-UHFFFAOYSA-N 0 1 364.879 4.573 20 0 FJADMN O=C(Nc1ccc(-c2nc3ccc(F)cc3[nH]2)cc1)c1ccc(F)c(F)c1 ZINC000303247960 568262703 /nfs/dbraw/zinc/26/27/03/568262703.db2.gz DUTHLQTURCODGO-UHFFFAOYSA-N 0 1 367.330 4.900 20 0 FJADMN Cc1c2cc(Cl)ccc2oc1C(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000604342509 568262948 /nfs/dbraw/zinc/26/29/48/568262948.db2.gz ZVNJGTTXKHONFM-UHFFFAOYSA-N 0 1 374.843 4.525 20 0 FJADMN Cc1c2ccccc2oc1CNCc1cc(Cl)c2c(c1)OCCCO2 ZINC000604417011 568275164 /nfs/dbraw/zinc/27/51/64/568275164.db2.gz XFUNWROLWPUKTM-UHFFFAOYSA-N 0 1 357.837 4.846 20 0 FJADMN Fc1ccc(-c2nc(CN[C@@H]3CCCN(c4ccccc4)C3)cs2)cc1 ZINC000604416892 568275202 /nfs/dbraw/zinc/27/52/02/568275202.db2.gz NCIZKZHYNRXMHU-GOSISDBHSA-N 0 1 367.493 4.708 20 0 FJADMN COCCOc1ccc(CNCc2ccc(-c3ccc(F)cc3C)o2)cc1 ZINC000604415126 568280140 /nfs/dbraw/zinc/28/01/40/568280140.db2.gz SXAKMVUZKCVGRQ-UHFFFAOYSA-N 0 1 369.436 4.709 20 0 FJADMN COC1CCC(N(C)Cc2csc(Cc3ccc(Cl)cc3)n2)CC1 ZINC000604392754 568282916 /nfs/dbraw/zinc/28/29/16/568282916.db2.gz SWQVBMWLSHISRV-UHFFFAOYSA-N 0 1 364.942 4.777 20 0 FJADMN CSCc1ccc(C(=O)Nc2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cc1 ZINC000604480793 568300378 /nfs/dbraw/zinc/30/03/78/568300378.db2.gz BOMDMEGYVCMQJA-SFHVURJKSA-N 0 1 367.474 4.530 20 0 FJADMN CSCc1ccc(C(=O)Nc2ccc3nc([C@H]4CCCO4)[nH]c3c2)cc1 ZINC000604480792 568300402 /nfs/dbraw/zinc/30/04/02/568300402.db2.gz BOMDMEGYVCMQJA-GOSISDBHSA-N 0 1 367.474 4.530 20 0 FJADMN C[C@](CO)(NCc1ccc(Oc2ccccc2F)c(F)c1)c1ccccc1 ZINC000604765618 568361828 /nfs/dbraw/zinc/36/18/28/568361828.db2.gz ZISQYTKXANESMS-JOCHJYFZSA-N 0 1 369.411 4.754 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)NCCCc2ccc(C(C)C)cc2)o1 ZINC000604849895 568377304 /nfs/dbraw/zinc/37/73/04/568377304.db2.gz RFUJHWNXJWRJPE-UHFFFAOYSA-N 0 1 356.510 4.607 20 0 FJADMN CCN(CC)[C@@H](C(=O)Nc1ccc2c(cnn2C(C)C)c1)c1ccccc1 ZINC000604991935 568509982 /nfs/dbraw/zinc/50/99/82/568509982.db2.gz SVMYEZARWFBZKG-OAQYLSRUSA-N 0 1 364.493 4.639 20 0 FJADMN CNC(=O)c1cccc(CN2CCCCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000605000364 568513860 /nfs/dbraw/zinc/51/38/60/568513860.db2.gz LKFBOQUXCUMBHK-FQEVSTJZSA-N 0 1 356.897 4.817 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)N[C@H](C)c2cccc(Cl)c2Cl)o1 ZINC000605113636 568571646 /nfs/dbraw/zinc/57/16/46/568571646.db2.gz QNDYQXVRJWWBPD-GFCCVEGCSA-N 0 1 369.292 4.919 20 0 FJADMN O=C(c1cccc(Br)c1O)N(Cc1ccccc1)CC1CCC1 ZINC000605181675 568606059 /nfs/dbraw/zinc/60/60/59/568606059.db2.gz DGABBSRVAMTPMP-UHFFFAOYSA-N 0 1 374.278 4.597 20 0 FJADMN O=C(c1ccc(F)cc1)[C@@H]1CCCN(c2ccnc3cc(F)ccc32)C1 ZINC000606155868 568675875 /nfs/dbraw/zinc/67/58/75/568675875.db2.gz XDRKIQAWXAKYIT-OAHLLOKOSA-N 0 1 352.384 4.612 20 0 FJADMN CCN(CC)[C@@H](CNC(=O)[C@H](C)c1ccsc1)c1ccccc1Cl ZINC000606162289 568680968 /nfs/dbraw/zinc/68/09/68/568680968.db2.gz XNUBMBPCELZBLG-KDOFPFPSSA-N 0 1 364.942 4.704 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)NC(c2cccs2)c2cccs2)o1 ZINC000606220369 568735103 /nfs/dbraw/zinc/73/51/03/568735103.db2.gz ZYWBXZFICMHYTA-UHFFFAOYSA-N 0 1 374.531 4.764 20 0 FJADMN Cc1cccc(C)c1NC(=O)[C@@H](C)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000110303162 209321263 /nfs/dbraw/zinc/32/12/63/209321263.db2.gz RAPXUOVXRITZMX-GOSISDBHSA-N 0 1 368.496 4.724 20 0 FJADMN Brc1ccc(CNCc2sccc2Br)s1 ZINC000043675124 209310685 /nfs/dbraw/zinc/31/06/85/209310685.db2.gz YCMQBHMQIUTQCQ-UHFFFAOYSA-N 0 1 367.131 4.624 20 0 FJADMN O=C(Cc1cccc2ccccc21)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1 ZINC000109022209 209295169 /nfs/dbraw/zinc/29/51/69/209295169.db2.gz DDLDZHQHPYUYFM-NRFANRHFSA-N 0 1 371.440 4.749 20 0 FJADMN O=C(Cc1ccc(Cl)cc1)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000108228352 209284520 /nfs/dbraw/zinc/28/45/20/209284520.db2.gz AHBOLCGASNWELJ-UHFFFAOYSA-N 0 1 351.793 4.658 20 0 FJADMN C[C@@H](CC(=O)Nc1cccc(CN2CCCCC2)c1)C(=O)c1ccccc1 ZINC000602089297 567922271 /nfs/dbraw/zinc/92/22/71/567922271.db2.gz COQSMRMILUNLFI-SFHVURJKSA-N 0 1 364.489 4.520 20 0 FJADMN C[C@H](CC(=O)Nc1ccc2nc(-c3ccco3)[nH]c2c1)C(=O)c1ccccc1 ZINC000602101302 567927179 /nfs/dbraw/zinc/92/71/79/567927179.db2.gz XOCOIRQJGBKNLK-CQSZACIVSA-N 0 1 373.412 4.671 20 0 FJADMN CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H](C)c2cc(F)ccc2F)cc1 ZINC000602570201 567996029 /nfs/dbraw/zinc/99/60/29/567996029.db2.gz ALTUOTXEXNJBTE-KBPBESRZSA-N 0 1 361.436 4.907 20 0 FJADMN Cc1nc([C@H](N[C@H](C)c2cccc(-c3ccncc3)c2)c2ccccc2)n[nH]1 ZINC000162662181 568002884 /nfs/dbraw/zinc/00/28/84/568002884.db2.gz PQBCJWXTJSRNBK-OPAMFIHVSA-N 0 1 369.472 4.615 20 0 FJADMN COc1ccc(C)cc1NC(=O)CN1CCCCC[C@H]1c1ccccc1 ZINC000521425758 568003525 /nfs/dbraw/zinc/00/35/25/568003525.db2.gz KUQSXVCSQAWBMS-FQEVSTJZSA-N 0 1 352.478 4.559 20 0 FJADMN CCN(CC)[C@@H](CNCc1c(Cl)cccc1OC(F)F)c1ccco1 ZINC000602909650 568010852 /nfs/dbraw/zinc/01/08/52/568010852.db2.gz GITGHIKBJSGENK-HNNXBMFYSA-N 0 1 372.843 4.707 20 0 FJADMN CCN(CC)[C@H](CNCc1c(Cl)cccc1OC(F)F)c1ccco1 ZINC000602909651 568010890 /nfs/dbraw/zinc/01/08/90/568010890.db2.gz GITGHIKBJSGENK-OAHLLOKOSA-N 0 1 372.843 4.707 20 0 FJADMN COc1ccc(OC(F)F)c(CNCc2ccc3[nH]c(C)c(C)c3c2)c1 ZINC000602909601 568010916 /nfs/dbraw/zinc/01/09/16/568010916.db2.gz CMZFYCMWDWTMTF-UHFFFAOYSA-N 0 1 360.404 4.685 20 0 FJADMN CCOc1c(OC)cc(CNC2(c3ccc(Cl)cc3)CC2)cc1OC ZINC000069878432 568098113 /nfs/dbraw/zinc/09/81/13/568098113.db2.gz XOOAJLJAKIEFDO-UHFFFAOYSA-N 0 1 361.869 4.535 20 0 FJADMN COc1cc(CN[C@H]2C[C@H](C)c3ccccc32)c(Br)cc1O ZINC000603513476 568111153 /nfs/dbraw/zinc/11/11/53/568111153.db2.gz QRJPENXEDHZGRS-ZBEGNZNMSA-N 0 1 362.267 4.501 20 0 FJADMN COc1cc(CN[C@@H]2C[C@H](C)c3ccccc32)c(Br)cc1O