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)c1cccc(C(C)C)c1NC(=O)CSc1nc2ccccc2o1 ZINC000000578252 219305365 /nfs/dbraw/zinc/30/53/65/219305365.db2.gz IDOAYRMZCOCFKB-UHFFFAOYSA-N 0 0 368.502 5.805 40 0 FKABRN O=C(C[C@H](c1ccccc1)[C@H]1CCCC1=O)c1ccc(Br)cc1 ZINC000000639164 570442319 /nfs/dbraw/zinc/44/23/19/570442319.db2.gz KMLJRYCKWBCLJW-QZTJIDSGSA-N 0 0 371.274 5.175 40 0 FKABRN O=C(C[C@@H](c1ccccc1)[C@H]1CCCC1=O)c1ccc(Br)cc1 ZINC000000639167 210254427 /nfs/dbraw/zinc/25/44/27/210254427.db2.gz KMLJRYCKWBCLJW-MSOLQXFVSA-N 0 0 371.274 5.175 40 0 FKABRN O=C(C[C@H](c1ccccc1)[C@@H]1CCCC1=O)c1ccc(Br)cc1 ZINC000000639169 210254887 /nfs/dbraw/zinc/25/48/87/210254887.db2.gz KMLJRYCKWBCLJW-ZWKOTPCHSA-N 0 0 371.274 5.175 40 0 FKABRN O=C(C[C@@H](c1ccccc1)[C@@H]1CCCC1=O)c1ccc(Br)cc1 ZINC000000639173 570442331 /nfs/dbraw/zinc/44/23/31/570442331.db2.gz KMLJRYCKWBCLJW-ROUUACIJSA-N 0 0 371.274 5.175 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(C(=O)Oc3ccc(Cl)cc3)cc2)cc1 ZINC000000639406 219307840 /nfs/dbraw/zinc/30/78/40/219307840.db2.gz YWBJQDIGSUKYRP-UHFFFAOYSA-N 0 0 365.816 5.120 40 0 FKABRN CCCC(=O)Oc1cc2ccccc2cc1C(=O)Nc1ccc(C)cc1C ZINC000000643191 570443028 /nfs/dbraw/zinc/44/30/28/570443028.db2.gz OSBXUQZQTBGULF-UHFFFAOYSA-N 0 0 361.441 5.414 40 0 FKABRN O=C(c1ccccc1)[C@@H](Sc1cccc2cccnc21)c1ccccc1 ZINC000000644996 570443337 /nfs/dbraw/zinc/44/33/37/570443337.db2.gz WXWVWLKCEREGRF-QHCPKHFHSA-N 0 0 355.462 5.951 40 0 FKABRN O=C(c1ccccc1)[C@H](Sc1cccc2cccnc21)c1ccccc1 ZINC000000644998 210256227 /nfs/dbraw/zinc/25/62/27/210256227.db2.gz WXWVWLKCEREGRF-HSZRJFAPSA-N 0 0 355.462 5.951 40 0 FKABRN O=C1c2ccccc2N[C@H](c2cccc3cccnc32)N1c1ccc(F)cc1 ZINC000000669325 527134244 /nfs/dbraw/zinc/13/42/44/527134244.db2.gz WLLYSAISAFWUFF-QFIPXVFZSA-N 0 0 369.399 5.145 40 0 FKABRN O=C1c2ccccc2N[C@@H](c2cccc3cccnc32)N1c1ccc(F)cc1 ZINC000000669326 527134208 /nfs/dbraw/zinc/13/42/08/527134208.db2.gz WLLYSAISAFWUFF-JOCHJYFZSA-N 0 0 369.399 5.145 40 0 FKABRN O=C(Nc1ccc(-c2nc3ncccc3o2)cc1)c1cccc2ccccc21 ZINC000000677022 263141787 /nfs/dbraw/zinc/14/17/87/263141787.db2.gz KIUBWQBRPJOYTI-UHFFFAOYSA-N 0 0 365.392 5.295 40 0 FKABRN Cc1ccc(-c2cc(NC(=O)Nc3ccccc3)n(-c3ccccc3)n2)cc1 ZINC000000704318 209374050 /nfs/dbraw/zinc/37/40/50/209374050.db2.gz ZLZJUYZFODBLCG-UHFFFAOYSA-N 0 0 368.440 5.492 40 0 FKABRN Cc1nc2cc(C)ccn2c1-c1csc(Nc2ccc(Cl)cc2)n1 ZINC000000709328 219315546 /nfs/dbraw/zinc/31/55/46/219315546.db2.gz NNTJBMUMIPXVOA-UHFFFAOYSA-N 0 0 354.866 5.472 40 0 FKABRN Fc1ccc(Nc2ncnc3c2cnn3-c2ccc(Cl)cc2)cc1Cl ZINC000000756740 203948098 /nfs/dbraw/zinc/94/80/98/203948098.db2.gz PZWOXHBIQACGII-UHFFFAOYSA-N 0 0 374.206 5.005 40 0 FKABRN Cc1cc(C)c(NC(=O)[C@H](C)Sc2cccc3ccc(C)nc32)c(C)c1 ZINC000000784039 209375865 /nfs/dbraw/zinc/37/58/65/209375865.db2.gz CJUMOVUDKDXADY-KRWDZBQOSA-N 0 0 364.514 5.588 40 0 FKABRN Cc1cc(C)c(NC(=O)[C@@H](C)Sc2cccc3ccc(C)nc32)c(C)c1 ZINC000000784040 219320963 /nfs/dbraw/zinc/32/09/63/219320963.db2.gz CJUMOVUDKDXADY-QGZVFWFLSA-N 0 0 364.514 5.588 40 0 FKABRN Cc1sc2nc(C)nc(SCC(=O)c3ccc(Cl)cc3)c2c1C ZINC000000784670 206132831 /nfs/dbraw/zinc/13/28/31/206132831.db2.gz ASUCWPPWZGYXAU-UHFFFAOYSA-N 0 0 362.907 5.245 40 0 FKABRN Cc1c2ccccc2oc1C(=O)Nc1ccccc1C(=O)c1ccccc1 ZINC000000786049 209375265 /nfs/dbraw/zinc/37/52/65/209375265.db2.gz UGJFXQYACRRYNE-UHFFFAOYSA-N 0 0 355.393 5.225 40 0 FKABRN Cc1cc(OCc2nnc(SC(C)C)n2-c2ccccc2)ccc1Cl ZINC000000793887 206134237 /nfs/dbraw/zinc/13/42/37/206134237.db2.gz RGAXOYRADSUUQZ-UHFFFAOYSA-N 0 0 373.909 5.309 40 0 FKABRN Cc1ccc2oc(-c3ccc(NC(=O)c4cccc(C)c4)c(C)c3)nc2c1 ZINC000000793914 219321442 /nfs/dbraw/zinc/32/14/42/219321442.db2.gz IAYZOGBSNDMMDR-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(Br)cc1 ZINC000000797278 219322798 /nfs/dbraw/zinc/32/27/98/219322798.db2.gz ZMZJRWCBIOIMHX-UHFFFAOYSA-N 0 0 368.230 5.494 40 0 FKABRN O=Cc1ccc(Oc2cc(-c3ccccc3)nc(-c3ccccc3)n2)cc1 ZINC000000797401 206133517 /nfs/dbraw/zinc/13/35/17/206133517.db2.gz LIFZPHDRVIMFLU-UHFFFAOYSA-N 0 0 352.393 5.415 40 0 FKABRN CCOc1ccc2nc(S[C@@H](C)C(=O)Nc3ccccc3)c(C)cc2c1 ZINC000000801492 206134911 /nfs/dbraw/zinc/13/49/11/206134911.db2.gz GDCOBWQZBPWMEH-HNNXBMFYSA-N 0 0 366.486 5.061 40 0 FKABRN CCOc1ccc2nc(S[C@H](C)C(=O)Nc3ccccc3)c(C)cc2c1 ZINC000000801493 209377274 /nfs/dbraw/zinc/37/72/74/209377274.db2.gz GDCOBWQZBPWMEH-OAHLLOKOSA-N 0 0 366.486 5.061 40 0 FKABRN Cc1cc2nc(-c3ccc(C)c(NC(=O)c4ccccc4C)c3)oc2c(C)c1 ZINC000000805978 206134533 /nfs/dbraw/zinc/13/45/33/206134533.db2.gz PZYYSOGUKJYEMS-UHFFFAOYSA-N 0 0 370.452 5.981 40 0 FKABRN CCOc1ccc2nc(NC(=O)c3ccc(Cl)cc3Cl)sc2c1 ZINC000000809229 570457425 /nfs/dbraw/zinc/45/74/25/570457425.db2.gz HFNHOHBQIJMYGV-UHFFFAOYSA-N 0 0 367.257 5.254 40 0 FKABRN Cc1cccc(C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)c1 ZINC000000816689 219325626 /nfs/dbraw/zinc/32/56/26/219325626.db2.gz UGELPQPGAVMFIN-UHFFFAOYSA-N 0 0 358.157 5.029 40 0 FKABRN Cc1ccc(-c2nc(OCc3ccccc3)nc(-c3ccc(C)cc3)n2)cc1 ZINC000000816809 219325664 /nfs/dbraw/zinc/32/56/64/219325664.db2.gz FJXQKXMIOILHNG-UHFFFAOYSA-N 0 0 367.452 5.401 40 0 FKABRN O=C1c2c(c(Cl)c(Cl)c(Cl)c2Cl)-c2nc3ccccc3n21 ZINC000000819846 219326249 /nfs/dbraw/zinc/32/62/49/219326249.db2.gz NAEMQHRBHSRZLO-UHFFFAOYSA-N 0 0 358.011 5.319 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc1 ZINC000000820602 570762510 /nfs/dbraw/zinc/76/25/10/570762510.db2.gz LXKHQAWZEQQLJN-UHFFFAOYSA-N 0 0 364.832 5.153 40 0 FKABRN COc1ccccc1-c1nc2cc(NC(=O)c3ccc(C)cc3)ccc2o1 ZINC000000821770 570458669 /nfs/dbraw/zinc/45/86/69/570458669.db2.gz RRQFPGJVPCOXHG-UHFFFAOYSA-N 0 0 358.397 5.064 40 0 FKABRN O=C(Nc1cc(Cl)cc(Cl)c1)c1sc2ccccc2c1Cl ZINC000000823064 219326751 /nfs/dbraw/zinc/32/67/51/219326751.db2.gz ONPPJTCUOCSWQW-UHFFFAOYSA-N 0 0 356.661 6.114 40 0 FKABRN Cc1ccc2nc(-c3ccc(C)c(NC(=O)c4ccccc4C)c3)oc2c1 ZINC000000824706 210276866 /nfs/dbraw/zinc/27/68/66/210276866.db2.gz PNSCMKJLQUBHLG-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN O=C1c2cc(Cl)c(Cl)cc2C(=O)N1c1ccc(Cl)cc1Cl ZINC000000824812 219326930 /nfs/dbraw/zinc/32/69/30/219326930.db2.gz DGWMQWUXZCACQX-UHFFFAOYSA-N 0 0 361.011 5.101 40 0 FKABRN O=C(Nc1cccc(Cl)c1)[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000000825291 206134828 /nfs/dbraw/zinc/13/48/28/206134828.db2.gz BEBOOZPBGCKVKJ-ATKRNPRHSA-N 0 0 359.856 5.576 40 0 FKABRN O=C(Nc1cccc(Cl)c1)[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000000825292 209376888 /nfs/dbraw/zinc/37/68/88/209376888.db2.gz BEBOOZPBGCKVKJ-ORFBVSJDSA-N 0 0 359.856 5.576 40 0 FKABRN C[C@@]1(C(=O)Nc2cccc(Cl)c2)CC2c3ccccc3C1c1ccccc12 ZINC000000825297 206133919 /nfs/dbraw/zinc/13/39/19/206133919.db2.gz XCDBQXXGCSUWRQ-UBVWURDFSA-N 0 0 373.883 5.966 40 0 FKABRN C[C@]1(C(=O)Nc2cccc(Cl)c2)CC2c3ccccc3C1c1ccccc12 ZINC000000825298 219326829 /nfs/dbraw/zinc/32/68/29/219326829.db2.gz XCDBQXXGCSUWRQ-IWAAJCSBSA-N 0 0 373.883 5.966 40 0 FKABRN COc1ccc2ccc3c(c2c1)N=C[C@@]1(O3)N(C)c2ccccc2C1(C)C ZINC000000825621 219327122 /nfs/dbraw/zinc/32/71/22/219327122.db2.gz GPNTUDAYHULMHB-QHCPKHFHSA-N 0 0 358.441 5.067 40 0 aggregator FKABRN Cc1cccc(C(=O)Nc2cccc(-c3nc4cc(C)cc(C)c4o3)c2)c1 ZINC000000826431 219327726 /nfs/dbraw/zinc/32/77/26/219327726.db2.gz HVNDLTVQISDDKD-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN Cc1ccc(C(=O)Nc2cccc(-c3nc4cc(C)cc(C)c4o3)c2)cc1 ZINC000000826432 219327997 /nfs/dbraw/zinc/32/79/97/219327997.db2.gz GLSRZWSWYWWZEV-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN O=C(Nc1nc(-c2ccc3c(c2)Cc2ccccc2-3)cs1)c1ccccc1 ZINC000000826953 206134437 /nfs/dbraw/zinc/13/44/37/206134437.db2.gz JDTDDIGNQWTQCT-UHFFFAOYSA-N 0 0 368.461 5.634 40 0 FKABRN COc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1OC ZINC000000827350 219328220 /nfs/dbraw/zinc/32/82/20/219328220.db2.gz UVJOJMPBILPOEC-UHFFFAOYSA-N 0 0 356.425 5.428 40 0 FKABRN CCOc1cccc(C(=O)Nc2cccc(-c3nc4ccccc4s3)c2)c1 ZINC000000828048 206133818 /nfs/dbraw/zinc/13/38/18/206133818.db2.gz HVGZDGMUDSFDHE-UHFFFAOYSA-N 0 0 374.465 5.614 40 0 FKABRN CCOc1cccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)c1 ZINC000000828050 206134800 /nfs/dbraw/zinc/13/48/00/206134800.db2.gz OPFNNHMMADVHKR-UHFFFAOYSA-N 0 0 374.465 5.614 40 0 FKABRN CCOc1ccc(Nc2cc(Nc3ccc(OCC)cc3)nc(C)n2)cc1 ZINC000000829578 219328058 /nfs/dbraw/zinc/32/80/58/219328058.db2.gz CUIXBGJRZXMYML-UHFFFAOYSA-N 0 0 364.449 5.070 40 0 FKABRN O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1cccc(Br)c1 ZINC000000830127 219327905 /nfs/dbraw/zinc/32/79/05/219327905.db2.gz PMPLUDGTZNXSRC-UHFFFAOYSA-N 0 0 364.242 5.273 40 0 FKABRN O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc(Br)cc1 ZINC000000830128 219328200 /nfs/dbraw/zinc/32/82/00/219328200.db2.gz FANKYPZBNYUMBG-UHFFFAOYSA-N 0 0 364.242 5.273 40 0 FKABRN O=C(Nc1cc(Cl)c(Cl)cc1Cl)c1ccc(Br)o1 ZINC000000830167 219327871 /nfs/dbraw/zinc/32/78/71/219327871.db2.gz OYWACAPWSDQNEZ-UHFFFAOYSA-N 0 0 369.429 5.255 40 0 FKABRN Cc1ccccc1N(Cc1cccs1)C(=O)Nc1ccc2ccccc2c1 ZINC000000831620 570459394 /nfs/dbraw/zinc/45/93/94/570459394.db2.gz AHHVPOIRHVVMPJ-UHFFFAOYSA-N 0 0 372.493 6.448 40 0 FKABRN Cc1ccc(NC(=O)c2cccc3c(Br)cccc23)cc1C ZINC000000834913 219329117 /nfs/dbraw/zinc/32/91/17/219329117.db2.gz AZBPLVZISOOTRK-UHFFFAOYSA-N 0 0 354.247 5.471 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2cccc3c(Br)cccc23)c1 ZINC000000834915 209378052 /nfs/dbraw/zinc/37/80/52/209378052.db2.gz LTSQYCCWQZZGCR-UHFFFAOYSA-N 0 0 354.247 5.471 40 0 FKABRN O=C(Nc1cccc(Cl)c1)c1cccc2c(Br)cccc12 ZINC000000834919 206134192 /nfs/dbraw/zinc/13/41/92/206134192.db2.gz HGKWMDOYMRHQQN-UHFFFAOYSA-N 0 0 360.638 5.508 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1cccc2c(Br)cccc12 ZINC000000834921 206135367 /nfs/dbraw/zinc/13/53/67/206135367.db2.gz JQNBSAHEEWUNGR-UHFFFAOYSA-N 0 0 360.638 5.508 40 0 FKABRN C[C@@H]1C[C@](C)(C(=O)NCc2ccco2)[C@@H](c2ccccc2)c2ccccc21 ZINC000000840249 206225051 /nfs/dbraw/zinc/22/50/51/206225051.db2.gz ALRCIZCYZVAYTB-UWSIMGETSA-N 0 0 359.469 5.241 40 0 FKABRN Cc1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)cc1Cl ZINC000000840437 219328875 /nfs/dbraw/zinc/32/88/75/219328875.db2.gz RQPVSYFWOZTCFE-SNVBAGLBSA-N 0 0 358.652 5.361 40 0 FKABRN Cc1ccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)cc1Cl ZINC000000840439 219328830 /nfs/dbraw/zinc/32/88/30/219328830.db2.gz RQPVSYFWOZTCFE-JTQLQIEISA-N 0 0 358.652 5.361 40 0 FKABRN COc1cccc(NC(=O)[C@@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C)c1 ZINC000000840470 209376883 /nfs/dbraw/zinc/37/68/83/209376883.db2.gz HIORUUZRQAWFBA-JDKMENPHSA-N 0 0 369.464 5.177 40 0 FKABRN COc1cccc(NC(=O)[C@@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C)c1 ZINC000000840471 219328918 /nfs/dbraw/zinc/32/89/18/219328918.db2.gz HIORUUZRQAWFBA-JUIQIXIKSA-N 0 0 369.464 5.177 40 0 FKABRN COc1cccc(NC(=O)[C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C)c1 ZINC000000840472 206136750 /nfs/dbraw/zinc/13/67/50/206136750.db2.gz HIORUUZRQAWFBA-LWCKNFILSA-N 0 0 369.464 5.177 40 0 FKABRN COc1cccc(NC(=O)[C@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C)c1 ZINC000000840473 219328821 /nfs/dbraw/zinc/32/88/21/219328821.db2.gz HIORUUZRQAWFBA-MABQZBNFSA-N 0 0 369.464 5.177 40 0 FKABRN O=C(Nc1nc(-c2ccccc2)c(-c2ccccc2)s1)c1ccccc1 ZINC000000840604 219328921 /nfs/dbraw/zinc/32/89/21/219328921.db2.gz JQHAHDXKCUBZBX-UHFFFAOYSA-N 0 0 356.450 5.729 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000000840790 206135382 /nfs/dbraw/zinc/13/53/82/206135382.db2.gz CODCKVRNAUWJIH-VIFPVBQESA-N 0 0 360.693 5.766 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000000840792 219329135 /nfs/dbraw/zinc/32/91/35/219329135.db2.gz CODCKVRNAUWJIH-SECBINFHSA-N 0 0 360.693 5.766 40 0 FKABRN CC1(C)OC(=O)N(c2ccccc2)[C@@]12C=Cc1c(ccc3ccccc31)O2 ZINC000000841156 219328657 /nfs/dbraw/zinc/32/86/57/219328657.db2.gz MXXBBRWOXKNIBO-HSZRJFAPSA-N 0 0 357.409 5.377 40 0 aggregator FKABRN CC1(C)OC(=O)N(c2ccccc2)[C@]12C=Cc1c(ccc3ccccc31)O2 ZINC000000841158 209377959 /nfs/dbraw/zinc/37/79/59/209377959.db2.gz MXXBBRWOXKNIBO-QHCPKHFHSA-N 0 0 357.409 5.377 40 0 aggregator FKABRN Cc1ccc2nc(-c3ccc(C)c(NC(=O)/C=C/c4ccco4)c3)oc2c1 ZINC000000843714 219329777 /nfs/dbraw/zinc/32/97/77/219329777.db2.gz JHQBFBPNVMEGDU-CSKARUKUSA-N 0 0 358.397 5.357 40 0 FKABRN CCc1ccc2oc(-c3cccc(NC(=O)/C=C/c4ccco4)c3)nc2c1 ZINC000000843727 219329769 /nfs/dbraw/zinc/32/97/69/219329769.db2.gz UHEFTSAZVROTOA-PKNBQFBNSA-N 0 0 358.397 5.302 40 0 FKABRN COc1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccc(F)cc3)[nH]2)cc1 ZINC000000844118 219330239 /nfs/dbraw/zinc/33/02/39/219330239.db2.gz CXGMKIXPRAIOPJ-UHFFFAOYSA-N 0 0 362.379 5.698 40 0 FKABRN COC(=O)c1ccc(Nc2nc3ccc(C)cc3c(-c3ccccc3)n2)cc1 ZINC000000844718 206136429 /nfs/dbraw/zinc/13/64/29/206136429.db2.gz HTEINQVEMPNTAK-UHFFFAOYSA-N 0 0 369.424 5.135 40 0 FKABRN Cc1ccccc1NC(=O)Nc1cccc(NC(=O)Nc2ccccc2C)c1 ZINC000000844837 210279165 /nfs/dbraw/zinc/27/91/65/210279165.db2.gz QPRZJIMXMVWCAO-UHFFFAOYSA-N 0 0 374.444 5.591 40 0 FKABRN COC(=O)c1ccc(Nc2nc(-c3cc(C)ccc3C)c(C)s2)cc1 ZINC000000845834 219330044 /nfs/dbraw/zinc/33/00/44/219330044.db2.gz PDIFUFMPIVHMAY-UHFFFAOYSA-N 0 0 352.459 5.266 40 0 FKABRN CCCc1sc(Nc2ccc(C(=O)OC)cc2)nc1-c1ccccc1 ZINC000000845836 206136548 /nfs/dbraw/zinc/13/65/48/206136548.db2.gz WIUMYBQBAJVRLN-UHFFFAOYSA-N 0 0 352.459 5.293 40 0 FKABRN CCCc1sc(Nc2ccc(C(=O)OC)cc2)nc1-c1ccc(F)cc1 ZINC000000845838 206135338 /nfs/dbraw/zinc/13/53/38/206135338.db2.gz JFTBYFGJFGNOQB-UHFFFAOYSA-N 0 0 370.449 5.432 40 0 FKABRN O=C(Nc1ccc(Cl)c(-c2nc3ccccc3[nH]2)c1)c1cccc(F)c1 ZINC000000848911 219331347 /nfs/dbraw/zinc/33/13/47/219331347.db2.gz ZIQZZBPQHBJFLR-UHFFFAOYSA-N 0 0 365.795 5.275 40 0 FKABRN Cc1ccc(-c2nc3cc(C)c(C)cc3o2)cc1NC(=O)c1cccnc1 ZINC000000848954 209378450 /nfs/dbraw/zinc/37/84/50/209378450.db2.gz MDLYGJQWNHKXAY-UHFFFAOYSA-N 0 0 357.413 5.067 40 0 FKABRN O=C(Nc1ccc2oc(-c3ccc4ccccc4c3)nc2c1)c1cccnc1 ZINC000000848969 206135595 /nfs/dbraw/zinc/13/55/95/206135595.db2.gz PCHKXRKYTYTKKE-UHFFFAOYSA-N 0 0 365.392 5.295 40 0 FKABRN CC(C)Oc1cccc(C(=O)Nc2cccc(-c3nc4ccccc4o3)c2)c1 ZINC000000849002 219330908 /nfs/dbraw/zinc/33/09/08/219330908.db2.gz MGFXYIRDYGJOPB-UHFFFAOYSA-N 0 0 372.424 5.534 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2cccc(-c3nc4ccccc4o3)c2)cc1 ZINC000000849049 219330918 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350.643 5.023 40 0 FKABRN COc1cc(Cl)c(C)cc1NC(=O)/C=C/c1c(Cl)cccc1Cl ZINC000000957081 210074392 /nfs/dbraw/zinc/07/43/92/210074392.db2.gz UPNOGHNPCNXCFR-VOTSOKGWSA-N 0 0 370.663 5.616 40 0 FKABRN COc1ccc(NC(=O)/C=C/c2c(Cl)cccc2Cl)cc1Cl ZINC000000957083 571140358 /nfs/dbraw/zinc/14/03/58/571140358.db2.gz WIOWMEDZUAXQCJ-SOFGYWHQSA-N 0 0 356.636 5.307 40 0 FKABRN Cc1cccc(C)c1OCC(=O)Nc1nc(-c2ccc(Cl)cc2)cs1 ZINC000000959318 571063926 /nfs/dbraw/zinc/06/39/26/571063926.db2.gz ISEOZSUKPBLEEM-UHFFFAOYSA-N 0 0 372.877 5.098 40 0 FKABRN Cc1sc(NC(=O)COc2c(C)ccc(C)c2C)nc1-c1ccccc1 ZINC000000959347 219348005 /nfs/dbraw/zinc/34/80/05/219348005.db2.gz WJANEYGAGWNPPX-UHFFFAOYSA-N 0 0 366.486 5.061 40 0 FKABRN Cc1ccc(NC(=O)CCCc2c3ccccc3[nH]c2-c2ccccn2)cc1 ZINC000001020509 570471746 /nfs/dbraw/zinc/47/17/46/570471746.db2.gz MVXMZMCBAWUUQE-UHFFFAOYSA-N 0 0 369.468 5.500 40 0 FKABRN O=C(CNc1ccc(Cc2ccncc2)cc1)c1cccc2ccccc21 ZINC000001049855 570641868 /nfs/dbraw/zinc/64/18/68/570641868.db2.gz YBCXAUKFBHEUKM-UHFFFAOYSA-N 0 0 352.437 5.120 40 0 FKABRN CCOC(=O)c1c(C)c(C)sc1NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000001053021 219359189 /nfs/dbraw/zinc/35/91/89/219359189.db2.gz JWYNRLYNYAJVTD-UHFFFAOYSA-N 0 0 372.273 5.101 40 0 FKABRN O=C(Nc1nnc(C2CCCCC2)s1)c1ccc(Cl)c(Cl)c1 ZINC000001059842 219361796 /nfs/dbraw/zinc/36/17/96/219361796.db2.gz VNRBUXGYROVZTH-UHFFFAOYSA-N 0 0 356.278 5.145 40 0 FKABRN O[C@H](c1oc2ccccc2c1-c1cnn(-c2ccccc2)c1)c1ccccc1 ZINC000001081968 219366924 /nfs/dbraw/zinc/36/69/24/219366924.db2.gz NBDOSILRDJUOQH-QHCPKHFHSA-N 0 0 366.420 5.367 40 0 FKABRN O[C@@H](c1oc2ccccc2c1-c1cnn(-c2ccccc2)c1)c1ccccc1 ZINC000001081969 210315207 /nfs/dbraw/zinc/31/52/07/210315207.db2.gz NBDOSILRDJUOQH-HSZRJFAPSA-N 0 0 366.420 5.367 40 0 FKABRN CCCC(=O)Nc1ccc(NC(=O)[C@@H](c2ccccc2)C2CCCC2)cc1 ZINC000001081971 219366502 /nfs/dbraw/zinc/36/65/02/219366502.db2.gz NGALJTCRKDJLLR-QFIPXVFZSA-N 0 0 364.489 5.338 40 0 FKABRN CCCC(=O)Nc1ccc(NC(=O)[C@H](c2ccccc2)C2CCCC2)cc1 ZINC000001081972 219366619 /nfs/dbraw/zinc/36/66/19/219366619.db2.gz NGALJTCRKDJLLR-JOCHJYFZSA-N 0 0 364.489 5.338 40 0 FKABRN Cc1ccc(NC(=O)c2cccc(OC(=O)N(C)c3ccccc3)c2)cc1C ZINC000001082436 203981019 /nfs/dbraw/zinc/98/10/19/203981019.db2.gz HKNIHCVLSMVBQV-UHFFFAOYSA-N 0 0 374.440 5.191 40 0 FKABRN COc1ccccc1NC(=O)c1ccc(COc2cccc3ccccc32)o1 ZINC000001083423 219366558 /nfs/dbraw/zinc/36/65/58/219366558.db2.gz CXMFFUWTHXCCKG-UHFFFAOYSA-N 0 0 373.408 5.273 40 0 FKABRN CC1CCN(C(=O)c2ccc(COc3ccc(C(C)(C)C)cc3)o2)CC1 ZINC000001083425 570641941 /nfs/dbraw/zinc/64/19/41/570641941.db2.gz SHWMQQUXOODIRK-UHFFFAOYSA-N 0 0 355.478 5.028 40 0 FKABRN Cc1ccc2c(c1)N=C(C)c1c(c3ccccc3n(-c3ccccc3)c1=O)O2 ZINC000001084159 570642011 /nfs/dbraw/zinc/64/20/11/570642011.db2.gz KUVBAIHWIFOMHK-UHFFFAOYSA-N 0 0 366.420 5.546 40 0 FKABRN CC(C)(C)C(=O)c1sc2nc3c(c(-c4cccs4)c2c1N)CCC3 ZINC000001084887 219367476 /nfs/dbraw/zinc/36/74/76/219367476.db2.gz CIKPGGNZLLYUBA-UHFFFAOYSA-N 0 0 356.516 5.325 40 0 FKABRN Cc1cc(S(=O)c2cc(C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1 ZINC000001085208 219367567 /nfs/dbraw/zinc/36/75/67/219367567.db2.gz UYCYHQZXSNDUEK-UHFFFAOYSA-N 0 0 374.546 5.476 40 0 FKABRN Nc1ccccc1SCc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1 ZINC000001085564 210314252 /nfs/dbraw/zinc/31/42/52/210314252.db2.gz HQYAANXKBBXSPZ-UHFFFAOYSA-N 0 0 368.889 5.467 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1ccc(CSc2ccccn2)cc1 ZINC000001085565 219367608 /nfs/dbraw/zinc/36/76/08/219367608.db2.gz PZRLTGLAPKAWCJ-UHFFFAOYSA-N 0 0 354.862 5.280 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1ccc(CSCc2ccco2)cc1 ZINC000001085567 219367520 /nfs/dbraw/zinc/36/75/20/219367520.db2.gz SIQJRKYEMGWHAM-UHFFFAOYSA-N 0 0 357.862 5.619 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1ccc(CSc2ccccc2)cc1 ZINC000001085570 219367746 /nfs/dbraw/zinc/36/77/46/219367746.db2.gz LPOGKGYHDDPNLA-UHFFFAOYSA-N 0 0 353.874 5.885 40 0 FKABRN Cc1cc(O)c(C(C)(C)C)cc1S(=O)c1cc(C(C)(C)C)c(O)cc1C ZINC000001086610 570642421 /nfs/dbraw/zinc/64/24/21/570642421.db2.gz UZGWOIVYFUKNDE-UHFFFAOYSA-N 0 0 374.546 5.476 40 0 FKABRN COc1ccc(Nc2nc3c(s2)CSc2ccc(Cl)cc2-3)cc1 ZINC000001087324 210314083 /nfs/dbraw/zinc/31/40/83/210314083.db2.gz HBEMBZDOMXDOSK-UHFFFAOYSA-N 0 0 360.891 5.821 40 0 FKABRN Cc1cccc(N2C(=O)CS[C@@H]2c2ccc(Oc3ccccc3)cc2)c1 ZINC000001088753 570642198 /nfs/dbraw/zinc/64/21/98/570642198.db2.gz LPOTVVZVUBSTAA-JOCHJYFZSA-N 0 0 361.466 5.566 40 0 FKABRN Cc1cccc(N2C(=O)CS[C@H]2c2ccc(Oc3ccccc3)cc2)c1 ZINC000001088754 210315307 /nfs/dbraw/zinc/31/53/07/210315307.db2.gz LPOTVVZVUBSTAA-QFIPXVFZSA-N 0 0 361.466 5.566 40 0 FKABRN CSC1=NC(C)(C)C[C@@]12C(C)=CC(C)=C1CC(C)(C)N=C(SC)C=C12 ZINC000001089579 570480313 /nfs/dbraw/zinc/48/03/13/570480313.db2.gz KXFAQMAXXWADQH-NRFANRHFSA-N 0 0 374.619 6.063 40 0 FKABRN CSC1=NC(C)(C)C[C@]12C(C)=CC(C)=C1CC(C)(C)N=C(SC)C=C12 ZINC000001089580 219368641 /nfs/dbraw/zinc/36/86/41/219368641.db2.gz KXFAQMAXXWADQH-OAQYLSRUSA-N 0 0 374.619 6.063 40 0 FKABRN Cc1cccc(NC(=O)c2ccc(OCc3c(F)cccc3Cl)cc2)n1 ZINC000001089602 219368623 /nfs/dbraw/zinc/36/86/23/219368623.db2.gz DKEBRAVDBQYHJQ-UHFFFAOYSA-N 0 0 370.811 5.014 40 0 FKABRN O=C(NC(=S)c1cccc2ccccc21)Nc1ccc2ccccc2c1 ZINC000001096153 570480258 /nfs/dbraw/zinc/48/02/58/570480258.db2.gz UUSDCTFIKKMBKO-UHFFFAOYSA-N 0 0 356.450 5.490 40 0 FKABRN CCc1nc2sc3c(c2c(-n2cnc4cc(C)c(C)cc42)n1)CCCC3 ZINC000001098285 203981850 /nfs/dbraw/zinc/98/18/50/203981850.db2.gz BJTAQPRYVILJLY-UHFFFAOYSA-N 0 0 362.502 5.088 40 0 FKABRN Cc1cc(O)c(C(=O)CSc2ccc(Cl)cc2)cc1Br ZINC000001102031 219369273 /nfs/dbraw/zinc/36/92/73/219369273.db2.gz LDHSAVFKKNSRKP-UHFFFAOYSA-N 0 0 371.683 5.092 40 0 FKABRN CCC1=C(C)c2cc3nc(C(=O)OCc4ccccc4)c(C)c-3c(C)n2[C@H]1C ZINC000001103460 570642406 /nfs/dbraw/zinc/64/24/06/570642406.db2.gz AGSOKVUCSAOFBU-INIZCTEOSA-N 0 0 374.484 5.720 40 0 FKABRN CCC1=C(C)c2cc3nc(C(=O)OCc4ccccc4)c(C)c-3c(C)n2[C@@H]1C ZINC000001103461 219369301 /nfs/dbraw/zinc/36/93/01/219369301.db2.gz AGSOKVUCSAOFBU-MRXNPFEDSA-N 0 0 374.484 5.720 40 0 FKABRN O=C(c1cccs1)N1CCc2c3ccccc3[nH]c2[C@@H]1c1ccccc1 ZINC000001103473 203804962 /nfs/dbraw/zinc/80/49/62/203804962.db2.gz OHMFAROINVAHPE-NRFANRHFSA-N 0 0 358.466 5.017 40 0 FKABRN O=C(CSc1ncnc2sc3c(c21)CCCC3)c1ccccc1Cl ZINC000001104256 570480634 /nfs/dbraw/zinc/48/06/34/570480634.db2.gz CILURDDTVMUHRE-UHFFFAOYSA-N 0 0 374.918 5.199 40 0 FKABRN O=C(Cc1coc2ccc3ccccc3c12)Nc1cccc(Cl)c1Cl ZINC000001105732 570480626 /nfs/dbraw/zinc/48/06/26/570480626.db2.gz MULOYJGNNZLBJW-UHFFFAOYSA-N 0 0 370.235 6.074 40 0 FKABRN O=C(Nc1ccc(Cl)cc1-c1nc2ccccc2s1)c1cccs1 ZINC000001107609 219370579 /nfs/dbraw/zinc/37/05/79/219370579.db2.gz QOGRVUVXQWIZGG-UHFFFAOYSA-N 0 0 370.886 5.931 40 0 FKABRN O=C(Nc1c(Cl)cccc1Cl)C1[C@@H]2CC/C=C\CC/C=C/CC[C@H]12 ZINC000001168421 219384933 /nfs/dbraw/zinc/38/49/33/219384933.db2.gz IBBHEQXRACLNGJ-LWAUDZLXSA-N 0 0 364.316 6.261 40 0 FKABRN COc1cccc(-c2nc3cc(NC(=O)/C=C/c4ccccc4)ccc3o2)c1 ZINC000001218933 570764186 /nfs/dbraw/zinc/76/41/86/570764186.db2.gz MLSZTKQFCYQTKR-JLHYYAGUSA-N 0 0 370.408 5.155 40 0 FKABRN Cc1ccc2cc(C)c(SCC(=O)Nc3cccc4ccccc43)nc2c1 ZINC000001221547 570650017 /nfs/dbraw/zinc/65/00/17/570650017.db2.gz CEBSHBUNFWSHMH-UHFFFAOYSA-N 0 0 372.493 5.736 40 0 FKABRN CCc1ccccc1NC(=O)c1sc2nc3ccc(C)cc3cc2c1N ZINC000001222367 570650101 /nfs/dbraw/zinc/65/01/01/570650101.db2.gz BZOHCMQAGVUMRI-UHFFFAOYSA-N 0 0 361.470 5.155 40 0 FKABRN CCc1ccc(NC(=O)c2sc3nc4ccc(C)cc4cc3c2N)cc1 ZINC000001222368 209386349 /nfs/dbraw/zinc/38/63/49/209386349.db2.gz LSMYHJQNFUIATL-UHFFFAOYSA-N 0 0 361.470 5.155 40 0 FKABRN Cc1ccc2nc3sc(C(=O)Nc4cccc(C)c4C)c(N)c3cc2c1 ZINC000001222369 206144605 /nfs/dbraw/zinc/14/46/05/206144605.db2.gz TZAPAADVWKGYTL-UHFFFAOYSA-N 0 0 361.470 5.209 40 0 FKABRN Cc1ccc2nc3sc(C(=O)Nc4cc(C)cc(C)c4)c(N)c3cc2c1 ZINC000001222372 570649998 /nfs/dbraw/zinc/64/99/98/570649998.db2.gz SEACNBZVIXUAPN-UHFFFAOYSA-N 0 0 361.470 5.209 40 0 FKABRN CCc1nc2sc3c(c2c(SCC(=O)c2cccs2)n1)CCCC3 ZINC000001223157 570650028 /nfs/dbraw/zinc/65/00/28/570650028.db2.gz GXKVBGNIMFICMF-UHFFFAOYSA-N 0 0 374.556 5.169 40 0 FKABRN Cc1[nH]c2ccc(-c3nnc(SCc4ccc(F)cc4)o3)cc2c1C ZINC000001223283 209385661 /nfs/dbraw/zinc/38/56/61/209385661.db2.gz SRXFJYKGDMZVTL-UHFFFAOYSA-N 0 0 353.422 5.266 40 0 FKABRN Cc1[nH]c2ccc(-c3nnc(SCc4ccccc4F)o3)cc2c1C ZINC000001223301 570650076 /nfs/dbraw/zinc/65/00/76/570650076.db2.gz NXYDUYIKEWXQNM-UHFFFAOYSA-N 0 0 353.422 5.266 40 0 FKABRN Cc1sc(NC(=O)c2ccc(Cl)cc2)c(C(=O)c2ccccc2)c1C ZINC000001224360 209387785 /nfs/dbraw/zinc/38/77/85/209387785.db2.gz QOFUECJQRMVWTA-UHFFFAOYSA-N 0 0 369.873 5.502 40 0 FKABRN Cc1sc(NC(=O)c2ccccc2F)c(C(=O)c2ccc(C)cc2)c1C ZINC000001224365 219391831 /nfs/dbraw/zinc/39/18/31/219391831.db2.gz AJQMZQREDXCPGP-UHFFFAOYSA-N 0 0 367.445 5.296 40 0 FKABRN Cc1sc(NC(=O)c2ccccc2)c(C(=O)c2ccc(Cl)cc2)c1C ZINC000001224368 206145543 /nfs/dbraw/zinc/14/55/43/206145543.db2.gz AOOUITAJTXLIJN-UHFFFAOYSA-N 0 0 369.873 5.502 40 0 FKABRN Oc1ccccc1-c1nnc(SCc2ccc(Cl)c(Cl)c2)o1 ZINC000001224418 219391121 /nfs/dbraw/zinc/39/11/21/219391121.db2.gz NRLMUFNGQFLXER-UHFFFAOYSA-N 0 0 353.230 5.041 40 0 FKABRN O=C(c1ccccc1)N1CC[C@@]2(Cl)CCCC[C@H]2[C@@H]1c1ccccc1 ZINC000001236014 219392875 /nfs/dbraw/zinc/39/28/75/219392875.db2.gz NGNPHNWIFLLNLJ-ONTIZHBOSA-N 0 0 353.893 5.442 40 0 FKABRN CCc1ccccc1NC(=O)/C=C/c1cc(Cl)cc(Cl)c1OC ZINC000001255678 219393179 /nfs/dbraw/zinc/39/31/79/219393179.db2.gz RRVMFWAJVYQTIC-CMDGGOBGSA-N 0 0 350.245 5.216 40 0 FKABRN Cc1ccc(NC(=O)c2ccc(-c3cccc(Cl)c3Cl)o2)c(C)c1 ZINC000001256145 570496654 /nfs/dbraw/zinc/49/66/54/570496654.db2.gz GIINTMDVMNZVJH-UHFFFAOYSA-N 0 0 360.240 6.123 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1ccc2ccccc2c1 ZINC000001256166 203997362 /nfs/dbraw/zinc/99/73/62/203997362.db2.gz DFIFTBXYSUTQMA-VQHVLOKHSA-N 0 0 372.251 5.807 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1ccccc1C(C)C ZINC000001256178 210339298 /nfs/dbraw/zinc/33/92/98/210339298.db2.gz FFXLYNUHUGEQNB-CMDGGOBGSA-N 0 0 364.272 5.777 40 0 FKABRN Cc1ccc2nc(-c3ccc(NC(=O)c4ccc(C)cc4C)cc3)oc2c1 ZINC000001256284 570496639 /nfs/dbraw/zinc/49/66/39/570496639.db2.gz BVSPSOYZYDZEQA-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN CCc1cccc(C)c1NC(=O)/C=C/c1cc(Cl)cc(Cl)c1OC ZINC000001256359 219392820 /nfs/dbraw/zinc/39/28/20/219392820.db2.gz OPLVRUHHWALGGZ-CMDGGOBGSA-N 0 0 364.272 5.525 40 0 FKABRN CCOc1ccccc1NC(=O)/C=C/c1cc(Cl)cc(Cl)c1OC ZINC000001256386 219392179 /nfs/dbraw/zinc/39/21/79/219392179.db2.gz XYXRHZQYEDTUDV-CMDGGOBGSA-N 0 0 366.244 5.053 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc3oc(-c4cc(C)cc(C)c4)nc3c2)c(C)c1 ZINC000001256416 210339304 /nfs/dbraw/zinc/33/93/04/210339304.db2.gz IKBJWTCVEDEWFC-UHFFFAOYSA-N 0 0 370.452 5.981 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1ccc(Cl)cc1 ZINC000001261993 203996425 /nfs/dbraw/zinc/99/64/25/203996425.db2.gz DVAWYHIFYXSPTI-FARCUNLSSA-N 0 0 356.636 5.307 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc3oc(-c4ccccc4C)nc3c2)c(C)c1 ZINC000001262245 570496549 /nfs/dbraw/zinc/49/65/49/570496549.db2.gz MGBKXENNTUHVLU-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc3oc(-c4ccccc4F)nc3c2)c(C)c1 ZINC000001262671 570496694 /nfs/dbraw/zinc/49/66/94/570496694.db2.gz FANAXJODVZWEMM-UHFFFAOYSA-N 0 0 360.388 5.503 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1cc(C)ccc1C ZINC000001262912 219392997 /nfs/dbraw/zinc/39/29/97/219392997.db2.gz HVZASTHUQOBPCY-VOTSOKGWSA-N 0 0 350.245 5.271 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc3oc(-c4ccc(F)cc4)nc3c2)c(C)c1 ZINC000001262945 570496581 /nfs/dbraw/zinc/49/65/81/570496581.db2.gz SLFSWMPKIRWBSP-UHFFFAOYSA-N 0 0 360.388 5.503 40 0 FKABRN Cc1ccc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C)c1 ZINC000001263114 206872316 /nfs/dbraw/zinc/87/23/16/206872316.db2.gz ZRYJIGCKWLBJSM-UHFFFAOYSA-N 0 0 361.285 5.593 40 0 FKABRN CCCC(=O)Nc1cc(-c2nc3cc([C@@H](C)CC)ccc3o2)ccc1Cl ZINC000001263141 206872024 /nfs/dbraw/zinc/87/20/24/206872024.db2.gz KRHUWEIYVLVZOX-ZDUSSCGKSA-N 0 0 370.880 6.400 40 0 FKABRN CCCC(=O)Nc1cc(-c2nc3cc([C@H](C)CC)ccc3o2)ccc1Cl ZINC000001263142 203997507 /nfs/dbraw/zinc/99/75/07/203997507.db2.gz KRHUWEIYVLVZOX-CYBMUJFWSA-N 0 0 370.880 6.400 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1c(C)cc(C)cc1C ZINC000001264197 203997070 /nfs/dbraw/zinc/99/70/70/203997070.db2.gz LAXVYNYBEBIRDG-AATRIKPKSA-N 0 0 364.272 5.579 40 0 FKABRN CCc1ccc(-c2nc3cc(NC(=O)c4ccc(C)cc4C)ccc3o2)cc1 ZINC000001264299 570496564 /nfs/dbraw/zinc/49/65/64/570496564.db2.gz UUIWBWRSTJHLDX-UHFFFAOYSA-N 0 0 370.452 5.926 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1ccc(F)c(Cl)c1 ZINC000001264421 570496650 /nfs/dbraw/zinc/49/66/50/570496650.db2.gz AMCBSFTUJRUHGU-GORDUTHDSA-N 0 0 374.626 5.446 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1ccc(C(C)C)cc1 ZINC000001265559 570496412 /nfs/dbraw/zinc/49/64/12/570496412.db2.gz YZWOVKFXYXXHQA-RMKNXTFCSA-N 0 0 364.272 5.777 40 0 FKABRN CCC(=O)Nc1cc(-c2nc3cc([C@H](C)CC)ccc3o2)ccc1Cl ZINC000001265691 570496569 /nfs/dbraw/zinc/49/65/69/570496569.db2.gz PGERHCYHROLTII-GFCCVEGCSA-N 0 0 356.853 6.010 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1ccc(C)c(Cl)c1 ZINC000001265730 570496707 /nfs/dbraw/zinc/49/67/07/570496707.db2.gz VZSKZACDWIDYNJ-GQCTYLIASA-N 0 0 370.663 5.616 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)c(C)c1 ZINC000001268171 570496916 /nfs/dbraw/zinc/49/69/16/570496916.db2.gz DNGBIYZHQGAPCM-UHFFFAOYSA-N 0 0 351.833 6.001 40 0 FKABRN CCOc1ccc(NC(=O)/C=C/c2cc(Cl)cc(Cl)c2OC)cc1 ZINC000001268410 570497015 /nfs/dbraw/zinc/49/70/15/570497015.db2.gz WGLVLLASHFASLY-RUDMXATFSA-N 0 0 366.244 5.053 40 0 FKABRN Cc1ccc(C(=O)Nc2cccc(NC(=O)c3ccccc3C)c2)c(C)c1 ZINC000001268485 570497134 /nfs/dbraw/zinc/49/71/34/570497134.db2.gz UAFATNVCVNOYKW-UHFFFAOYSA-N 0 0 358.441 5.116 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1cccc(Cl)c1C ZINC000001268500 570496935 /nfs/dbraw/zinc/49/69/35/570496935.db2.gz ARMYKMNCRXXBHT-VOTSOKGWSA-N 0 0 370.663 5.616 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2ccc(-c3cccc(Cl)c3Cl)o2)c1 ZINC000001268605 570496927 /nfs/dbraw/zinc/49/69/27/570496927.db2.gz KVMGABVCYSVZPH-UHFFFAOYSA-N 0 0 360.240 6.123 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1cc(Cl)ccc1C ZINC000001268788 570497076 /nfs/dbraw/zinc/49/70/76/570497076.db2.gz MBMAWGPWVBLIIS-GQCTYLIASA-N 0 0 370.663 5.616 40 0 FKABRN CC1(C)[C@@H]2CC[C@@H](C2)[C@]1(O)CSCc1cccc(Oc2ccccc2)c1 ZINC000001272643 206872854 /nfs/dbraw/zinc/87/28/54/206872854.db2.gz CULVDJPYQHYKQJ-SELNLUPBSA-N 0 0 368.542 5.899 40 0 FKABRN CC(=O)Nc1ccc(N[C@@H](c2c(C)[nH]c3ccccc32)c2cccnc2)cc1 ZINC000001281027 571180428 /nfs/dbraw/zinc/18/04/28/571180428.db2.gz DXRPPJSMJMUHDI-HSZRJFAPSA-N 0 0 370.456 5.031 40 0 FKABRN CC(=O)Nc1ccc(N[C@H](c2c(C)[nH]c3ccccc32)c2cccnc2)cc1 ZINC000001281028 571180390 /nfs/dbraw/zinc/18/03/90/571180390.db2.gz DXRPPJSMJMUHDI-QHCPKHFHSA-N 0 0 370.456 5.031 40 0 FKABRN CCOc1ccc(N[C@H](c2c(C)[nH]c3ccccc32)c2ccncc2)cc1 ZINC000001281067 571180427 /nfs/dbraw/zinc/18/04/27/571180427.db2.gz HRGZIFBPLYCZLD-QHCPKHFHSA-N 0 0 357.457 5.472 40 0 FKABRN CCOc1ccc(N[C@@H](c2c(C)[nH]c3ccccc32)c2ccncc2)cc1 ZINC000001281068 571180397 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COc1ccccc1[C@H](Nc1ccc(F)cc1)c1c(C)[nH]c2ccccc21 ZINC000001281096 571180385 /nfs/dbraw/zinc/18/03/85/571180385.db2.gz CBCVZRLKRSZIRJ-QHCPKHFHSA-N 0 0 360.432 5.826 40 0 FKABRN COc1ccc(-c2csc(NC(=O)c3ccc(C(C)C)cc3)n2)cc1 ZINC000001284191 263144021 /nfs/dbraw/zinc/14/40/21/263144021.db2.gz HVIUBZWEINFBJO-UHFFFAOYSA-N 0 0 352.459 5.194 40 0 FKABRN COc1ccc(N[C@@H](c2c(C)[nH]c3ccccc32)c2ccccc2OC)cc1 ZINC000001298071 210340593 /nfs/dbraw/zinc/34/05/93/210340593.db2.gz OGCCLCVQPODCDS-XMMPIXPASA-N 0 0 372.468 5.695 40 0 FKABRN COc1ccc(N[C@H](c2c(C)[nH]c3ccccc32)c2ccccc2OC)cc1 ZINC000001298072 210340834 /nfs/dbraw/zinc/34/08/34/210340834.db2.gz OGCCLCVQPODCDS-DEOSSOPVSA-N 0 0 372.468 5.695 40 0 FKABRN COc1ccccc1[C@@H](Nc1cccc(F)c1)c1c(C)[nH]c2ccccc21 ZINC000001298074 219394117 /nfs/dbraw/zinc/39/41/17/219394117.db2.gz KFSNQMMPEDWCOM-HSZRJFAPSA-N 0 0 360.432 5.826 40 0 FKABRN COc1ccccc1[C@H](Nc1cccc(F)c1)c1c(C)[nH]c2ccccc21 ZINC000001298076 219393613 /nfs/dbraw/zinc/39/36/13/219393613.db2.gz KFSNQMMPEDWCOM-QHCPKHFHSA-N 0 0 360.432 5.826 40 0 FKABRN COc1cccc(N[C@@H](c2c(C)[nH]c3ccccc32)c2ccccc2OC)c1 ZINC000001298078 219393458 /nfs/dbraw/zinc/39/34/58/219393458.db2.gz GHVIHQMVQNYTRF-XMMPIXPASA-N 0 0 372.468 5.695 40 0 FKABRN COc1cccc(N[C@H](c2c(C)[nH]c3ccccc32)c2ccccc2OC)c1 ZINC000001298080 210341261 /nfs/dbraw/zinc/34/12/61/210341261.db2.gz GHVIHQMVQNYTRF-DEOSSOPVSA-N 0 0 372.468 5.695 40 0 FKABRN COc1ccccc1[C@@H](Nc1ccccc1F)c1c(C)[nH]c2ccccc21 ZINC000001298085 571187138 /nfs/dbraw/zinc/18/71/38/571187138.db2.gz BKKALZKXSYLBSO-HSZRJFAPSA-N 0 0 360.432 5.826 40 0 FKABRN COc1ccccc1[C@H](Nc1ccccc1F)c1c(C)[nH]c2ccccc21 ZINC000001298087 219394141 /nfs/dbraw/zinc/39/41/41/219394141.db2.gz BKKALZKXSYLBSO-QHCPKHFHSA-N 0 0 360.432 5.826 40 0 FKABRN COc1ccccc1N[C@@H](c1c(C)[nH]c2ccccc21)c1ccccc1OC ZINC000001298088 210341094 /nfs/dbraw/zinc/34/10/94/210341094.db2.gz OFQWDIWPBZRSFC-XMMPIXPASA-N 0 0 372.468 5.695 40 0 FKABRN COc1ccccc1N[C@H](c1c(C)[nH]c2ccccc21)c1ccccc1OC ZINC000001298090 210340985 /nfs/dbraw/zinc/34/09/85/210340985.db2.gz OFQWDIWPBZRSFC-DEOSSOPVSA-N 0 0 372.468 5.695 40 0 FKABRN COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1c(C)cccc1C ZINC000001312003 219394846 /nfs/dbraw/zinc/39/48/46/219394846.db2.gz FJHRKQHYKNEBDO-BQYQJAHWSA-N 0 0 350.245 5.271 40 0 FKABRN O=C(Nc1cccc(F)c1)c1cc2sccc2n1Cc1ccc(F)cc1 ZINC000001324261 219395350 /nfs/dbraw/zinc/39/53/50/219395350.db2.gz CJHIBJGMLALWAG-UHFFFAOYSA-N 0 0 368.408 5.282 40 0 FKABRN O=C(Nc1ccccc1F)c1cc2sccc2n1Cc1ccc(F)cc1 ZINC000001324262 219394830 /nfs/dbraw/zinc/39/48/30/219394830.db2.gz RCVHSKFSNMYOEC-UHFFFAOYSA-N 0 0 368.408 5.282 40 0 FKABRN O=C(Nc1ccc(F)cc1)c1cc2sccc2n1Cc1ccc(F)cc1 ZINC000001324275 206146279 /nfs/dbraw/zinc/14/62/79/206146279.db2.gz MINHEBYPOYEAKO-UHFFFAOYSA-N 0 0 368.408 5.282 40 0 FKABRN O=C(NC1CCCCCC1)c1cc2sccc2n1Cc1ccc(F)cc1 ZINC000001324381 219394732 /nfs/dbraw/zinc/39/47/32/219394732.db2.gz XMHMMAVNGKJIGD-UHFFFAOYSA-N 0 0 370.493 5.343 40 0 FKABRN O=C(CSc1nc2cc(Cl)ccc2s1)c1ccc(Cl)cc1 ZINC000001325298 206146933 /nfs/dbraw/zinc/14/69/33/206146933.db2.gz IFMDZQHEIWLBBO-UHFFFAOYSA-N 0 0 354.283 5.578 40 0 FKABRN Cc1nc2sc3c(c2c(SCC(=O)c2ccccc2)n1)CC[C@H](C)C3 ZINC000001326151 209387924 /nfs/dbraw/zinc/38/79/24/209387924.db2.gz DECJHNWAFFONSX-LBPRGKRZSA-N 0 0 368.527 5.100 40 0 FKABRN Cc1nc2sc3c(c2c(SCC(=O)c2ccccc2)n1)CC[C@@H](C)C3 ZINC000001326153 209388158 /nfs/dbraw/zinc/38/81/58/209388158.db2.gz DECJHNWAFFONSX-GFCCVEGCSA-N 0 0 368.527 5.100 40 0 FKABRN Cc1cccc(NC(=S)N2CCC(c3nc4ccccc4s3)CC2)c1 ZINC000001326975 206146481 /nfs/dbraw/zinc/14/64/81/206146481.db2.gz SLDVUQSVONDILU-UHFFFAOYSA-N 0 0 367.543 5.181 40 0 FKABRN Cc1ccc(NC(=S)N2CCC(c3nc4ccccc4s3)CC2)cc1 ZINC000001326982 209388054 /nfs/dbraw/zinc/38/80/54/209388054.db2.gz NEBWPDMSEQCVBW-UHFFFAOYSA-N 0 0 367.543 5.181 40 0 aggregator FKABRN Cc1ccc(C)c(NC(=S)N2CCC(c3nc4ccccc4o3)CC2)c1 ZINC000001326991 219394793 /nfs/dbraw/zinc/39/47/93/219394793.db2.gz OLVWQUZWQMUUHY-UHFFFAOYSA-N 0 0 365.502 5.021 40 0 FKABRN Cc1ccc(NC(=S)N2CCC(c3nc4ccccc4o3)CC2)c(C)c1 ZINC000001327000 219395165 /nfs/dbraw/zinc/39/51/65/219395165.db2.gz UGZYYVZZHDZOND-UHFFFAOYSA-N 0 0 365.502 5.021 40 0 FKABRN Fc1ccc(NC(=S)N2CCC(c3nc4ccccc4s3)CC2)cc1 ZINC000001327160 206146340 /nfs/dbraw/zinc/14/63/40/206146340.db2.gz RBKSQUXRXWJKSO-UHFFFAOYSA-N 0 0 371.506 5.012 40 0 FKABRN Cc1ccc(NC(=S)N2CCC(c3nc4ccccc4o3)CC2)cc1C ZINC000001327198 206146750 /nfs/dbraw/zinc/14/67/50/206146750.db2.gz ZAIZNRTYRDAJTF-UHFFFAOYSA-N 0 0 365.502 5.021 40 0 FKABRN Cc1cc(C)cc(NC(=S)N2CCC(c3nc4ccccc4o3)CC2)c1 ZINC000001327206 209388390 /nfs/dbraw/zinc/38/83/90/209388390.db2.gz JTAZCXQOLBOXNH-UHFFFAOYSA-N 0 0 365.502 5.021 40 0 FKABRN Fc1ccc(-c2nnc(SCc3ccc(Cl)c(Cl)c3)o2)cc1 ZINC000001328697 219396149 /nfs/dbraw/zinc/39/61/49/219396149.db2.gz MFVDXBYTNSACGA-UHFFFAOYSA-N 0 0 355.221 5.475 40 0 FKABRN Fc1cccc(-c2nnc(SCc3ccc(Cl)c(Cl)c3)o2)c1 ZINC000001328700 206146332 /nfs/dbraw/zinc/14/63/32/206146332.db2.gz YXIYHLANVVXBMM-UHFFFAOYSA-N 0 0 355.221 5.475 40 0 FKABRN Fc1ccccc1-c1nnc(SCc2ccc(Cl)c(Cl)c2)o1 ZINC000001328703 219395719 /nfs/dbraw/zinc/39/57/19/219395719.db2.gz ZHQDDZSGMVYUSL-UHFFFAOYSA-N 0 0 355.221 5.475 40 0 FKABRN Cc1cc2nc(-c3ccc(SCc4ccccc4F)nc3)[nH]c2cc1C ZINC000001329603 219396017 /nfs/dbraw/zinc/39/60/17/219396017.db2.gz GYZRXXSIKZBERE-UHFFFAOYSA-N 0 0 363.461 5.673 40 0 FKABRN Cc1ccc(NC(=O)c2cccs2)cc1NC(=O)c1cccc(Cl)c1 ZINC000001330011 219396354 /nfs/dbraw/zinc/39/63/54/219396354.db2.gz IDAKJJMLEMIZPR-UHFFFAOYSA-N 0 0 370.861 5.215 40 0 FKABRN Cc1ccc(NC(=O)c2cccs2)cc1NC(=O)CCC1CCCC1 ZINC000001330038 570497447 /nfs/dbraw/zinc/49/74/47/570497447.db2.gz PMSPEKMIMGOWSQ-UHFFFAOYSA-N 0 0 356.491 5.218 40 0 FKABRN CCC(C)(C)Nc1c(-c2cc3cccc(C)c3[nH]c2=O)nc2cc(C)ccn21 ZINC000001330111 206147081 /nfs/dbraw/zinc/14/70/81/206147081.db2.gz RRVPPQFBXSWODN-UHFFFAOYSA-N 0 0 374.488 5.060 40 0 FKABRN CCC(C)(C)Nc1c(-c2cc3ccc(C)c(C)c3[nH]c2=O)nc2ccccn21 ZINC000001330144 570497499 /nfs/dbraw/zinc/49/74/99/570497499.db2.gz XTJYNQWDMIWKJG-UHFFFAOYSA-N 0 0 374.488 5.060 40 0 FKABRN c1ccc(CSc2nc(C3CC3)nc3sc4c(c32)CCCC4)nc1 ZINC000001332808 209386936 /nfs/dbraw/zinc/38/69/36/209386936.db2.gz HOJFOGJCOTXBSR-UHFFFAOYSA-N 0 0 353.516 5.135 40 0 FKABRN CC(C)(C)c1ccc(CSc2nnc(-c3c[nH]c4ccccc43)o2)cc1 ZINC000001332825 210343091 /nfs/dbraw/zinc/34/30/91/210343091.db2.gz NBHHNZSNMLHRHK-UHFFFAOYSA-N 0 0 363.486 5.808 40 0 FKABRN Cc1sc2nc(C)nc(SCC(=O)c3c[nH]c4ccccc43)c2c1C ZINC000001333006 219396330 /nfs/dbraw/zinc/39/63/30/219396330.db2.gz IAXNDXXHUSDYMJ-UHFFFAOYSA-N 0 0 367.499 5.073 40 0 FKABRN CCc1ccccc1NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 ZINC000001336622 219395920 /nfs/dbraw/zinc/39/59/20/219395920.db2.gz CDEJUVHUDVUTEL-UHFFFAOYSA-N 0 0 370.880 5.029 40 0 FKABRN CCc1ccc(-c2ccc(C(=O)Nc3cccc(NC(C)=O)c3)cc2)cc1 ZINC000001337680 209387645 /nfs/dbraw/zinc/38/76/45/209387645.db2.gz VIOXHBJPCOGERF-UHFFFAOYSA-N 0 0 358.441 5.127 40 0 FKABRN 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CC[C@@H](c1ccc(C(C)=O)c(O)c1)[C@@H](CC)c1ccc(C(C)=O)c(O)c1 ZINC000001607580 570503174 /nfs/dbraw/zinc/50/31/74/570503174.db2.gz ITYQQEPZCIHICS-ROUUACIJSA-N 0 0 354.446 5.190 40 0 FKABRN CC[C@H](c1ccc(C(C)=O)c(O)c1)[C@H](CC)c1ccc(C(C)=O)c(O)c1 ZINC000001607583 570503097 /nfs/dbraw/zinc/50/30/97/570503097.db2.gz ITYQQEPZCIHICS-QZTJIDSGSA-N 0 0 354.446 5.190 40 0 FKABRN COc1cc(-c2c(C)oc(C)c2C(C)=O)ccc1OCc1ccccc1 ZINC000001608095 206889294 /nfs/dbraw/zinc/88/92/94/206889294.db2.gz NMSMGRLMGNBOAP-UHFFFAOYSA-N 0 0 350.414 5.354 40 0 FKABRN COc1ccc(-c2oc(=O)cc(-c3ccccc3)c2-c2ccccc2)cc1 ZINC000001608108 210362160 /nfs/dbraw/zinc/36/21/60/210362160.db2.gz MXRIRHIXZUYMBZ-UHFFFAOYSA-N 0 0 354.405 5.649 40 0 FKABRN CC(=O)c1c(C)n2c(c1Br)-c1ccccc1-c1ccccc1-2 ZINC000001610049 570503163 /nfs/dbraw/zinc/50/31/63/570503163.db2.gz JVCYLSBYDAQUKH-UHFFFAOYSA-N 0 0 352.231 5.398 40 0 FKABRN Cc1ccc(S(=O)(=O)Nc2c(C)c(Cl)c(C)c3ccccc32)cc1 ZINC000001610531 204014113 /nfs/dbraw/zinc/01/41/13/204014113.db2.gz 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/nfs/dbraw/zinc/36/28/27/210362827.db2.gz NPQQZLFETDHOGE-UHFFFAOYSA-N 0 0 351.405 5.532 40 0 FKABRN COc1ccc(C(=O)CCc2c3ccccc3[nH]c2-c2ccccc2)c(O)c1 ZINC000001612529 570502858 /nfs/dbraw/zinc/50/28/58/570502858.db2.gz GWTMZTWKLYUKOI-UHFFFAOYSA-N 0 0 371.436 5.365 40 0 FKABRN CCC(=O)Oc1ccc2c(c1)oc(CC)c(-c1ccc(OC)cc1)c2=S ZINC000001615726 571245165 /nfs/dbraw/zinc/24/51/65/571245165.db2.gz QOBLBNZMFPVDCS-UHFFFAOYSA-N 0 0 368.454 5.716 40 0 FKABRN O=C(Nc1cc(Cl)ccc1Cl)c1cc2cccc(Cl)c2oc1=O ZINC000001616262 210362669 /nfs/dbraw/zinc/36/26/69/210362669.db2.gz OGMVVDUUSOJPEV-UHFFFAOYSA-N 0 0 368.603 5.006 40 0 FKABRN CC(C)=CCC/C(C)=C/CC[C@@]1(C)C=Cc2c(=O)oc3ccccc3c2O1 ZINC000001618093 210362151 /nfs/dbraw/zinc/36/21/51/210362151.db2.gz JQLNFODDCYXPCO-KAAOTHNJSA-N 0 0 364.485 6.430 40 0 FKABRN CC(C)=CCC/C(C)=C/CC[C@]1(C)C=Cc2c(=O)oc3ccccc3c2O1 ZINC000001618095 204014525 /nfs/dbraw/zinc/01/45/25/204014525.db2.gz JQLNFODDCYXPCO-CNAUTRJHSA-N 0 0 364.485 6.430 40 0 FKABRN CN(c1ccccc1)c1c2ccc3occc3c2oc(=O)c1-c1ccccc1 ZINC000001618931 206890112 /nfs/dbraw/zinc/89/01/12/206890112.db2.gz LQLVTFUDSZJKLC-UHFFFAOYSA-N 0 0 367.404 5.974 40 0 FKABRN CCOC(=O)C(C)(c1c(C)[nH]c2ccccc21)c1c(C)[nH]c2ccccc21 ZINC000001618977 570503178 /nfs/dbraw/zinc/50/31/78/570503178.db2.gz NCXIIPCDUJPFDG-UHFFFAOYSA-N 0 0 360.457 5.135 40 0 FKABRN O=C(Oc1ccc(-c2ccccc2)cc1Br)c1ccccc1 ZINC000001621427 570503235 /nfs/dbraw/zinc/50/32/35/570503235.db2.gz HNOUUPFJAYHYIH-UHFFFAOYSA-N 0 0 353.215 5.335 40 0 FKABRN O=C(Oc1ccc(-c2ccc(Br)cc2)cc1)c1ccccc1 ZINC000001621428 204014581 /nfs/dbraw/zinc/01/45/81/204014581.db2.gz RGPNGUWAEKRPGP-UHFFFAOYSA-N 0 0 353.215 5.335 40 0 FKABRN c1sc2ccccc2c1Cc1ccc2cccc3c2c1Cc1ccccc1-3 ZINC000001622911 210362516 /nfs/dbraw/zinc/36/25/16/210362516.db2.gz IVMQMUUDYJMRCA-UHFFFAOYSA-N 0 0 362.497 7.217 40 0 FKABRN COc1ccc(-c2oc(-c3c(C)c(C)cc(C)c3C)c3ccccc32)cc1 ZINC000001626839 204015460 /nfs/dbraw/zinc/01/54/60/204015460.db2.gz MCXLCGUCUDPBEB-UHFFFAOYSA-N 0 0 356.465 7.009 40 0 FKABRN COc1ccc(C(=O)Oc2ccc(C)c(CC(Cl)(Cl)Cl)c2)cc1 ZINC000001626882 204015369 /nfs/dbraw/zinc/01/53/69/204015369.db2.gz GVYYKCPAEPDMGG-UHFFFAOYSA-N 0 0 373.663 5.136 40 0 FKABRN ClC(Cl)=C1C(=C(Cl)Cl)C(Cl)(Cl)C1(Cl)Cl ZINC000001627666 210361392 /nfs/dbraw/zinc/36/13/92/210361392.db2.gz WNYCWKSFQDZCCY-UHFFFAOYSA-N 0 0 355.690 5.726 40 0 FKABRN ClC1=C(Cl)C(Cl)=C(Cl)C1=Cc1ccc(Cl)cc1Cl ZINC000001628210 210362620 /nfs/dbraw/zinc/36/26/20/210362620.db2.gz HDNRJBPQWIJEIW-UHFFFAOYSA-N 0 0 360.882 6.769 40 0 FKABRN ClC(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccccc2)cc1 ZINC000001632686 219414081 /nfs/dbraw/zinc/41/40/81/219414081.db2.gz PUFFHJWTKOTSBE-UHFFFAOYSA-N 0 0 366.891 7.509 40 0 FKABRN c1ccc2c(c1)Oc1ccccc1C2C1c2ccccc2Oc2ccccc21 ZINC000001634075 204014461 /nfs/dbraw/zinc/01/44/61/204014461.db2.gz ITCRKCCNJBBRCM-UHFFFAOYSA-N 0 0 362.428 6.862 40 0 FKABRN Clc1ccccc1C(SCc1ccccc1)SCc1ccccc1 ZINC000001636932 204014794 /nfs/dbraw/zinc/01/47/94/204014794.db2.gz ZGCRQUHDTJZIOR-UHFFFAOYSA-N 0 0 370.970 7.205 40 0 FKABRN Clc1ccc(C(SCc2ccccc2)SCc2ccccc2)cc1 ZINC000001636937 204015582 /nfs/dbraw/zinc/01/55/82/204015582.db2.gz PBLDEPWBRALBPE-UHFFFAOYSA-N 0 0 370.970 7.205 40 0 FKABRN C(=C/C(SCc1ccccc1)SCc1ccccc1)\c1ccccc1 ZINC000001636941 210363321 /nfs/dbraw/zinc/36/33/21/210363321.db2.gz CNHUOVMDLVOTFW-WUKNDPDISA-N 0 0 362.563 6.893 40 0 FKABRN Fc1ccc(-c2sc(-c3ccsc3)cc2Cc2ccsc2)cc1 ZINC000001637821 210364340 /nfs/dbraw/zinc/36/43/40/210364340.db2.gz SSSJMUFVTMLUET-UHFFFAOYSA-N 0 0 356.512 6.935 40 0 FKABRN Clc1cccc(-c2sc(-c3ccsc3)cc2Cc2ccsc2)c1 ZINC000001637822 204015228 /nfs/dbraw/zinc/01/52/28/204015228.db2.gz VMQJSUSFENIZEP-UHFFFAOYSA-N 0 0 372.967 7.449 40 0 FKABRN CCOP(=O)(Nc1cc2c(cc1Cl)-c1ccccc1C2)OCC ZINC000001638400 204014837 /nfs/dbraw/zinc/01/48/37/204014837.db2.gz AGPAUBKGKCIJDM-UHFFFAOYSA-N 0 0 351.770 5.504 40 0 FKABRN O=C(Nc1cccc2ccccc21)Oc1ccccc1Cc1ccccc1 ZINC000001640179 204015119 /nfs/dbraw/zinc/01/51/19/204015119.db2.gz CYNPKXFVNVESDB-UHFFFAOYSA-N 0 0 353.421 6.042 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)Oc1cc(Cl)c(Cl)cc1Cl ZINC000001640298 204014593 /nfs/dbraw/zinc/01/45/93/204014593.db2.gz KEAHDEUZFCRXGT-UHFFFAOYSA-N 0 0 365.043 6.220 40 0 FKABRN Clc1ccc2c(c1)nccc2NCCCCN1O[C@@H]1c1ccccc1 ZINC000001640557 204014892 /nfs/dbraw/zinc/01/48/92/204014892.db2.gz MMUAXWUXILQCRK-CGHJUBPDSA-N 0 0 353.853 5.026 40 0 FKABRN CC(C)OC(=O)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl ZINC000001641150 570503694 /nfs/dbraw/zinc/50/36/94/570503694.db2.gz SIVWOEZATKKCEA-UHFFFAOYSA-N 0 0 352.428 5.877 40 0 FKABRN O=P(Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1Cl ZINC000001641188 219413817 /nfs/dbraw/zinc/41/38/17/219413817.db2.gz NMPAICLYKOKXAP-UHFFFAOYSA-N 0 0 360.733 5.985 40 0 FKABRN O=Cc1cn(CCCCCn2cc(C=O)c3ccccc32)c2ccccc12 ZINC000001643007 210364646 /nfs/dbraw/zinc/36/46/46/210364646.db2.gz VAAJFERPENUVEB-UHFFFAOYSA-N 0 0 358.441 5.092 40 0 FKABRN CC(=O)Oc1ccc(C(=CC(C)(C)C)c2ccc(OC(C)=O)cc2)cc1 ZINC000001643967 204015292 /nfs/dbraw/zinc/01/52/92/204015292.db2.gz RCLUNYSSRVOIHZ-UHFFFAOYSA-N 0 0 352.430 5.015 40 0 FKABRN COc1ccc(C(=C(Cl)c2ccccc2)c2ccc(OC)cc2)cc1 ZINC000001645251 570503685 /nfs/dbraw/zinc/50/36/85/570503685.db2.gz SXHPIOYGNGNXRF-UHFFFAOYSA-N 0 0 350.845 5.859 40 0 FKABRN O=C1O[C@](Oc2ccc3ccccc3c2)(c2ccccc2)c2ccccc21 ZINC000001646454 570503631 /nfs/dbraw/zinc/50/36/31/570503631.db2.gz BKLCPJRXUIWIBE-XMMPIXPASA-N 0 0 352.389 5.290 40 0 FKABRN O=C(Oc1ccc2ccccc2c1)c1ccccc1C(=O)c1ccccc1 ZINC000001646455 570503590 /nfs/dbraw/zinc/50/35/90/570503590.db2.gz IIULSTSLQMVCCN-UHFFFAOYSA-N 0 0 352.389 5.290 40 0 FKABRN O=C(Oc1cccc2ccccc21)c1ccccc1C(=O)c1ccccc1 ZINC000001646456 204015868 /nfs/dbraw/zinc/01/58/68/204015868.db2.gz KETXTACUVUIUHI-UHFFFAOYSA-N 0 0 352.389 5.290 40 0 FKABRN O=C(C[C@@H](c1ccccc1)c1ccc(Br)cc1)c1ccccc1 ZINC000001646494 210363514 /nfs/dbraw/zinc/36/35/14/210363514.db2.gz WTKRBWMQAHGKHB-FQEVSTJZSA-N 0 0 365.270 5.854 40 0 FKABRN Cc1cc(Cl)ccc1OCC(=O)OCC[C@H]1CC[C@H]2C[C@@H]1C2(C)C ZINC000001648529 570503602 /nfs/dbraw/zinc/50/36/02/570503602.db2.gz WREMQSJLLUEZTM-VYDXJSESSA-N 0 0 350.886 5.033 40 0 FKABRN C[C@H](OC(=O)c1ccccc1C(=O)O[C@@H](C)c1ccccc1)c1ccccc1 ZINC000001651936 210363549 /nfs/dbraw/zinc/36/35/49/210363549.db2.gz RZHCBUNQWKVGAW-ROUUACIJSA-N 0 0 374.436 5.523 40 0 FKABRN C[C@@H](OC(=O)c1ccccc1C(=O)O[C@H](C)c1ccccc1)c1ccccc1 ZINC000001651939 210364640 /nfs/dbraw/zinc/36/46/40/210364640.db2.gz RZHCBUNQWKVGAW-QZTJIDSGSA-N 0 0 374.436 5.523 40 0 FKABRN O=C(Nc1ccccc1)Oc1c(Cl)cc(Cl)c(Cl)c1Cl ZINC000001652014 206891265 /nfs/dbraw/zinc/89/12/65/206891265.db2.gz GKGKPDNYJJGJJA-UHFFFAOYSA-N 0 0 351.016 5.911 40 0 FKABRN CC[C@@H](OC(=O)[C@H]1[C@H](C=C(C)C)C1(C)C)c1cc2c(cc1Cl)OCO2 ZINC000001652182 206891641 /nfs/dbraw/zinc/89/16/41/206891641.db2.gz DHABYFASWXICCE-JCKWVBRZSA-N 0 0 364.869 5.301 40 0 FKABRN CC(C)(CCC(C)(C)N1O[C@H]1c1ccccc1)N1O[C@@H]1c1ccccc1 ZINC000001652613 219413948 /nfs/dbraw/zinc/41/39/48/219413948.db2.gz ZVYPDPQJQPXXNB-TUUBTQOTSA-N 0 0 352.478 5.216 40 0 FKABRN CCCCC1(CC)COP(=O)(OCC(Cl)(Cl)Cl)OC1 ZINC000001653086 204016685 /nfs/dbraw/zinc/01/66/85/204016685.db2.gz IBBHUJFRHVOZQA-UHFFFAOYSA-N 0 0 353.610 5.115 40 0 FKABRN Cc1ccccc1C(=O)c1cccc2cccc(C(=O)c3ccccc3C)c21 ZINC000001654125 210363955 /nfs/dbraw/zinc/36/39/55/210363955.db2.gz WFHPOUZAFFBDCI-UHFFFAOYSA-N 0 0 364.444 5.919 40 0 FKABRN CCO[C@@]1(c2ccccc2)c2cccc3cccc(c23)[C@@]1(O)c1ccccc1 ZINC000001654141 219415384 /nfs/dbraw/zinc/41/53/84/219415384.db2.gz RRJHOZWINJAEKQ-UIOOFZCWSA-N 0 0 366.460 5.369 40 0 FKABRN CCO[C@]1(c2ccccc2)c2cccc3cccc(c23)[C@@]1(O)c1ccccc1 ZINC000001654142 570503630 /nfs/dbraw/zinc/50/36/30/570503630.db2.gz RRJHOZWINJAEKQ-IZZNHLLZSA-N 0 0 366.460 5.369 40 0 FKABRN CCO[C@@]1(c2ccccc2)c2cccc3cccc(c23)[C@]1(O)c1ccccc1 ZINC000001654143 219415026 /nfs/dbraw/zinc/41/50/26/219415026.db2.gz RRJHOZWINJAEKQ-FTJBHMTQSA-N 0 0 366.460 5.369 40 0 FKABRN CCO[C@]1(c2ccccc2)c2cccc3cccc(c23)[C@]1(O)c1ccccc1 ZINC000001654144 206891261 /nfs/dbraw/zinc/89/12/61/206891261.db2.gz RRJHOZWINJAEKQ-CLJLJLNGSA-N 0 0 366.460 5.369 40 0 FKABRN CC1(C)c2ccccc2[C@@](C)(C(Cl)(Cl)Cl)c2ccc(Cl)cc21 ZINC000001654268 570503625 /nfs/dbraw/zinc/50/36/25/570503625.db2.gz KLOARVIYAREIJR-QGZVFWFLSA-N 0 0 374.138 6.656 40 0 FKABRN O=C(c1ccc(Cl)cc1)c1ccccc1Cc1cccc2ccccc21 ZINC000001654310 206891276 /nfs/dbraw/zinc/89/12/76/206891276.db2.gz KHVMPHIHUSFNJB-UHFFFAOYSA-N 0 0 356.852 6.315 40 0 FKABRN COc1ccccc1C(=O)c1ccccc1Cc1cccc2ccccc21 ZINC000001654324 570503622 /nfs/dbraw/zinc/50/36/22/570503622.db2.gz XRSUKYHOFHZYED-UHFFFAOYSA-N 0 0 352.433 5.670 40 0 FKABRN CC1=C(C(=O)O[C@H]2C[C@@H](C)CC[C@@H]2C(C)C)C(=O)C(c2ccccc2)N1 ZINC000001654574 570765807 /nfs/dbraw/zinc/76/58/07/570765807.db2.gz PFCVPDHSSAWHDG-QGTPRVQTSA-N 0 0 355.478 5.313 40 0 FKABRN O=C(Nc1cccc(Cl)c1)Oc1c(Cl)cc(Cl)cc1Cl ZINC000001655924 210364377 /nfs/dbraw/zinc/36/43/77/210364377.db2.gz WIYWJUVPLQRJFP-UHFFFAOYSA-N 0 0 351.016 5.911 40 0 FKABRN Cc1cccc(C)c1C(=O)c1ccccc1Cc1ccc2ccccc2c1 ZINC000001656974 204016225 /nfs/dbraw/zinc/01/62/25/204016225.db2.gz PLRGCPCTSLIKPM-UHFFFAOYSA-N 0 0 350.461 6.278 40 0 FKABRN Cc1cccc(C(=O)c2ccccc2Cc2cccc3ccccc32)c1C ZINC000001656975 570503607 /nfs/dbraw/zinc/50/36/07/570503607.db2.gz HLCLKJLAGPYKSX-UHFFFAOYSA-N 0 0 350.461 6.278 40 0 FKABRN Cc1ccc(C(=O)c2ccccc2Cc2cccc3ccccc32)c(C)c1 ZINC000001656976 206890539 /nfs/dbraw/zinc/89/05/39/206890539.db2.gz WGCWXXTWCQWHSI-UHFFFAOYSA-N 0 0 350.461 6.278 40 0 FKABRN Cc1ccc(C(=O)c2ccccc2Cc2cccc3ccccc32)cc1C ZINC000001656977 210364589 /nfs/dbraw/zinc/36/45/89/210364589.db2.gz KCFHSFNVCBQLGB-UHFFFAOYSA-N 0 0 350.461 6.278 40 0 FKABRN Cc1cc(C)c(C(=O)c2ccccc2Cc2cccc3ccccc32)c(C)c1 ZINC000001656986 570503619 /nfs/dbraw/zinc/50/36/19/570503619.db2.gz VOBUGAGLHFXALX-UHFFFAOYSA-N 0 0 364.488 6.587 40 0 FKABRN Clc1ccc(Oc2nc(Cl)nc(Oc3ccc(Cl)cc3)n2)cc1 ZINC000001657287 570503576 /nfs/dbraw/zinc/50/35/76/570503576.db2.gz UJLTYAFXTVJVAL-UHFFFAOYSA-N 0 0 368.607 5.416 40 0 FKABRN Clc1nc(Oc2ccccc2Cl)nc(Oc2ccccc2Cl)n1 ZINC000001657288 570503613 /nfs/dbraw/zinc/50/36/13/570503613.db2.gz KWGGFSBFIIFECJ-UHFFFAOYSA-N 0 0 368.607 5.416 40 0 FKABRN Cc1c(C)c(C(=O)Cc2ccccc2)c(C)c(C(=O)Cc2ccccc2)c1C ZINC000001662252 570504004 /nfs/dbraw/zinc/50/40/04/570504004.db2.gz RFDTXAJUAZZFBG-UHFFFAOYSA-N 0 0 370.492 5.771 40 0 FKABRN CCOP(=O)(Nc1ccc2c(c1)Cc1cc(Cl)ccc1-2)OCC ZINC000001662438 570504062 /nfs/dbraw/zinc/50/40/62/570504062.db2.gz DWLAYRHEOGVGCT-UHFFFAOYSA-N 0 0 351.770 5.504 40 0 FKABRN O=C(c1ccc(Cl)cc1)[C@@H](Nc1ccccc1)c1ccc(Cl)cc1 ZINC000001663985 263144320 /nfs/dbraw/zinc/14/43/20/263144320.db2.gz FNKQIIMQTYKJKK-IBGZPJMESA-N 0 0 356.252 6.030 40 0 FKABRN O[C@H](c1ccc(Cl)cc1)[C@@H](Nc1ccccc1)c1ccc(Cl)cc1 ZINC000001663986 263144242 /nfs/dbraw/zinc/14/42/42/263144242.db2.gz KMNIXXUSNTVJHM-VQTJNVASSA-N 0 0 358.268 5.880 40 0 FKABRN O[C@H](c1ccc(Cl)cc1)[C@H](Nc1ccccc1)c1ccc(Cl)cc1 ZINC000001663987 263144209 /nfs/dbraw/zinc/14/42/09/263144209.db2.gz KMNIXXUSNTVJHM-WOJBJXKFSA-N 0 0 358.268 5.880 40 0 FKABRN O[C@@H](c1ccc(Cl)cc1)[C@@H](Nc1ccccc1)c1ccc(Cl)cc1 ZINC000001663988 263144252 /nfs/dbraw/zinc/14/42/52/263144252.db2.gz KMNIXXUSNTVJHM-PMACEKPBSA-N 0 0 358.268 5.880 40 0 FKABRN O[C@@H](c1ccc(Cl)cc1)[C@H](Nc1ccccc1)c1ccc(Cl)cc1 ZINC000001663989 263144231 /nfs/dbraw/zinc/14/42/31/263144231.db2.gz KMNIXXUSNTVJHM-UXHICEINSA-N 0 0 358.268 5.880 40 0 FKABRN Cc1cc(O)c(C(C)C)cc1NC(=S)Nc1cc(C(C)C)c(O)cc1C ZINC000001665043 210365856 /nfs/dbraw/zinc/36/58/56/210365856.db2.gz PYYQOOZYVPLIRE-UHFFFAOYSA-N 0 0 372.534 5.770 40 0 FKABRN Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccc(Br)cc1 ZINC000001665704 210366313 /nfs/dbraw/zinc/36/63/13/210366313.db2.gz NHGIZQKGWGEYJI-UHFFFAOYSA-N 0 0 363.255 5.231 40 0 FKABRN CCN(CC)c1ccc(N[C@@H](C(=O)c2ccccc2)c2ccccc2)cc1 ZINC000001666900 210365303 /nfs/dbraw/zinc/36/53/03/210365303.db2.gz UMKRQXBBEFYXRM-HSZRJFAPSA-N 0 0 358.485 5.569 40 0 FKABRN Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1cc(Cl)ccc1Cl ZINC000001667341 204016613 /nfs/dbraw/zinc/01/66/13/204016613.db2.gz DQSYOFZBLYRZCR-UHFFFAOYSA-N 0 0 353.249 5.775 40 0 FKABRN C[C@]12O[C@H](c3ccccc3)[C@](C)(C1=O)C(c1ccccc1)=C2c1ccccc1 ZINC000001667695 570504053 /nfs/dbraw/zinc/50/40/53/570504053.db2.gz KOFXUASYYBAGTQ-LGPLSSKUSA-N 0 0 366.460 5.717 40 0 FKABRN Cc1ccccc1N[P@]1(=O)OCCCN1Cc1ccccc1Cl ZINC000001667931 204015983 /nfs/dbraw/zinc/01/59/83/204015983.db2.gz ZBYOZLJGPPQQHR-QHCPKHFHSA-N 0 0 350.786 5.091 40 0 FKABRN c1ccc2cc(OCCOCCOc3ccc4ccccc4c3)ccc2c1 ZINC000001669828 210365727 /nfs/dbraw/zinc/36/57/27/210365727.db2.gz YXUDAKFADPXOHE-UHFFFAOYSA-N 0 0 358.437 5.467 40 0 FKABRN c1ccc2cc(Nc3cccc(Nc4ccc5ccccc5c4)c3)ccc2c1 ZINC000001669829 204016545 /nfs/dbraw/zinc/01/65/45/204016545.db2.gz AJOAZEMNFCIPMQ-UHFFFAOYSA-N 0 0 360.460 7.480 40 0 FKABRN ClC1=C(Cl)[C@@]2(Cl)C(c3ccccc3)=C[C@]1(Cl)C2(Cl)Cl ZINC000001670559 210365362 /nfs/dbraw/zinc/36/53/62/210365362.db2.gz YTYROSMTUXHMPY-NEPJUHHUSA-N 0 0 374.909 5.916 40 0 FKABRN ClC1=C(Cl)[C@@]2(Cl)C=C(c3ccccc3)[C@]1(Cl)C2(Cl)Cl ZINC000001670560 210366578 /nfs/dbraw/zinc/36/65/78/210366578.db2.gz YTYROSMTUXHMPY-NWDGAFQWSA-N 0 0 374.909 5.916 40 0 FKABRN C(/C=C/c1ccc(-c2ccccc2)cc1)=C\c1ccc(-c2ccccc2)cc1 ZINC000001670929 570503966 /nfs/dbraw/zinc/50/39/66/570503966.db2.gz FNGCNIQEQUNTCR-FIFLTTCUSA-N 0 0 358.484 7.747 40 0 FKABRN CCC(=O)O[C@@H]1CC[C@H]2[C@@H]3C[C@H](C)[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000001670991 570503963 /nfs/dbraw/zinc/50/39/63/570503963.db2.gz OIHORBOMFNFQBP-YMWIJFBKSA-N 0 0 360.538 5.166 40 0 FKABRN O=C(c1ccccc1Cl)[C@H](Nc1ccccc1)c1ccccc1Cl ZINC000001671901 570504121 /nfs/dbraw/zinc/50/41/21/570504121.db2.gz ZNLDXUATLQISIG-LJQANCHMSA-N 0 0 356.252 6.030 40 0 FKABRN CCN(CC)c1ccc(Nc2ccc(CC(=O)c3ccccc3)cc2)cc1 ZINC000001671919 570503941 /nfs/dbraw/zinc/50/39/41/570503941.db2.gz ACRQLRWDJMXCIY-UHFFFAOYSA-N 0 0 358.485 5.702 40 0 in-vivo FKABRN O=C(Oc1ccc(Cl)cc1Cl)Oc1ccc(Cl)cc1Cl ZINC000001672044 570503982 /nfs/dbraw/zinc/50/39/82/570503982.db2.gz HBLSZXRYFSCREB-UHFFFAOYSA-N 0 0 352.000 5.878 40 0 FKABRN c1ccc(SC(Sc2ccccc2)c2ccc3c(c2)OCO3)cc1 ZINC000001672779 204015698 /nfs/dbraw/zinc/01/56/98/204015698.db2.gz CTZRGBQIQAQJIM-UHFFFAOYSA-N 0 0 352.480 5.999 40 0 in-vitro FKABRN Cc1ccc(OP(Oc2ccc(C)cc2)Oc2ccc(C)cc2)cc1 ZINC000001672973 210365452 /nfs/dbraw/zinc/36/54/52/210365452.db2.gz FEVFLQDDNUQKRY-UHFFFAOYSA-N 0 0 352.370 6.376 40 0 FKABRN O=[P@@]1(Nc2ccccc2)OCCCN1Cc1ccc(Cl)c(Cl)c1 ZINC000001674396 204016173 /nfs/dbraw/zinc/01/61/73/204016173.db2.gz UQRUMXNNLCPJRN-QHCPKHFHSA-N 0 0 371.204 5.436 40 0 FKABRN Cc1ccccc1N[P@]1(=O)OCCCN1Cc1ccc(Cl)cc1 ZINC000001674399 570503945 /nfs/dbraw/zinc/50/39/45/570503945.db2.gz SUXIXFFDAWGPIE-QHCPKHFHSA-N 0 0 350.786 5.091 40 0 FKABRN C=COC(=O)Sc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl ZINC000001674583 210366129 /nfs/dbraw/zinc/36/61/29/210366129.db2.gz WXSIDIDMEDMNQQ-UHFFFAOYSA-N 0 0 352.453 6.326 40 0 FKABRN CCOC(=O)/C(=C/c1cccc2ccccc12)P(=O)(OCC)OCC ZINC000001674637 204016131 /nfs/dbraw/zinc/01/61/31/204016131.db2.gz UXIVPFUAIKXJLT-JXAWBTAJSA-N 0 0 362.362 5.010 40 0 FKABRN CCCC[C@@H](CC)CNP(=O)(Oc1ccccc1)Oc1ccccc1 ZINC000001675286 570504356 /nfs/dbraw/zinc/50/43/56/570504356.db2.gz PYXAOGFFDJUJLS-GOSISDBHSA-N 0 0 361.422 6.059 40 0 FKABRN OC(c1ccc(Cl)cc1)(c1ccc(Cl)cc1)C(F)(Cl)Cl ZINC000001675578 570504417 /nfs/dbraw/zinc/50/44/17/570504417.db2.gz YOIFHPFEVRRPJF-UHFFFAOYSA-N 0 0 354.035 5.330 40 0 FKABRN Cc1cc(C)cc(NNc2cc(Br)cc(Br)c2)c1 ZINC000001675950 206891857 /nfs/dbraw/zinc/89/18/57/206891857.db2.gz JOESANGUNBNQIG-UHFFFAOYSA-N 0 0 370.088 5.267 40 0 FKABRN Clc1c(SCc2ccccc2)ncnc1SCc1ccccc1 ZINC000001676003 210365968 /nfs/dbraw/zinc/36/59/68/210365968.db2.gz NLEZHNVZIWFZIG-UHFFFAOYSA-N 0 0 358.919 5.715 40 0 FKABRN CCCc1cc([C@H](CC)[C@@H](CC)c2ccc(O)c(CCC)c2)ccc1O ZINC000001677709 570504316 /nfs/dbraw/zinc/50/43/16/570504316.db2.gz VIUBQLSSDPDWRH-VXKWHMMOSA-N 0 0 354.534 6.690 40 0 FKABRN CCCc1cc([C@@H](CC)[C@H](CC)c2ccc(O)c(CCC)c2)ccc1O ZINC000001677710 204016693 /nfs/dbraw/zinc/01/66/93/204016693.db2.gz VIUBQLSSDPDWRH-FGZHOGPDSA-N 0 0 354.534 6.690 40 0 FKABRN CC(C)OP(=O)(OC(C)C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000001679141 204016082 /nfs/dbraw/zinc/01/60/82/204016082.db2.gz NVIKINKSKIRSJR-UHFFFAOYSA-N 0 0 354.170 5.568 40 0 FKABRN CCCOP(=O)(OCCC)C(=O)Nc1ccc(Br)cc1 ZINC000001679143 210365046 /nfs/dbraw/zinc/36/50/46/210365046.db2.gz SNLFTLTYTBPJHT-UHFFFAOYSA-N 0 0 364.176 5.027 40 0 FKABRN CSc1ncc(Br)c(Nc2ccc(Cl)c(Cl)c2)n1 ZINC000001679409 570504597 /nfs/dbraw/zinc/50/45/97/570504597.db2.gz WETOVCDWESMINS-UHFFFAOYSA-N 0 0 365.083 5.011 40 0 FKABRN CCCCNc1nc(SCc2ccc(Cl)cc2Cl)ncc1C ZINC000001679415 206892873 /nfs/dbraw/zinc/89/28/73/206892873.db2.gz AFSULSPZSBLCIY-UHFFFAOYSA-N 0 0 356.322 5.596 40 0 FKABRN Cc1ccc(O)c(Cc2cc(Cl)cc(Cc3cc(C)ccc3O)c2[O-])c1 ZINC000001679636 571248640 /nfs/dbraw/zinc/24/86/40/571248640.db2.gz BWZRLHQJZYOXOA-UHFFFAOYSA-N 0 0 368.860 5.255 40 0 FKABRN Cc1cc(C)c(O)c(Cc2cccc(Cc3cc(C)cc(C)c3O)c2O)c1 ZINC000001679639 210365206 /nfs/dbraw/zinc/36/52/06/210365206.db2.gz ZBVMHRPGUVTUBV-UHFFFAOYSA-N 0 0 362.469 5.219 40 0 in-vitro FKABRN Clc1ccc(Cl)c(Nc2ccnc(SCc3ccccc3)n2)c1 ZINC000001679759 560183746 /nfs/dbraw/zinc/18/37/46/560183746.db2.gz NMZQXFCSDNBWFV-UHFFFAOYSA-N 0 0 362.285 5.819 40 0 in-vitro FKABRN C[C@H](CCc1ccc(OC(=O)c2ccccc2)cc1)OC(=O)c1ccccc1 ZINC000001680263 210366136 /nfs/dbraw/zinc/36/61/36/210366136.db2.gz NCAAUHIYNZZUAB-GOSISDBHSA-N 0 0 374.436 5.084 40 0 FKABRN CC(=O)N(COc1ccc2ccccc2c1)COc1ccc2ccccc2c1 ZINC000001680964 204015859 /nfs/dbraw/zinc/01/58/59/204015859.db2.gz NSJZXWDHGFQEMV-UHFFFAOYSA-N 0 0 371.436 5.214 40 0 FKABRN O=C(Oc1cc(Cl)c(Cl)cc1Cl)c1ccc(Cl)cc1Cl ZINC000001681455 570504607 /nfs/dbraw/zinc/50/46/07/570504607.db2.gz YKBGBWKNWHJWFR-UHFFFAOYSA-N 0 0 370.446 6.173 40 0 FKABRN COc1cc(C(CC(=O)c2ccccc2)CC(=O)c2ccccc2)ccc1O ZINC000001681526 570504617 /nfs/dbraw/zinc/50/46/17/570504617.db2.gz JFGKMBQRWSRGFP-UHFFFAOYSA-N 0 0 374.436 5.030 40 0 FKABRN O=C(Nc1ccc(Br)cc1-c1ccccc1)c1ccccc1 ZINC000001682307 206892307 /nfs/dbraw/zinc/89/23/07/206892307.db2.gz OLWIHTQPXRCRFK-UHFFFAOYSA-N 0 0 352.231 5.368 40 0 FKABRN O=C(Nc1ccccc1)C(Cl)=C1C(Cl)=C(Cl)C(Cl)=C1Cl ZINC000001683529 219415629 /nfs/dbraw/zinc/41/56/29/219415629.db2.gz SSJCXFQAYVYZGU-UHFFFAOYSA-N 0 0 369.462 5.510 40 0 FKABRN Cl[C@@]1(c2ccccc2)OCCOC1(c1ccccc1)c1ccccc1 ZINC000001684661 570504324 /nfs/dbraw/zinc/50/43/24/570504324.db2.gz GZCUZZBVNFDHCQ-QFIPXVFZSA-N 0 0 350.845 5.069 40 0 FKABRN CC(C)(Cl)C(=O)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl ZINC000001684808 570504328 /nfs/dbraw/zinc/50/43/28/570504328.db2.gz SYDVCIYNOQRLFQ-UHFFFAOYSA-N 0 0 370.874 5.876 40 0 FKABRN CC(=O)O[C@@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(F)(F)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000001684827 570504311 /nfs/dbraw/zinc/50/43/11/570504311.db2.gz BUIQHUBDLNDWCY-HSXTZPDUSA-N 0 0 354.481 5.596 40 0 FKABRN CCN(c1ccc(Br)cc1)c1ccc(Br)cc1 ZINC000001686634 570504400 /nfs/dbraw/zinc/50/44/00/570504400.db2.gz FHIKFPXFLDHXGZ-UHFFFAOYSA-N 0 0 355.073 5.370 40 0 FKABRN CCC(=O)O[C@@H]1CC[C@H]2[C@@H]3CC[C@@]4(C)CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000001686691 570504336 /nfs/dbraw/zinc/50/43/36/570504336.db2.gz WDCJNWGWSPGXBU-ZAZLRJHESA-N 0 0 360.538 5.310 40 0 FKABRN O=C1c2ccccc2[C@](c2ccccc2)(N2CCCCC2)N1c1ccccc1 ZINC000001686907 204017442 /nfs/dbraw/zinc/01/74/42/204017442.db2.gz XOFLLIGIYUYVOD-RUZDIDTESA-N 0 0 368.480 5.034 40 0 FKABRN Clc1c(Cl)c(Cl)c(SCc2ccccc2)c(Cl)c1Cl ZINC000001687468 210365885 /nfs/dbraw/zinc/36/58/85/210365885.db2.gz KYUMKYGLPMWORT-UHFFFAOYSA-N 0 0 372.531 7.246 40 0 FKABRN CC(C)OC(=O)Nc1ccc(-c2ccc(NC(=O)OC(C)C)cc2)cc1 ZINC000001688148 210365751 /nfs/dbraw/zinc/36/57/51/210365751.db2.gz JCZSQMPAVPDRMC-UHFFFAOYSA-N 0 0 356.422 5.267 40 0 FKABRN CCCCOC(=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)OC ZINC000001688871 204017322 /nfs/dbraw/zinc/01/73/22/204017322.db2.gz QCGIWDQTELRVRW-UHFFFAOYSA-N 0 0 374.047 5.044 40 0 FKABRN Cc1cc(C)c(-c2oc(-c3c(C)cc(C)cc3C)c3ccccc32)c(C)c1 ZINC000001689998 210365272 /nfs/dbraw/zinc/36/52/72/210365272.db2.gz NDCFOZQLVARBFP-UHFFFAOYSA-N 0 0 354.493 7.617 40 0 FKABRN Cc1c2cc(C(C)(C)c3ccccc3)ccc2[nH]c1C(C)(C)c1ccccc1 ZINC000001691955 219416063 /nfs/dbraw/zinc/41/60/63/219416063.db2.gz QGCKKHVGKYNLBK-UHFFFAOYSA-N 0 0 367.536 7.128 40 0 FKABRN CCOC(=O)C(C)(c1[nH]c2ccccc2c1C)c1[nH]c2ccccc2c1C ZINC000001691957 204017258 /nfs/dbraw/zinc/01/72/58/204017258.db2.gz OZIOGZXYRIDFKQ-UHFFFAOYSA-N 0 0 360.457 5.135 40 0 FKABRN O=C1c2cc(Br)ccc2-c2c1cc(Br)cc2Cl ZINC000001692047 570504703 /nfs/dbraw/zinc/50/47/03/570504703.db2.gz RPYMQMJNHXPZMN-UHFFFAOYSA-N 0 0 372.443 5.076 40 0 FKABRN CSc1nc(Cl)c(Nc2ccc(Cl)c(Cl)c2)c(Cl)n1 ZINC000001692431 204017407 /nfs/dbraw/zinc/01/74/07/204017407.db2.gz NDAJYJXFLJOUQF-UHFFFAOYSA-N 0 0 355.077 5.556 40 0 FKABRN CC(=O)[C@H]1c2ccccc2[C@](C(C)=O)(c2ccccc2)[C@@H]1c1ccccc1 ZINC000001692702 570504805 /nfs/dbraw/zinc/50/48/05/570504805.db2.gz RNKAQPXYHASEMI-GVAUOCQISA-N 0 0 354.449 5.032 40 0 FKABRN Clc1nncc(SCc2ccccc2)c1SCc1ccccc1 ZINC000001693181 210366500 /nfs/dbraw/zinc/36/65/00/210366500.db2.gz QDHXRHUGDGBXDW-UHFFFAOYSA-N 0 0 358.919 5.715 40 0 FKABRN c1ccc(CSc2ccc3nncc(SCc4ccccc4)c3c2)cc1 ZINC000001693190 571249199 /nfs/dbraw/zinc/24/91/99/571249199.db2.gz XQMJVNPACMENQI-UHFFFAOYSA-N 0 0 374.534 6.214 40 0 FKABRN O=C(COc1c(Cl)cc(Cl)c(Cl)c1Cl)NC1CCCCC1 ZINC000001693575 571249216 /nfs/dbraw/zinc/24/92/16/571249216.db2.gz FTUHROOCYOPNJT-UHFFFAOYSA-N 0 0 371.091 5.128 40 0 FKABRN CCOP(=O)(CCOc1cc(Cl)c(Cl)cc1Cl)OCC ZINC000001694639 571249185 /nfs/dbraw/zinc/24/91/85/571249185.db2.gz RMLMYKSAELCSQG-UHFFFAOYSA-N 0 0 361.589 5.292 40 0 FKABRN COc1ccc(C(SCc2ccccc2)SCc2ccccc2)cc1 ZINC000001696685 570504798 /nfs/dbraw/zinc/50/47/98/570504798.db2.gz XXCULLCDFXVZRH-UHFFFAOYSA-N 0 0 366.551 6.561 40 0 FKABRN CCOP(=O)(Nc1cc2c(cc1Cl)-c1ccccc1C2=O)OCC ZINC000001699690 210365558 /nfs/dbraw/zinc/36/55/58/210365558.db2.gz VGASVABEPVIAJX-UHFFFAOYSA-N 0 0 365.753 5.144 40 0 FKABRN Nc1ccc(-c2ccc(N)c(Oc3ccccc3)c2)cc1Oc1ccccc1 ZINC000001700510 219415974 /nfs/dbraw/zinc/41/59/74/219415974.db2.gz HIZMHZUNSCYTSM-UHFFFAOYSA-N 0 0 368.436 6.103 40 0 FKABRN Cc1cc(Cl)nc2ccc(Cc3ccc4nc(Cl)cc(C)c4c3)cc12 ZINC000001701460 560184088 /nfs/dbraw/zinc/18/40/88/560184088.db2.gz RVHRUJSUMLKIHE-UHFFFAOYSA-N 0 0 367.279 6.297 40 0 in-vitro FKABRN c1cc(CCCCCCCCCCc2ccc3c(c2)CCC3)cc2c1CCC2 ZINC000001703239 204017291 /nfs/dbraw/zinc/01/72/91/204017291.db2.gz JBKAJYLVPBVSBI-UHFFFAOYSA-N 0 0 374.612 7.570 40 0 FKABRN CC(=O)c1cc(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cc12 ZINC000001703591 570504945 /nfs/dbraw/zinc/50/49/45/570504945.db2.gz JDUIVSHBIXUJGP-UHFFFAOYSA-N 0 0 350.632 6.065 40 0 FKABRN COC(=O)c1cc(-c2ccc(Cl)cc2)nc2cc(Cl)c(OC)cc21 ZINC000001703602 204017415 /nfs/dbraw/zinc/01/74/15/204017415.db2.gz ZFQZFEALFKSCST-UHFFFAOYSA-N 0 0 362.212 5.004 40 0 FKABRN CC[C@@H](c1ccc(OC)cc1)[C@@H](CC)c1ccc(OCOC(C)=O)cc1 ZINC000001705432 570504811 /nfs/dbraw/zinc/50/48/11/570504811.db2.gz RZWYEKGKFDVTDP-VXKWHMMOSA-N 0 0 356.462 5.282 40 0 FKABRN CC[C@@H](c1ccc(OCOC(C)=O)cc1)[C@H](CC)c1ccc(OC)cc1 ZINC000001705433 210365406 /nfs/dbraw/zinc/36/54/06/210365406.db2.gz RZWYEKGKFDVTDP-YADHBBJMSA-N 0 0 356.462 5.282 40 0 FKABRN CC[C@@H](c1ccc(OC)cc1)[C@H](CC)c1ccc(OCOC(C)=O)cc1 ZINC000001705434 570504748 /nfs/dbraw/zinc/50/47/48/570504748.db2.gz RZWYEKGKFDVTDP-FCHUYYIVSA-N 0 0 356.462 5.282 40 0 FKABRN CC[C@H](c1ccc(OC)cc1)[C@H](CC)c1ccc(OCOC(C)=O)cc1 ZINC000001705435 570504776 /nfs/dbraw/zinc/50/47/76/570504776.db2.gz RZWYEKGKFDVTDP-FGZHOGPDSA-N 0 0 356.462 5.282 40 0 FKABRN O=C(c1ccccc1)N1c2ccccc2Sc2cc3ccccc3cc21 ZINC000001705769 132382310 /nfs/dbraw/zinc/38/23/10/132382310.db2.gz AVGOWIKOHJXCCQ-UHFFFAOYSA-N 0 0 353.446 6.283 40 0 FKABRN O=C(CN1CCCCC1)N1c2ccccc2Sc2cc3ccccc3cc21 ZINC000001705770 132382269 /nfs/dbraw/zinc/38/22/69/132382269.db2.gz VEWLAKCSTPGRJF-UHFFFAOYSA-N 0 0 374.509 5.455 40 0 FKABRN Cc1ccc(-c2nc(-c3nccc4ccccc43)oc2-c2ccccc2)cc1 ZINC000001705919 210368138 /nfs/dbraw/zinc/36/81/38/210368138.db2.gz IOAOVPFXAIBMCW-UHFFFAOYSA-N 0 0 362.432 6.532 40 0 in-vitro FKABRN O=C(C[C@H]1C=Cc2ccccc2N1C(=O)c1ccccc1)c1ccccc1 ZINC000001705925 132382214 /nfs/dbraw/zinc/38/22/14/132382214.db2.gz YEANANYGJKAFAG-OAQYLSRUSA-N 0 0 353.421 5.002 40 0 in-vitro FKABRN O=C1c2ccccc2-c2cc(Br)c(NCc3ccccc3)cc21 ZINC000001706825 570504767 /nfs/dbraw/zinc/50/47/67/570504767.db2.gz FKGLQQJDTIQSDI-UHFFFAOYSA-N 0 0 364.242 5.273 40 0 FKABRN Br/C(Cc1ccccc1)=C(/Br)Cc1ccccc1 ZINC000001707165 570504894 /nfs/dbraw/zinc/50/48/94/570504894.db2.gz LGDCZULANHVHFY-FOCLMDBBSA-N 0 0 366.096 5.473 40 0 FKABRN CC(=O)O[C@@H]1C(c2ccccc2)=C(c2ccccc2)O[C@@H]1c1ccccc1 ZINC000001707628 570505241 /nfs/dbraw/zinc/50/52/41/570505241.db2.gz PRDNSCQNLIWGBQ-DNQXCXABSA-N 0 0 356.421 5.258 40 0 FKABRN CC(=O)O[C@H]1C(c2ccccc2)=C(c2ccccc2)O[C@@H]1c1ccccc1 ZINC000001707629 570505328 /nfs/dbraw/zinc/50/53/28/570505328.db2.gz PRDNSCQNLIWGBQ-RPWUZVMVSA-N 0 0 356.421 5.258 40 0 FKABRN CC(=O)O[C@@H]1C(c2ccccc2)=C(c2ccccc2)O[C@H]1c1ccccc1 ZINC000001707630 570505288 /nfs/dbraw/zinc/50/52/88/570505288.db2.gz PRDNSCQNLIWGBQ-BJKOFHAPSA-N 0 0 356.421 5.258 40 0 FKABRN CC(=O)O[C@H]1C(c2ccccc2)=C(c2ccccc2)O[C@H]1c1ccccc1 ZINC000001707631 570505157 /nfs/dbraw/zinc/50/51/57/570505157.db2.gz PRDNSCQNLIWGBQ-ZEQRLZLVSA-N 0 0 356.421 5.258 40 0 FKABRN O=C(/C=C/c1ccccc1)N1c2ccccc2C[C@H]1c1c[nH]c2ccccc21 ZINC000001708997 570505094 /nfs/dbraw/zinc/50/50/94/570505094.db2.gz DMQRESCOMHWLMW-ZXYASIKESA-N 0 0 364.448 5.512 40 0 FKABRN C[C@H]1CCC[C@@H](C(c2c[nH]c3ccccc32)c2c[nH]c3ccccc32)C1=O ZINC000001709021 570505261 /nfs/dbraw/zinc/50/52/61/570505261.db2.gz BDKKAZPMAWNHHE-YJBOKZPZSA-N 0 0 356.469 5.786 40 0 FKABRN C[C@@H]1CCC[C@@H](C(c2c[nH]c3ccccc32)c2c[nH]c3ccccc32)C1=O ZINC000001709022 570505202 /nfs/dbraw/zinc/50/52/02/570505202.db2.gz BDKKAZPMAWNHHE-QAPCUYQASA-N 0 0 356.469 5.786 40 0 FKABRN C[C@H]1CCC[C@H](C(c2c[nH]c3ccccc32)c2c[nH]c3ccccc32)C1=O ZINC000001709023 210367118 /nfs/dbraw/zinc/36/71/18/210367118.db2.gz BDKKAZPMAWNHHE-MAUKXSAKSA-N 0 0 356.469 5.786 40 0 FKABRN C[C@@H]1CCC[C@H](C(c2c[nH]c3ccccc32)c2c[nH]c3ccccc32)C1=O ZINC000001709024 570505313 /nfs/dbraw/zinc/50/53/13/570505313.db2.gz BDKKAZPMAWNHHE-CRAIPNDOSA-N 0 0 356.469 5.786 40 0 FKABRN Clc1ccnc2c(Br)c(Cl)cc(Br)c12 ZINC000001710743 570505267 /nfs/dbraw/zinc/50/52/67/570505267.db2.gz XBJDXWCPIZHOCR-UHFFFAOYSA-N 0 0 355.844 5.067 40 0 FKABRN CCC(C)(C)OC(=O)Nc1ccc(C)c(NC(=O)OC(C)(C)CC)c1 ZINC000001711200 570505141 /nfs/dbraw/zinc/50/51/41/570505141.db2.gz PPHAMAPDJVFCRS-UHFFFAOYSA-N 0 0 350.459 5.469 40 0 FKABRN CC(=O)O[C@]1(C)C(=C(Cl)Cl)C2c3ccccc3C1c1ccccc12 ZINC000001711926 206893868 /nfs/dbraw/zinc/89/38/68/206893868.db2.gz DNQJDTRWFGGUIA-UHYCVJNDSA-N 0 0 359.252 5.288 40 0 FKABRN O=P(Nc1ccccc1)(OCc1ccccc1)OCc1ccccc1 ZINC000001712134 570505133 /nfs/dbraw/zinc/50/51/33/570505133.db2.gz QHAMRRYRTCVVSF-UHFFFAOYSA-N 0 0 353.358 5.640 40 0 FKABRN O=P(NCc1ccccc1)(OCc1ccccc1)OCc1ccccc1 ZINC000001712140 570505257 /nfs/dbraw/zinc/50/52/57/570505257.db2.gz KACDMMDAWRUYBT-UHFFFAOYSA-N 0 0 367.385 5.318 40 0 FKABRN O=C(N[C@H](c1ccccc1)C(Cl)(Cl)c1ccccc1)c1ccccc1 ZINC000001712328 570505506 /nfs/dbraw/zinc/50/55/06/570505506.db2.gz CZHBXWZDLKZHAW-LJQANCHMSA-N 0 0 370.279 5.488 40 0 FKABRN Cc1cc(Cc2ccccc2Cl)ccc1OC(=O)c1ccc(Cl)cc1 ZINC000001712788 206893692 /nfs/dbraw/zinc/89/36/92/206893692.db2.gz ZVKQGCBKOWTAMZ-UHFFFAOYSA-N 0 0 371.263 6.112 40 0 FKABRN Cc1cc(Cc2ccc(Cl)cc2)ccc1OC(=O)c1ccc(Cl)cc1 ZINC000001712789 571249233 /nfs/dbraw/zinc/24/92/33/571249233.db2.gz LRFZJMZWLQOTMW-UHFFFAOYSA-N 0 0 371.263 6.112 40 0 FKABRN C[C@@H](/C=C/c1ccc(Br)cc1)c1ccc(Br)cc1 ZINC000001712857 570505548 /nfs/dbraw/zinc/50/55/48/570505548.db2.gz ZIBMZYVKNSKPBU-JDGPPOGSSA-N 0 0 366.096 6.029 40 0 FKABRN C[C@H](/C=C/c1ccc(Br)cc1)c1ccc(Br)cc1 ZINC000001712859 570505554 /nfs/dbraw/zinc/50/55/54/570505554.db2.gz ZIBMZYVKNSKPBU-QAVQXKDTSA-N 0 0 366.096 6.029 40 0 FKABRN CCCCC1=C(P(=O)(OCC)OCC)C(F)(F)C(F)(F)C1(F)F ZINC000001713070 570505629 /nfs/dbraw/zinc/50/56/29/570505629.db2.gz WTDKIUIWKUUAAP-UHFFFAOYSA-N 0 0 368.254 5.616 40 0 FKABRN CC(C)CCOC(=O)c1cc2ccccc2cc1C(=O)OCCC(C)C ZINC000001713088 570505585 /nfs/dbraw/zinc/50/55/85/570505585.db2.gz SMZRPVSSAVLTSY-UHFFFAOYSA-N 0 0 356.462 5.246 40 0 FKABRN CCOP(=O)(OCC)C1=C(SCC)C(F)(F)C(F)(F)C1(F)F ZINC000001713093 210368275 /nfs/dbraw/zinc/36/82/75/210368275.db2.gz FAHDOMPKBWHPNY-UHFFFAOYSA-N 0 0 372.267 5.137 40 0 FKABRN CCC1=C(c2ccc(OC)cc2)C(C)(C)Oc2cc(OC(C)=O)ccc21 ZINC000001713463 560184360 /nfs/dbraw/zinc/18/43/60/560184360.db2.gz HZTLJZSOMGPVTM-UHFFFAOYSA-N 0 0 352.430 5.112 40 0 in-vitro FKABRN CCCC1=C(c2ccc(OC)cc2)C(C)(C)Oc2cc(OC(C)=O)ccc21 ZINC000001713464 560184336 /nfs/dbraw/zinc/18/43/36/560184336.db2.gz NSETTWBXUXKUOF-UHFFFAOYSA-N 0 0 366.457 5.502 40 0 in-vitro FKABRN O=C(OC1CCCCC1)[C@H]1C(=O)C[C@H](c2ccccc2)[C@H]1c1ccccc1 ZINC000001713628 210367558 /nfs/dbraw/zinc/36/75/58/210367558.db2.gz JSHJFTGXJFYJMM-MZYLBHOOSA-N 0 0 362.469 5.019 40 0 FKABRN COc1ccc(/C=C/c2cc(/C=C/c3ccc(OC)cc3)c(N)cc2N)cc1 ZINC000001714431 570505615 /nfs/dbraw/zinc/50/56/15/570505615.db2.gz RXBPXGIEMLRJMB-LQIBPGRFSA-N 0 0 372.468 5.209 40 0 FKABRN C(c1ccccc1)=C1c2c(ccc3ccccc32)Oc2ccc3ccccc3c21 ZINC000001715122 210367289 /nfs/dbraw/zinc/36/72/89/210367289.db2.gz HFUICCPXFBIFMB-UHFFFAOYSA-N 0 0 370.451 7.688 40 0 FKABRN COc1cc2cccnc2c(Nc2ccc(Oc3ccc(O)cc3)cc2)c1 ZINC000001717586 210367515 /nfs/dbraw/zinc/36/75/15/210367515.db2.gz PHGYBLRYEBZGQT-UHFFFAOYSA-N 0 0 358.397 5.485 40 0 FKABRN NC(=O)c1c(-c2ccccc2)c2c3ccccc3ccn2c1-c1ccccc1 ZINC000001718212 570505635 /nfs/dbraw/zinc/50/56/35/570505635.db2.gz YOEPZPNFIZZEDI-UHFFFAOYSA-N 0 0 362.432 5.525 40 0 FKABRN CCCCSc1cc(C(=O)OCC)c2cc(Cl)cc(Cl)c2n1 ZINC000001718230 570505486 /nfs/dbraw/zinc/50/54/86/570505486.db2.gz YEQXRUITUBXMKF-UHFFFAOYSA-N 0 0 358.290 5.611 40 0 FKABRN Cc1cc(C)c(-c2cc(O)c(-c3c(C)cc(C)c(C)c3C)cc2O)c(C)c1C ZINC000001718637 219417037 /nfs/dbraw/zinc/41/70/37/219417037.db2.gz VLRWLVJPSDPSIO-UHFFFAOYSA-N 0 0 374.524 6.899 40 0 FKABRN Cc1cc(OCC(O)COc2cc(C)c(Cl)c(C)c2)cc(C)c1Cl ZINC000001718669 571311551 /nfs/dbraw/zinc/31/15/51/571311551.db2.gz FNYAMHVEMAPASS-UHFFFAOYSA-N 0 0 369.288 5.046 40 0 FKABRN CCC(=O)c1c(-c2ccccc2)[nH]c(-c2ccccc2)c1-c1ccccc1 ZINC000001718738 570505542 /nfs/dbraw/zinc/50/55/42/570505542.db2.gz ICXAWGXMPXMUKL-UHFFFAOYSA-N 0 0 351.449 6.608 40 0 FKABRN c1ccc2c(c1)Cc1cc(NNc3ccc4c(c3)Cc3ccccc3-4)ccc1-2 ZINC000001719566 571249156 /nfs/dbraw/zinc/24/91/56/571249156.db2.gz CAGLTNAOEQSKLI-UHFFFAOYSA-N 0 0 360.460 6.268 40 0 FKABRN CC(=O)Oc1ccc(C(c2ccc(OC(C)=O)cc2)[C@@H]2CC=CCC2)cc1 ZINC000001719869 219416802 /nfs/dbraw/zinc/41/68/02/219416802.db2.gz PQWHISPSOTUKEL-GOSISDBHSA-N 0 0 364.441 5.025 40 0 FKABRN Clc1ccc(-c2cc(-c3ccc(Cl)cc3)n(-c3ccccc3)n2)cc1 ZINC000001719996 219417243 /nfs/dbraw/zinc/41/72/43/219417243.db2.gz CFUKVDGORIYESD-UHFFFAOYSA-N 0 0 365.263 6.513 40 0 FKABRN COc1ccc(-c2cc(-c3ccc(Cl)cc3)n(-c3ccccc3)n2)cc1 ZINC000001719997 210368255 /nfs/dbraw/zinc/36/82/55/210368255.db2.gz NIABHPPISVHWPZ-UHFFFAOYSA-N 0 0 360.844 5.868 40 0 FKABRN Clc1ccc(-c2cc(-c3ccccc3)nn2-c2ccc(Cl)cc2)cc1 ZINC000001719998 210367229 /nfs/dbraw/zinc/36/72/29/210367229.db2.gz DDWSBPXXVYZECX-UHFFFAOYSA-N 0 0 365.263 6.513 40 0 FKABRN c1ccc(C2C(c3ccccc3)C(c3ccccc3)C2c2ccccc2)cc1 ZINC000001721794 210367146 /nfs/dbraw/zinc/36/71/46/210367146.db2.gz RJWNMNWMVUOVHV-UHFFFAOYSA-N 0 0 360.500 7.135 40 0 FKABRN CC(=O)C[C@H]1CCc2ccc3ccccc3c2[C@H]1c1cccc2ccccc21 ZINC000001722263 210367951 /nfs/dbraw/zinc/36/79/51/210367951.db2.gz PSUHDCHDMUHPFQ-AJTFRIOCSA-N 0 0 364.488 6.666 40 0 FKABRN CC(=O)C[C@@H]1CCc2ccc3ccccc3c2[C@H]1c1cccc2ccccc21 ZINC000001722264 210368312 /nfs/dbraw/zinc/36/83/12/210368312.db2.gz