ZINC000603513475 568111155 /nfs/dbraw/zinc/11/11/55/568111155.db2.gz QRJPENXEDHZGRS-MEDUHNTESA-N 0 1 362.267 4.501 20 0 FJADMN COc1cccc2c1OCC[C@@H]2NCc1ccc(OC(F)F)c(Cl)c1 ZINC000603518919 568112910 /nfs/dbraw/zinc/11/29/10/568112910.db2.gz QGHNOEOODZPTHR-AWEZNQCLSA-N 0 1 369.795 4.563 20 0 FJADMN Cc1c(C(=O)Nc2nc(-c3ccc(C)cc3)n[nH]2)sc2cccc(F)c12 ZINC000603628809 568127670 /nfs/dbraw/zinc/12/76/70/568127670.db2.gz DYCKJWQUBRYDAT-UHFFFAOYSA-N 0 1 366.421 4.695 20 0 FJADMN CCOc1ccc2nc(S[C@H](C)C(=O)Nc3ccc(C)cc3C)[nH]c2c1 ZINC000007060130 568146880 /nfs/dbraw/zinc/14/68/80/568146880.db2.gz NSNAHAPALATHCN-CQSZACIVSA-N 0 1 369.490 4.698 20 0 FJADMN CC[C@H](NC(=O)c1ccc(CN(CC)CC)o1)c1ccc(Cl)s1 ZINC000603835255 568159155 /nfs/dbraw/zinc/15/91/55/568159155.db2.gz SWCUVVBWXXZZEU-ZDUSSCGKSA-N 0 1 354.903 4.717 20 0 FJADMN O=C(c1cc(-c2ccccc2)[nH]n1)N1CCC[C@H]1c1ccccc1Cl ZINC000617127732 568220227 /nfs/dbraw/zinc/22/02/27/568220227.db2.gz NJSIZALKHAGRAM-IBGZPJMESA-N 0 1 351.837 4.707 20 0 FJADMN Cc1cc(CN2CCSCC2)ccc1NC(=O)CC1CCC(C)CC1 ZINC000604281757 568240779 /nfs/dbraw/zinc/24/07/79/568240779.db2.gz WEWDJKULKBVLOS-UHFFFAOYSA-N 0 1 360.567 4.699 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)c1ccccc1COc1ccccc1 ZINC000604266779 568241394 /nfs/dbraw/zinc/24/13/94/568241394.db2.gz USZFGUOPNVIJGK-UHFFFAOYSA-N 0 1 353.805 4.877 20 0 FJADMN CCc1c(NC(=O)CCC2CC2)[nH]nc1-c1ccc(Br)cc1 ZINC000604331653 568251150 /nfs/dbraw/zinc/25/11/50/568251150.db2.gz BVGGSYIBTAGGJR-UHFFFAOYSA-N 0 1 362.271 4.530 20 0 FJADMN Cc1csc(Sc2ccc(NC(=O)CN(C)C(C)C)cc2Cl)n1 ZINC000303145866 568253281 /nfs/dbraw/zinc/25/32/81/568253281.db2.gz LSSKFERAAPXMSE-UHFFFAOYSA-N 0 1 369.943 4.535 20 0 FJADMN C[C@H](c1ccc2ccccc2c1)N(CC(=O)N(C)Cc1ccco1)C1CC1 ZINC000303282210 568264278 /nfs/dbraw/zinc/26/42/78/568264278.db2.gz UUJPIYJPQSBQQZ-QGZVFWFLSA-N 0 1 362.473 4.617 20 0 FJADMN C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000604358368 568267542 /nfs/dbraw/zinc/26/75/42/568267542.db2.gz YAFDNDFJBUGXTD-ZBFHGGJFSA-N 0 1 365.864 4.748 20 0 FJADMN Cc1cc(F)ccc1-c1ccc(CNCc2ccnc(N3CCCC3)c2)o1 ZINC000604414872 568279724 /nfs/dbraw/zinc/27/97/24/568279724.db2.gz JCQKTXCIAHYGAL-UHFFFAOYSA-N 0 1 365.452 4.679 20 0 FJADMN C[C@H](C(=O)Nc1cc(Cl)ccc1F)N1C[C@@H](c2ccccc2)C[C@H]1C ZINC000604392997 568283089 /nfs/dbraw/zinc/28/30/89/568283089.db2.gz QGDBBLCYUDPIPA-FMKPAKJESA-N 0 1 360.860 4.684 20 0 FJADMN CC[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1noc(Cc2ccccc2)n1 ZINC000525796759 568286071 /nfs/dbraw/zinc/28/60/71/568286071.db2.gz HUYRGWMFLAADSS-SFTDATJTSA-N 0 1 361.489 4.819 20 0 FJADMN Clc1ccc(OCc2nc(CN(CC3CC3)CC3CC3)cs2)cc1 ZINC000604395478 568295070 /nfs/dbraw/zinc/29/50/70/568295070.db2.gz CQEMIRACXMDSKK-UHFFFAOYSA-N 0 1 362.926 4.998 20 0 FJADMN Cc1ccc2nc([C@H]3CCCN(C(=O)CC4CCC(C)CC4)C3)[nH]c2c1 ZINC000604601467 568323551 /nfs/dbraw/zinc/32/35/51/568323551.db2.gz MPTVSVORLZLDSM-VJFUWPCTSA-N 0 1 353.510 4.794 20 0 FJADMN Cc1ccc(C(=O)CCC(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)cc1 ZINC000617133850 568351490 /nfs/dbraw/zinc/35/14/90/568351490.db2.gz FUXXZQRAFMAWAC-UHFFFAOYSA-N 0 1 373.412 4.733 20 0 FJADMN Cc1cc(C(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)c2ccccc2n1 ZINC000617133900 568351653 /nfs/dbraw/zinc/35/16/53/568351653.db2.gz LAPLPLOUWRRCFR-UHFFFAOYSA-N 0 1 368.396 4.932 20 0 FJADMN Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000617133912 568351671 /nfs/dbraw/zinc/35/16/71/568351671.db2.gz LRXNDNSRDCUXCY-UHFFFAOYSA-N 0 1 370.412 4.794 20 0 FJADMN C[C@@](CO)(NCc1ccc(Oc2ccccc2F)c(F)c1)c1ccccc1 ZINC000604765620 568361861 /nfs/dbraw/zinc/36/18/61/568361861.db2.gz ZISQYTKXANESMS-QFIPXVFZSA-N 0 1 369.411 4.754 20 0 FJADMN CCOc1ccc2nc(S[C@H](C)c3nnc(-c4ccccc4)o3)[nH]c2c1 ZINC000005165172 568380126 /nfs/dbraw/zinc/38/01/26/568380126.db2.gz APUIWTDPCDVORV-GFCCVEGCSA-N 0 1 366.446 4.865 20 0 FJADMN Fc1ccc(CCN(Cc2csc(-c3ccccn3)n2)C2CC2)cc1 ZINC000604903048 568385337 /nfs/dbraw/zinc/38/53/37/568385337.db2.gz DMWAJGYVFUPTIY-UHFFFAOYSA-N 0 1 353.466 4.551 20 0 FJADMN CC[C@H](C)N(Cc1ccccc1)C(=O)NC[C@H](c1ccco1)N(CC)CC ZINC000604916416 568389327 /nfs/dbraw/zinc/38/93/27/568389327.db2.gz JUBRNDWRSOFBNF-AZUAARDMSA-N 0 1 371.525 4.673 20 0 FJADMN CCOc1ccc2nc(SCC(=O)Nc3c(C)cc(C)cc3C)[nH]c2c1 ZINC000005691505 568389578 /nfs/dbraw/zinc/38/95/78/568389578.db2.gz JBURFGNJLSZJOR-UHFFFAOYSA-N 0 1 369.490 4.618 20 0 FJADMN COc1ccc(F)cc1[C@@H](C)N[C@@H]1CCc2c1cccc2Br ZINC000319743197 568414199 /nfs/dbraw/zinc/41/41/99/568414199.db2.gz RCDFUQDIIIBLJL-PIGZYNQJSA-N 0 1 364.258 4.935 20 0 FJADMN Cc1ccc(S(=O)(=O)Nc2cccc(Cl)c2C)c(Br)c1 ZINC000028196194 568525794 /nfs/dbraw/zinc/52/57/94/568525794.db2.gz YBGAYIHTPLKWDP-UHFFFAOYSA-N 0 1 374.687 4.520 20 0 FJADMN Cc1ccc2nc(CNCc3ccc(-c4c(F)cccc4F)o3)[nH]c2c1 ZINC000525802812 568573924 /nfs/dbraw/zinc/57/39/24/568573924.db2.gz AKQHBMXWWMBUBH-UHFFFAOYSA-N 0 1 353.372 4.699 20 0 FJADMN O=C(N[C@H](CN1CCCCC1)c1ccccc1)c1cc2cc(F)ccc2o1 ZINC000605125754 568579517 /nfs/dbraw/zinc/57/95/17/568579517.db2.gz PNYTUXFJXFJWIC-LJQANCHMSA-N 0 1 366.436 4.529 20 0 FJADMN FC(F)(F)[C@@H]1C[C@@H](C(F)(F)F)CN(CCSc2ccccc2)C1 ZINC000605150023 568587209 /nfs/dbraw/zinc/58/72/09/568587209.db2.gz FMPKVPKDEAMAEU-VXGBXAGGSA-N 0 1 357.363 4.841 20 0 FJADMN Brc1ccc2c(c1)C=C(CN[C@@H]1CSc3ccccc31)CO2 ZINC000605165874 568594053 /nfs/dbraw/zinc/59/40/53/568594053.db2.gz CSZCCXPVOZZFNJ-MRXNPFEDSA-N 0 1 374.303 4.662 20 0 FJADMN c1nc2ccccc2n1-c1ccc(CN[C@@H]2CSc3ccccc32)cc1 ZINC000605165932 568594400 /nfs/dbraw/zinc/59/44/00/568594400.db2.gz HIDCKLIMKSZLDE-HXUWFJFHSA-N 0 1 357.482 4.962 20 0 FJADMN Fc1ccc(-c2cc(CN3CCS[C@@H](c4ccccc4)C3)on2)cc1 ZINC000605154225 