PSUHDCHDMUHPFQ-WXVAWEFUSA-N 0 0 364.488 6.666 40 0 FKABRN CC(=O)C[C@H]1CCc2ccc3ccccc3c2[C@@H]1c1cccc2ccccc21 ZINC000001722265 570506056 /nfs/dbraw/zinc/50/60/56/570506056.db2.gz PSUHDCHDMUHPFQ-AMGIVPHBSA-N 0 0 364.488 6.666 40 0 FKABRN CC(=O)C[C@@H]1CCc2ccc3ccccc3c2[C@@H]1c1cccc2ccccc21 ZINC000001722266 219416552 /nfs/dbraw/zinc/41/65/52/219416552.db2.gz PSUHDCHDMUHPFQ-CUNXSJBXSA-N 0 0 364.488 6.666 40 0 FKABRN CC(=O)c1ccccc1[C@H](C)c1ccc(Br)c2ccccc21 ZINC000001722281 571311605 /nfs/dbraw/zinc/31/16/05/571311605.db2.gz HSPMSMQEQJDROB-ZDUSSCGKSA-N 0 0 353.259 5.957 40 0 FKABRN Clc1ccc2c(c1)/C(=C/c1cccnc1)c1cc(Cl)cc(Cl)c1-2 ZINC000001722527 210368468 /nfs/dbraw/zinc/36/84/68/210368468.db2.gz KHTICSQHPDGZJB-UUASQNMZSA-N 0 0 358.655 6.611 40 0 FKABRN c1ccc(NN(c2ccccc2)C(c2ccccc2)c2ccccc2)cc1 ZINC000001723164 204017886 /nfs/dbraw/zinc/01/78/86/204017886.db2.gz YXESRKDORWIWKZ-UHFFFAOYSA-N 0 0 350.465 6.310 40 0 FKABRN Brc1c(Br)c(-c2ccccc2)nc2ccccc12 ZINC000001724703 210368428 /nfs/dbraw/zinc/36/84/28/210368428.db2.gz VCDSZBBXLSQKDD-UHFFFAOYSA-N 0 0 363.052 5.427 40 0 FKABRN CC(C)c1cc(C(C)C)c(S(=O)(=O)/C=C/c2ccccc2)c(C(C)C)c1 ZINC000001725424 206893147 /nfs/dbraw/zinc/89/31/47/206893147.db2.gz JDCBWDMWRVHKRK-OUKQBFOZSA-N 0 0 370.558 6.501 40 0 FKABRN CC(C)(C(=O)c1ccccc1)[C@@H](OC(=O)c1ccccc1)c1ccccc1 ZINC000001726773 204017923 /nfs/dbraw/zinc/01/79/23/204017923.db2.gz MJKOVHMVOGRLLG-QFIPXVFZSA-N 0 0 358.437 5.494 40 0 FKABRN CCOC(Cc1cccc2ccccc21)(c1ccccc1)c1ccccc1 ZINC000001727311 204018919 /nfs/dbraw/zinc/01/89/19/204018919.db2.gz OMBHFZNBAXKZSO-UHFFFAOYSA-N 0 0 352.477 6.363 40 0 FKABRN Cc1ccc(S(=O)(=O)/C=C(/C=C/c2ccccc2)c2ccccc2)cc1 ZINC000001727719 204017891 /nfs/dbraw/zinc/01/78/91/204017891.db2.gz QQDNIDJIUIOMIN-CESFLCHSSA-N 0 0 360.478 5.523 40 0 FKABRN O=C(Nc1ccc(NC(=O)c2ccccc2)c2ccccc12)c1ccccc1 ZINC000001727939 210368252 /nfs/dbraw/zinc/36/82/52/210368252.db2.gz XVPMQVGFUKFASI-UHFFFAOYSA-N 0 0 366.420 5.344 40 0 FKABRN COC(=O)c1c(C)c(-c2ccccc2)c(-c2ccccc2)c(C)c1C(=O)OC ZINC000001731806 204018362 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c1ccc([C@H]2C[C@@H](c3ccccc3)n3c4ccccc4c4c3[C@@H]2CCC4)cc1 ZINC000002329084 570654712 /nfs/dbraw/zinc/65/47/12/570654712.db2.gz FHODAKNLNSDHSR-MZKUHISZSA-N 0 0 363.504 6.838 40 0 FKABRN O=C(Nc1ccc2ccccc2c1)N1c2ccccc2Sc2ccccc21 ZINC000002336814 132383142 /nfs/dbraw/zinc/38/31/42/132383142.db2.gz SCQCSTNUDBBQGR-UHFFFAOYSA-N 0 0 368.461 6.675 40 0 FKABRN C[C@]12C[C@H](CC(C)(C)C1)N(c1ncnc3c4cc(Cl)ccc4[nH]c31)C2 ZINC000002364534 210393263 /nfs/dbraw/zinc/39/32/63/210393263.db2.gz GWWNHPTXJAWKAF-RBZFPXEDSA-N 0 0 354.885 5.170 40 0 FKABRN CCn1c(SCc2ccc(C)c(C)c2)nc2sc(C)c(C)c2c1=O ZINC000002388488 570520375 /nfs/dbraw/zinc/52/03/75/570520375.db2.gz IZEGHIPKUQJMIY-UHFFFAOYSA-N 0 0 358.532 5.004 40 0 FKABRN S=c1sc2ccccc2n1CSc1nc(-c2ccccc2)no1 ZINC000002388818 204036599 /nfs/dbraw/zinc/03/65/99/204036599.db2.gz VMIZJJLLVMITKH-UHFFFAOYSA-N 0 0 357.485 5.232 40 0 FKABRN Cc1ccc(-n2c(SCc3cccc(C)c3)nnc2-c2ccccc2)cc1 ZINC000002446625 571146866 /nfs/dbraw/zinc/14/68/66/571146866.db2.gz HVWKEZRYVAWUKX-UHFFFAOYSA-N 0 0 371.509 5.843 40 0 FKABRN C[C@]12C[C@H](CC(C)(C)C1)N(C(=O)c1cc(-c3ccc(Cl)cc3)on1)C2 ZINC000002465518 204040450 /nfs/dbraw/zinc/04/04/50/204040450.db2.gz KTTNDFBJUZZYFH-YWZLYKJASA-N 0 0 358.869 5.036 40 0 FKABRN C[C@@]12C[C@@H](CC(C)(C)C1)N(C(=O)c1cc(-c3ccc(Cl)cc3)on1)C2 ZINC000002465520 571293252 /nfs/dbraw/zinc/29/32/52/571293252.db2.gz KTTNDFBJUZZYFH-FOIQADDNSA-N 0 0 358.869 5.036 40 0 FKABRN C[C@]12C[C@H](CC(C)(C)C1)N(C(=O)c1cc(-c3cccc(Cl)c3)on1)C2 ZINC000002465609 571293228 /nfs/dbraw/zinc/29/32/28/571293228.db2.gz HZSVNSHDFDKZCS-YWZLYKJASA-N 0 0 358.869 5.036 40 0 FKABRN C[C@@]12C[C@@H](CC(C)(C)C1)N(C(=O)c1cc(-c3cccc(Cl)c3)on1)C2 ZINC000002465611 204040963 /nfs/dbraw/zinc/04/09/63/204040963.db2.gz HZSVNSHDFDKZCS-FOIQADDNSA-N 0 0 358.869 5.036 40 0 FKABRN COc1ccccc1C(=O)Oc1c(CC(C)C)cc(C)cc1CC(C)C ZINC000002513775 204043044 /nfs/dbraw/zinc/04/30/44/204043044.db2.gz MXIBKFFRGFUAFU-UHFFFAOYSA-N 0 0 354.490 5.620 40 0 FKABRN O=C(Nc1ccccc1)c1cc2ccccc2cc1OC(=O)c1ccccc1 ZINC000002516267 570523585 /nfs/dbraw/zinc/52/35/85/570523585.db2.gz ADTBJFVXCOYHAO-UHFFFAOYSA-N 0 0 367.404 5.311 40 0 FKABRN CCCCC[C@@H](CC)OC(=O)c1ccccc1C(=O)OCc1ccccc1 ZINC000002521504 570523635 /nfs/dbraw/zinc/52/36/35/570523635.db2.gz AMJMHZXMMFYORT-LJQANCHMSA-N 0 0 368.473 5.559 40 0 FKABRN Clc1ccc(-c2ccc(Cl)c(Cl)c2Cl)c(Cl)c1Cl ZINC000002521556 570523913 /nfs/dbraw/zinc/52/39/13/570523913.db2.gz BTAGRXWGMYTPBY-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cccc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)c1Cl ZINC000002521557 570524207 /nfs/dbraw/zinc/52/42/07/570524207.db2.gz VQQKIXKPMJTUMP-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(Cl)c(-c2cc(Cl)cc(Cl)c2Cl)c1 ZINC000002521558 560187382 /nfs/dbraw/zinc/18/73/82/560187382.db2.gz AJKLKINFZLWHQE-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 in-vitro FKABRN Clc1ccc(Cl)c(-c2c(Cl)ccc(Cl)c2Cl)c1Cl ZINC000002521559 560187335 /nfs/dbraw/zinc/18/73/35/560187335.db2.gz FZFUUSROAHKTTF-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 in-vitro FKABRN Clc1ccc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)c(Cl)c1 ZINC000002521560 570524062 /nfs/dbraw/zinc/52/40/62/570524062.db2.gz CKLLRBPBZLTGDJ-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1ccc(Cl)c(-c2cc(Cl)c(Cl)c(Cl)c2Cl)c1 ZINC000002521561 206920896 /nfs/dbraw/zinc/92/08/96/206920896.db2.gz UCLKLGIYGBLTSM-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1ccc(-c2c(Cl)cc(Cl)c(Cl)c2Cl)c(Cl)c1 ZINC000002521564 570524058 /nfs/dbraw/zinc/52/40/58/570524058.db2.gz SPOPSCCFZQFGDL-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(-c2cc(Cl)c(Cl)cc2Cl)c(Cl)c1 ZINC000002521565 570523935 /nfs/dbraw/zinc/52/39/35/570523935.db2.gz QXZHEJWDLVUFFB-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(-c2c(Cl)cc(Cl)cc2Cl)c(Cl)c1 ZINC000002521566 560187322 /nfs/dbraw/zinc/18/73/22/560187322.db2.gz ICOAEPDGFWLUTI-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 in-vitro FKABRN Clc1ccc(-c2c(Cl)cc(Cl)c(Cl)c2Cl)cc1Cl ZINC000002521568 210404560 /nfs/dbraw/zinc/40/45/60/210404560.db2.gz ZQUPQXINXTWCQR-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)cc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)c1 ZINC000002521569 210405222 /nfs/dbraw/zinc/40/52/22/210405222.db2.gz YZKLGRAIIIGOHB-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1ccc(-c2c(Cl)c(Cl)c(Cl)c(Cl)c2Cl)cc1 ZINC000002521570 204044359 /nfs/dbraw/zinc/04/43/59/204044359.db2.gz BTOCFTAWZMMTNB-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(-c2cc(Cl)c(Cl)c(Cl)c2)cc1Cl ZINC000002521571 204043472 /nfs/dbraw/zinc/04/34/72/204043472.db2.gz AZXHAWRMEPZSSV-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 in-vitro FKABRN Clc1cc(-c2cc(Cl)c(Cl)c(Cl)c2)cc(Cl)c1Cl ZINC000002521572 204044172 /nfs/dbraw/zinc/04/41/72/204044172.db2.gz ZHLICBPIXDOFFG-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 in-vitro FKABRN Cc1ccc([C@H](OC(=O)c2ccc(C(C)(C)C)cc2)c2ccccc2)cc1 ZINC000002534529 204043991 /nfs/dbraw/zinc/04/39/91/204043991.db2.gz DKEARUXPJORAQB-HSZRJFAPSA-N 0 0 358.481 6.239 40 0 FKABRN S=c1sc2ccccc2n1CSc1nc(-c2ccccc2)cs1 ZINC000002535315 204043982 /nfs/dbraw/zinc/04/39/82/204043982.db2.gz CULRWWWXWKSQGT-UHFFFAOYSA-N 0 0 372.565 6.306 40 0 FKABRN O=C(c1sc2ccccc2c1Cl)c1ccc(OC(F)(F)F)cc1 ZINC000002540161 570524551 /nfs/dbraw/zinc/52/45/51/570524551.db2.gz FXMWBLIZUOCAJC-UHFFFAOYSA-N 0 0 356.752 5.684 40 0 FKABRN C1=C(c2ccccc2)S/C(=C2\SC=C(c3ccccc3)S2)S1 ZINC000002545383 571153843 /nfs/dbraw/zinc/15/38/43/571153843.db2.gz UXYULNILNJCKTO-ISLYRVAYSA-N 0 0 356.562 7.070 40 0 FKABRN COc1ccccc1[C@H](Nc1ccc(C)cc1)c1c(C)[nH]c2ccccc21 ZINC000002546240 204044344 /nfs/dbraw/zinc/04/43/44/204044344.db2.gz KXKWKWNZIOPFFK-DEOSSOPVSA-N 0 0 356.469 5.995 40 0 FKABRN COc1ccccc1[C@@H](Nc1ccc(C)cc1)c1c(C)[nH]c2ccccc21 ZINC000002546242 571252515 /nfs/dbraw/zinc/25/25/15/571252515.db2.gz KXKWKWNZIOPFFK-XMMPIXPASA-N 0 0 356.469 5.995 40 0 FKABRN COc1ccccc1[C@H](Nc1ccccc1C)c1c(C)[nH]c2ccccc21 ZINC000002546264 571252528 /nfs/dbraw/zinc/25/25/28/571252528.db2.gz YOTWPSKFBDGSSP-DEOSSOPVSA-N 0 0 356.469 5.995 40 0 FKABRN COc1ccccc1[C@@H](Nc1ccccc1C)c1c(C)[nH]c2ccccc21 ZINC000002546267 571252548 /nfs/dbraw/zinc/25/25/48/571252548.db2.gz YOTWPSKFBDGSSP-XMMPIXPASA-N 0 0 356.469 5.995 40 0 FKABRN COc1ccccc1[C@H](Nc1ccc(C)c(C)c1)c1c(C)[nH]c2ccccc21 ZINC000002546269 571252543 /nfs/dbraw/zinc/25/25/43/571252543.db2.gz GFNWEMKFJXPBGO-VWLOTQADSA-N 0 0 370.496 6.303 40 0 FKABRN COc1ccccc1[C@@H](Nc1ccc(C)c(C)c1)c1c(C)[nH]c2ccccc21 ZINC000002546272 210404737 /nfs/dbraw/zinc/40/47/37/210404737.db2.gz GFNWEMKFJXPBGO-RUZDIDTESA-N 0 0 370.496 6.303 40 0 FKABRN COc1ccccc1[C@H](Nc1cc(C)cc(C)c1)c1c(C)[nH]c2ccccc21 ZINC000002546275 571252468 /nfs/dbraw/zinc/25/24/68/571252468.db2.gz AYLSUSMKJKTDGC-VWLOTQADSA-N 0 0 370.496 6.303 40 0 FKABRN COc1ccccc1[C@@H](Nc1cc(C)cc(C)c1)c1c(C)[nH]c2ccccc21 ZINC000002546278 204044208 /nfs/dbraw/zinc/04/42/08/204044208.db2.gz AYLSUSMKJKTDGC-RUZDIDTESA-N 0 0 370.496 6.303 40 0 FKABRN C(CSc1ccccc1)=C(Sc1ccccc1)Sc1ccccc1 ZINC000002560369 204043745 /nfs/dbraw/zinc/04/37/45/204043745.db2.gz XBMCYJDHTDKVJI-UHFFFAOYSA-N 0 0 366.576 7.205 40 0 FKABRN CC(=O)OC1=CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000002562843 571253341 /nfs/dbraw/zinc/25/33/41/571253341.db2.gz GDNCPMQDMBBSRP-HKZQYKGFSA-N 0 0 374.521 5.018 40 0 FKABRN Clc1cc(C(Cl)(Cl)Cl)nc2ccc(Br)cc12 ZINC000002564349 570525369 /nfs/dbraw/zinc/52/53/69/570525369.db2.gz MPWQIBGYKXGDAH-UHFFFAOYSA-N 0 0 359.865 5.477 40 0 FKABRN C[C@H]1[C@H](c2ccccc2)[NH2+][C@H](c2ccccc2)[C@H](C)C1(O)Cc1ccccc1 ZINC000002568910 570647852 /nfs/dbraw/zinc/64/78/52/570647852.db2.gz YRMXCILLNZAXNX-MCLUHZGWSA-N 0 0 371.524 5.318 40 0 FKABRN Clc1ccc2c(c1)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1O2 ZINC000002569331 210406135 /nfs/dbraw/zinc/40/61/35/210406135.db2.gz WRNGAZFESPEMCN-UHFFFAOYSA-N 0 0 356.419 6.852 40 0 FKABRN Clc1cc(Cl)c2c(c1)Oc1c(Cl)cc(Cl)c(Cl)c1O2 ZINC000002569335 570648893 /nfs/dbraw/zinc/64/88/93/570648893.db2.gz QLBBXWPVEFJZEC-UHFFFAOYSA-N 0 0 356.419 6.852 40 0 FKABRN Clc1cc(Cl)c(Cl)c(-c2ccc(Cl)c(Cl)c2Cl)c1 ZINC000002569345 204045613 /nfs/dbraw/zinc/04/56/13/204045613.db2.gz YFSLABAYQDPWPF-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(Cl)c(-c2c(Cl)ccc(Cl)c2Cl)c1 ZINC000002569351 570525458 /nfs/dbraw/zinc/52/54/58/570525458.db2.gz UUTNFLRSJBQQJM-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(Cl)c(-c2cc(Cl)c(Cl)cc2Cl)c1 ZINC000002569353 570525359 /nfs/dbraw/zinc/52/53/59/570525359.db2.gz BQHCQAQLTCQFJZ-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(-c2cc(Cl)cc(Cl)c2Cl)c(Cl)c1 ZINC000002569354 204044727 /nfs/dbraw/zinc/04/47/27/204044727.db2.gz CTVRBEKNQHJPLX-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(-c2c(Cl)ccc(Cl)c2Cl)c(Cl)c1 ZINC000002569355 570525387 /nfs/dbraw/zinc/52/53/87/570525387.db2.gz RPPNJBZNXQNKNM-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1ccc(Cl)c(-c2cc(Cl)c(Cl)c(Cl)c2)c1Cl ZINC000002569358 570525182 /nfs/dbraw/zinc/52/51/82/570525182.db2.gz HAZQOLYHFUUJJN-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN Clc1cc(Cl)c(Cl)c(-c2cc(Cl)c(Cl)c(Cl)c2)c1 ZINC000002569359 219449798 /nfs/dbraw/zinc/44/97/98/219449798.db2.gz AHZUOPSGLWYCNF-UHFFFAOYSA-N 0 0 360.882 7.274 40 0 FKABRN CCCCCCc1ccc(C(=O)Oc2ccc(OCCCC)cc2)cc1 ZINC000002569867 568253593 /nfs/dbraw/zinc/25/35/93/568253593.db2.gz DFHWCSVHLVOKND-UHFFFAOYSA-N 0 0 354.490 6.208 40 0 FKABRN Clc1cc2oc3cc(Cl)c(Cl)c(Cl)c3c2c(Cl)c1Cl ZINC000002569956 560188141 /nfs/dbraw/zinc/18/81/41/560188141.db2.gz PYUSJFJVDVSXIU-UHFFFAOYSA-N 0 0 374.865 7.506 40 0 in-vitro FKABRN Clc1cc2c(cc1Cl)Oc1c(Cl)c(Cl)c(Cl)cc1O2 ZINC000002569972 560188147 /nfs/dbraw/zinc/18/81/47/560188147.db2.gz FSPZPQQWDODWAU-UHFFFAOYSA-N 0 0 356.419 6.852 40 0 in-vitro FKABRN Clc1cc2oc3c(cc(Cl)c(Cl)c3Cl)c2c(Cl)c1Cl ZINC000002569973 206921050 /nfs/dbraw/zinc/92/10/50/206921050.db2.gz JEYJJJXOFWNEHN-UHFFFAOYSA-N 0 0 374.865 7.506 40 0 in-vitro FKABRN Clc1cc2c3cc(Cl)c(Cl)c(Cl)c3oc2c(Cl)c1Cl ZINC000002569974 560188150 /nfs/dbraw/zinc/18/81/50/560188150.db2.gz XTAHLACQOVXINQ-UHFFFAOYSA-N 0 0 374.865 7.506 40 0 in-vitro FKABRN C=Cn1c2ccc(Br)cc2c2cc(Br)ccc21 ZINC000002571936 570525428 /nfs/dbraw/zinc/52/54/28/570525428.db2.gz ORMIJZCMQBMNFA-UHFFFAOYSA-N 0 0 351.041 5.420 40 0 FKABRN CC(C)(C)P(c1ccccc1P(C(C)(C)C)C(C)(C)C)C(C)(C)C ZINC000002572422 570525293 /nfs/dbraw/zinc/52/52/93/570525293.db2.gz WWUOMCDYYCYMIK-UHFFFAOYSA-N 0 0 366.510 7.095 40 0 FKABRN O=C(C[C@H](Sc1ccc(Cl)cc1)c1ccccc1)c1ccccc1 ZINC000002573031 204044659 /nfs/dbraw/zinc/04/46/59/204044659.db2.gz QHEFZMJWIHYYGN-NRFANRHFSA-N 0 0 352.886 6.446 40 0 FKABRN O=c1oc2ccccc2c(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1 ZINC000002573880 204044874 /nfs/dbraw/zinc/04/48/74/204044874.db2.gz KBGRDGSUVCUMTR-UHFFFAOYSA-N 0 0 367.231 6.434 40 0 FKABRN CCOc1ccc2c(c1)oc(=O)c(-c1ccc(O)cc1)c2-c1ccccc1 ZINC000002573923 204044777 /nfs/dbraw/zinc/04/47/77/204044777.db2.gz SSZKULMJZXTFPJ-UHFFFAOYSA-N 0 0 358.393 5.231 40 0 FKABRN CC(C)c1cc(Oc2ccccc2)cc(C(C)C)c1NC(=O)NC(C)(C)C ZINC000002585462 570680869 /nfs/dbraw/zinc/68/08/69/570680869.db2.gz WLIVADBOJWNAPY-UHFFFAOYSA-N 0 0 368.521 6.646 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(C(=O)OC3CCCCC3)cc2)cc1 ZINC000002609220 263325787 /nfs/dbraw/zinc/32/57/87/263325787.db2.gz VGXQYFQYWOKXGC-UHFFFAOYSA-N 0 0 365.473 5.552 40 0 FKABRN COc1ccc(/N=c2/nc(-c3ccc(C)cc3)n(-c3ccccc3)s2)cc1 ZINC000002666136 570527571 /nfs/dbraw/zinc/52/75/71/570527571.db2.gz JYXZQYHEHNCACA-FCQUAONHSA-N 0 0 373.481 5.150 40 0 FKABRN Cc1ccc(C)c(OC(=O)c2cc(-c3ccccc3)nc3ccccc32)c1 ZINC000002667045 204050313 /nfs/dbraw/zinc/05/03/13/204050313.db2.gz OMHPMZYMNSBYCC-UHFFFAOYSA-N 0 0 353.421 5.738 40 0 FKABRN Cc1ccc(-c2csc(=NCc3ccccc3)n2Cc2ccccc2)cc1 ZINC000002677000 570656014 /nfs/dbraw/zinc/65/60/14/570656014.db2.gz DIPIKFMPADBBFE-UHFFFAOYSA-O 0 0 371.529 5.671 40 0 FKABRN Cc1s/c(=N\c2ccccc2)n(CCc2ccccc2)c1-c1ccccc1 ZINC000002677216 570527581 /nfs/dbraw/zinc/52/75/81/570527581.db2.gz FGQMPKBXLIIQNN-IZHYLOQSSA-N 0 0 370.521 6.000 40 0 FKABRN CCCCCCNC(=O)C12C[C@@H]3C[C@H](C1)CC(c1ccc(C)cc1)(C3)C2 ZINC000002684001 570527561 /nfs/dbraw/zinc/52/75/61/570527561.db2.gz YIZWGCJJWFMBOJ-TUUBTQOTSA-N 0 0 353.550 5.530 40 0 FKABRN Cc1ccccc1-c1sc(=S)n2c1n(C(C)C)c(=O)c1ccccc12 ZINC000002693339 571340409 /nfs/dbraw/zinc/34/04/09/571340409.db2.gz BSFBSQIVDAEPBC-UHFFFAOYSA-N 0 0 366.511 5.602 40 0 FKABRN c1ccc(CCn2c3ccccc3nc2Cc2cccc3ccccc32)cc1 ZINC000002695672 570527920 /nfs/dbraw/zinc/52/79/20/570527920.db2.gz HNRORBFVWNZXMQ-UHFFFAOYSA-N 0 0 362.476 6.023 40 0 FKABRN Cc1ccc(OCCCn2c(Cc3ccccc3)nc3ccccc32)cc1 ZINC000002713376 204051930 /nfs/dbraw/zinc/05/19/30/204051930.db2.gz GDXWFWULLDYHJE-UHFFFAOYSA-N 0 0 356.469 5.405 40 0 FKABRN Cc1ccccc1OCCCn1c(Cc2ccccc2)nc2ccccc21 ZINC000002713382 210415082 /nfs/dbraw/zinc/41/50/82/210415082.db2.gz CATCKLCFHAPJSK-UHFFFAOYSA-N 0 0 356.469 5.405 40 0 FKABRN Cc1ccc(C23C[C@@H]4C[C@@H](CC(CC(=O)NC5CCCCC5)(C4)C2)C3)cc1 ZINC000002713471 570528374 /nfs/dbraw/zinc/52/83/74/570528374.db2.gz PNEPEPKQCOTRMN-KVEMZPMDSA-N 0 0 365.561 5.672 40 0 FKABRN CCn1nc(C)c2c1nc(-c1ccc(Cl)c(Cl)c1)cc2C(F)F ZINC000002732352 210075403 /nfs/dbraw/zinc/07/54/03/210075403.db2.gz HUTSDDUXOMFQAI-UHFFFAOYSA-N 0 0 356.203 5.671 40 0 FKABRN Cc1ccccc1-c1cc(-c2ccccc2C)n(Cc2cccc(F)c2)n1 ZINC000002733304 571065492 /nfs/dbraw/zinc/06/54/92/571065492.db2.gz VWFHRBICJFTYJY-UHFFFAOYSA-N 0 0 356.444 6.021 40 0 FKABRN CCc1ccccc1-n1nc(-c2ccc(C)cc2)c(C)c1-c1ccc(C)cc1 ZINC000002733329 571065446 /nfs/dbraw/zinc/06/54/46/571065446.db2.gz CHHXDBBLINBFKR-UHFFFAOYSA-N 0 0 366.508 6.694 40 0 FKABRN COc1ccccc1-c1cc(-c2ccccc2OC)n(Cc2ccccc2)n1 ZINC000002733367 571065339 /nfs/dbraw/zinc/06/53/39/571065339.db2.gz DCOYAUVHUFWEBQ-UHFFFAOYSA-N 0 0 370.452 5.283 40 0 FKABRN C=Cc1ccc(Cn2nc(-c3ccccc3C)cc2-c2ccccc2C)cc1 ZINC000002733462 571065373 /nfs/dbraw/zinc/06/53/73/571065373.db2.gz REFIEAUDKDKPQX-UHFFFAOYSA-N 0 0 364.492 6.525 40 0 FKABRN Cc1cccc(-c2nn(-c3cccc(C)c3)c(-c3cccc(C)c3)c2Cl)c1 ZINC000002733515 571065475 /nfs/dbraw/zinc/06/54/75/571065475.db2.gz JCCZIYYGCQDGCY-UHFFFAOYSA-N 0 0 372.899 6.785 40 0 FKABRN 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CCCCC[C@@H](C)[C@@H](C)c1cc(O)c2c(c1)OC(C)(C)C1=C2CCCS1 ZINC000004214460 570581301 /nfs/dbraw/zinc/58/13/01/570581301.db2.gz YCNTYPIGYVTFBO-HZPDHXFCSA-N 0 0 374.590 7.121 40 0 in-man FKABRN Cc1sc2nc(C(C)C)nc(SCC(=O)c3ccc(C)cc3)c2c1C ZINC000004217486 570666431 /nfs/dbraw/zinc/66/64/31/570666431.db2.gz HJNOMDGCUNCQKK-UHFFFAOYSA-N 0 0 370.543 5.715 40 0 FKABRN Cn1c(SCc2cccc(Cl)c2)nnc1-c1ccc(Cl)cc1 ZINC000004287907 570773225 /nfs/dbraw/zinc/77/32/25/570773225.db2.gz CLTJFDKZRVRVHZ-UHFFFAOYSA-N 0 0 350.274 5.081 40 0 FKABRN CC(C)c1ccc(N2C(=O)N[C@@H]3C[C@@]2(C)Oc2ccc(Cl)cc23)cc1 ZINC000004313419 132254798 /nfs/dbraw/zinc/25/47/98/132254798.db2.gz BQIJQUGKICFGMV-YLJYHZDGSA-N 0 0 356.853 5.233 40 0 FKABRN Cc1ccc(C(=O)N2CC[C@@]3(Cl)CCCC[C@H]3[C@@H]2c2ccccc2)cc1 ZINC000004318340 207014268 /nfs/dbraw/zinc/01/42/68/207014268.db2.gz FRSWBIPUVISLPB-FUDKSRODSA-N 0 0 367.920 5.750 40 0 FKABRN O=C(c1ccc(F)cc1)N1CC[C@@]2(Cl)CCCC[C@H]2[C@H]1c1ccccc1 ZINC000004318351 207013513 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Cn1c(C(=O)N(Cc2cccs2)Cc2ccccc2)cc2sccc21 ZINC000004354025 570667598 /nfs/dbraw/zinc/66/75/98/570667598.db2.gz DOXQZJLWXCAISC-UHFFFAOYSA-N 0 0 366.511 5.144 40 0 FKABRN Cc1nc(NC(=O)Nc2ccccc2)sc1CC(Cl)(Cl)Cl ZINC000004356774 204135422 /nfs/dbraw/zinc/13/54/22/204135422.db2.gz UOMXRCUNQSHRKJ-UHFFFAOYSA-N 0 0 364.685 5.008 40 0 FKABRN Cc1cccc(NC(=O)c2ccc(OC(=S)N(C(C)C)C(C)C)cc2)c1 ZINC000004356953 570586455 /nfs/dbraw/zinc/58/64/55/570586455.db2.gz RZFVMNXEIDRMKH-UHFFFAOYSA-N 0 0 370.518 5.030 40 0 FKABRN CC(C)CC(=O)Nc1ccc(C(=O)N(c2ccccc2)c2ccccc2)cc1 ZINC000004359678 207016010 /nfs/dbraw/zinc/01/60/10/207016010.db2.gz YQGXPQVAWHIZOF-UHFFFAOYSA-N 0 0 372.468 5.650 40 0 FKABRN Cn1c(SCc2cccc3ccccc32)nnc1-c1ccc(Cl)cc1 ZINC000004362113 570773210 /nfs/dbraw/zinc/77/32/10/570773210.db2.gz AWBOPEOOUBXBEI-UHFFFAOYSA-N 0 0 365.889 5.581 40 0 FKABRN O=C(c1ccccc1)N1CC[C@@]2(Cl)CCCC[C@H]2[C@H]1c1ccccc1 ZINC000004362649 571293458 /nfs/dbraw/zinc/29/34/58/571293458.db2.gz NGNPHNWIFLLNLJ-VWPQPMDRSA-N 0 0 353.893 5.442 40 0 FKABRN O=C(c1ccccc1)N1CC[C@@]2(Cl)CCCC[C@@H]2[C@H]1c1ccccc1 ZINC000004362656 219570126 /nfs/dbraw/zinc/57/01/26/219570126.db2.gz NGNPHNWIFLLNLJ-SJBKTWHCSA-N 0 0 353.893 5.442 40 0 FKABRN O=C(c1ccccc1)N1CC[C@@]2(Cl)CCCC[C@@H]2[C@@H]1c1ccccc1 ZINC000004362660 219570206 /nfs/dbraw/zinc/57/02/06/219570206.db2.gz NGNPHNWIFLLNLJ-URVUXULASA-N 0 0 353.893 5.442 40 0 FKABRN Fc1ccc(C2=Nc3ccccc3S[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000004377316 204135759 /nfs/dbraw/zinc/13/57/59/204135759.db2.gz MDRUPUOMLFCZJM-OAQYLSRUSA-N 0 0 367.876 6.837 40 0 FKABRN Fc1ccc(C2=Nc3ccccc3S[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000004377317 570588474 /nfs/dbraw/zinc/58/84/74/570588474.db2.gz MDRUPUOMLFCZJM-NRFANRHFSA-N 0 0 367.876 6.837 40 0 FKABRN CCCCCCOC(=O)C[C@H]1C[C@H](C(=O)OCCCCCC)C1(C)C ZINC000004403543 204139152 /nfs/dbraw/zinc/13/91/52/204139152.db2.gz LQWWBUISXKONLQ-QZTJIDSGSA-N 0 0 354.531 5.286 40 0 FKABRN c1ccc(COC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1 ZINC000004403575 570589695 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C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O[C@@H]5CCCCO5)CC[C@@]43C)[C@@H]1CC[C@@H]2O ZINC000004416485 204138791 /nfs/dbraw/zinc/13/87/91/204138791.db2.gz OEECLXWCHUIMAU-KIHUSNISSA-N 0 0 374.565 5.222 40 0 in-vitro FKABRN Cc1ccccc1SC(c1ccccc1)(c1ccccc1)c1ccccc1 ZINC000004428837 204137881 /nfs/dbraw/zinc/13/78/81/204137881.db2.gz GPDUQHRULOJFSH-UHFFFAOYSA-N 0 0 366.529 7.079 40 0 FKABRN Cc1cccc(SC(c2ccccc2)(c2ccccc2)c2ccccc2)c1 ZINC000004428839 570591113 /nfs/dbraw/zinc/59/11/13/570591113.db2.gz FRRWTQOHBLUKNB-UHFFFAOYSA-N 0 0 366.529 7.079 40 0 FKABRN Cc1ccc(SC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1 ZINC000004428840 204138185 /nfs/dbraw/zinc/13/81/85/204138185.db2.gz ZVEWCYZUOYQHDF-UHFFFAOYSA-N 0 0 366.529 7.079 40 0 FKABRN Cc1ccc(NC(=O)Cc2cc3ccccc3n2Cc2ccccc2)cc1 ZINC000004456044 203808950 /nfs/dbraw/zinc/80/89/50/203808950.db2.gz DLZUDAPYJXECHM-UHFFFAOYSA-N 0 0 354.453 5.179 40 0 FKABRN CCCCC/C=C/C(=O)Nc1ccc(NC(=O)/C=C/CCCCC)cc1 ZINC000004473826 570591588 /nfs/dbraw/zinc/59/15/88/570591588.db2.gz QAIFFBGIUJKMRW-PHEQNACWSA-N 0 0 356.510 5.837 40 0 FKABRN O=C(Nc1cccc(Cl)c1)C1[C@@H]2CC[C@@H]3[C@H](CC[C@H]12)C3(Cl)Cl ZINC000004482012 207021761 /nfs/dbraw/zinc/02/17/61/207021761.db2.gz RRSLLQLMRWNJBR-RRIFHVCJSA-N 0 0 358.696 5.135 40 0 FKABRN O=C(Nc1cccc(Cl)c1)C1[C@@H]2CC[C@@H]3[C@H](CC[C@@H]12)C3(Cl)Cl ZINC000004482013 571293477 /nfs/dbraw/zinc/29/34/77/571293477.db2.gz RRSLLQLMRWNJBR-ARJVPZMDSA-N 0 0 358.696 5.135 40 0 FKABRN Cc1ccc(NC(=O)C2[C@@H]3CC[C@@H]4[C@H](CC[C@H]23)C4(Cl)Cl)c(C)c1 ZINC000004482021 204141511 /nfs/dbraw/zinc/14/15/11/204141511.db2.gz SITHMOVLUSCACU-CQQIWXSWSA-N 0 0 352.305 5.098 40 0 FKABRN Cc1ccc(NC(=O)C2[C@@H]3CC[C@@H]4[C@H](CC[C@@H]23)C4(Cl)Cl)c(C)c1 ZINC000004482022 210533097 /nfs/dbraw/zinc/53/30/97/210533097.db2.gz SITHMOVLUSCACU-WQYWAISESA-N 0 0 352.305 5.098 40 0 FKABRN CCN1c2ccccc2C(Cl)(c2ccc(N(C)C)cc2)c2ccccc21 ZINC000004522512 204144314 /nfs/dbraw/zinc/14/43/14/204144314.db2.gz MMADRDLIYQPCQG-UHFFFAOYSA-N 0 0 362.904 5.755 40 0 FKABRN 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FWYDHMOJYZZHMD-UHFFFAOYSA-N 0 0 366.457 5.502 40 0 FKABRN CCCCCCOC(=O)NCCCCCCNC(=O)OCCCCCC ZINC000004778127 570606112 /nfs/dbraw/zinc/60/61/12/570606112.db2.gz SJKILKFUOWJLHT-UHFFFAOYSA-N 0 0 372.550 5.160 40 0 FKABRN CCCOC(=O)C[C@@H](C(=O)OCCC)C(C)(C)/C=C(\C)C[C@@H](C)CCC ZINC000004783535 570606523 /nfs/dbraw/zinc/60/65/23/570606523.db2.gz AGNQUSDMKNHBPT-DABYADSQSA-N 0 0 368.558 5.698 40 0 FKABRN CCC(=O)O[C@H]1CC[C@H]2[C@@H]3C[C@@H](C)[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000004783592 210563450 /nfs/dbraw/zinc/56/34/50/210563450.db2.gz OIHORBOMFNFQBP-CMMFVDGISA-N 0 0 360.538 5.166 40 0 in-vitro FKABRN Clc1ccc(-c2nnc3sc(/C=C/c4ccccc4)nn32)c(Cl)c1 ZINC000004784622 571068398 /nfs/dbraw/zinc/06/83/98/571068398.db2.gz IEJADHPURKTODC-RMKNXTFCSA-N 0 0 373.268 5.330 40 0 FKABRN COc1ccc([C@H](Cc2ccccc2)N(C)C(=O)Nc2ccccc2)cc1 ZINC000004785167 219606643 /nfs/dbraw/zinc/60/66/43/219606643.db2.gz FFZLSVACFRRBRK-QFIPXVFZSA-N 0 0 360.457 5.143 40 0 FKABRN COc1ccc([C@@H](Cc2ccccc2)N(C)C(=O)Nc2ccccc2)cc1 ZINC000004785170 210079397 /nfs/dbraw/zinc/07/93/97/210079397.db2.gz FFZLSVACFRRBRK-JOCHJYFZSA-N 0 0 360.457 5.143 40 0 FKABRN Nc1cc2ccc1C(=O)CCCCCC1CCC(CCCCCC2)CC1 ZINC000004788013 210562779 /nfs/dbraw/zinc/56/27/79/210562779.db2.gz HAHYOCUORPCHLY-UHFFFAOYSA-N 0 0 355.566 6.715 40 0 FKABRN COc1cc2c(cc1OC)[C@H](c1cccc3ccccc31)O[C@H]1CCCC[C@H]21 ZINC000004788342 219606729 /nfs/dbraw/zinc/60/67/29/219606729.db2.gz GEPYGDSDXRTPJA-MOADCYBESA-N 0 0 374.480 6.003 40 0 FKABRN COc1cc2c(cc1OC)[C@@H](c1cccc3ccccc31)O[C@H]1CCCC[C@H]21 ZINC000004788345 570909965 /nfs/dbraw/zinc/90/99/65/570909965.db2.gz GEPYGDSDXRTPJA-WSUBETFTSA-N 0 0 374.480 6.003 40 0 FKABRN COc1cc2c(cc1OC)[C@H](c1cccc3ccccc31)O[C@@H]1CCCC[C@H]21 ZINC000004788348 204164415 /nfs/dbraw/zinc/16/44/15/204164415.db2.gz GEPYGDSDXRTPJA-KPCPBYSCSA-N 0 0 374.480 6.003 40 0 FKABRN COc1cc2c(cc1OC)[C@@H](c1cccc3ccccc31)O[C@@H]1CCCC[C@H]21 ZINC000004788354 207047556 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C[C@@H]1CCC[C@@H](N2Cn3c4ccccc4nc3N(Cc3ccccc3)C2)[C@@H]1C ZINC000007499264 263351259 /nfs/dbraw/zinc/35/12/59/263351259.db2.gz FVTHMBPMOXVALS-WOIUINJBSA-N 0 0 374.532 5.098 40 0 FKABRN Cc1cc(NC(=O)c2ccc(N3CCCCC3)cc2)ccc1Br ZINC000007504706 571299012 /nfs/dbraw/zinc/29/90/12/571299012.db2.gz YQEFFOQXZFNCQW-UHFFFAOYSA-N 0 0 373.294 5.000 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(N2CCCCC2)cc1 ZINC000007504980 571299097 /nfs/dbraw/zinc/29/90/97/571299097.db2.gz PKLSIKHULCYPFF-UHFFFAOYSA-N 0 0 372.468 5.722 40 0 FKABRN Cc1ccc(SCCC(=O)Nc2ccccc2Oc2ccccc2)cc1 ZINC000007511304 570790947 /nfs/dbraw/zinc/79/09/47/570790947.db2.gz XHJSPJBKWJIZCE-UHFFFAOYSA-N 0 0 363.482 5.908 40 0 FKABRN O=C(CCSc1ccc(Cl)cc1)Nc1cc(Cl)cc(Cl)c1 ZINC000007511491 263351932 /nfs/dbraw/zinc/35/19/32/263351932.db2.gz BQRUOICKEMUVLH-UHFFFAOYSA-N 0 0 360.693 5.768 40 0 FKABRN O=C(CCSc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl ZINC000007511500 263351871 /nfs/dbraw/zinc/35/18/71/263351871.db2.gz SXJVKSQEUBJROG-UHFFFAOYSA-N 0 0 360.693 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570592496 /nfs/dbraw/zinc/59/24/96/570592496.db2.gz QSWONKYPUPSKOG-UHFFFAOYSA-N 0 0 367.257 5.344 40 0 FKABRN Cc1cc(Cl)ccc1OCc1nnc(SCc2ccc(F)cc2)o1 ZINC000007605264 571299267 /nfs/dbraw/zinc/29/92/67/571299267.db2.gz LNLOOIHEKTZBBF-UHFFFAOYSA-N 0 0 364.829 5.042 40 0 FKABRN COc1cc(C(=O)Nc2cc(C)ccc2C)ccc1OCc1ccccc1 ZINC000007608186 571299211 /nfs/dbraw/zinc/29/92/11/571299211.db2.gz CPNJAXZWEBJNAO-UHFFFAOYSA-N 0 0 361.441 5.143 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2c(C)cccc2CC)cc1OC ZINC000007653234 219813947 /nfs/dbraw/zinc/81/39/47/219813947.db2.gz FRYOLEYXGRIBHC-UHFFFAOYSA-N 0 0 361.869 5.261 40 0 FKABRN O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(COc2ccccc2)o1 ZINC000007654543 570669215 /nfs/dbraw/zinc/66/92/15/570669215.db2.gz RVYRGVIPPRTWFR-UHFFFAOYSA-N 0 0 361.319 5.130 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)c1ccccc1OCc1ccccc1 ZINC000007655707 570669176 /nfs/dbraw/zinc/66/91/76/570669176.db2.gz KEQBZNIXPCZSSO-UHFFFAOYSA-N 0 0 367.832 5.180 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)c1cccc(OCc2ccccc2)c1 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570813019 /nfs/dbraw/zinc/81/30/19/570813019.db2.gz RKXLTBZSFPQZHZ-QGZVFWFLSA-N 0 0 355.547 5.403 40 0 FKABRN Cc1ccc(CSCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000010111751 570698163 /nfs/dbraw/zinc/69/81/63/570698163.db2.gz AGTYKYQYVSFSAC-KRWDZBQOSA-N 0 0 355.547 5.403 40 0 FKABRN Cc1ccc(CSCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000010111752 207294270 /nfs/dbraw/zinc/29/42/70/207294270.db2.gz AGTYKYQYVSFSAC-QGZVFWFLSA-N 0 0 355.547 5.403 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000010111753 570812998 /nfs/dbraw/zinc/81/29/98/570812998.db2.gz MJGWMHDBLYGKMB-SFHVURJKSA-N 0 0 369.574 5.712 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000010111754 570812929 /nfs/dbraw/zinc/81/29/29/570812929.db2.gz MJGWMHDBLYGKMB-GOSISDBHSA-N 0 0 369.574 5.712 40 0 FKABRN Cc1ccc(SCCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000010111783 570812883 /nfs/dbraw/zinc/81/28/83/570812883.db2.gz YJTJYTLCMLAZGV-KRWDZBQOSA-N 0 0 355.547 5.652 40 0 FKABRN Cc1ccc(SCCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000010111784 570813075 /nfs/dbraw/zinc/81/30/75/570813075.db2.gz YJTJYTLCMLAZGV-QGZVFWFLSA-N 0 0 355.547 5.652 40 0 FKABRN C[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(C(C)(C)C)cc1 ZINC000010111787 570698143 /nfs/dbraw/zinc/69/81/43/570698143.db2.gz KPQLDFGKJLYNET-SFHVURJKSA-N 0 0 357.497 6.142 40 0 FKABRN C[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(C(C)(C)C)cc1 ZINC000010111788 204390750 /nfs/dbraw/zinc/39/07/50/204390750.db2.gz KPQLDFGKJLYNET-GOSISDBHSA-N 0 0 357.497 6.142 40 0 FKABRN C[C@H](NC(=O)c1ccc(N2CCCCC2)cc1)c1ccc(C(C)(C)C)cc1 ZINC000010113053 571302779 /nfs/dbraw/zinc/30/27/79/571302779.db2.gz SDCVBWJUQDXNDW-SFHVURJKSA-N 0 0 364.533 5.465 40 0 FKABRN C[C@@H](NC(=O)c1ccc(N2CCCCC2)cc1)c1ccc(C(C)(C)C)cc1 ZINC000010113054 571302858 /nfs/dbraw/zinc/30/28/58/571302858.db2.gz SDCVBWJUQDXNDW-GOSISDBHSA-N 0 0 364.533 5.465 40 0 FKABRN Cc1nc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)ccc1Cl ZINC000010119499 570698708 /nfs/dbraw/zinc/69/87/08/570698708.db2.gz 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Cc1cc2nc(-c3ccc(CNC(=O)c4cccc(F)c4)cc3)oc2cc1C ZINC000010120307 263363536 /nfs/dbraw/zinc/36/35/36/263363536.db2.gz ZNLODKVUYZJDSB-UHFFFAOYSA-N 0 0 374.415 5.181 40 0 FKABRN Cc1cc2nc(-c3ccc(CNC(=O)c4ccc(F)cc4)cc3)oc2cc1C ZINC000010120311 206254732 /nfs/dbraw/zinc/25/47/32/206254732.db2.gz HOLUJQMTRMEHCW-UHFFFAOYSA-N 0 0 374.415 5.181 40 0 FKABRN CCCCCC(=O)NCc1ccc(-c2nc3cc(C)c(C)cc3o2)cc1 ZINC000010120357 263363640 /nfs/dbraw/zinc/36/36/40/263363640.db2.gz WIFGEKHKHAXRFL-UHFFFAOYSA-N 0 0 350.462 5.308 40 0 FKABRN Cc1cc2nc(-c3ccc(CNC(=O)c4cccs4)cc3)oc2cc1C ZINC000010120379 263363550 /nfs/dbraw/zinc/36/35/50/263363550.db2.gz OEJUNMIQHXLFDP-UHFFFAOYSA-N 0 0 362.454 5.103 40 0 FKABRN Cc1cc2nc(-c3ccc(CNC(=O)/C=C/c4ccco4)cc3)oc2cc1C ZINC000010120406 263363581 /nfs/dbraw/zinc/36/35/81/263363581.db2.gz LKOXKLOSTDLBNB-MDZDMXLPSA-N 0 0 372.424 5.034 40 0 FKABRN O=C(Nc1cccc(-c2nc3c(ccc4ccccc34)o2)c1)c1cccnc1 ZINC000010127427 207295204 /nfs/dbraw/zinc/29/52/04/207295204.db2.gz SJGNIOXWUZRHMQ-UHFFFAOYSA-N 0 0 365.392 5.295 40 0 FKABRN CC(C)Oc1cccc(NC(=O)c2cccc(OCc3ccccc3)c2)c1 ZINC000010156241 204392079 /nfs/dbraw/zinc/39/20/79/204392079.db2.gz CIPAJPUUYXRLQX-UHFFFAOYSA-N 0 0 361.441 5.305 40 0 FKABRN O=C1C[C@@H](c2ccco2)Cc2c1c(Nc1ccccc1)nn2-c1ccccc1 ZINC000010157223 219894501 /nfs/dbraw/zinc/89/45/01/219894501.db2.gz AFHDOQRFRHHYLJ-INIZCTEOSA-N 0 0 369.424 5.122 40 0 FKABRN O=C1C[C@H](c2ccco2)Cc2c1c(Nc1ccccc1)nn2-c1ccccc1 ZINC000010157224 207295689 /nfs/dbraw/zinc/29/56/89/207295689.db2.gz AFHDOQRFRHHYLJ-MRXNPFEDSA-N 0 0 369.424 5.122 40 0 FKABRN C[C@@]12CC[C@@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1C/C(=C\c1ccccc1)[C@@H]2O ZINC000010272326 204006766 /nfs/dbraw/zinc/00/67/66/204006766.db2.gz ZPIDDLUDNFHGDG-RGJUVONGSA-N 0 0 360.497 5.303 40 0 FKABRN C[C@@]12CC[C@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1C/C(=C\c1ccccc1)[C@@H]2O ZINC000010272328 219898182 /nfs/dbraw/zinc/89/81/82/219898182.db2.gz ZPIDDLUDNFHGDG-TYRDXMDDSA-N 0 0 360.497 5.303 40 0 FKABRN C[C@]12CC[C@H]3c4ccc(O)cc4CC[C@@H]3[C@@H]1C/C(=C\c1ccccc1)[C@@H]2O ZINC000010272329 570499653 /nfs/dbraw/zinc/49/96/53/570499653.db2.gz ZPIDDLUDNFHGDG-JSZQYLCGSA-N 0 0 360.497 5.303 40 0 FKABRN C[C@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(C(C)(C)C)cc1 ZINC000010275889 571302835 /nfs/dbraw/zinc/30/28/35/571302835.db2.gz HPAXHCSXKBKYJB-INIZCTEOSA-N 0 0 371.480 6.375 40 0 FKABRN C[C@@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(C(C)(C)C)cc1 ZINC000010275891 571302850 /nfs/dbraw/zinc/30/28/50/571302850.db2.gz HPAXHCSXKBKYJB-MRXNPFEDSA-N 0 0 371.480 6.375 40 0 FKABRN CC(C)c1ccc(CCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000010275967 571302838 /nfs/dbraw/zinc/30/28/38/571302838.db2.gz MIWJKCKYENHBKP-SFHVURJKSA-N 0 0 351.534 5.918 40 0 FKABRN CC(C)c1ccc(CCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000010275971 571302845 /nfs/dbraw/zinc/30/28/45/571302845.db2.gz MIWJKCKYENHBKP-GOSISDBHSA-N 0 0 351.534 5.918 40 0 FKABRN C[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1 ZINC000010275979 570802155 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CCOc1cccc(NC(=O)/C(=C/c2ccc(OC)cc2)c2ccccc2)c1 ZINC000010294177 263364413 /nfs/dbraw/zinc/36/44/13/263364413.db2.gz OUOCUDPVTLRHFS-XQNSMLJCSA-N 0 0 373.452 5.273 40 0 FKABRN CC1(C)Cc2cc(CNc3ccc(Br)c(Cl)c3)ccc2O1 ZINC000010299682 263364463 /nfs/dbraw/zinc/36/44/63/263364463.db2.gz JHZMAWMIPPZUMV-UHFFFAOYSA-N 0 0 366.686 5.428 40 0 FKABRN C[C@@H]1Cc2cc(CNc3ccc(Br)c(Cl)c3)ccc2O1 ZINC000010299688 570819729 /nfs/dbraw/zinc/81/97/29/570819729.db2.gz DUCLRILPVMIWAG-SNVBAGLBSA-N 0 0 352.659 5.038 40 0 FKABRN C[C@H]1Cc2cc(CNc3ccc(Br)c(Cl)c3)ccc2O1 ZINC000010299692 570819750 /nfs/dbraw/zinc/81/97/50/570819750.db2.gz DUCLRILPVMIWAG-JTQLQIEISA-N 0 0 352.659 5.038 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 ZINC000010313787 263364442 /nfs/dbraw/zinc/36/44/42/263364442.db2.gz ZPAWZBDBRPOUCG-UHFFFAOYSA-N 0 0 373.496 5.960 40 0 FKABRN CSc1cccc(NC(=O)c2ccccc2SCc2ccccc2)c1 ZINC000010313937 571302926 /nfs/dbraw/zinc/30/29/26/571302926.db2.gz VYQJAFSMEDWNPJ-UHFFFAOYSA-N 0 0 365.523 5.953 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)CCc3ccc(C)cc3)ccc21 ZINC000010315354 571303011 /nfs/dbraw/zinc/30/30/11/571303011.db2.gz WEBVKYDQXMQJCQ-UHFFFAOYSA-N 0 0 356.469 5.694 40 0 FKABRN O=C(Cc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000010324951 219899387 /nfs/dbraw/zinc/89/93/87/219899387.db2.gz IGIQELHJAMGPGG-UHFFFAOYSA-N 0 0 372.251 5.967 40 0 FKABRN CSc1ccccc1NC(=O)c1ccccc1SCc1ccccc1 ZINC000010326831 263365011 /nfs/dbraw/zinc/36/50/11/263365011.db2.gz QRWJLYIOZKYBFC-UHFFFAOYSA-N 0 0 365.523 5.953 40 0 FKABRN O=C(Nc1c(F)cccc1F)c1ccccc1SCc1ccccc1 ZINC000010328216 570700320 /nfs/dbraw/zinc/70/03/20/570700320.db2.gz UHHHTSSFQLZWLG-UHFFFAOYSA-N 0 0 355.409 5.509 40 0 FKABRN Cc1cccc(CSCCNC(=O)CCc2ccc(C(C)C)cc2)c1 ZINC000010328497 571303033 /nfs/dbraw/zinc/30/30/33/571303033.db2.gz KQWXEDMBXUDWCQ-UHFFFAOYSA-N 0 0 355.547 5.101 40 0 FKABRN CC(C)c1ccc(CCC(=O)NCc2ccc(Cl)cc2Cl)cc1 ZINC000010329505 570700331 /nfs/dbraw/zinc/70/03/31/570700331.db2.gz ZGFYOLGBXVSSPU-UHFFFAOYSA-N 0 0 350.289 5.366 40 0 FKABRN CC(C)c1ccc(CCC(=O)NCCSc2ccc(Cl)cc2)cc1 ZINC000010330174 571303090 /nfs/dbraw/zinc/30/30/90/571303090.db2.gz MXJXVWUIUKPUJY-UHFFFAOYSA-N 0 0 361.938 5.305 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccccc2Oc2ccccc2)cc1 ZINC000010330462 571303072 /nfs/dbraw/zinc/30/30/72/571303072.db2.gz UZGDPQCPCWLFSS-UHFFFAOYSA-N 0 0 359.469 6.174 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)NCc2ccc(Cl)cc2Cl)cc1 ZINC000010330722 570700433 /nfs/dbraw/zinc/70/04/33/570700433.db2.gz KDAAHDPGLJAPCE-UHFFFAOYSA-N 0 0 364.316 5.540 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2ccc(Cl)cc2Cl)cc1 ZINC000010331330 570803612 /nfs/dbraw/zinc/80/36/12/570803612.db2.gz CJTXCRRSUUSZSW-UHFFFAOYSA-N 0 0 350.289 5.862 40 0 FKABRN Cc1ccccc1CSCCNC(=O)CCc1ccc(C(C)(C)C)cc1 ZINC000010331677 571303020 /nfs/dbraw/zinc/30/30/20/571303020.db2.gz PDZSGSCXBYIRKE-UHFFFAOYSA-N 0 0 369.574 5.275 40 0 FKABRN CCc1ccc(CCC(=O)Nc2ccc(Br)c(Cl)c2)cc1 ZINC000010331702 571302995 /nfs/dbraw/zinc/30/29/95/571302995.db2.gz LOQNSEUHLBHIFD-UHFFFAOYSA-N 0 0 366.686 5.236 40 0 FKABRN Cc1ccc(CSCCNC(=O)CCc2ccc(C(C)(C)C)cc2)cc1 ZINC000010331975 571303000 /nfs/dbraw/zinc/30/30/00/571303000.db2.gz WAKMJVNNQMPRPE-UHFFFAOYSA-N 0 0 369.574 5.275 40 0 FKABRN CC(C)c1ccc(CCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1 ZINC000010332027 571302989 /nfs/dbraw/zinc/30/29/89/571302989.db2.gz IOTTZKPMIWMENT-UHFFFAOYSA-N 0 0 371.524 5.972 40 0 FKABRN Cc1cc(NC(=O)CCc2ccc(C(C)C)cc2)ccc1Br ZINC000010332594 571303206 /nfs/dbraw/zinc/30/32/06/571303206.db2.gz DHVNICUWULZVGS-UHFFFAOYSA-N 0 0 360.295 5.452 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2cc(Cl)cc(Cl)c2)cc1 ZINC000010333148 206269144 /nfs/dbraw/zinc/26/91/44/206269144.db2.gz LWRLXJHLSUGGHA-UHFFFAOYSA-N 0 0 350.289 5.862 40 0 FKABRN Cc1ccccc1CSCCNC(=O)CCc1ccc(C(C)C)cc1 ZINC000010333309 571303140 /nfs/dbraw/zinc/30/31/40/571303140.db2.gz CYBCJKAWGJDZLG-UHFFFAOYSA-N 0 0 355.547 5.101 40 0 FKABRN CC(C)c1ccc(CCC(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000010333368 570803176 /nfs/dbraw/zinc/80/31/76/570803176.db2.gz YEOZHFDSWOKMLY-UHFFFAOYSA-N 0 0 357.497 5.648 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 ZINC000010333977 570700235 /nfs/dbraw/zinc/70/02/35/570700235.db2.gz CVNDBAPBGKIPSS-UHFFFAOYSA-N 0 0 359.469 6.174 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2ccc(Br)cc2)cc1 ZINC000010334145 570700301 /nfs/dbraw/zinc/70/03/01/570700301.db2.gz AIGZTZSUYSCHCX-UHFFFAOYSA-N 0 0 360.295 5.318 40 0 FKABRN Cc1cccc(CSCCNC(=O)CCc2ccc(C(C)(C)C)cc2)c1 ZINC000010334750 571303200 /nfs/dbraw/zinc/30/32/00/571303200.db2.gz IFOUQUOHJAEIQM-UHFFFAOYSA-N 0 0 369.574 5.275 40 0 FKABRN Cc1cc(NC(=O)CCc2ccc(C(C)(C)C)cc2)ccc1Br ZINC000010335482 571303195 /nfs/dbraw/zinc/30/31/95/571303195.db2.gz ALXJVYAGCPLLDG-UHFFFAOYSA-N 0 0 374.322 5.626 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2ccccc2Br)cc1 ZINC000010336754 210870386 /nfs/dbraw/zinc/87/03/86/210870386.db2.gz DAOPKXYLGQHAMO-UHFFFAOYSA-N 0 0 360.295 5.318 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1 ZINC000010336803 206274242 /nfs/dbraw/zinc/27/42/42/206274242.db2.gz MMBFOURDCGQZBN-UHFFFAOYSA-N 0 0 369.814 6.054 40 0 FKABRN O=C(Cc1ccc(Cl)cc1)Nc1ccc(CSc2ccccc2)cc1 ZINC000010336993 570700253 /nfs/dbraw/zinc/70/02/53/570700253.db2.gz FDVWMVYVQBCOFI-UHFFFAOYSA-N 0 0 367.901 5.814 40 0 FKABRN Cc1ccc(CSCCNC(=O)CCc2ccc(C(C)C)cc2)cc1 ZINC000010337695 263365419 /nfs/dbraw/zinc/36/54/19/263365419.db2.gz XRCUDCCTOKWWAD-UHFFFAOYSA-N 0 0 355.547 5.101 40 0 FKABRN O=C(Nc1ccc(F)c(F)c1)c1ccccc1SCc1ccccc1 ZINC000010337758 571303183 /nfs/dbraw/zinc/30/31/83/571303183.db2.gz IDXLVIRSFFJKRW-UHFFFAOYSA-N 0 0 355.409 5.509 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000010338098 570803402 /nfs/dbraw/zinc/80/34/02/570803402.db2.gz QVOKDXBGJZPJIB-UHFFFAOYSA-N 0 0 369.814 6.054 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccc(Br)cc2F)cc1 ZINC000010338108 570803607 /nfs/dbraw/zinc/80/36/07/570803607.db2.gz LJOKDWLPIZNMPN-UHFFFAOYSA-N 0 0 364.258 5.283 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2cc(Cl)ccc2Cl)cc1 ZINC000010338129 571303171 /nfs/dbraw/zinc/30/31/71/571303171.db2.gz RXQTYBIGGIJKAQ-UHFFFAOYSA-N 0 0 350.289 5.862 40 0 FKABRN CC(C)c1ccccc1NC(=O)c1ccccc1SCc1ccccc1 ZINC000010338434 571303201 /nfs/dbraw/zinc/30/32/01/571303201.db2.gz HEWBOPBSSUFETR-UHFFFAOYSA-N 0 0 361.510 6.355 40 0 FKABRN CCc1ccc(CCC(=O)Nc2ccccc2Sc2ccccc2)cc1 ZINC000010338526 570832522 /nfs/dbraw/zinc/83/25/22/570832522.db2.gz PYARNNDHJFYIQR-UHFFFAOYSA-N 0 0 361.510 5.972 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000010338535 570803514 /nfs/dbraw/zinc/80/35/14/570803514.db2.gz VKSKBVWBWWCEPU-UHFFFAOYSA-N 0 0 371.524 5.823 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 ZINC000010338543 570803576 /nfs/dbraw/zinc/80/35/76/570803576.db2.gz BTYRZPOKDMYPDL-UHFFFAOYSA-N 0 0 369.814 6.054 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)N2CCC(Cc3ccccc3)CC2)cc1 ZINC000010338554 571303208 /nfs/dbraw/zinc/30/32/08/571303208.db2.gz UXCMNBUCASLXQY-UHFFFAOYSA-N 0 0 363.545 5.398 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2cccc(Cl)c2Cl)cc1 ZINC000010338642 571303207 /nfs/dbraw/zinc/30/32/07/571303207.db2.gz YZLUCCWOFPAYGI-UHFFFAOYSA-N 0 0 350.289 5.862 40 0 FKABRN O=C(NCCC1=CCCCC1)c1ccccc1SCc1ccccc1 ZINC000010338662 571303142 /nfs/dbraw/zinc/30/31/42/571303142.db2.gz PLKGZVDXRXHJLA-UHFFFAOYSA-N 0 0 351.515 5.599 40 0 FKABRN CCc1ccc(CCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1 ZINC000010338755 263365131 /nfs/dbraw/zinc/36/51/31/263365131.db2.gz OQZSLLHGVBTAQN-UHFFFAOYSA-N 0 0 355.787 5.493 40 0 FKABRN CCc1ccc(CCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 ZINC000010338794 571303212 /nfs/dbraw/zinc/30/32/12/571303212.db2.gz NHIUPHNTSRWVRT-UHFFFAOYSA-N 0 0 356.680 5.781 40 0 FKABRN CCCCOC(=O)c1ccc(NC(=O)CCc2ccc(C(C)C)cc2)cc1 ZINC000010338820 263364860 /nfs/dbraw/zinc/36/48/60/263364860.db2.gz FBQBKGVXEDBMFM-UHFFFAOYSA-N 0 0 367.489 5.338 40 0 FKABRN CCc1ccc(CCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 ZINC000010339044 571303219 /nfs/dbraw/zinc/30/32/19/571303219.db2.gz QDSZYCUZEVBPDT-UHFFFAOYSA-N 0 0 359.469 5.399 40 0 FKABRN Cc1ccc(CCC(=O)Nc2ccc(CSc3ccccc3)cc2)cc1 ZINC000010339182 571303121 /nfs/dbraw/zinc/30/31/21/571303121.db2.gz DSEUCWQCFCCKDR-UHFFFAOYSA-N 0 0 361.510 5.859 40 0 FKABRN Cc1ccc(SCCNC(=O)CCc2ccc(C(C)(C)C)cc2)cc1 ZINC000010357305 570700393 /nfs/dbraw/zinc/70/03/93/570700393.db2.gz SXUQSBUFFKMHMW-UHFFFAOYSA-N 0 0 355.547 5.134 40 0 FKABRN CCc1cccc(C)c1NC(=O)c1ccccc1SCc1ccccc1 ZINC000010359104 571303129 /nfs/dbraw/zinc/30/31/29/571303129.db2.gz FVDXMGSGYVZFGP-UHFFFAOYSA-N 0 0 361.510 6.102 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2c(Cl)cccc2Cl)cc1 ZINC000010361757 571303220 /nfs/dbraw/zinc/30/32/20/571303220.db2.gz WZEHHOBFCDDGIL-UHFFFAOYSA-N 0 0 350.289 5.862 40 0 FKABRN Cc1ccc(CCC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1 ZINC000010362722 263365393 /nfs/dbraw/zinc/36/53/93/263365393.db2.gz GKIGCLKTTXFKOF-UHFFFAOYSA-N 0 0 365.860 6.012 40 0 FKABRN COc1cc(NC(=O)CCc2ccc(C(C)C)cc2)c(OC)cc1Cl ZINC000010363950 570803415 /nfs/dbraw/zinc/80/34/15/570803415.db2.gz RSXXSYKTPSDOON-UHFFFAOYSA-N 0 0 361.869 5.052 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 ZINC000010364884 570700258 /nfs/dbraw/zinc/70/02/58/570700258.db2.gz QQHFRGNQCIQFCB-UHFFFAOYSA-N 0 0 370.707 6.342 40 0 FKABRN CCc1ccc(CCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000010365800 571303246 /nfs/dbraw/zinc/30/32/46/571303246.db2.gz YDWGJNVOISFBBX-UHFFFAOYSA-N 0 0 355.787 5.493 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2ccccc2-c2ccccc2)cc1 ZINC000010366702 571303265 /nfs/dbraw/zinc/30/32/65/571303265.db2.gz CUDYGFUIOCEFED-UHFFFAOYSA-N 0 0 357.497 6.222 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000010371606 209552748 /nfs/dbraw/zinc/55/27/48/209552748.db2.gz QDHSWDYDGUMALP-UHFFFAOYSA-N 0 0 350.289 5.862 40 0 FKABRN CCc1ccc(CCC(=O)Nc2ccc3c(c2)c2ccccc2n3CC)cc1 ZINC000010371668 571303248 /nfs/dbraw/zinc/30/32/48/571303248.db2.gz WIJQPTHXFHRXRS-UHFFFAOYSA-N 0 0 370.496 5.948 40 0 FKABRN O=C(Nc1ccc(N2CCCC2)c(Cl)c1)C1(c2ccccc2)CCCC1 ZINC000010372763 204395311 /nfs/dbraw/zinc/39/53/11/204395311.db2.gz DOYCCKPNIWSTHZ-UHFFFAOYSA-N 0 0 368.908 5.391 40 0 FKABRN O=C(Nc1cccc(Cl)c1N1CCCC1)C1(c2ccccc2)CCCC1 ZINC000010372768 207299288 /nfs/dbraw/zinc/29/92/88/207299288.db2.gz LCOIQWWOAOURRK-UHFFFAOYSA-N 0 0 368.908 5.391 40 0 FKABRN O=C(Nc1ccc2c(c1)Cc1ccccc1-2)C1(c2ccccc2)CCCC1 ZINC000010372787 207299058 /nfs/dbraw/zinc/29/90/58/207299058.db2.gz YZZVVCYAGGELEQ-UHFFFAOYSA-N 0 0 353.465 5.708 40 0 FKABRN O=C(Nc1ccc2c(c1)oc1ccccc12)C1(c2ccccc2)CCCC1 ZINC000010372790 204395989 /nfs/dbraw/zinc/39/59/89/204395989.db2.gz ZPOPUYLTVFKSRO-UHFFFAOYSA-N 0 0 355.437 6.037 40 0 FKABRN CC1CCN(c2ccc(NC(=O)C3(c4ccccc4)CCCC3)cc2)CC1 ZINC000010372804 132848246 /nfs/dbraw/zinc/84/82/46/132848246.db2.gz WCWSTTXWLWJTBS-UHFFFAOYSA-N 0 0 362.517 5.373 40 0 FKABRN C[C@H](Sc1nc2ccccc2o1)C(=O)n1c2ccccc2c2ccccc21 ZINC000010381924 209552135 /nfs/dbraw/zinc/55/21/35/209552135.db2.gz BJNLAGAXKKOFFV-AWEZNQCLSA-N 0 0 372.449 5.757 40 0 FKABRN C[C@@H](Sc1nc2ccccc2o1)C(=O)n1c2ccccc2c2ccccc21 ZINC000010381928 570803582 /nfs/dbraw/zinc/80/35/82/570803582.db2.gz BJNLAGAXKKOFFV-CQSZACIVSA-N 0 0 372.449 5.757 40 0 FKABRN Cc1cc(C)nc(S[C@@H](C)C(=O)n2c3ccccc3c3ccccc32)n1 ZINC000010381945 570803590 /nfs/dbraw/zinc/80/35/90/570803590.db2.gz BKXPGFCMXUEJCO-HNNXBMFYSA-N 0 0 361.470 5.022 40 0 FKABRN Cc1cc(C)nc(S[C@H](C)C(=O)n2c3ccccc3c3ccccc32)n1 ZINC000010381947 206279634 /nfs/dbraw/zinc/27/96/34/206279634.db2.gz BKXPGFCMXUEJCO-OAHLLOKOSA-N 0 0 361.470 5.022 40 0 FKABRN Cc1ccc(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)cc1Cl ZINC000010408787 210870018 /nfs/dbraw/zinc/87/00/18/210870018.db2.gz GKOPVVADBUWKLT-UHFFFAOYSA-N 0 0 358.800 5.014 40 0 FKABRN CCc1ccc(CCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1 ZINC000010433831 571303243 /nfs/dbraw/zinc/30/32/43/571303243.db2.gz INYJSNYHTPETAC-UHFFFAOYSA-N 0 0 357.497 5.411 40 0 FKABRN Cc1ccc(C(=O)Nc2cccc(C(=O)c3ccc(C(C)(C)C)cc3)c2)cc1 ZINC000010433925 570803567 /nfs/dbraw/zinc/80/35/67/570803567.db2.gz WAWZRBQLLORBAV-UHFFFAOYSA-N 0 0 371.480 5.776 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2cccc(Br)c2)cc1 ZINC000010434128 570803933 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CCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCc4cc(O)ccc4[C@@H]3CC[C@]12C ZINC000012656664 220017321 /nfs/dbraw/zinc/01/73/21/220017321.db2.gz RSEPBGGWRJCQGY-FLQYYVGBSA-N 0 0 356.506 5.350 40 0 FKABRN O=C1O[C@H]2CCCC[C@H]2C2(CCCCC2)[C@@H]1CCCCNc1ccccc1 ZINC000012657810 220016307 /nfs/dbraw/zinc/01/63/07/220016307.db2.gz OZRXHOCLDHJQJT-VSKRKVRLSA-N 0 0 369.549 5.951 40 0 FKABRN C[C@@H]1[C@@H]([C@@]2(C)CC[C@@H]3[C@@H](O2)c2ccccc2OC3(C)C)C1(Cl)Cl ZINC000012657997 206295716 /nfs/dbraw/zinc/29/57/16/206295716.db2.gz DYGSLTDGTPXLQY-OLIQAWCMSA-N 0 0 355.305 5.524 40 0 FKABRN C[C@H]1[C@@H]([C@@]2(C)CC[C@@H]3[C@@H](O2)c2ccccc2OC3(C)C)C1(Cl)Cl ZINC000012658000 209570409 /nfs/dbraw/zinc/57/04/09/209570409.db2.gz DYGSLTDGTPXLQY-ZSHKUORVSA-N 0 0 355.305 5.524 40 0 FKABRN C[C@@H]1[C@H]([C@@]2(C)CC[C@@H]3[C@@H](O2)c2ccccc2OC3(C)C)C1(Cl)Cl ZINC000012658002 220017263 /nfs/dbraw/zinc/01/72/63/220017263.db2.gz DYGSLTDGTPXLQY-SQPXDBQVSA-N 0 0 355.305 5.524 40 0 FKABRN C[C@H]1[C@H]([C@@]2(C)CC[C@@H]3[C@@H](O2)c2ccccc2OC3(C)C)C1(Cl)Cl ZINC000012658004 220016387 /nfs/dbraw/zinc/01/63/87/220016387.db2.gz DYGSLTDGTPXLQY-PBQYVJEFSA-N 0 0 355.305 5.524 40 0 FKABRN Cc1nc(-c2nc(NCc3ccco3)ncc2-c2ccsc2)sc1C ZINC000012751767 210984675 /nfs/dbraw/zinc/98/46/75/210984675.db2.gz UXZRRUUFTNHFGT-UHFFFAOYSA-N 0 0 368.487 5.151 40 0 FKABRN Cc1ccc(-c2cc(-c3ccc(Cl)cc3)cc(-c3ccc(C)cc3)n2)cc1 ZINC000012931700 570767958 /nfs/dbraw/zinc/76/79/58/570767958.db2.gz KGNFDBKRLOBXLR-UHFFFAOYSA-N 0 0 369.895 7.353 40 0 FKABRN Clc1ccccc1[C@@H](Cc1c(Cl)cccc1Cl)Cn1ccnc1 ZINC000012948783 211012686 /nfs/dbraw/zinc/01/26/86/211012686.db2.gz YHTYTKSCZPOEET-ZDUSSCGKSA-N 0 0 365.691 5.870 40 0 FKABRN COc1ccc(-c2ccccc2)cc1NCc1cc2cc(C)ccc2[nH]c1=O ZINC000013086667 220057660 /nfs/dbraw/zinc/05/76/60/220057660.db2.gz IOASBVLGMFXSNM-UHFFFAOYSA-N 0 0 370.452 5.124 40 0 FKABRN CCn1c(-c2ccc(Br)cc2)cs/c1=N\c1ccc(C)cc1 ZINC000013129727 209576787 /nfs/dbraw/zinc/57/67/87/209576787.db2.gz 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Cc1cc(C)nc(Nc2nnc(Nc3cc(C)cc(C)n3)c3ccccc32)c1 ZINC000013212991 570775176 /nfs/dbraw/zinc/77/51/76/570775176.db2.gz FOPFXYUYVALNLQ-UHFFFAOYSA-N 0 0 370.460 5.141 40 0 FKABRN Nc1nc(-c2ccc(Nc3ccnc4cc(Cl)ccc43)cc2)cs1 ZINC000013213495 570775056 /nfs/dbraw/zinc/77/50/56/570775056.db2.gz WRFYXZDYESEFNY-UHFFFAOYSA-N 0 0 352.850 5.338 40 0 FKABRN Nc1ccc(-c2csc(Nc3ccnc4cc(Cl)ccc43)n2)cc1 ZINC000013213497 570775180 /nfs/dbraw/zinc/77/51/80/570775180.db2.gz FPOWWMKYLILCFX-UHFFFAOYSA-N 0 0 352.850 5.338 40 0 FKABRN COC(=O)Nc1c2ccccc2nc2c1[C@H](OC)C(C)(C)c1ccccc1-2 ZINC000013214709 211027860 /nfs/dbraw/zinc/02/78/60/211027860.db2.gz AHHNBAZHMCJAOH-FQEVSTJZSA-N 0 0 362.429 5.059 40 0 FKABRN C=C1c2nc3ccccc3n2C=C(c2ccc(C)cc2)N1c1ccc(C)cc1 ZINC000013218782 570775466 /nfs/dbraw/zinc/77/54/66/570775466.db2.gz PQHWGMCWXYEHIG-UHFFFAOYSA-N 