568598260 /nfs/dbraw/zinc/59/82/60/568598260.db2.gz LXFKZLKTAPZJAM-HXUWFJFHSA-N 0 1 354.450 4.771 20 0 FJADMN Cc1ccc(-c2cc(CN3CCS[C@H](c4ccccc4)C3)on2)cc1 ZINC000605156190 568601768 /nfs/dbraw/zinc/60/17/68/568601768.db2.gz MPOVFBUWAGHPNC-NRFANRHFSA-N 0 1 350.487 4.940 20 0 FJADMN O=C(c1ccc(F)cc1)[C@H]1CCCN(c2ccnc3cc(F)ccc32)C1 ZINC000606155862 568675937 /nfs/dbraw/zinc/67/59/37/568675937.db2.gz XDRKIQAWXAKYIT-HNNXBMFYSA-N 0 1 352.384 4.612 20 0 FJADMN CC[C@@H](Sc1nc(-c2ccc(Cl)cc2)n[nH]1)C(=O)c1ccccc1 ZINC000606151142 568687136 /nfs/dbraw/zinc/68/71/36/568687136.db2.gz FEUZYEOTDNZSKX-OAHLLOKOSA-N 0 1 357.866 4.879 20 0 FJADMN Cc1nnc([C@@H]2CC23CCN(Cc2ccc(Oc4ccccc4)o2)CC3)o1 ZINC000359995663 223143893 /nfs/dbraw/zinc/14/38/93/223143893.db2.gz DLYBYUUYKQMNQH-SFHVURJKSA-N 0 1 365.433 4.533 20 0 FJADMN CN(C)[C@@H](CNC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000071943394 221389001 /nfs/dbraw/zinc/38/90/01/221389001.db2.gz CYJXBJYEHFOREU-INIZCTEOSA-N 0 1 370.255 4.557 20 0 FJADMN O=C(N[C@H](c1ccccc1)c1ccc2nc[nH]c2c1)c1cc2ccccc2[nH]1 ZINC000097038238 222153892 /nfs/dbraw/zinc/15/38/92/222153892.db2.gz CDIOBXJCPQRSBZ-JOCHJYFZSA-N 0 1 366.424 4.564 20 0 FJADMN Brc1ccc(CN2CCC[C@H](c3cc4ccccc4[nH]3)C2)nc1 ZINC000601756634 567836569 /nfs/dbraw/zinc/83/65/69/567836569.db2.gz UNAWBLRWAOPOTA-HNNXBMFYSA-N 0 1 370.294 4.705 20 0 FJADMN Cc1ccc(-c2nc(CN3CC[C@@H](COCc4ccccc4)C3)co2)cc1 ZINC000075864401 567897482 /nfs/dbraw/zinc/89/74/82/567897482.db2.gz WLKATACGUCSQJC-HXUWFJFHSA-N 0 1 362.473 4.689 20 0 FJADMN CC[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1-c1nnc(C(C)C)[nH]1 ZINC000602106304 567928745 /nfs/dbraw/zinc/92/87/45/567928745.db2.gz YMKIGQXQJMFMHN-KRWDZBQOSA-N 0 1 362.477 4.803 20 0 FJADMN COc1ccc([C@@H](C)NCc2cc(F)cc(F)c2)cc1Br ZINC000221875703 567931658 /nfs/dbraw/zinc/93/16/58/567931658.db2.gz ZRUKYTCCYHSZJX-SNVBAGLBSA-N 0 1 356.210 4.587 20 0 FJADMN C[C@H](c1ccc(Br)cc1)N1CCCO[C@@H](c2ccccc2)C1 ZINC000602238745 567954897 /nfs/dbraw/zinc/95/48/97/567954897.db2.gz DCJVVJKARYNENJ-DNVCBOLYSA-N 0 1 360.295 4.974 20 0 FJADMN CC[C@H]1c2ccsc2CCN1C(=O)CN(CC)[C@@H](C)c1ccc(F)cc1 ZINC000521415322 567960643 /nfs/dbraw/zinc/96/06/43/567960643.db2.gz FJXVNJXOUOCSNU-KXBFYZLASA-N 0 1 374.525 4.806 20 0 FJADMN COc1ccc([C@@H](C)NCC(=O)Nc2ccc(C)cc2Cl)cc1Cl ZINC000602576749 567993228 /nfs/dbraw/zinc/99/32/28/567993228.db2.gz QFBXDZWVMJVYOU-GFCCVEGCSA-N 0 1 367.276 4.600 20 0 FJADMN COc1ccc(C)cc1NC(=O)CN1CCCCC[C@@H]1c1ccccc1 ZINC000521425759 568003564 /nfs/dbraw/zinc/00/35/64/568003564.db2.gz KUQSXVCSQAWBMS-HXUWFJFHSA-N 0 1 352.478 4.559 20 0 FJADMN COc1ccc(-c2nnc(CN3CCCCC[C@@H]3c3ccccc3)o2)cc1 ZINC000521425788 568003961 /nfs/dbraw/zinc/00/39/61/568003961.db2.gz MDTDXSWJAGVLFB-HXUWFJFHSA-N 0 1 363.461 4.863 20 0 FJADMN CC(C)c1nc(CCNCc2c(Cl)cccc2OC(F)F)cs1 ZINC000602909630 568010894 /nfs/dbraw/zinc/01/08/94/568010894.db2.gz FLDLXBUJNIGDJJ-UHFFFAOYSA-N 0 1 360.857 4.854 20 0 FJADMN Cc1c2cc(F)ccc2oc1CNCc1cc(Cl)c2c(c1)OCCO2 ZINC000522755449 568033779 /nfs/dbraw/zinc/03/37/79/568033779.db2.gz LGESQICYEVUYKF-UHFFFAOYSA-N 0 1 361.800 4.595 20 0 FJADMN Cc1cc(CNc2nc(C3CC3)nc3scc(-c4ccccc4)c32)n[nH]1 ZINC000603494801 568108131 /nfs/dbraw/zinc/10/81/31/568108131.db2.gz LVBREFZLMRLYJX-UHFFFAOYSA-N 0 1 361.474 4.879 20 0 FJADMN Cc1ccc(OCc2nc(CN[C@H](C)Cc3ccsc3)cs2)cc1 ZINC000603511938 568110736 /nfs/dbraw/zinc/11/07/36/568110736.db2.gz IPLUTCMESLKFMI-OAHLLOKOSA-N 0 1 358.532 4.813 20 0 FJADMN CC[C@H](NCc1csc(N(C(C)=O)c2ccc(F)cc2)n1)C(C)(C)C ZINC000603513329 568111093 /nfs/dbraw/zinc/11/10/93/568111093.db2.gz FAUWPRHXKDQACG-KRWDZBQOSA-N 0 1 363.502 4.881 20 0 FJADMN Cc1[nH]c2c(cc(C)cc2CNCc2cn3cc(Cl)ccc3n2)c1C ZINC000603513142 568111122 /nfs/dbraw/zinc/11/11/22/568111122.db2.gz LZUWCLPSRPWTQA-UHFFFAOYSA-N 0 1 352.869 4.684 20 0 FJADMN Cc1cc(CNC(=O)Nc2ccc(Sc3ccc(C)cc3C)cc2)n[nH]1 ZINC000603559834 568117362 /nfs/dbraw/zinc/11/73/62/568117362.db2.gz UWFUSUULZNIIRV-UHFFFAOYSA-N 0 1 366.490 4.808 20 0 FJADMN Cc1cc(CNC(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)n[nH]1 ZINC000603576138 568121242 /nfs/dbraw/zinc/12/12/42/568121242.db2.gz CMJFCCIVJHEDDK-UHFFFAOYSA-N 0 1 372.881 4.844 20 0 FJADMN Cc1ccc(-c2n[nH]c(NC(=O)c3sccc3-c3ccccc3)n2)cc1 ZINC000603628790 568127629 /nfs/dbraw/zinc/12/76/29/568127629.db2.gz UHHZBJOBPVZIOM-UHFFFAOYSA-N 0 1 360.442 4.761 20 0 FJADMN CCN(CC)Cc1ccc(C(=O)Nc2ccc(Oc3ccccn3)cc2)o1 ZINC000603668533 568132798 /nfs/dbraw/zinc/13/27/98/568132798.db2.gz LRWWRABABUDOHT-UHFFFAOYSA-N 0 1 365.433 4.561 20 0 FJADMN CCOc1ccc2nc(S[C@@H](C)C(=O)Nc3ccc(C)cc3C)[nH]c2c1 ZINC000007060116 568146876 /nfs/dbraw/zinc/14/68/76/568146876.db2.gz NSNAHAPALATHCN-AWEZNQCLSA-N 0 1 369.490 4.698 20 0 FJADMN C[C@H](C(=O)Nc1cccc(-c2nnc[nH]2)c1)c1c(Cl)cccc1Cl ZINC000603903045 568180400 /nfs/dbraw/zinc/18/04/00/568180400.db2.gz FRQMFLBQQUHWOV-JTQLQIEISA-N 0 1 361.232 4.521 20 0 FJADMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1sc2cc(F)ccc2c1Cl ZINC000603905172 568180833 /nfs/dbraw/zinc/18/08/33/568180833.db2.gz DALNALOOGZJZMK-UHFFFAOYSA-N 0 1 372.812 4.731 20 0 FJADMN FC(F)Oc1ccc(Cl)cc1CNC1(c2ccccc2)CCOCC1 ZINC000603937797 568184336 /nfs/dbraw/zinc/18/43/36/568184336.db2.gz CLCYSDZEOHEIDO-UHFFFAOYSA-N 0 1 367.823 4.737 20 0 FJADMN c1coc(-c2nc(CN3CCC[C@H](c4nc5ccccc5o4)C3)cs2)c1 ZINC000604041488 568203143 /nfs/dbraw/zinc/20/31/43/568203143.db2.gz RMYXVJOMZLAURY-AWEZNQCLSA-N 0 1 365.458 4.924 20 0 FJADMN COc1ccc([C@H]2CCCCC[N@H+]2CCc2ccccc2C(=O)[O-])cc1 ZINC000516657170 568210637 /nfs/dbraw/zinc/21/06/37/568210637.db2.gz VTYPEYYRNSZGJY-OAQYLSRUSA-N 0 1 353.462 4.553 20 0 FJADMN COc1ccc([C@H](Cc2ccccc2)NCc2ccc3c(n2)CCC3)cc1 ZINC000563118110 568223492 /nfs/dbraw/zinc/22/34/92/568223492.db2.gz XYMZJQLFNYWVLP-DEOSSOPVSA-N 0 1 358.485 4.653 20 0 FJADMN COc1cccc(Cl)c1C(=O)N1CCC[C@@H]1c1nc2ccc(C)cc2[nH]1 ZINC000607813332 568227140 /nfs/dbraw/zinc/22/71/40/568227140.db2.gz NKTZXLBEETZTPB-MRXNPFEDSA-N 0 1 369.852 4.511 20 0 FJADMN C[C@H](C(=O)Nc1cccc(CN2CCSCC2)c1)c1cccc(Cl)c1 ZINC000607813460 568227331 /nfs/dbraw/zinc/22/73/31/568227331.db2.gz YHGKXSIUOBSIOD-HNNXBMFYSA-N 0 1 374.937 4.631 20 0 FJADMN C[C@H](c1ccccc1)N(C)CC(=O)N(C)Cc1ccc(Cl)c(Cl)c1 ZINC000302737607 568236676 /nfs/dbraw/zinc/23/66/76/568236676.db2.gz KIAXCAZLVWYNPU-CQSZACIVSA-N 0 1 365.304 4.645 20 0 FJADMN O=C(Nc1cccc(Cl)c1O)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000604266481 568237267 /nfs/dbraw/zinc/23/72/67/568237267.db2.gz MWOAGGRWHBLLQV-NEPJUHHUSA-N 0 1 366.642 4.550 20 0 FJADMN C[C@@H](C(=O)Nc1ccccc1Cl)[N@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000303137033 568252921 /nfs/dbraw/zinc/25/29/21/568252921.db2.gz CZGKRHMBUBASOV-WMZOPIPTSA-N 0 1 356.897 4.937 20 0 FJADMN C[C@@H](C(=O)Nc1ccccc1Cl)N1CCC[C@H](c2ccccc2)CC1 ZINC000303137033 568252922 /nfs/dbraw/zinc/25/29/22/568252922.db2.gz CZGKRHMBUBASOV-WMZOPIPTSA-N 0 1 356.897 4.937 20 0 FJADMN CCN(CC)[C@@H](CNC(=O)c1sccc1C)c1ccccc1Cl ZINC000022681720 568269865 /nfs/dbraw/zinc/26/98/65/568269865.db2.gz LYQVARIKFPVNMQ-INIZCTEOSA-N 0 1 350.915 4.523 20 0 FJADMN Cc1c2ccccc2oc1CNCc1cnn(-c2ccc(Cl)cc2)c1 ZINC000604416786 568275017 /nfs/dbraw/zinc/27/50/17/568275017.db2.gz GSUCXMJZIHMVFN-UHFFFAOYSA-N 0 1 351.837 4.870 20 0 FJADMN Cc1cccc(C(C)C)c1NC(=O)CN1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000604393205 568283283 /nfs/dbraw/zinc/28/32/83/568283283.db2.gz UVIYMFSPBAUCKW-ICSRJNTNSA-N 0 1 350.506 4.935 20 0 FJADMN CCc1cccc(CC)c1NC(=O)CN1C[C@H](c2ccccc2)C[C@@H]1C ZINC000604394096 568284072 /nfs/dbraw/zinc/28/40/72/568284072.db2.gz AQNQTKMWEJOQKV-LAUBAEHRSA-N 0 1 350.506 4.628 20 0 FJADMN CCc1ccc(CCN2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 ZINC000604383735 568287524 /nfs/dbraw/zinc/28/75/24/568287524.db2.gz HFJKCWDNGQSCTH-GASCZTMLSA-N 0 1 353.350 4.854 20 0 FJADMN COC(=O)c1cc(CSc2nc3ccc(C(F)(F)F)cc3[nH]2)c(C)o1 ZINC000604511094 568306256 /nfs/dbraw/zinc/30/62/56/568306256.db2.gz UXGXQTSROJDWAW-UHFFFAOYSA-N 0 1 370.352 4.562 20 0 FJADMN COc1cccc2cc(C(=O)Nc3ccc4nc(-c5ccco5)[nH]c4c3)oc21 ZINC000617134648 568347957 /nfs/dbraw/zinc/34/79/57/568347957.db2.gz BXBRDAFRQRPQTJ-UHFFFAOYSA-N 0 1 373.368 4.830 20 0 FJADMN O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)[C@@H]1C[C@@H]1c1c(F)cccc1F ZINC000604745675 568356207 /nfs/dbraw/zinc/35/62/07/568356207.db2.gz OBFYTFFZGYYQCC-UONOGXRCSA-N 0 1 367.399 4.851 20 0 FJADMN CC(C)c1ccc(CN[C@](C)(CO)c2cccc(C(F)(F)F)c2)cc1 ZINC000604767461 568362337 /nfs/dbraw/zinc/36/23/37/568362337.db2.gz LGWGOEDJSZIMDJ-LJQANCHMSA-N 0 1 351.412 4.826 20 0 FJADMN