0 0 363.464 6.100 40 0 FKABRN Clc1ccc(CSc2nc3cc(Br)ccc3[nH]2)cc1 ZINC000013219483 570824598 /nfs/dbraw/zinc/82/45/98/570824598.db2.gz XYFKWHBSFVHXNQ-UHFFFAOYSA-N 0 0 353.672 5.271 40 0 FKABRN Nc1c(-c2nc3ccccc3[nH]2)sc(=S)n1-c1ccc(Cl)cc1 ZINC000013220280 211028141 /nfs/dbraw/zinc/02/81/41/211028141.db2.gz IGIAYWXMEXEKNP-UHFFFAOYSA-N 0 0 358.879 5.047 40 0 FKABRN Cc1scc(C(=O)N2CCC(c3cc4c(C)cccc4cn3)CC2)c1C ZINC000013227646 207455317 /nfs/dbraw/zinc/45/53/17/207455317.db2.gz CVFZOBMTZSLEAS-UHFFFAOYSA-N 0 0 364.514 5.241 40 0 FKABRN Cc1csc(-c2nc(NCc3cccs3)ncc2-c2ccsc2)n1 ZINC000013227962 211028326 /nfs/dbraw/zinc/02/83/26/211028326.db2.gz BZVTYSLVZVITGU-UHFFFAOYSA-N 0 0 370.528 5.311 40 0 FKABRN Fc1cccc(CNc2ncc(-c3ccsc3)c(-c3cccnc3)n2)c1 ZINC000013265899 207456270 /nfs/dbraw/zinc/45/62/70/207456270.db2.gz IYALSHYZUXKOTF-UHFFFAOYSA-N 0 0 362.433 5.018 40 0 FKABRN Fc1cccc(CNc2ncc(-c3ccsc3)c(-c3nccs3)n2)c1 ZINC000013265902 570775623 /nfs/dbraw/zinc/77/56/23/570775623.db2.gz SCARLDWWXVIHPM-UHFFFAOYSA-N 0 0 368.462 5.080 40 0 FKABRN Fc1ccc(CNc2ncc(-c3ccsc3)c(-c3nccs3)n2)cc1 ZINC000013266068 211027991 /nfs/dbraw/zinc/02/79/91/211027991.db2.gz 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/nfs/dbraw/zinc/77/59/24/570775924.db2.gz IDOYKAABHCKXBZ-UHFFFAOYSA-N 0 0 358.441 5.008 40 0 FKABRN Cc1ccc(C(=O)N(C)c2ccc(Cl)cc2C(=O)c2ccccc2)cc1 ZINC000013297395 204526679 /nfs/dbraw/zinc/52/66/79/204526679.db2.gz DQLHLNNWPSIELE-UHFFFAOYSA-N 0 0 363.844 5.156 40 0 FKABRN Cc1ccc(C23C[C@H]4C[C@H](CC(C(=O)Nc5cccc(C)c5C)(C4)C2)C3)cc1 ZINC000013302968 571294228 /nfs/dbraw/zinc/29/42/28/571294228.db2.gz UAKGXIBOBWUHHB-JGSRLKPESA-N 0 0 373.540 6.089 40 0 FKABRN Cc1ccc(C23C[C@H]4C[C@H](CC(C(=O)Nc5ccc(F)cc5)(C4)C2)C3)cc1 ZINC000013302978 571294213 /nfs/dbraw/zinc/29/42/13/571294213.db2.gz LYJFSIRHPSNREU-ISVJADKWSA-N 0 0 363.476 5.611 40 0 FKABRN CC(C)=CCOc1c2ccoc2c(OCC=C(C)C)c2oc(=O)ccc12 ZINC000013323006 220063450 /nfs/dbraw/zinc/06/34/50/220063450.db2.gz HJMDOAWWVCOEDW-UHFFFAOYSA-N 0 0 354.402 5.229 40 0 biogenic,in-vitro FKABRN CCCO[C@@]1(C(C)=O)CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000013408365 220067434 /nfs/dbraw/zinc/06/74/34/220067434.db2.gz MJCAQBZKCWIVPS-XIQUIRNFSA-N 0 0 374.565 5.353 40 0 FKABRN CC[C@@]1(OC(C)=O)CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000013408526 211032991 /nfs/dbraw/zinc/03/29/91/211032991.db2.gz ORZBNFZTRWEXII-XWJVLSSFSA-N 0 0 360.538 5.310 40 0 FKABRN CC[C@]1(OC(C)=O)CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000013408678 570777615 /nfs/dbraw/zinc/77/76/15/570777615.db2.gz ORZBNFZTRWEXII-ONCXAFAASA-N 0 0 360.538 5.310 40 0 FKABRN CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](C(C)C)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000013408723 570777659 /nfs/dbraw/zinc/77/76/59/570777659.db2.gz YNJRCCQKMDWYDP-OPKHLUCYSA-N 0 0 360.582 6.233 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@H]4CCCC[C@@]43C)[C@@H]1CC[C@@H]2OCc1ccccc1 ZINC000013408766 211031809 /nfs/dbraw/zinc/03/18/09/211031809.db2.gz PFVCATKPVAAICJ-JXFGHYCFSA-N 0 0 366.589 7.005 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)[C@@H]3CC[C@]4(C)C(/C(C)=N\O)=CC[C@H]4[C@@H]3CC[C@H]2C1 ZINC000013425057 560216648 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in-vitro FKABRN O=C(Nc1ccccc1Cl)c1ccc(Nc2cccc(Cl)c2)nc1 ZINC000013496479 570832477 /nfs/dbraw/zinc/83/24/77/570832477.db2.gz QHVPWKONHGQSEU-UHFFFAOYSA-N 0 0 358.228 5.384 40 0 FKABRN Cc1ccc(NC(=O)c2sc(=S)n(C3CCCCC3)c2N)c(C)c1 ZINC000013547275 220072640 /nfs/dbraw/zinc/07/26/40/220072640.db2.gz UODHHLAKPIBFKB-UHFFFAOYSA-N 0 0 361.536 5.236 40 0 FKABRN CC1=CC[C@@H]2[C@@H](C1)c1c(O)cc(C(C)(C)c3ccccc3)cc1OC2(C)C ZINC000013553596 204535368 /nfs/dbraw/zinc/53/53/68/204535368.db2.gz GZYXCXRHVALIJD-WOJBJXKFSA-N 0 0 362.513 6.329 40 0 in-vivo FKABRN Cc1ccc2cc(NCc3cc4cc(C(C)C)ccc4[nH]c3=O)ccc2n1 ZINC000013561292 220074496 /nfs/dbraw/zinc/07/44/96/220074496.db2.gz KQDZUDQQNMBSIT-UHFFFAOYSA-N 0 0 357.457 5.120 40 0 FKABRN CCOc1ccc2cc(CNc3ccccc3-c3ccccc3)c(=O)[nH]c2c1 ZINC000013561327 570833116 /nfs/dbraw/zinc/83/31/16/570833116.db2.gz QICRFOCMNSGCSQ-UHFFFAOYSA-N 0 0 370.452 5.206 40 0 FKABRN CCOc1ccc2[nH]c(=O)c(CNc3ccccc3-c3ccccc3)cc2c1 ZINC000013561328 220074867 /nfs/dbraw/zinc/07/48/67/220074867.db2.gz YCSBQKSNFPJSDH-UHFFFAOYSA-N 0 0 370.452 5.206 40 0 FKABRN Cc1ccc2[nH]c(=O)c(CNc3ccc(OCc4ccccc4)cc3)cc2c1 ZINC000013561358 206305094 /nfs/dbraw/zinc/30/50/94/206305094.db2.gz ZNAJIFGKDHAHCE-UHFFFAOYSA-N 0 0 370.452 5.028 40 0 FKABRN Cc1ccc2cc(CNc3ccc(OCc4ccccc4)cc3)c(=O)[nH]c2c1 ZINC000013561359 220074575 /nfs/dbraw/zinc/07/45/75/220074575.db2.gz MQWPADFXGHIWAI-UHFFFAOYSA-N 0 0 370.452 5.028 40 0 FKABRN Cc1cc(C)c2cc(CNc3cc(-c4ccccc4)ccc3O)c(=O)[nH]c2c1 ZINC000013561629 220074716 /nfs/dbraw/zinc/07/47/16/220074716.db2.gz XCISDBIXVVSJJP-UHFFFAOYSA-N 0 0 370.452 5.130 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)cs/c1=N\c1ccc(NC(C)=O)cc1 ZINC000013563210 206304444 /nfs/dbraw/zinc/30/44/44/206304444.db2.gz QFUUJYQGUWNUIK-QOCHGBHMSA-N 0 0 371.893 5.081 40 0 FKABRN CCc1cccc2cc3c(nc21)O[C@H](C)CN(CCCc1ccccc1)C3 ZINC000013563850 206304942 /nfs/dbraw/zinc/30/49/42/206304942.db2.gz WXQXZEDADFVFND-GOSISDBHSA-N 0 0 360.501 5.013 40 0 FKABRN CCc1cccc2cc3c(nc21)O[C@@H](C)CN(CCCc1ccccc1)C3 ZINC000013563852 206304802 /nfs/dbraw/zinc/30/48/02/206304802.db2.gz WXQXZEDADFVFND-SFHVURJKSA-N 0 0 360.501 5.013 40 0 FKABRN c1ccc(CN2Cc3cc4ccccc4nc3O[C@H](c3ccccc3)C2)cc1 ZINC000013563902 220074585 /nfs/dbraw/zinc/07/45/85/220074585.db2.gz XZSTYAGJDQGISH-DEOSSOPVSA-N 0 0 366.464 5.371 40 0 FKABRN c1ccc(CN2Cc3cc4ccccc4nc3O[C@@H](c3ccccc3)C2)cc1 ZINC000013563904 220074312 /nfs/dbraw/zinc/07/43/12/220074312.db2.gz XZSTYAGJDQGISH-XMMPIXPASA-N 0 0 366.464 5.371 40 0 FKABRN CCCC[C@@H]1CN(Cc2ccccc2)Cc2cc3ccc(C)c(C)c3nc2O1 ZINC000013564178 570833877 /nfs/dbraw/zinc/83/38/77/570833877.db2.gz NLZAJSMJSPJNTI-HSZRJFAPSA-N 0 0 374.528 5.805 40 0 FKABRN CCCC[C@H]1CN(Cc2ccccc2)Cc2cc3ccc(C)c(C)c3nc2O1 ZINC000013564179 220074848 /nfs/dbraw/zinc/07/48/48/220074848.db2.gz NLZAJSMJSPJNTI-QHCPKHFHSA-N 0 0 374.528 5.805 40 0 FKABRN Cc1ccc(C2C[C@H]3CC[C@@H](C2)N3C(=O)c2csc3c2CCCC3)cc1 ZINC000013566372 206303351 /nfs/dbraw/zinc/30/33/51/206303351.db2.gz VWSOAYQTKAJFTD-YQQQUEKLSA-N 0 0 365.542 5.486 40 0 FKABRN CC(C)Oc1ccc(CN(Cc2cccnc2)Cc2ccccc2F)cc1 ZINC000013569007 220075363 /nfs/dbraw/zinc/07/53/63/220075363.db2.gz ABVURCBWTCHWIU-UHFFFAOYSA-N 0 0 364.464 5.210 40 0 FKABRN Cc1oc2ccccc2c1CN(Cc1cccnc1)Cc1ccccc1F ZINC000013569017 220074444 /nfs/dbraw/zinc/07/44/44/220074444.db2.gz KFZDOVJPYSYLFE-UHFFFAOYSA-N 0 0 360.432 5.478 40 0 FKABRN c1csc(CN(Cc2cnn(C3CCCCC3)c2)Cc2cccnc2)c1 ZINC000013569772 220074891 /nfs/dbraw/zinc/07/48/91/220074891.db2.gz KEXMYTFGJYXLCR-UHFFFAOYSA-N 0 0 366.534 5.047 40 0 FKABRN COc1cccc(CNC(=O)N2c3ccccc3Sc3ccccc32)c1 ZINC000013574422 570779784 /nfs/dbraw/zinc/77/97/84/570779784.db2.gz OFIKHUSDVLLITH-UHFFFAOYSA-N 0 0 362.454 5.208 40 0 FKABRN CCOc1ccc(C(=O)N(Cc2ccccc2)Cc2ccccc2)cc1C ZINC000013582368 204537063 /nfs/dbraw/zinc/53/70/63/204537063.db2.gz CKAIOPHAHOMWJM-UHFFFAOYSA-N 0 0 359.469 5.236 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccccc2Sc2ccccc2)cc1C ZINC000013582417 207469529 /nfs/dbraw/zinc/46/95/29/207469529.db2.gz SACDICHXWJLZOF-UHFFFAOYSA-N 0 0 363.482 5.797 40 0 FKABRN CCOc1cccc(NC(=O)c2ccc(CSc3ccccc3)cc2)c1 ZINC000013612526 570780862 /nfs/dbraw/zinc/78/08/62/570780862.db2.gz JIYDADFYEOQOPA-UHFFFAOYSA-N 0 0 363.482 5.630 40 0 FKABRN COc1ccc(OCCCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013613629 211044675 /nfs/dbraw/zinc/04/46/75/211044675.db2.gz HRLNJMIGVXZGRZ-KRWDZBQOSA-N 0 0 369.505 5.029 40 0 FKABRN COc1ccc(OCCCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013613632 220079696 /nfs/dbraw/zinc/07/96/96/220079696.db2.gz HRLNJMIGVXZGRZ-QGZVFWFLSA-N 0 0 369.505 5.029 40 0 FKABRN C[C@@H]1C[C@@](C)(C(=O)NCc2ccco2)[C@@H](c2ccccc2)c2ccccc21 ZINC000013615245 209582104 /nfs/dbraw/zinc/58/21/04/209582104.db2.gz ALRCIZCYZVAYTB-OUPRXKBMSA-N 0 0 359.469 5.241 40 0 FKABRN Clc1ccc(C2=NN3[C@@H](C2)c2ccccc2O[C@@H]3C2CCCCC2)cc1 ZINC000013616430 206304333 /nfs/dbraw/zinc/30/43/33/206304333.db2.gz PWCMHOUWWCOYKL-RBBKRZOGSA-N 0 0 366.892 5.790 40 0 FKABRN Cc1ccc2nc(-c3ccc(C)c(NC(=O)/C=C\c4ccccc4)c3)oc2c1 ZINC000013616718 206304586 /nfs/dbraw/zinc/30/45/86/206304586.db2.gz LAEFCSNTHQKQKL-RAXLEYEMSA-N 0 0 368.436 5.764 40 0 FKABRN CCOc1ccc(Br)cc1C(=O)Nc1ccc2ccccc2c1 ZINC000013627339 570837627 /nfs/dbraw/zinc/83/76/27/570837627.db2.gz GYDMTKFMHJAMAC-UHFFFAOYSA-N 0 0 370.246 5.253 40 0 FKABRN CCCCCC(=O)Nc1cccc(NC(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000013628423 570837704 /nfs/dbraw/zinc/83/77/04/570837704.db2.gz LWRSVMVIWHDXFE-UHFFFAOYSA-N 0 0 366.505 5.755 40 0 FKABRN CC(C)Oc1cccc(CCCNC(=O)c2ccc(-c3ccccc3)cc2)c1 ZINC000013632018 570781221 /nfs/dbraw/zinc/78/12/21/570781221.db2.gz BINMHEWRULFCPP-UHFFFAOYSA-N 0 0 373.496 5.503 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)cc1 ZINC000013632183 570781314 /nfs/dbraw/zinc/78/13/14/570781314.db2.gz WXPPJYYNEZCLOR-UHFFFAOYSA-N 0 0 358.441 5.315 40 0 FKABRN CC1(C)C[C@@H](NC(=O)c2ccc(Cl)cc2Cl)c2ccccc2O1 ZINC000013632258 211045085 /nfs/dbraw/zinc/04/50/85/211045085.db2.gz KPNJCIGLLJITQN-OAHLLOKOSA-N 0 0 350.245 5.026 40 0 FKABRN CC1(C)C[C@H](NC(=O)c2ccc(Cl)cc2Cl)c2ccccc2O1 ZINC000013632260 570781202 /nfs/dbraw/zinc/78/12/02/570781202.db2.gz KPNJCIGLLJITQN-HNNXBMFYSA-N 0 0 350.245 5.026 40 0 FKABRN CCOc1cccc(NC(=O)CSCc2c(Cl)cccc2Cl)c1 ZINC000013632261 220079962 /nfs/dbraw/zinc/07/99/62/220079962.db2.gz PAUOJOKZJPJXKF-UHFFFAOYSA-N 0 0 370.301 5.264 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013632331 206304154 /nfs/dbraw/zinc/30/41/54/206304154.db2.gz VQEZLRURMSSDEM-UHFFFAOYSA-N 0 0 352.478 5.221 40 0 FKABRN CCc1nc2nc(-c3ccc4ccccc4c3)cc(-c3ccccc3)n2n1 ZINC000013637427 220080589 /nfs/dbraw/zinc/08/05/89/220080589.db2.gz KWNDCCKPILSUBP-UHFFFAOYSA-N 0 0 350.425 5.174 40 0 FKABRN CSc1nc2nc(-c3ccc4ccccc4c3)cc(-c3ccccc3)n2n1 ZINC000013637433 570781680 /nfs/dbraw/zinc/78/16/80/570781680.db2.gz SXVYBEQDQMIGBL-UHFFFAOYSA-N 0 0 368.465 5.333 40 0 FKABRN CC(C)CSc1nc2ccccc2c2nc(-c3ccc(Cl)cc3)nn21 ZINC000013640183 570838122 /nfs/dbraw/zinc/83/81/22/570838122.db2.gz BOMBQEDUPIGGKO-UHFFFAOYSA-N 0 0 368.893 5.346 40 0 FKABRN O=C(NCC12CC3C[C@H](C1)CC[C@@H](C3)C2)c1ccc(Cl)cc1Cl ZINC000013644971 211046493 /nfs/dbraw/zinc/04/64/93/211046493.db2.gz DUZBJZBCURKBHL-QCDJMGEHSA-N 0 0 352.305 5.330 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)N3CCCc4ccccc43)cc2)cc1 ZINC000013646371 570782068 /nfs/dbraw/zinc/78/20/68/570782068.db2.gz DYYJKUZVGFIRNH-UHFFFAOYSA-N 0 0 373.521 5.880 40 0 FKABRN C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(C(C)(C)C)cc1 ZINC000013646863 570782152 /nfs/dbraw/zinc/78/21/52/570782152.db2.gz GKPTZVJEWYVLIG-GFCCVEGCSA-N 0 0 350.289 5.782 40 0 FKABRN C[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(C(C)(C)C)cc1 ZINC000013646865 570782170 /nfs/dbraw/zinc/78/21/70/570782170.db2.gz GKPTZVJEWYVLIG-LBPRGKRZSA-N 0 0 350.289 5.782 40 0 FKABRN C[C@@H](NC(=O)c1ccc(Br)cc1)c1ccc(C(C)(C)C)cc1 ZINC000013647454 210181704 /nfs/dbraw/zinc/18/17/04/210181704.db2.gz JYVFBMUYYAHHFT-CYBMUJFWSA-N 0 0 360.295 5.238 40 0 FKABRN C[C@H](NC(=O)c1ccc(Br)cc1)c1ccc(C(C)(C)C)cc1 ZINC000013647456 570837657 /nfs/dbraw/zinc/83/76/57/570837657.db2.gz JYVFBMUYYAHHFT-ZDUSSCGKSA-N 0 0 360.295 5.238 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)NCCSCc2ccccc2F)cc1 ZINC000013647874 211046990 /nfs/dbraw/zinc/04/69/90/211046990.db2.gz ZGCALOBGDDYUJC-JLHYYAGUSA-N 0 0 371.521 5.186 40 0 FKABRN COc1ccc(CSCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013648284 570782130 /nfs/dbraw/zinc/78/21/30/570782130.db2.gz RHEAGKWLKWQVHL-INIZCTEOSA-N 0 0 371.546 5.103 40 0 FKABRN COc1ccc(CSCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013648287 570782116 /nfs/dbraw/zinc/78/21/16/570782116.db2.gz RHEAGKWLKWQVHL-MRXNPFEDSA-N 0 0 371.546 5.103 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013649175 570782537 /nfs/dbraw/zinc/78/25/37/570782537.db2.gz QMWFDJJCQMNJMF-IAGOWNOFSA-N 0 0 355.547 5.651 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013649177 570782580 /nfs/dbraw/zinc/78/25/80/570782580.db2.gz QMWFDJJCQMNJMF-DLBZAZTESA-N 0 0 355.547 5.651 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013649179 570782458 /nfs/dbraw/zinc/78/24/58/570782458.db2.gz QMWFDJJCQMNJMF-SJORKVTESA-N 0 0 355.547 5.651 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013649181 570782630 /nfs/dbraw/zinc/78/26/30/570782630.db2.gz QMWFDJJCQMNJMF-IRXDYDNUSA-N 0 0 355.547 5.651 40 0 FKABRN CC[C@@H](Oc1ccc(OC)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000013649203 211046982 /nfs/dbraw/zinc/04/69/82/211046982.db2.gz VGSQCXPOGNHWKM-HRAATJIYSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](Oc1ccc(OC)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000013649205 204542054 /nfs/dbraw/zinc/54/20/54/204542054.db2.gz VGSQCXPOGNHWKM-KKSFZXQISA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@@H](Oc1ccc(OC)cc1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000013649207 570782569 /nfs/dbraw/zinc/78/25/69/570782569.db2.gz VGSQCXPOGNHWKM-IIBYNOLFSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](Oc1ccc(OC)cc1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000013649209 570782475 /nfs/dbraw/zinc/78/24/75/570782475.db2.gz VGSQCXPOGNHWKM-IERDGZPVSA-N 0 0 369.505 5.028 40 0 FKABRN O=C(CSCc1c(Cl)cccc1Cl)N1CCCc2ccccc21 ZINC000013668158 570783241 /nfs/dbraw/zinc/78/32/41/570783241.db2.gz PFBKOWFFVNIITF-UHFFFAOYSA-N 0 0 366.313 5.206 40 0 FKABRN O=C(Nc1ccc(OC2CCCC2)cc1)c1ccc(Cl)cc1Cl ZINC000013668426 570783375 /nfs/dbraw/zinc/78/33/75/570783375.db2.gz KAXNLOYXEQNGET-UHFFFAOYSA-N 0 0 350.245 5.567 40 0 FKABRN Cc1ccc(C(=O)Nc2ccccc2SCc2ccc(Cl)cc2)cc1 ZINC000013668624 220081926 /nfs/dbraw/zinc/08/19/26/220081926.db2.gz USLQFMAWKQFDPL-UHFFFAOYSA-N 0 0 367.901 6.193 40 0 FKABRN COc1cccc2cc(C(=O)N[C@@H](C)c3ccc(C(C)(C)C)cc3)oc21 ZINC000013668898 211047560 /nfs/dbraw/zinc/04/75/60/211047560.db2.gz LLOPDAFELWUDNB-AWEZNQCLSA-N 0 0 351.446 5.230 40 0 FKABRN COc1cccc2cc(C(=O)N[C@H](C)c3ccc(C(C)(C)C)cc3)oc21 ZINC000013668899 220081613 /nfs/dbraw/zinc/08/16/13/220081613.db2.gz LLOPDAFELWUDNB-CQSZACIVSA-N 0 0 351.446 5.230 40 0 FKABRN CCOC(=O)c1cccc(NC(=O)c2cc3c(ccc4ccccc34)o2)c1C ZINC000013668911 220081907 /nfs/dbraw/zinc/08/19/07/220081907.db2.gz KYWWSOIDPVIIPS-UHFFFAOYSA-N 0 0 373.408 5.323 40 0 FKABRN CN(C(=O)c1ccc(-c2ccccc2)cc1)c1ccc(N2CCCC2)cc1 ZINC000013669180 211047555 /nfs/dbraw/zinc/04/75/55/211047555.db2.gz XWEUREJQZPRIRZ-UHFFFAOYSA-N 0 0 356.469 5.230 40 0 FKABRN Cc1ccc(OCCCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013669316 570783285 /nfs/dbraw/zinc/78/32/85/570783285.db2.gz LDERNOYRQVKBFS-GOSISDBHSA-N 0 0 353.506 5.329 40 0 FKABRN Cc1ccc(OCCCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013669317 570783381 /nfs/dbraw/zinc/78/33/81/570783381.db2.gz LDERNOYRQVKBFS-SFHVURJKSA-N 0 0 353.506 5.329 40 0 FKABRN CCOc1cccc(NC(=O)c2ccccc2SCc2ccccc2)c1 ZINC000013669553 220081496 /nfs/dbraw/zinc/08/14/96/220081496.db2.gz FTQRAVZGAQEBIK-UHFFFAOYSA-N 0 0 363.482 5.630 40 0 FKABRN O=C(c1ccc(CSc2ccccc2)cc1)N1CCCc2ccccc21 ZINC000013669642 570783329 /nfs/dbraw/zinc/78/33/29/570783329.db2.gz HVHIWHGBRUPHAT-UHFFFAOYSA-N 0 0 359.494 5.572 40 0 FKABRN Cc1cccc(CNC(=O)/C(=C/c2ccccc2Cl)c2ccccc2)c1 ZINC000013669693 570783239 /nfs/dbraw/zinc/78/32/39/570783239.db2.gz GMQQVWAYSCICHP-RCCKNPSSSA-N 0 0 361.872 5.505 40 0 FKABRN C[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(C(C)(C)C)cc1 ZINC000013669766 570783357 /nfs/dbraw/zinc/78/33/57/570783357.db2.gz ZILRUAKZVVBNNB-KIJZHVTOSA-N 0 0 373.496 5.995 40 0 FKABRN C[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(C(C)(C)C)cc1 ZINC000013669767 570783371 /nfs/dbraw/zinc/78/33/71/570783371.db2.gz ZILRUAKZVVBNNB-LWJGVMBGSA-N 0 0 373.496 5.995 40 0 FKABRN CC(C)Oc1ccc(CCCNC(=O)c2ccc(C(C)(C)C)cc2)cc1 ZINC000013669859 204542740 /nfs/dbraw/zinc/54/27/40/204542740.db2.gz YKGKERDDUSAICL-UHFFFAOYSA-N 0 0 353.506 5.134 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)cc1OCC ZINC000013670145 204543443 /nfs/dbraw/zinc/54/34/43/204543443.db2.gz KBVSQHBJCZNREZ-MRXNPFEDSA-N 0 0 369.505 5.273 40 0 FKABRN CCOc1ccc([C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)cc1OCC ZINC000013670146 570783610 /nfs/dbraw/zinc/78/36/10/570783610.db2.gz KBVSQHBJCZNREZ-INIZCTEOSA-N 0 0 369.505 5.273 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)NCCSCc2ccccc2F)cc1 ZINC000013670185 211047471 /nfs/dbraw/zinc/04/74/71/211047471.db2.gz WXNOCPDDRQYXLU-UHFFFAOYSA-N 0 0 373.537 5.105 40 0 FKABRN CC(C)Oc1cccc(CCCNC(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000013670201 570783639 /nfs/dbraw/zinc/78/36/39/570783639.db2.gz ATOCEHXRGDRUTA-UHFFFAOYSA-N 0 0 353.506 5.134 40 0 FKABRN CCOc1ccccc1CCCNC(=O)CCc1ccc(C(C)(C)C)cc1 ZINC000013670382 570783623 /nfs/dbraw/zinc/78/36/23/570783623.db2.gz ZAFWBWRIGAKARZ-UHFFFAOYSA-N 0 0 367.533 5.064 40 0 FKABRN C[C@@H](NC(=O)[C@@H](C)SCc1ccccc1)c1ccc(C(C)(C)C)cc1 ZINC000013670414 570783694 /nfs/dbraw/zinc/78/36/94/570783694.db2.gz GMBFTBUIOAMRTF-IAGOWNOFSA-N 0 0 355.547 5.483 40 0 FKABRN C[C@@H](SCc1ccccc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000013670415 570783787 /nfs/dbraw/zinc/78/37/87/570783787.db2.gz GMBFTBUIOAMRTF-DLBZAZTESA-N 0 0 355.547 5.483 40 0 FKABRN C[C@@H](NC(=O)[C@H](C)SCc1ccccc1)c1ccc(C(C)(C)C)cc1 ZINC000013670416 570783780 /nfs/dbraw/zinc/78/37/80/570783780.db2.gz GMBFTBUIOAMRTF-SJORKVTESA-N 0 0 355.547 5.483 40 0 FKABRN C[C@H](NC(=O)[C@H](C)SCc1ccccc1)c1ccc(C(C)(C)C)cc1 ZINC000013670417 570783700 /nfs/dbraw/zinc/78/37/00/570783700.db2.gz GMBFTBUIOAMRTF-IRXDYDNUSA-N 0 0 355.547 5.483 40 0 FKABRN C[C@@H](NC(=O)c1ccccc1Br)c1ccc(C(C)(C)C)cc1 ZINC000013670545 220082306 /nfs/dbraw/zinc/08/23/06/220082306.db2.gz KJHREHQXDGQBMN-CYBMUJFWSA-N 0 0 360.295 5.238 40 0 FKABRN C[C@H](NC(=O)c1ccccc1Br)c1ccc(C(C)(C)C)cc1 ZINC000013670546 220082702 /nfs/dbraw/zinc/08/27/02/220082702.db2.gz KJHREHQXDGQBMN-ZDUSSCGKSA-N 0 0 360.295 5.238 40 0 FKABRN C[C@@H]1Cc2ccccc2N1C(=O)CSCc1c(Cl)cccc1Cl ZINC000013670684 570783647 /nfs/dbraw/zinc/78/36/47/570783647.db2.gz KSUIKIQULZETKB-GFCCVEGCSA-N 0 0 366.313 5.204 40 0 FKABRN C[C@H]1Cc2ccccc2N1C(=O)CSCc1c(Cl)cccc1Cl ZINC000013670685 220082504 /nfs/dbraw/zinc/08/25/04/220082504.db2.gz 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CC(C)Oc1ccc(CCCNC(=O)c2ccc(-c3ccccc3)cc2)cc1 ZINC000013675544 570784160 /nfs/dbraw/zinc/78/41/60/570784160.db2.gz MOGGGCHBMUSPJR-UHFFFAOYSA-N 0 0 373.496 5.503 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NCc3cccc(C)c3)cc2)cc1 ZINC000013675611 570784170 /nfs/dbraw/zinc/78/41/70/570784170.db2.gz DOFDBMQFKIJJTP-UHFFFAOYSA-N 0 0 361.510 5.526 40 0 FKABRN C[C@@H]1Cc2ccccc2N1C(=O)c1ccccc1SCc1ccccc1 ZINC000013676274 570784229 /nfs/dbraw/zinc/78/42/29/570784229.db2.gz NLIJALFQRCACSI-QGZVFWFLSA-N 0 0 359.494 5.570 40 0 FKABRN C[C@H]1Cc2ccccc2N1C(=O)c1ccccc1SCc1ccccc1 ZINC000013676276 570784192 /nfs/dbraw/zinc/78/41/92/570784192.db2.gz NLIJALFQRCACSI-KRWDZBQOSA-N 0 0 359.494 5.570 40 0 FKABRN C[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)c1ccc(C(C)(C)C)cc1 ZINC000013676681 570784157 /nfs/dbraw/zinc/78/41/57/570784157.db2.gz GHTYPHBNHBQENE-MRXNPFEDSA-N 0 0 367.514 5.177 40 0 FKABRN C[C@H](NS(=O)(=O)c1ccc2ccccc2c1)c1ccc(C(C)(C)C)cc1 ZINC000013676682 570784163 /nfs/dbraw/zinc/78/41/63/570784163.db2.gz GHTYPHBNHBQENE-INIZCTEOSA-N 0 0 367.514 5.177 40 0 FKABRN O=C(c1ccccc1SCc1ccccc1)N1CCc2ccccc2C1 ZINC000013677388 204544375 /nfs/dbraw/zinc/54/43/75/204544375.db2.gz JCRPHUDVDDOYFN-UHFFFAOYSA-N 0 0 359.494 5.177 40 0 FKABRN CC(C)c1ccccc1NS(=O)(=O)Cc1c(Cl)cccc1Cl ZINC000013677723 570784189 /nfs/dbraw/zinc/78/41/89/570784189.db2.gz HQUQLOLDDOVMKM-UHFFFAOYSA-N 0 0 358.290 5.059 40 0 FKABRN O=S(=O)(Cc1c(Cl)cccc1Cl)Nc1cccc2ccccc21 ZINC000013678523 220084291 /nfs/dbraw/zinc/08/42/91/220084291.db2.gz JGWHZSPDEGLTQT-UHFFFAOYSA-N 0 0 366.269 5.089 40 0 FKABRN CCc1cccc(CC)c1NS(=O)(=O)Cc1c(Cl)cccc1Cl ZINC000013679691 220084876 /nfs/dbraw/zinc/08/48/76/220084876.db2.gz PBUDBIHLTLSRRX-UHFFFAOYSA-N 0 0 372.317 5.060 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)c1ccccc1OCc1ccccc1 ZINC000013687053 220085840 /nfs/dbraw/zinc/08/58/40/220085840.db2.gz JEKOSBFNKHUZML-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN O=C(NCCSC1CCCCC1)c1ccccc1OCc1ccccc1 ZINC000013687157 211048034 /nfs/dbraw/zinc/04/80/34/211048034.db2.gz 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570784817 /nfs/dbraw/zinc/78/48/17/570784817.db2.gz FURPCWSCQBFSLI-UHFFFAOYSA-N 0 0 370.279 6.031 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(Br)c1 ZINC000013689061 570784892 /nfs/dbraw/zinc/78/48/92/570784892.db2.gz AOAKWIZRUIDDJO-CYBMUJFWSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(Br)c1 ZINC000013689063 211050164 /nfs/dbraw/zinc/05/01/64/211050164.db2.gz AOAKWIZRUIDDJO-ZDUSSCGKSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000013689107 570784813 /nfs/dbraw/zinc/78/48/13/570784813.db2.gz PGLGHURYEUFGPC-CYBMUJFWSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000013689110 207476176 /nfs/dbraw/zinc/47/61/76/207476176.db2.gz PGLGHURYEUFGPC-ZDUSSCGKSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1Br ZINC000013689119 207476988 /nfs/dbraw/zinc/47/69/88/207476988.db2.gz WSHVPAFHKWAIAT-CYBMUJFWSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1Br ZINC000013689121 220085855 /nfs/dbraw/zinc/08/58/55/220085855.db2.gz WSHVPAFHKWAIAT-ZDUSSCGKSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000013689128 220086423 /nfs/dbraw/zinc/08/64/23/220086423.db2.gz WXJXHUANAZURJC-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000013689130 220085729 /nfs/dbraw/zinc/08/57/29/220085729.db2.gz WXJXHUANAZURJC-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000013689146 204546814 /nfs/dbraw/zinc/54/68/14/204546814.db2.gz BTESUYIYUFPSAS-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000013689148 570784841 /nfs/dbraw/zinc/78/48/41/570784841.db2.gz BTESUYIYUFPSAS-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc(Cl)cc1Cl ZINC000013708281 220088156 /nfs/dbraw/zinc/08/81/56/220088156.db2.gz YVBPSFXVKHJIAS-CYBMUJFWSA-N 0 0 374.267 5.230 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc(Cl)cc1Cl ZINC000013708283 220087847 /nfs/dbraw/zinc/08/78/47/220087847.db2.gz YVBPSFXVKHJIAS-ZDUSSCGKSA-N 0 0 374.267 5.230 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000013708573 211050807 /nfs/dbraw/zinc/05/08/07/211050807.db2.gz NMOIBYVPDJIIHG-CYBMUJFWSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000013708575 220087811 /nfs/dbraw/zinc/08/78/11/220087811.db2.gz NMOIBYVPDJIIHG-ZDUSSCGKSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000013708606 570785284 /nfs/dbraw/zinc/78/52/84/570785284.db2.gz GYJUATPUGODPOZ-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000013708608 570785190 /nfs/dbraw/zinc/78/51/90/570785190.db2.gz GYJUATPUGODPOZ-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(Cl)c1Cl ZINC000013708610 570785230 /nfs/dbraw/zinc/78/52/30/570785230.db2.gz QICNRCHMDIHCDG-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(Cl)c1Cl ZINC000013708612 220088042 /nfs/dbraw/zinc/08/80/42/220088042.db2.gz QICNRCHMDIHCDG-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1-c1ccccc1 ZINC000013708638 211049807 /nfs/dbraw/zinc/04/98/07/211049807.db2.gz HBNXRWIPGJSRQO-GOSISDBHSA-N 0 0 367.448 5.913 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1-c1ccccc1 ZINC000013708640 570785303 /nfs/dbraw/zinc/78/53/03/570785303.db2.gz HBNXRWIPGJSRQO-SFHVURJKSA-N 0 0 367.448 5.913 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000013708742 570785348 /nfs/dbraw/zinc/78/53/48/570785348.db2.gz XLNNQAQVLQOVRO-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000013708743 570785272 /nfs/dbraw/zinc/78/52/72/570785272.db2.gz XLNNQAQVLQOVRO-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1c(Cl)cccc1Cl ZINC000013708745 204547788 /nfs/dbraw/zinc/54/77/88/204547788.db2.gz SQLQSIHQVDNPCM-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1c(Cl)cccc1Cl ZINC000013708747 570785202 /nfs/dbraw/zinc/78/52/02/570785202.db2.gz SQLQSIHQVDNPCM-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(Br)c1 ZINC000013708888 570785192 /nfs/dbraw/zinc/78/51/92/570785192.db2.gz ARZMUTZEGHVJJP-CYBMUJFWSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(Br)c1 ZINC000013708890 570785397 /nfs/dbraw/zinc/78/53/97/570785397.db2.gz ARZMUTZEGHVJJP-ZDUSSCGKSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Br)cc1 ZINC000013708892 211050232 /nfs/dbraw/zinc/05/02/32/211050232.db2.gz SSUSFERJQYUKGO-CYBMUJFWSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Br)cc1 ZINC000013708894 570785392 /nfs/dbraw/zinc/78/53/92/570785392.db2.gz SSUSFERJQYUKGO-ZDUSSCGKSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000013708935 570785660 /nfs/dbraw/zinc/78/56/60/570785660.db2.gz FRIFIUAKQLRVJL-CYBMUJFWSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000013708937 211050468 /nfs/dbraw/zinc/05/04/68/211050468.db2.gz FRIFIUAKQLRVJL-ZDUSSCGKSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccccc1Br ZINC000013708948 220088476 /nfs/dbraw/zinc/08/84/76/220088476.db2.gz QFVRPKKZZRMXFJ-CYBMUJFWSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccccc1Br ZINC000013708950 570785647 /nfs/dbraw/zinc/78/56/47/570785647.db2.gz QFVRPKKZZRMXFJ-ZDUSSCGKSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl ZINC000013708968 220088346 /nfs/dbraw/zinc/08/83/46/220088346.db2.gz KMYWOLNPILSSRZ-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl ZINC000013708970 220088308 /nfs/dbraw/zinc/08/83/08/220088308.db2.gz KMYWOLNPILSSRZ-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)NCc1ccc(Cl)cc1Cl ZINC000013709032 220088233 /nfs/dbraw/zinc/08/82/33/220088233.db2.gz GQXHCAYEVGWFQG-CYBMUJFWSA-N 0 0 374.267 5.230 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)NCc1ccc(Cl)cc1Cl ZINC000013709034 204547759 /nfs/dbraw/zinc/54/77/59/204547759.db2.gz GQXHCAYEVGWFQG-ZDUSSCGKSA-N 0 0 374.267 5.230 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccccc1C(F)(F)F ZINC000013709090 570785681 /nfs/dbraw/zinc/78/56/81/570785681.db2.gz NOLZNIGZNMTFAS-CYBMUJFWSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccccc1C(F)(F)F ZINC000013709092 570785659 /nfs/dbraw/zinc/78/56/59/570785659.db2.gz NOLZNIGZNMTFAS-ZDUSSCGKSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000013709130 570785673 /nfs/dbraw/zinc/78/56/73/570785673.db2.gz MLHKBRORYLOQEZ-LJQANCHMSA-N 0 0 373.496 5.088 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000013709132 211050744 /nfs/dbraw/zinc/05/07/44/211050744.db2.gz MLHKBRORYLOQEZ-IBGZPJMESA-N 0 0 373.496 5.088 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000013709324 570785633 /nfs/dbraw/zinc/78/56/33/570785633.db2.gz AWQGMSIJOKCBPG-CYBMUJFWSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000013709326 220088404 /nfs/dbraw/zinc/08/84/04/220088404.db2.gz AWQGMSIJOKCBPG-ZDUSSCGKSA-N 0 0 359.347 5.265 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000013709363 220088382 /nfs/dbraw/zinc/08/83/82/220088382.db2.gz GFRYIFXHVJKMRC-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000013709365 570785631 /nfs/dbraw/zinc/78/56/31/570785631.db2.gz GFRYIFXHVJKMRC-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(Cl)c1Cl ZINC000013709367 220087920 /nfs/dbraw/zinc/08/79/20/220087920.db2.gz HRZFQRFGWVRTIL-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(Cl)c1Cl ZINC000013709368 220088572 /nfs/dbraw/zinc/08/85/72/220088572.db2.gz HRZFQRFGWVRTIL-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)cc1Cl ZINC000013709514 570785678 /nfs/dbraw/zinc/78/56/78/570785678.db2.gz NKBHQNOYIKTMRZ-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)cc1Cl ZINC000013709515 220087936 /nfs/dbraw/zinc/08/79/36/220087936.db2.gz NKBHQNOYIKTMRZ-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1c(Cl)cccc1Cl ZINC000013709517 570785613 /nfs/dbraw/zinc/78/56/13/570785613.db2.gz PAHOYBWSARTXGM-GFCCVEGCSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)Nc1c(Cl)cccc1Cl ZINC000013709519 207477693 /nfs/dbraw/zinc/47/76/93/207477693.db2.gz PAHOYBWSARTXGM-LBPRGKRZSA-N 0 0 360.240 5.553 40 0 FKABRN C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000013709630 211049818 /nfs/dbraw/zinc/04/98/18/211049818.db2.gz ZBJMFJLKPXLIEQ-OAHLLOKOSA-N 0 0 367.832 5.538 40 0 FKABRN C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000013709632 570785657 /nfs/dbraw/zinc/78/56/57/570785657.db2.gz ZBJMFJLKPXLIEQ-HNNXBMFYSA-N 0 0 367.832 5.538 40 0 FKABRN C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000013709996 211050595 /nfs/dbraw/zinc/05/05/95/211050595.db2.gz JZQIGWNHNNAHSL-OAHLLOKOSA-N 0 0 367.832 5.538 40 0 FKABRN C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000013709998 570785705 /nfs/dbraw/zinc/78/57/05/570785705.db2.gz JZQIGWNHNNAHSL-HNNXBMFYSA-N 0 0 367.832 5.538 40 0 FKABRN Cc1ccc(C)c(O[C@H](C)C(=O)N(Cc2ccccc2)Cc2ccccc2)c1 ZINC000013710179 570785689 /nfs/dbraw/zinc/78/56/89/570785689.db2.gz WOXINRUGYKXILR-OAQYLSRUSA-N 0 0 373.496 5.300 40 0 FKABRN Cc1ccc(C)c(O[C@@H](C)C(=O)N(Cc2ccccc2)Cc2ccccc2)c1 ZINC000013710180 220088499 /nfs/dbraw/zinc/08/84/99/220088499.db2.gz WOXINRUGYKXILR-NRFANRHFSA-N 0 0 373.496 5.300 40 0 FKABRN Cc1ccc(C)c(O[C@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)c1 ZINC000013710250 220088335 /nfs/dbraw/zinc/08/83/35/220088335.db2.gz GDDOCCSBMIBZGA-GOSISDBHSA-N 0 0 361.441 5.502 40 0 FKABRN Cc1ccc(C)c(O[C@@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)c1 ZINC000013710252 211050096 /nfs/dbraw/zinc/05/00/96/211050096.db2.gz GDDOCCSBMIBZGA-SFHVURJKSA-N 0 0 361.441 5.502 40 0 FKABRN Cc1ccc(C)c(O[C@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1 ZINC000013710467 570785663 /nfs/dbraw/zinc/78/56/63/570785663.db2.gz XMAXXEGQJJTBMK-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1ccc(C)c(O[C@@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1 ZINC000013710469 220088515 /nfs/dbraw/zinc/08/85/15/220088515.db2.gz XMAXXEGQJJTBMK-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1ccc(C)c(O[C@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1 ZINC000013710612 220087805 /nfs/dbraw/zinc/08/78/05/220087805.db2.gz MHDCVKZCKBJGNU-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1ccc(C)c(O[C@@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1 ZINC000013710614 220088454 /nfs/dbraw/zinc/08/84/54/220088454.db2.gz MHDCVKZCKBJGNU-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1ccc(C)c(O[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)c1 ZINC000013710773 220088638 /nfs/dbraw/zinc/08/86/38/220088638.db2.gz GVMGGLMKAUWAQV-GOSISDBHSA-N 0 0 361.441 5.502 40 0 FKABRN Cc1ccc(C)c(O[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)c1 ZINC000013710775 220088087 /nfs/dbraw/zinc/08/80/87/220088087.db2.gz GVMGGLMKAUWAQV-SFHVURJKSA-N 0 0 361.441 5.502 40 0 FKABRN Cc1ccc(C)c(O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 ZINC000013710813 570785643 /nfs/dbraw/zinc/78/56/43/570785643.db2.gz SUUTYVGTPLZUGG-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1ccc(C)c(O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 ZINC000013710815 211050113 /nfs/dbraw/zinc/05/01/13/211050113.db2.gz SUUTYVGTPLZUGG-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1ccc(C)c(O[C@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1 ZINC000013710875 570786039 /nfs/dbraw/zinc/78/60/39/570786039.db2.gz IHZKNLUHQIJPRE-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1ccc(C)c(O[C@@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1 ZINC000013710877 207478339 /nfs/dbraw/zinc/47/83/39/207478339.db2.gz IHZKNLUHQIJPRE-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN O=C(CC(c1ccccc1)c1ccccc1)NCCSc1ccccc1 ZINC000013716963 570786033 /nfs/dbraw/zinc/78/60/33/570786033.db2.gz OYMCBAXTMQCYAG-UHFFFAOYSA-N 0 0 361.510 5.117 40 0 FKABRN O=C(CC(c1ccccc1)c1ccccc1)NCCSC1CCCCC1 ZINC000013717005 570786049 /nfs/dbraw/zinc/78/60/49/570786049.db2.gz UCRFDOADCWNKMV-UHFFFAOYSA-N 0 0 367.558 5.391 40 0 FKABRN CC(C)Oc1ccc(NC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000013717043 211052402 /nfs/dbraw/zinc/05/24/02/211052402.db2.gz RDAWEGSUHJZIQL-UHFFFAOYSA-N 0 0 359.469 5.635 40 0 FKABRN CC(C)Oc1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1 ZINC000013717045 211051668 /nfs/dbraw/zinc/05/16/68/211051668.db2.gz GQBAEKPNQYMSRY-UHFFFAOYSA-N 0 0 359.469 5.635 40 0 FKABRN O=C(Nc1ccccc1Cl)N1c2ccccc2Sc2ccccc21 ZINC000013717074 570786032 /nfs/dbraw/zinc/78/60/32/570786032.db2.gz OEGYHSYRGPLMQZ-UHFFFAOYSA-N 0 0 352.846 6.175 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717122 570786068 /nfs/dbraw/zinc/78/60/68/570786068.db2.gz QXQIUBQVCIXHQL-UHFFFAOYSA-N 0 0 366.873 6.483 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717124 570786027 /nfs/dbraw/zinc/78/60/27/570786027.db2.gz LISNQHLONZZODP-UHFFFAOYSA-N 0 0 366.873 6.483 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717126 570786053 /nfs/dbraw/zinc/78/60/53/570786053.db2.gz MLWZSTCGWXTTGF-UHFFFAOYSA-N 0 0 366.873 6.483 40 0 FKABRN CC(C)(C)SCCNC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717158 570786016 /nfs/dbraw/zinc/78/60/16/570786016.db2.gz UXGZAGIRTCNORC-UHFFFAOYSA-N 0 0 358.532 5.531 40 0 FKABRN CSc1cccc(NC(=O)N2c3ccccc3Sc3ccccc32)c1 ZINC000013717160 570786024 /nfs/dbraw/zinc/78/60/24/570786024.db2.gz UVYDXXGTMXRADX-UHFFFAOYSA-N 0 0 364.495 6.243 40 0 FKABRN O=C(Nc1ccc(F)c(Cl)c1)N1c2ccccc2Sc2ccccc21 ZINC000013717171 570786055 /nfs/dbraw/zinc/78/60/55/570786055.db2.gz LSVDWRPYDLEMFO-UHFFFAOYSA-N 0 0 370.836 6.314 40 0 FKABRN O=C(Nc1ccc(F)cc1F)N1c2ccccc2Sc2ccccc21 ZINC000013717173 570786044 /nfs/dbraw/zinc/78/60/44/570786044.db2.gz YVYZYVKXXLRCPS-UHFFFAOYSA-N 0 0 354.381 5.800 40 0 FKABRN Cc1cc(C)c(NC(=O)N2c3ccccc3Sc3ccccc32)c(C)c1 ZINC000013717181 570786018 /nfs/dbraw/zinc/78/60/18/570786018.db2.gz WDBDWLIGZWETAO-UHFFFAOYSA-N 0 0 360.482 6.447 40 0 FKABRN CCc1cccc(CC)c1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717183 570786023 /nfs/dbraw/zinc/78/60/23/570786023.db2.gz OJPYUXLDXCLJBR-UHFFFAOYSA-N 0 0 374.509 6.646 40 0 FKABRN CC(C)c1ccccc1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717189 132870308 /nfs/dbraw/zinc/87/03/08/132870308.db2.gz AKJKIAUNQJZLIX-UHFFFAOYSA-N 0 0 360.482 6.645 40 0 FKABRN CCc1cccc(C)c1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717193 570786025 /nfs/dbraw/zinc/78/60/25/570786025.db2.gz PJBFWGHATYSOFY-UHFFFAOYSA-N 0 0 360.482 6.392 40 0 FKABRN CC(=O)c1cccc(NC(=O)N2c3ccccc3Sc3ccccc32)c1 ZINC000013717204 570786045 /nfs/dbraw/zinc/78/60/45/570786045.db2.gz SVQYVCOCRUDLJG-UHFFFAOYSA-N 0 0 360.438 5.724 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717215 570786353 /nfs/dbraw/zinc/78/63/53/570786353.db2.gz NPVBGSGSKSDMAF-UHFFFAOYSA-N 0 0 374.509 6.953 40 0 FKABRN CSc1ccccc1NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000013717227 570786386 /nfs/dbraw/zinc/78/63/86/570786386.db2.gz LLWHHHPTBQASER-UHFFFAOYSA-N 0 0 364.495 6.243 40 0 FKABRN O=C(Nc1c(F)cccc1F)N1c2ccccc2Sc2ccccc21 ZINC000013717229 132870528 /nfs/dbraw/zinc/87/05/28/132870528.db2.gz WUBSJSIZYWTVMG-UHFFFAOYSA-N 0 0 354.381 5.800 40 0 FKABRN O=C(Nc1ccc(F)c(F)c1)N1c2ccccc2Sc2ccccc21 ZINC000013717231 132870591 /nfs/dbraw/zinc/87/05/91/132870591.db2.gz MNLRWCNPRDDTFH-UHFFFAOYSA-N 0 0 354.381 5.800 40 0 FKABRN CCOc1ccc(CNC(=S)Nc2ccc(C(C)C)cc2)cc1OCC ZINC000013754895 570789507 /nfs/dbraw/zinc/78/95/07/570789507.db2.gz NYSCANNPCRRQPF-UHFFFAOYSA-N 0 0 372.534 5.094 40 0 FKABRN Cc1ccc(NC(=S)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1Cl ZINC000013774805 211058699 /nfs/dbraw/zinc/05/86/99/211058699.db2.gz MTHIUGNHSVNJCJ-CQSZACIVSA-N 0 0 360.954 5.994 40 0 FKABRN Cc1ccc(NC(=S)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1Cl ZINC000013774806 220093202 /nfs/dbraw/zinc/09/32/02/220093202.db2.gz MTHIUGNHSVNJCJ-AWEZNQCLSA-N 0 0 360.954 5.994 40 0 FKABRN COc1ccc(NC(=S)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1OC ZINC000013774810 211057910 /nfs/dbraw/zinc/05/79/10/211057910.db2.gz UAKFUGIBJSPFPM-AWEZNQCLSA-N 0 0 372.534 5.049 40 0 FKABRN COc1ccc(NC(=S)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1OC ZINC000013774811 570790694 /nfs/dbraw/zinc/79/06/94/570790694.db2.gz UAKFUGIBJSPFPM-CQSZACIVSA-N 0 0 372.534 5.049 40 0 FKABRN COc1ccc(NC(=S)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c(OC)c1 ZINC000013774813 570790591 /nfs/dbraw/zinc/79/05/91/570790591.db2.gz ZNTFDADUKLKYJH-AWEZNQCLSA-N 0 0 372.534 5.049 40 0 FKABRN COc1ccc(NC(=S)N[C@H](C)c2ccc(C(C)(C)C)cc2)c(OC)c1 ZINC000013774815 220092999 /nfs/dbraw/zinc/09/29/99/220092999.db2.gz ZNTFDADUKLKYJH-CQSZACIVSA-N 0 0 372.534 5.049 40 0 FKABRN Cc1cc(C)c(NC(=O)C2[C@@H]3CC[C@@H]4[C@@H](CC[C@H]23)C4(Cl)Cl)c(C)c1 ZINC000013785979 570791046 /nfs/dbraw/zinc/79/10/46/570791046.db2.gz AJTJBLIFAGTZAF-AKWQBFHWSA-N 0 0 366.332 5.406 40 0 FKABRN Cc1cc(C)c(NC(=O)C2[C@H]3CC[C@@H]4[C@@H](CC[C@H]23)C4(Cl)Cl)c(C)c1 ZINC000013785981 220094338 /nfs/dbraw/zinc/09/43/38/220094338.db2.gz AJTJBLIFAGTZAF-CAOSSQGBSA-N 0 0 366.332 5.406 40 0 FKABRN Fc1cc(Br)ccc1NC(=S)Nc1ccc(Cl)cc1 ZINC000013788472 570790991 /nfs/dbraw/zinc/79/09/91/570790991.db2.gz PVMXHWPWAMTKEQ-UHFFFAOYSA-N 0 0 359.651 5.051 40 0 FKABRN FC(F)(F)c1ccc(Cl)c(NC(=S)Nc2ccc(Cl)cc2)c1 ZINC000013792009 220094263 /nfs/dbraw/zinc/09/42/63/220094263.db2.gz KSWDXXJXKYBSBH-UHFFFAOYSA-N 0 0 365.207 5.821 40 0 FKABRN Cc1ccc(NC(=O)C2[C@@H]3CC[C@@H]4[C@@H](CC[C@H]23)C4(Cl)Cl)c(C)c1 ZINC000013810411 206307183 /nfs/dbraw/zinc/30/71/83/206307183.db2.gz SITHMOVLUSCACU-JPEUKKKJSA-N 0 0 352.305 5.098 40 0 FKABRN Cc1ccc(NC(=O)C2[C@H]3CC[C@@H]4[C@@H](CC[C@H]23)C4(Cl)Cl)c(C)c1 ZINC000013810412 220095809 /nfs/dbraw/zinc/09/58/09/220095809.db2.gz SITHMOVLUSCACU-BYNSBNAKSA-N 0 0 352.305 5.098 40 0 FKABRN S=C(Nc1ccc(Cl)cc1)Nc1ccccc1Oc1ccccc1 ZINC000013812371 211061559 /nfs/dbraw/zinc/06/15/59/211061559.db2.gz HMFXLWDYWBPJLZ-UHFFFAOYSA-N 0 0 354.862 5.941 40 0 FKABRN CC(C)c1ccc(NC(=S)NCc2ccc(Cl)cc2Cl)cc1 ZINC000013815189 570792049 /nfs/dbraw/zinc/79/20/49/570792049.db2.gz DXEGBNDUEHDQML-UHFFFAOYSA-N 0 0 353.318 5.603 40 0 FKABRN Fc1ccc(NC(=S)NCc2ccc(Cl)cc2Cl)cc1Cl ZINC000013815195 211062271 /nfs/dbraw/zinc/06/22/71/211062271.db2.gz CJGTYYCXTCJFGA-UHFFFAOYSA-N 0 0 363.672 5.273 40 0 FKABRN Cc1ccc(NC(=S)NCc2ccc(Cl)cc2Cl)cc1Cl ZINC000013815226 207487536 /nfs/dbraw/zinc/48/75/36/207487536.db2.gz YLQULHXJWNBPHB-UHFFFAOYSA-N 0 0 359.709 5.442 40 0 FKABRN S=C(Nc1ccc(Cl)cc1Cl)NC12CC3CC(CC(C3)C1)C2 ZINC000013819448 570792159 /nfs/dbraw/zinc/79/21/59/570792159.db2.gz CWMOAJKWLOBLJQ-UHFFFAOYSA-N 0 0 355.334 5.249 40 0 FKABRN S=C(Nc1cccc(Cl)c1)NC(c1ccccc1)c1ccccc1 ZINC000013820590 570792667 /nfs/dbraw/zinc/79/26/67/570792667.db2.gz SPQRUNQCFUXAOV-UHFFFAOYSA-N 0 0 352.890 5.416 40 0 FKABRN S=C(Nc1ccccc1Cl)NC(c1ccccc1)c1ccccc1 ZINC000013820592 211061420 /nfs/dbraw/zinc/06/14/20/211061420.db2.gz FLHAOYVFSTZFTN-UHFFFAOYSA-N 0 0 352.890 5.416 40 0 FKABRN CC(C)c1ccc(NC(=S)NC(c2ccccc2)c2ccccc2)cc1 ZINC000013820597 220096980 /nfs/dbraw/zinc/09/69/80/220096980.db2.gz HSRLVCIINNGWAO-UHFFFAOYSA-N 0 0 360.526 5.886 40 0 FKABRN Fc1ccc(NC(=S)NC(c2ccccc2)c2ccccc2)c(F)c1 ZINC000013820606 570792492 /nfs/dbraw/zinc/79/24/92/570792492.db2.gz BMCSVOKRRLAKAA-UHFFFAOYSA-N 0 0 354.425 5.041 40 0 FKABRN Fc1ccc(NC(=S)NC(c2ccccc2)c2ccccc2)cc1Cl ZINC000013820608 570792583 /nfs/dbraw/zinc/79/25/83/570792583.db2.gz NMGWHYJBGJPENR-UHFFFAOYSA-N 0 0 370.880 5.555 40 0 FKABRN Cc1ccc(NC(=S)NC(c2ccccc2)c2ccccc2)cc1Cl ZINC000013820620 570792420 /nfs/dbraw/zinc/79/24/20/570792420.db2.gz LAQFJRLXJYOOBM-UHFFFAOYSA-N 0 0 366.917 5.724 40 0 FKABRN CCOc1ccccc1NC(=S)NC(c1ccccc1)c1ccccc1 ZINC000013820644 220096976 /nfs/dbraw/zinc/09/69/76/220096976.db2.gz YDPHBDAWBFNUGD-UHFFFAOYSA-N 0 0 362.498 5.161 40 0 FKABRN FC(F)(F)c1cccc(NC(=S)N[C@@H]2CCCc3ccccc32)c1 ZINC000013823381 570792661 /nfs/dbraw/zinc/79/26/61/570792661.db2.gz ZOAABJICFHMDSF-MRXNPFEDSA-N 0 0 350.409 5.069 40 0 FKABRN FC(F)(F)c1cccc(NC(=S)N[C@H]2CCCc3ccccc32)c1 ZINC000013823383 211061801 /nfs/dbraw/zinc/06/18/01/211061801.db2.gz ZOAABJICFHMDSF-INIZCTEOSA-N 0 0 350.409 5.069 40 0 FKABRN S=C(Nc1ccc(Cl)cc1Cl)Nc1ccccc1-c1ccccc1 ZINC000013841474 220097166 /nfs/dbraw/zinc/09/71/66/220097166.db2.gz BARDWASRUYAKJL-UHFFFAOYSA-N 0 0 373.308 6.469 40 0 FKABRN CCc1ccc(OCc2nnc(SCc3ccc(C)cc3)n2CC)cc1 ZINC000013842191 570840268 /nfs/dbraw/zinc/84/02/68/570840268.db2.gz YXUOMIPLHQKHSI-UHFFFAOYSA-N 0 0 367.518 5.040 40 0 FKABRN CCCC/N=c1\scc(-c2ccc(Br)cc2)n1CCCC ZINC000013843550 570792822 /nfs/dbraw/zinc/79/28/22/570792822.db2.gz XVCZAJKRKGVUHX-ZPHPHTNESA-N 0 0 367.356 5.480 40 0 FKABRN CCn1c(SCc2cccc(C)c2)nnc1[C@@H](C)Oc1ccccc1 ZINC000013849834 211063554 /nfs/dbraw/zinc/06/35/54/211063554.db2.gz XMLOXXYJTUWGTJ-MRXNPFEDSA-N 0 0 353.491 5.039 40 0 FKABRN CCn1c(SCc2cccc(C)c2)nnc1[C@H](C)Oc1ccccc1 ZINC000013849836 220098429 /nfs/dbraw/zinc/09/84/29/220098429.db2.gz XMLOXXYJTUWGTJ-INIZCTEOSA-N 0 0 353.491 5.039 40 0 FKABRN CCn1c(SCc2cccc(Cl)c2)nnc1[C@@H](C)Oc1ccccc1 ZINC000013849870 211063329 /nfs/dbraw/zinc/06/33/29/211063329.db2.gz HWVVFQPXMNSVLK-CQSZACIVSA-N 0 0 373.909 5.384 40 0 FKABRN CCn1c(SCc2cccc(Cl)c2)nnc1[C@H](C)Oc1ccccc1 ZINC000013849872 571121913 /nfs/dbraw/zinc/12/19/13/571121913.db2.gz HWVVFQPXMNSVLK-AWEZNQCLSA-N 0 0 373.909 5.384 40 0 FKABRN Cc1nnc(SCc2ccc(Cl)c(Cl)c2)n1-c1ccc(C)cc1 ZINC000013881735 570839534 /nfs/dbraw/zinc/83/95/34/570839534.db2.gz YGVOTXGGWVOAIK-UHFFFAOYSA-N 0 0 364.301 5.483 40 0 FKABRN Cc1ccccc1NCc1cc(Cl)ccc1OCc1ccc(F)cc1 ZINC000013895943 570839335 /nfs/dbraw/zinc/83/93/35/570839335.db2.gz IUMHZMIFVLAVLG-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN O=C1Nc2ccc(Br)cc2/C1=C/c1ccc(Cl)c(Cl)c1 ZINC000013915523 208305023 /nfs/dbraw/zinc/30/50/23/208305023.db2.gz LYJKMJPHTQTRID-WZUFQYTHSA-N 0 0 369.045 5.249 40 0 FKABRN Cc1ccc(C2=N/C(=C\c3ccc(-c4cccc(Cl)c4)o3)C(=O)O2)cc1 ZINC000013925367 220099032 /nfs/dbraw/zinc/09/90/32/220099032.db2.gz HDOLFUCRQOPLGB-PDGQHHTCSA-N 0 0 363.800 5.253 40 0 FKABRN Cc1ccc([C@@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)cc1C ZINC000013930896 211065959 /nfs/dbraw/zinc/06/59/59/211065959.db2.gz JLFXBRCKQIJNKI-CYBMUJFWSA-N 0 0 352.425 5.370 40 0 FKABRN Cc1ccc([C@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)cc1C ZINC000013930897 220099074 /nfs/dbraw/zinc/09/90/74/220099074.db2.gz JLFXBRCKQIJNKI-ZDUSSCGKSA-N 0 0 352.425 5.370 40 0 FKABRN Cc1ccc(C)c([C@@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)c1 ZINC000013931246 220099158 /nfs/dbraw/zinc/09/91/58/220099158.db2.gz XMCZSCXBTGPRSU-CYBMUJFWSA-N 0 0 352.425 5.370 40 0 FKABRN Cc1ccc(C)c([C@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)c1 ZINC000013931247 211065272 /nfs/dbraw/zinc/06/52/72/211065272.db2.gz XMCZSCXBTGPRSU-ZDUSSCGKSA-N 0 0 352.425 5.370 40 0 FKABRN Cc1ccc([C@@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)c(C)c1 ZINC000013931412 570797017 /nfs/dbraw/zinc/79/70/17/570797017.db2.gz HDADOCGXLHWHIM-CYBMUJFWSA-N 0 0 352.425 5.370 40 0 FKABRN Cc1ccc([C@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)c(C)c1 ZINC000013931413 570797069 /nfs/dbraw/zinc/79/70/69/570797069.db2.gz HDADOCGXLHWHIM-ZDUSSCGKSA-N 0 0 352.425 5.370 40 0 FKABRN CC[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(C)cc1 ZINC000013931720 211065077 /nfs/dbraw/zinc/06/50/77/211065077.db2.gz BAAVQGKBZUCUGW-MRXNPFEDSA-N 0 0 352.425 5.452 40 0 FKABRN CC[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(C)cc1 ZINC000013931721 211066060 /nfs/dbraw/zinc/06/60/60/211066060.db2.gz BAAVQGKBZUCUGW-INIZCTEOSA-N 0 0 352.425 5.452 40 0 FKABRN FC(F)(F)c1cc(NC(=S)Nc2ccc(Cl)cc2)ccc1Cl ZINC000013934105 570797517 /nfs/dbraw/zinc/79/75/17/570797517.db2.gz SQNFMUGFEMSBIS-UHFFFAOYSA-N 0 0 365.207 5.821 40 0 FKABRN Fc1ccc(NC(=S)Nc2ccccc2Sc2ccccc2)cc1 ZINC000013935233 570797560 /nfs/dbraw/zinc/79/75/60/570797560.db2.gz LUARFXFKGBKEPR-UHFFFAOYSA-N 0 0 354.475 5.786 40 0 FKABRN S=C(Nc1ccc(Cl)cc1)N(Cc1ccccc1)c1ccccc1 ZINC000013935948 570797451 /nfs/dbraw/zinc/79/74/51/570797451.db2.gz JFKAXLDBRDHHPY-UHFFFAOYSA-N 0 0 352.890 5.744 40 0 FKABRN COc1ccc(Cn2nc(-c3ccccc3C)cc2-c2ccccc2C)cc1 ZINC000013960651 220099423 /nfs/dbraw/zinc/09/94/23/220099423.db2.gz AGBDHVSYGNHEJC-UHFFFAOYSA-N 0 0 368.480 5.891 40 0 FKABRN Cc1cccc(-c2cc(-c3cccc(C)c3)n(-c3ccc(Cl)cc3)n2)c1 ZINC000013960783 220100257 /nfs/dbraw/zinc/10/02/57/220100257.db2.gz XWQYSVSEJGIFQM-UHFFFAOYSA-N 0 0 358.872 6.477 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1 ZINC000013992578 570840544 /nfs/dbraw/zinc/84/05/44/570840544.db2.gz UNCDRGDZJMRHOJ-JTQLQIEISA-N 0 0 358.652 5.361 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1 ZINC000013992581 570840526 /nfs/dbraw/zinc/84/05/26/570840526.db2.gz UNCDRGDZJMRHOJ-SNVBAGLBSA-N 0 0 358.652 5.361 40 0 FKABRN Cc1ccccc1O[C@@H](C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000013993720 207492666 /nfs/dbraw/zinc/49/26/66/207492666.db2.gz VUYYFZWNZXYHMG-JTQLQIEISA-N 0 0 358.652 5.361 40 0 FKABRN Cc1ccccc1O[C@H](C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000013993723 211066990 /nfs/dbraw/zinc/06/69/90/211066990.db2.gz VUYYFZWNZXYHMG-SNVBAGLBSA-N 0 0 358.652 5.361 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000013994557 570801156 /nfs/dbraw/zinc/80/11/56/570801156.db2.gz ACKYMXAVJQTJTD-NRFANRHFSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000013994560 570801125 /nfs/dbraw/zinc/80/11/25/570801125.db2.gz ACKYMXAVJQTJTD-OAQYLSRUSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000013994800 570801174 /nfs/dbraw/zinc/80/11/74/570801174.db2.gz SBCCFHXIWVSADA-HNNXBMFYSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000013994802 570801195 /nfs/dbraw/zinc/80/11/95/570801195.db2.gz SBCCFHXIWVSADA-OAHLLOKOSA-N 0 0 372.679 5.751 40 0 FKABRN Cc1ccc(Cl)cc1NC(=S)NC(=O)c1ccc(Cl)cc1Cl ZINC000014002643 570843295 /nfs/dbraw/zinc/84/32/95/570843295.db2.gz XXDHABGESNQMGI-UHFFFAOYSA-N 0 0 373.692 5.082 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)Nc1ccccc1C(=O)N1CCCCCC1 ZINC000014002781 207495764 /nfs/dbraw/zinc/49/57/64/207495764.db2.gz DXYIWVLRKKBBOD-UHFFFAOYSA-N 0 0 371.868 5.000 40 0 FKABRN O=C(Nc1cccc(Cl)c1)Nc1ccccc1C(=O)N1CCCCCC1 ZINC000014002886 211067995 /nfs/dbraw/zinc/06/79/95/211067995.db2.gz HCBOAIPHABANON-UHFFFAOYSA-N 0 0 371.868 5.000 40 0 