OC[C@@H](NCc1ccc(Oc2cc(F)cc(F)c2)cc1)c1cccc(F)c1 ZINC000604768438 568362573 /nfs/dbraw/zinc/36/25/73/568362573.db2.gz BQOPYLCQJLJOFY-OAQYLSRUSA-N 0 1 373.374 4.719 20 0 FJADMN Cc1ccc(CCNCc2csc(COc3ccc(C)cc3)n2)cc1 ZINC000604768441 568362604 /nfs/dbraw/zinc/36/26/04/568362604.db2.gz CAVDQVGOIJYQQJ-UHFFFAOYSA-N 0 1 352.503 4.671 20 0 FJADMN Cc1cc2c[nH]nc2c(C(=O)N(CCc2ccc(Cl)cc2)CC2CC2)c1 ZINC000604877951 568383219 /nfs/dbraw/zinc/38/32/19/568383219.db2.gz OGEKSQYRQWOFEU-UHFFFAOYSA-N 0 1 367.880 4.620 20 0 FJADMN CCN(CC(=O)Nc1ccccc1C(F)(F)F)C[C@@H](C)c1ccccc1 ZINC000604884126 568384417 /nfs/dbraw/zinc/38/44/17/568384417.db2.gz XPYNFSBGSQHBCF-OAHLLOKOSA-N 0 1 364.411 4.770 20 0 FJADMN Cc1ccc(-c2nnc([C@@H](C)Sc3nc(-c4ccccc4)n[nH]3)o2)cc1 ZINC000007149439 568466491 /nfs/dbraw/zinc/46/64/91/568466491.db2.gz MVPYQDCPFALKEK-CYBMUJFWSA-N 0 1 363.446 4.683 20 0 FJADMN Cc1ccc(-c2nnc([C@H](C)Sc3nc(-c4ccccc4)n[nH]3)o2)cc1 ZINC000007149444 568466577 /nfs/dbraw/zinc/46/65/77/568466577.db2.gz MVPYQDCPFALKEK-ZDUSSCGKSA-N 0 1 363.446 4.683 20 0 FJADMN O=C(Nc1nc(C=Cc2ccccc2)cs1)c1cc(-c2ccco2)n[nH]1 ZINC000604990224 568509332 /nfs/dbraw/zinc/50/93/32/568509332.db2.gz JBVQKAJCFGUKGQ-HJWRWDBZSA-N 0 1 362.414 4.549 20 0 FJADMN CC(C)[C@@H]1CCCCN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000605000329 568513868 /nfs/dbraw/zinc/51/38/68/568513868.db2.gz JBDRWWSBHNLPJG-LBPRGKRZSA-N 0 1 370.316 4.571 20 0 FJADMN CC(C)Oc1cccc(CN2CCC(C(=O)c3cc(F)ccc3F)CC2)c1 ZINC000051857549 568520601 /nfs/dbraw/zinc/52/06/01/568520601.db2.gz ATYLOCBKRMEFIJ-UHFFFAOYSA-N 0 1 373.443 4.847 20 0 FJADMN Cc1[nH]ncc1CCCNC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000605043916 568537659 /nfs/dbraw/zinc/53/76/59/568537659.db2.gz FFMCGBXNANGQAT-IBGZPJMESA-N 0 1 374.916 4.631 20 0 FJADMN O=C(C[C@H]1CCOc2ccccc21)Nc1ccc2nc(-c3ccco3)[nH]c2c1 ZINC000605122911 568578622 /nfs/dbraw/zinc/57/86/22/568578622.db2.gz TWRVVGVRNSXTPP-CQSZACIVSA-N 0 1 373.412 4.718 20 0 FJADMN FC(F)(F)[C@@H]1C[C@H](C(F)(F)F)CN(CCSc2ccccc2)C1 ZINC000605150022 568587227 /nfs/dbraw/zinc/58/72/27/568587227.db2.gz FMPKVPKDEAMAEU-TXEJJXNPSA-N 0 1 357.363 4.841 20 0 FJADMN COc1cc(CN2CCS[C@H](c3ccccc3)C2)ccc1OC(F)F ZINC000605187588 568615002 /nfs/dbraw/zinc/61/50/02/568615002.db2.gz FXVYVKQHKYMZHO-SFHVURJKSA-N 0 1 365.445 4.587 20 0 FJADMN CC[C@H](CC(=O)NC[C@@H](c1ccco1)N1CCCCC1)c1ccc(C)cc1 ZINC000606161081 568679910 /nfs/dbraw/zinc/67/99/10/568679910.db2.gz CNRJTYOAJRDPEY-CTNGQTDRSA-N 0 1 368.521 4.815 20 0 FJADMN CCN(CC)[C@@H](CNC(=O)[C@@H](C)c1cccs1)c1ccccc1Cl ZINC000606162318 568681007 /nfs/dbraw/zinc/68/10/07/568681007.db2.gz YYMIFMRIPAWDBB-YOEHRIQHSA-N 0 1 364.942 4.704 20 0 FJADMN CC[C@@H](Sc1nc(C=Cc2ccc(C)o2)n[nH]1)C(=O)c1ccccc1 ZINC000606152454 568688670 /nfs/dbraw/zinc/68/86/70/568688670.db2.gz IAORTWWGCXNZCQ-YUQCYMQKSA-N 0 1 353.447 4.630 20 0 FJADMN