FKABRN COc1ccc(O[C@@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 ZINC000014006254 570843204 /nfs/dbraw/zinc/84/32/04/570843204.db2.gz KCLTWBLXBBYLMI-VIFPVBQESA-N 0 0 374.651 5.061 40 0 FKABRN COc1ccc(O[C@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 ZINC000014006255 570843251 /nfs/dbraw/zinc/84/32/51/570843251.db2.gz KCLTWBLXBBYLMI-SECBINFHSA-N 0 0 374.651 5.061 40 0 FKABRN COc1ccccc1O[C@@H](C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000014006530 570843645 /nfs/dbraw/zinc/84/36/45/570843645.db2.gz OBNSSQXVOAQHJD-VIFPVBQESA-N 0 0 374.651 5.061 40 0 FKABRN COc1ccccc1O[C@H](C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000014006531 570843584 /nfs/dbraw/zinc/84/35/84/570843584.db2.gz OBNSSQXVOAQHJD-SECBINFHSA-N 0 0 374.651 5.061 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000014013267 570843588 /nfs/dbraw/zinc/84/35/88/570843588.db2.gz LJLLHWULPBQKDN-QFIPXVFZSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000014013269 570843598 /nfs/dbraw/zinc/84/35/98/570843598.db2.gz LJLLHWULPBQKDN-JOCHJYFZSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000014013425 570843587 /nfs/dbraw/zinc/84/35/87/570843587.db2.gz PNSAVYKGSGHMTD-INIZCTEOSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000014013428 570843545 /nfs/dbraw/zinc/84/35/45/570843545.db2.gz PNSAVYKGSGHMTD-MRXNPFEDSA-N 0 0 372.679 5.751 40 0 FKABRN O=Cc1c(OC(=O)c2sc3ccccc3c2Cl)ccc2ccccc21 ZINC000014015694 570843612 /nfs/dbraw/zinc/84/36/12/570843612.db2.gz KPOYFZFBFHVXBQ-UHFFFAOYSA-N 0 0 366.825 5.740 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000014022387 570802247 /nfs/dbraw/zinc/80/22/47/570802247.db2.gz OFRPOJMTQSJNKT-QFIPXVFZSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000014022391 570802322 /nfs/dbraw/zinc/80/23/22/570802322.db2.gz OFRPOJMTQSJNKT-JOCHJYFZSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000014022618 570802297 /nfs/dbraw/zinc/80/22/97/570802297.db2.gz YDRJMQYWYIXEQV-INIZCTEOSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000014022621 570802391 /nfs/dbraw/zinc/80/23/91/570802391.db2.gz YDRJMQYWYIXEQV-MRXNPFEDSA-N 0 0 372.679 5.751 40 0 FKABRN CCCCCCOc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cc1 ZINC000014028158 570843964 /nfs/dbraw/zinc/84/39/64/570843964.db2.gz WIODSWSCEZMGDT-UHFFFAOYSA-N 0 0 366.288 6.205 40 0 FKABRN CCCCCCOc1ccc(C(=O)Nc2cccc(Cl)c2Cl)cc1 ZINC000014028247 570843847 /nfs/dbraw/zinc/84/38/47/570843847.db2.gz OPYXMYCCPZQRSP-UHFFFAOYSA-N 0 0 366.288 6.205 40 0 FKABRN CCCCCCOc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1 ZINC000014028276 570843983 /nfs/dbraw/zinc/84/39/83/570843983.db2.gz NPGICSVDCMMACC-UHFFFAOYSA-N 0 0 366.288 6.205 40 0 FKABRN CCCCOc1ccccc1C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000014031982 570844000 /nfs/dbraw/zinc/84/40/00/570844000.db2.gz BMGIHNOKVIFOCI-UHFFFAOYSA-N 0 0 361.441 5.910 40 0 FKABRN O=C(Nc1cccc2ccccc21)c1ccccc1OCc1ccccc1 ZINC000014035461 570843997 /nfs/dbraw/zinc/84/39/97/570843997.db2.gz RVMGVPFQJPONMS-UHFFFAOYSA-N 0 0 353.421 5.671 40 0 FKABRN O=C(Nc1ccc(Cl)cc1Cl)c1ccccc1OCc1ccccc1 ZINC000014035466 570843978 /nfs/dbraw/zinc/84/39/78/570843978.db2.gz XPNOOZSUPHQJMX-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)c1ccccc1OCc1ccccc1 ZINC000014035486 570843961 /nfs/dbraw/zinc/84/39/61/570843961.db2.gz KYKDBICQXOMCIE-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)c1ccccc1OCc1ccccc1 ZINC000014035490 570843926 /nfs/dbraw/zinc/84/39/26/570843926.db2.gz PNZIRUJHDULYHP-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN Cc1ccc(NC(=O)c2ccccc2OCc2ccccc2)cc1Cl ZINC000014035502 570843944 /nfs/dbraw/zinc/84/39/44/570843944.db2.gz TVYHQNBIYYDLDK-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN O=C(Nc1cccc(Cl)c1Cl)c1ccccc1OCc1ccccc1 ZINC000014035504 570844008 /nfs/dbraw/zinc/84/40/08/570844008.db2.gz IOMFGEBQSPHWGJ-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN O=C(Nc1cc(Cl)ccc1Cl)c1ccccc1OCc1ccccc1 ZINC000014035518 570843902 /nfs/dbraw/zinc/84/39/02/570843902.db2.gz OPQOVRDWRTVJER-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)c1ccccc1OCc1ccccc1 ZINC000014035531 570843969 /nfs/dbraw/zinc/84/39/69/570843969.db2.gz OZEAAMFFFODLIT-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN O=C(Nc1cccc(Cl)c1Cl)c1ccc(OCc2ccccc2)cc1 ZINC000014042493 570843893 /nfs/dbraw/zinc/84/38/93/570843893.db2.gz DZUQODKQBLLTIU-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN CCc1ccccc1NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000014049920 204563212 /nfs/dbraw/zinc/56/32/12/204563212.db2.gz SCOBHHOLTSWUKB-UHFFFAOYSA-N 0 0 354.837 5.129 40 0 FKABRN CCn1c(SCc2ccc(Cl)c(Cl)c2)nnc1-c1cccs1 ZINC000014062505 570512815 /nfs/dbraw/zinc/51/28/15/570512815.db2.gz XKSAONHUJOUUDX-UHFFFAOYSA-N 0 0 370.330 5.626 40 0 FKABRN Cc1ccc(-c2nnc(SCc3ccc(Cl)c(Cl)c3)n2C)cc1 ZINC000014082196 570843525 /nfs/dbraw/zinc/84/35/25/570843525.db2.gz FOFZARJBVKEZRJ-UHFFFAOYSA-N 0 0 364.301 5.390 40 0 FKABRN CCOc1ccccc1-c1nnc(SCc2ccc(Cl)cc2)n1CC ZINC000014085339 570843548 /nfs/dbraw/zinc/84/35/48/570843548.db2.gz UPBJCFGBAVESTO-UHFFFAOYSA-N 0 0 373.909 5.309 40 0 FKABRN CCOc1ccccc1-c1nnc(SCc2ccccc2Cl)n1CC ZINC000014085344 570843581 /nfs/dbraw/zinc/84/35/81/570843581.db2.gz RQHMOSXTSLRROJ-UHFFFAOYSA-N 0 0 373.909 5.309 40 0 FKABRN CCn1c(COc2cccc(C)c2)nnc1SCc1ccc(Cl)cc1 ZINC000014122219 570844309 /nfs/dbraw/zinc/84/43/09/570844309.db2.gz VCVQFEZMBPLTQX-UHFFFAOYSA-N 0 0 373.909 5.131 40 0 FKABRN CCn1c(COc2cccc(C)c2C)nnc1SCc1ccc(C)cc1 ZINC000014126426 570844294 /nfs/dbraw/zinc/84/42/94/570844294.db2.gz LNCDBGXLQXBJRK-UHFFFAOYSA-N 0 0 367.518 5.095 40 0 FKABRN O=C1Nc2cc(C(F)(F)F)ccc2/C1=C/c1ccc(Cl)cc1Cl ZINC000014130319 570844244 /nfs/dbraw/zinc/84/42/44/570844244.db2.gz QBFVCXSFSSXPQF-XGICHPGQSA-N 0 0 358.146 5.505 40 0 FKABRN O=C1S/C(=C/c2cccs2)C(=O)N1Cc1cccc2ccccc21 ZINC000014131929 570844316 /nfs/dbraw/zinc/84/43/16/570844316.db2.gz SXJATHFITJZWHC-GZTJUZNOSA-N 0 0 351.452 5.138 40 0 FKABRN Cc1ccccc1/C=C1/SC(=O)N(Cc2cccc3ccccc32)C1=O ZINC000014131996 570844238 /nfs/dbraw/zinc/84/42/38/570844238.db2.gz GNJGDFMZJPWNLP-DEDYPNTBSA-N 0 0 359.450 5.385 40 0 FKABRN O=C1S/C(=C/c2ccc(F)cc2)C(=O)N1Cc1cccc2ccccc21 ZINC000014132006 570844241 /nfs/dbraw/zinc/84/42/41/570844241.db2.gz QIQNHJPGGPAMKK-XDHOZWIPSA-N 0 0 363.413 5.215 40 0 FKABRN Cc1ccsc1/C=C1/SC(=O)N(Cc2cccc3ccccc32)C1=O ZINC000014132140 570844256 /nfs/dbraw/zinc/84/42/56/570844256.db2.gz FMHZFBAVXPZVRZ-WOJGMQOQSA-N 0 0 365.479 5.446 40 0 FKABRN O=C1S/C(=C/c2ccccc2F)C(=O)N1Cc1cccc2ccccc21 ZINC000014132148 570844321 /nfs/dbraw/zinc/84/43/21/570844321.db2.gz QOKJZDVWIZQTMX-XDHOZWIPSA-N 0 0 363.413 5.215 40 0 FKABRN O=C1S/C(=C/c2cccc(F)c2)C(=O)N1Cc1cccc2ccccc21 ZINC000014132150 570844251 /nfs/dbraw/zinc/84/42/51/570844251.db2.gz UUZVNKYLZTUFJD-XDHOZWIPSA-N 0 0 363.413 5.215 40 0 FKABRN Cc1ccc(/C=C2/SC(=O)N(Cc3cccc4ccccc43)C2=O)s1 ZINC000014132456 570844276 /nfs/dbraw/zinc/84/42/76/570844276.db2.gz NOFGTWGZLNFGAC-WOJGMQOQSA-N 0 0 365.479 5.446 40 0 FKABRN Cc1ccc(/C=C/C(=O)Nc2ccc(C3C4CC5CC(C4)CC3C5)cc2)cc1 ZINC000014153215 570844636 /nfs/dbraw/zinc/84/46/36/570844636.db2.gz XSVQERMNEDZMIQ-IZZDOVSWSA-N 0 0 371.524 6.187 40 0 FKABRN Cc1ccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)cc1C ZINC000014206597 220116668 /nfs/dbraw/zinc/11/66/68/220116668.db2.gz XFCKUOYJQUKOFU-UHFFFAOYSA-N 0 0 354.837 5.183 40 0 FKABRN O=C(CCc1ncc(-c2ccccc2)o1)Nc1ccc(Cl)cc1Cl ZINC000014211787 220117264 /nfs/dbraw/zinc/11/72/64/220117264.db2.gz MAQWHINIZYTCEJ-UHFFFAOYSA-N 0 0 361.228 5.220 40 0 FKABRN CC(C)c1ccc(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)cc1 ZINC000014222251 207512089 /nfs/dbraw/zinc/51/20/89/207512089.db2.gz QJEWUESGOHJUDW-UHFFFAOYSA-N 0 0 352.409 5.175 40 0 FKABRN Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2Sc2ccccc2)c1 ZINC000014223135 220116496 /nfs/dbraw/zinc/11/64/96/220116496.db2.gz JJOHGEQQRSNJKL-UHFFFAOYSA-N 0 0 369.511 5.255 40 0 FKABRN C=C/C(=C\C=C(/C)OCC)OCCCOc1cccc(Br)c1 ZINC000014244566 570521858 /nfs/dbraw/zinc/52/18/58/570521858.db2.gz UCQLHOMLMUBTLN-OMRAMHMRSA-N 0 0 367.283 5.245 40 0 FKABRN CC(C)c1ccc(S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 ZINC000014256843 570816694 /nfs/dbraw/zinc/81/66/94/570816694.db2.gz LBBLMTXCPDGIJD-UHFFFAOYSA-N 0 0 367.470 5.403 40 0 FKABRN Cc1cc(C)c(S(=O)(=O)Nc2ccc(Oc3ccccc3)cc2)c(C)c1 ZINC000014256858 570845386 /nfs/dbraw/zinc/84/53/86/570845386.db2.gz OVVBXXQXACAQFF-UHFFFAOYSA-N 0 0 367.470 5.205 40 0 FKABRN CCC(=O)Nc1c(Cl)cc(Cl)cc1-c1nc2ccccc2s1 ZINC000014257872 209588688 /nfs/dbraw/zinc/58/86/88/209588688.db2.gz QTECQGPDSCWCLJ-UHFFFAOYSA-N 0 0 351.258 5.619 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1 ZINC000014257874 570845889 /nfs/dbraw/zinc/84/58/89/570845889.db2.gz LHMLRLJTOAEKDY-UHFFFAOYSA-N 0 0 358.466 5.778 40 0 FKABRN Cc1cc(-c2nc3ccccc3s2)ccc1NC(=O)Cc1ccccc1 ZINC000014257880 206309671 /nfs/dbraw/zinc/30/96/71/206309671.db2.gz RQKSDIRJDAZFSQ-UHFFFAOYSA-N 0 0 358.466 5.453 40 0 FKABRN Cc1ccc(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)c(Cl)c1 ZINC000014257886 206308755 /nfs/dbraw/zinc/30/87/55/206308755.db2.gz ICYYMKFTKCODBK-UHFFFAOYSA-N 0 0 361.832 5.444 40 0 FKABRN Cc1ccccc1C(=O)Nc1cc(-c2nc3ccccc3[nH]2)ccc1Cl ZINC000014257896 570845771 /nfs/dbraw/zinc/84/57/71/570845771.db2.gz TZADGESVEKVFSQ-UHFFFAOYSA-N 0 0 361.832 5.444 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc(Cl)c(-c2nc3cc(Cl)ccc3o2)c1 ZINC000014257900 570845893 /nfs/dbraw/zinc/84/58/93/570845893.db2.gz ARKJAEILMNDPKL-UHFFFAOYSA-N 0 0 363.244 5.786 40 0 FKABRN CC(C)(C)C(=O)Nc1cccc(-c2nc3cc(Cl)cc(Cl)c3o2)c1 ZINC000014257902 206308696 /nfs/dbraw/zinc/30/86/96/206308696.db2.gz VBBCSHQOVZGZHK-UHFFFAOYSA-N 0 0 363.244 5.786 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3nc4cc(C)ccc4o3)cc2)cc1 ZINC000014257913 570845719 /nfs/dbraw/zinc/84/57/19/570845719.db2.gz YYHNZNQGWAFLFG-UHFFFAOYSA-N 0 0 356.425 5.618 40 0 FKABRN COc1ccc(C(=O)Nc2ccc(-c3nc4ccc(C)cc4o3)cc2)cc1 ZINC000014257915 570845813 /nfs/dbraw/zinc/84/58/13/570845813.db2.gz KOXYBCRBRWNAAS-UHFFFAOYSA-N 0 0 358.397 5.064 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3nc4ccc(C)cc4o3)cc2)cc1 ZINC000014257917 570845833 /nfs/dbraw/zinc/84/58/33/570845833.db2.gz KMJODMLBRXOJSU-UHFFFAOYSA-N 0 0 356.425 5.618 40 0 FKABRN O=C(NCc1ccc(-c2nc3ccccc3o2)cc1)c1ccc(Cl)cc1 ZINC000014257923 206309651 /nfs/dbraw/zinc/30/96/51/206309651.db2.gz ZOIVMYRQLYMSKI-UHFFFAOYSA-N 0 0 362.816 5.078 40 0 FKABRN O=C(NCc1ccc(-c2nc3ccccc3o2)cc1)c1cccc(Cl)c1 ZINC000014257924 570845706 /nfs/dbraw/zinc/84/57/06/570845706.db2.gz HZPWPQGZCRNROS-UHFFFAOYSA-N 0 0 362.816 5.078 40 0 FKABRN CCc1ccc(C(=O)Nc2cccc(-c3nc4cc(C)ccc4o3)c2)cc1 ZINC000014257934 570845701 /nfs/dbraw/zinc/84/57/01/570845701.db2.gz IXKPLKRCWYSQJH-UHFFFAOYSA-N 0 0 356.425 5.618 40 0 FKABRN CCc1ccc(C(=O)Nc2cccc(-c3nc4ccc(C)cc4o3)c2)cc1 ZINC000014257937 570845677 /nfs/dbraw/zinc/84/56/77/570845677.db2.gz CIWNVTFNRRFIEL-UHFFFAOYSA-N 0 0 356.425 5.618 40 0 FKABRN COc1ccc(-c2nc3ccccc3o2)cc1NC(=O)c1cccc(C)c1 ZINC000014257946 570845689 /nfs/dbraw/zinc/84/56/89/570845689.db2.gz VDKKPMFYKXYTOS-UHFFFAOYSA-N 0 0 358.397 5.064 40 0 FKABRN COc1ccc(-c2nc3cc(C(C)C)ccc3o2)cc1NC(=O)C(C)C ZINC000014257948 570845905 /nfs/dbraw/zinc/84/59/05/570845905.db2.gz QDBHOMILPBDPIN-UHFFFAOYSA-N 0 0 352.434 5.221 40 0 FKABRN CCc1ccc(C(=O)Nc2cccc(-c3nc4ccccc4o3)c2C)cc1 ZINC000014257950 570845898 /nfs/dbraw/zinc/84/58/98/570845898.db2.gz VBFYPYMKQJBJFE-UHFFFAOYSA-N 0 0 356.425 5.618 40 0 FKABRN Cc1ccc(C(=O)Nc2cc(-c3nc4cc(C)ccc4o3)ccc2C)cc1 ZINC000014257952 570845830 /nfs/dbraw/zinc/84/58/30/570845830.db2.gz BUSRPKVSDPCKJZ-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN Cc1ccc2oc(-c3ccc(C)c(NC(=O)c4ccc(F)cc4)c3)nc2c1 ZINC000014257954 206309278 /nfs/dbraw/zinc/30/92/78/206309278.db2.gz XRHAMUHAYXPJQS-UHFFFAOYSA-N 0 0 360.388 5.503 40 0 FKABRN Cc1ccc2nc(-c3ccc(C)c(NC(=O)c4cccc(F)c4)c3)oc2c1 ZINC000014257958 570845660 /nfs/dbraw/zinc/84/56/60/570845660.db2.gz GHFSALJFHIXITL-UHFFFAOYSA-N 0 0 360.388 5.503 40 0 FKABRN CCc1ccc2oc(-c3ccc(C)c(NC(=O)c4cccs4)c3)nc2c1 ZINC000014257966 206309810 /nfs/dbraw/zinc/30/98/10/206309810.db2.gz OTLVIGSWZOGNIB-UHFFFAOYSA-N 0 0 362.454 5.679 40 0 FKABRN Cc1ccc(-c2nc3cc(C(C)C)ccc3o2)cc1NC(=O)C(C)(C)C ZINC000014257971 570845909 /nfs/dbraw/zinc/84/59/09/570845909.db2.gz HTRRXJIJEDMPKY-UHFFFAOYSA-N 0 0 350.462 5.911 40 0 FKABRN O=C(/C=C/c1ccc(-c2cc(Cl)cc(Cl)c2)o1)Nc1cccnc1 ZINC000014257984 570846075 /nfs/dbraw/zinc/84/60/75/570846075.db2.gz GTXNJSWUEVKSMX-GQCTYLIASA-N 0 0 359.212 5.300 40 0 FKABRN Cc1ccc(C)c2sc(NC(=O)c3ccc(Cl)c(Cl)c3)nc21 ZINC000014258000 206308749 /nfs/dbraw/zinc/30/87/49/206308749.db2.gz DWOWAXJRSXCSGU-UHFFFAOYSA-N 0 0 351.258 5.472 40 0 FKABRN CCOc1ccc(C(=O)Nc2nc3c(s2)c(C)ccc3C)cc1Cl ZINC000014258009 570846078 /nfs/dbraw/zinc/84/60/78/570846078.db2.gz DXZDYNCJWZGXDO-UHFFFAOYSA-N 0 0 360.866 5.218 40 0 FKABRN Cc1ccc(C)c2sc(NC(=O)COc3ccc(C(C)C)cc3)nc21 ZINC000014258020 570846232 /nfs/dbraw/zinc/84/62/32/570846232.db2.gz JYAKPRPMJRHEJJ-UHFFFAOYSA-N 0 0 354.475 5.054 40 0 FKABRN Cc1cc2sc(NC(=O)/C=C/c3ccc(C(C)C)cc3)nc2c(C)c1 ZINC000014258024 206308971 /nfs/dbraw/zinc/30/89/71/206308971.db2.gz MZYHLEQZDDWFRC-JXMROGBWSA-N 0 0 350.487 5.688 40 0 FKABRN CCOc1ccc(C(=O)Nc2nc3c(cc(C)cc3C)s2)cc1Cl ZINC000014258025 206309821 /nfs/dbraw/zinc/30/98/21/206309821.db2.gz GUPCFGJFQKGEQU-UHFFFAOYSA-N 0 0 360.866 5.218 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1nc(-c2ccc(Cl)cc2)cs1 ZINC000014258034 206309987 /nfs/dbraw/zinc/30/99/87/206309987.db2.gz VZFSDUXTOKRTEP-UHFFFAOYSA-N 0 0 358.850 5.033 40 0 FKABRN COc1ccc(-c2csc(NC(=O)c3ccc(C)c(Cl)c3)n2)cc1 ZINC000014258038 570846327 /nfs/dbraw/zinc/84/63/27/570846327.db2.gz UCHUAXYWIBEINC-UHFFFAOYSA-N 0 0 358.850 5.033 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1ccc2oc(-c3ccccc3)nc2c1 ZINC000014258042 206310031 /nfs/dbraw/zinc/31/00/31/206310031.db2.gz YHBGXJLDEXMREN-UHFFFAOYSA-N 0 0 358.397 5.064 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccccc4C)nc3c2)cc1 ZINC000014258044 570846241 /nfs/dbraw/zinc/84/62/41/570846241.db2.gz WPELJMVLCCGRJV-UHFFFAOYSA-N 0 0 356.425 5.618 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccc(C)cc4)nc3c2)cc1 ZINC000014258047 570846026 /nfs/dbraw/zinc/84/60/26/570846026.db2.gz FFJLWAHFRKWJGF-UHFFFAOYSA-N 0 0 356.425 5.618 40 0 FKABRN Cc1cc(C)cc(-c2nc3cc(NC(=O)/C=C/c4ccco4)ccc3o2)c1 ZINC000014258054 206309111 /nfs/dbraw/zinc/30/91/11/206309111.db2.gz RADHRWZLDRLZNU-SOFGYWHQSA-N 0 0 358.397 5.357 40 0 FKABRN Cc1cc(C)cc(-c2nc3cc(NC(=O)c4ccc(F)cc4)ccc3o2)c1 ZINC000014258055 570846189 /nfs/dbraw/zinc/84/61/89/570846189.db2.gz RQJJBPDSCIFAQP-UHFFFAOYSA-N 0 0 360.388 5.503 40 0 FKABRN Cc1cccc(C(=O)Nc2ccc3oc(-c4cc(C)cc(C)c4)nc3c2)c1 ZINC000014258058 570846279 /nfs/dbraw/zinc/84/62/79/570846279.db2.gz FKXLZNHWPYCTEH-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN Cc1cc(C)cc(-c2nc3cc(NC(=O)c4cccc(F)c4)ccc3o2)c1 ZINC000014258059 570846172 /nfs/dbraw/zinc/84/61/72/570846172.db2.gz GAYLLCHBYPBNNZ-UHFFFAOYSA-N 0 0 360.388 5.503 40 0 FKABRN CCCCCC(=O)Nc1ccc2oc(-c3cccc4ccccc43)nc2c1 ZINC000014258065 570846116 /nfs/dbraw/zinc/84/61/16/570846116.db2.gz GZIBGYNKKMXINI-UHFFFAOYSA-N 0 0 358.441 6.167 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccccc4F)nc3c2)cc1 ZINC000014258067 570846204 /nfs/dbraw/zinc/84/62/04/570846204.db2.gz JTYVBKQOLALHLT-UHFFFAOYSA-N 0 0 360.388 5.449 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccc(F)cc4)nc3c2)cc1 ZINC000014258074 570846056 /nfs/dbraw/zinc/84/60/56/570846056.db2.gz SLYZIWGCQBYOSR-UHFFFAOYSA-N 0 0 360.388 5.449 40 0 FKABRN O=C(Nc1ccc2oc(-c3ccc(Cl)cc3)nc2c1)c1cccs1 ZINC000014258076 570846121 /nfs/dbraw/zinc/84/61/21/570846121.db2.gz MGLUJCXCOGBAMD-UHFFFAOYSA-N 0 0 354.818 5.462 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc2oc(-c3ccc(Cl)cc3Cl)nc2c1 ZINC000014258081 570846034 /nfs/dbraw/zinc/84/60/34/570846034.db2.gz CCIZUCAPQACMFS-UHFFFAOYSA-N 0 0 363.244 5.786 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc2oc(-c3ccc(Cl)c(Cl)c3)nc2c1 ZINC000014258082 570846037 /nfs/dbraw/zinc/84/60/37/570846037.db2.gz FYJSGYPNJPNMFK-UHFFFAOYSA-N 0 0 363.244 5.786 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc2oc(-c3cc(Cl)ccc3Cl)nc2c1 ZINC000014258084 209588935 /nfs/dbraw/zinc/58/89/35/209588935.db2.gz GMGZCRXDUHSSGT-UHFFFAOYSA-N 0 0 363.244 5.786 40 0 FKABRN Cc1c(Cl)c(C)c(Cl)c(OCC(=O)Nc2ccccc2)c1Cl ZINC000014258120 570846126 /nfs/dbraw/zinc/84/61/26/570846126.db2.gz FSKIVTUENDMUDB-UHFFFAOYSA-N 0 0 358.652 5.281 40 0 FKABRN CC(C)c1ccccc1NC(=O)COc1ccc(C2CCCCC2)cc1 ZINC000014258128 570846225 /nfs/dbraw/zinc/84/62/25/570846225.db2.gz JBACYYLHCBJLSZ-UHFFFAOYSA-N 0 0 351.490 5.875 40 0 FKABRN CC(C)c1ccc(NC(=O)COc2ccc(C3CCCCC3)cc2)cc1 ZINC000014258136 570846198 /nfs/dbraw/zinc/84/61/98/570846198.db2.gz WYAMUAXXQCUYAK-UHFFFAOYSA-N 0 0 351.490 5.875 40 0 FKABRN CC[C@@H](C)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2OC)cc1 ZINC000014258138 206309342 /nfs/dbraw/zinc/30/93/42/206309342.db2.gz BTZHOMKXVXGMIX-LLVKDONJSA-N 0 0 352.261 5.768 40 0 FKABRN CC[C@H](C)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2OC)cc1 ZINC000014258139 209590176 /nfs/dbraw/zinc/59/01/76/209590176.db2.gz BTZHOMKXVXGMIX-NSHDSACASA-N 0 0 352.261 5.768 40 0 FKABRN CCc1cccc(C)c1NC(=O)COc1ccc(C2CCCCC2)cc1 ZINC000014258151 570846301 /nfs/dbraw/zinc/84/63/01/570846301.db2.gz DEEDBQCDAJPNNV-UHFFFAOYSA-N 0 0 351.490 5.623 40 0 FKABRN O=C(Nc1ccccc1Br)c1cccc2c(Cl)cccc12 ZINC000014258225 570846339 /nfs/dbraw/zinc/84/63/39/570846339.db2.gz PUIRTELYHKHKIH-UHFFFAOYSA-N 0 0 360.638 5.508 40 0 FKABRN O=C(Nc1cccc(Br)c1)c1cccc2c(Cl)cccc12 ZINC000014258229 206309976 /nfs/dbraw/zinc/30/99/76/206309976.db2.gz XZDHBKRJPADVTI-UHFFFAOYSA-N 0 0 360.638 5.508 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)COc1ccc(C2CCCCC2)cc1 ZINC000014258245 570846315 /nfs/dbraw/zinc/84/63/15/570846315.db2.gz BCKCZZAQJZIFLI-UHFFFAOYSA-N 0 0 357.881 5.714 40 0 FKABRN O=C(Nc1cccc(Cl)c1Cl)c1cccc2c(Cl)cccc12 ZINC000014258249 570846269 /nfs/dbraw/zinc/84/62/69/570846269.db2.gz DNHQHDSNMLYXBZ-UHFFFAOYSA-N 0 0 350.632 6.052 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)c1cccc2c(Cl)cccc12 ZINC000014258255 570846309 /nfs/dbraw/zinc/84/63/09/570846309.db2.gz KSTMBRVOPPJTDZ-UHFFFAOYSA-N 0 0 350.632 6.052 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)cc1 ZINC000014258343 570846468 /nfs/dbraw/zinc/84/64/68/570846468.db2.gz NYCOYQOQECZCMZ-UHFFFAOYSA-N 0 0 351.833 5.947 40 0 FKABRN CCN(CC)c1ccc(NC(=O)c2ccc(OCC(C)C)cc2)c(C)c1 ZINC000014258351 570846622 /nfs/dbraw/zinc/84/66/22/570846622.db2.gz YPSNFEMWBQJYID-UHFFFAOYSA-N 0 0 354.494 5.128 40 0 FKABRN CCCCc1ccc(NC(=O)c2cc(Cl)cc(Cl)c2OC)cc1 ZINC000014258353 570846613 /nfs/dbraw/zinc/84/66/13/570846613.db2.gz QREICRGZNCWMSC-UHFFFAOYSA-N 0 0 352.261 5.597 40 0 FKABRN CC(C)Oc1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000014258383 570846565 /nfs/dbraw/zinc/84/65/65/570846565.db2.gz LODWOMSBEPFPFL-UHFFFAOYSA-N 0 0 357.759 5.398 40 0 FKABRN CC(C)Oc1cccc(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)c1 ZINC000014258384 570846537 /nfs/dbraw/zinc/84/65/37/570846537.db2.gz XWWUPGPYRMWJRF-UHFFFAOYSA-N 0 0 357.759 5.398 40 0 FKABRN CCCOc1cccc(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)c1 ZINC000014258386 570846532 /nfs/dbraw/zinc/84/65/32/570846532.db2.gz RKSIWZIDUUVHGX-UHFFFAOYSA-N 0 0 357.759 5.400 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(Br)cc2Cl)cc1 ZINC000014258394 570846609 /nfs/dbraw/zinc/84/66/09/570846609.db2.gz GMZAXHUAZFDDTI-UHFFFAOYSA-N 0 0 352.659 5.478 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(Br)cc2Cl)c(Cl)c1 ZINC000014258397 570846644 /nfs/dbraw/zinc/84/66/44/570846644.db2.gz ZVLWJTXBENKMNC-UHFFFAOYSA-N 0 0 359.050 5.317 40 0 FKABRN CCC(=O)Nc1ccc(NC(=O)c2cccc3c(Cl)cccc23)cc1 ZINC000014258402 570846603 /nfs/dbraw/zinc/84/66/03/570846603.db2.gz MCPNZUSADTWBIU-UHFFFAOYSA-N 0 0 352.821 5.094 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(NC(=O)c3cccc(C)c3)cc2)cc1 ZINC000014258418 206309640 /nfs/dbraw/zinc/30/96/40/206309640.db2.gz IWXMAKZOZZUTPS-UHFFFAOYSA-N 0 0 358.441 5.062 40 0 FKABRN CCCCCC(=O)Nc1ccc(NC(=O)c2cc3ccccc3o2)cc1 ZINC000014258442 570846651 /nfs/dbraw/zinc/84/66/51/570846651.db2.gz DFTUCWCGQQWNIA-UHFFFAOYSA-N 0 0 350.418 5.204 40 0 FKABRN CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000014258459 206309362 /nfs/dbraw/zinc/30/93/62/206309362.db2.gz SWSWCVDXXYWJMV-UHFFFAOYSA-N 0 0 358.869 5.238 40 0 FKABRN CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc3ccccc3c2)c1 ZINC000014258460 570846592 /nfs/dbraw/zinc/84/65/92/570846592.db2.gz YXMLDHKKZHDTRP-UHFFFAOYSA-N 0 0 352.821 5.094 40 0 FKABRN CCc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)cc1 ZINC000014258484 206309645 /nfs/dbraw/zinc/30/96/45/206309645.db2.gz IFPYTQMZEKNSOY-UHFFFAOYSA-N 0 0 362.395 5.120 40 0 FKABRN O=C(Nc1ccc(N2CCCC2)cc1)c1cccc2c(Cl)cccc12 ZINC000014258487 570846489 /nfs/dbraw/zinc/84/64/89/570846489.db2.gz ZFXMYMDYUDSSDJ-UHFFFAOYSA-N 0 0 350.849 5.346 40 0 FKABRN O=C(COc1ccccc1Cl)Nc1ccc2c(c1)oc1ccccc12 ZINC000014258493 570846507 /nfs/dbraw/zinc/84/65/07/570846507.db2.gz FZTLLBQUBOSKBB-UHFFFAOYSA-N 0 0 351.789 5.257 40 0 FKABRN O=C(Nc1ccc2c3c(cccc31)CC2)c1cccc2c(Cl)cccc12 ZINC000014258522 570846894 /nfs/dbraw/zinc/84/68/94/570846894.db2.gz INLXYYKHYZYDBE-UHFFFAOYSA-N 0 0 357.840 5.997 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1 ZINC000014258531 570846912 /nfs/dbraw/zinc/84/69/12/570846912.db2.gz OZKKBTARVCXLMX-KPKJPENVSA-N 0 0 356.469 5.448 40 0 FKABRN CC1CCN(c2ccc(NC(=O)c3cccc(Cl)c3)cc2Cl)CC1 ZINC000014258618 570846985 /nfs/dbraw/zinc/84/69/85/570846985.db2.gz PKWGLVDDOLJUQH-UHFFFAOYSA-N 0 0 363.288 5.482 40 0 FKABRN CCc1ccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)cc1 ZINC000014266970 204578838 /nfs/dbraw/zinc/57/88/38/204578838.db2.gz CCUHTMDYXCGYHP-UHFFFAOYSA-N 0 0 354.837 5.129 40 0 FKABRN CC1CCN(c2ccc(NC(=O)/C=C/c3ccccc3)cc2Cl)CC1 ZINC000014268860 132874265 /nfs/dbraw/zinc/87/42/65/132874265.db2.gz GLFAVFNYBGHOEO-JXMROGBWSA-N 0 0 354.881 5.228 40 0 FKABRN CC1CCN(c2ccc(NC(=O)c3ccccc3Cl)cc2Cl)CC1 ZINC000014268874 132874224 /nfs/dbraw/zinc/87/42/24/132874224.db2.gz VJDPDEWUMQNUSG-UHFFFAOYSA-N 0 0 363.288 5.482 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1 ZINC000014268895 570846966 /nfs/dbraw/zinc/84/69/66/570846966.db2.gz BLSQSRBWQIQFSE-CYBMUJFWSA-N 0 0 363.288 5.625 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1 ZINC000014268897 132874101 /nfs/dbraw/zinc/87/41/01/132874101.db2.gz BLSQSRBWQIQFSE-ZDUSSCGKSA-N 0 0 363.288 5.625 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)/C=C/c2ccc(Cl)cc2)cc1 ZINC000014268926 570846981 /nfs/dbraw/zinc/84/69/81/570846981.db2.gz PYCQJDVAWPJFKM-SNQWNFELSA-N 0 0 354.881 5.371 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)/C=C/c2ccc(Cl)cc2)cc1 ZINC000014268928 570846860 /nfs/dbraw/zinc/84/68/60/570846860.db2.gz PYCQJDVAWPJFKM-KAMPRCONSA-N 0 0 354.881 5.371 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)cc1 ZINC000014268942 570846961 /nfs/dbraw/zinc/84/69/61/570846961.db2.gz HTSKDDGXVVPFKL-HVRVZBDQSA-N 0 0 362.517 5.841 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)cc1 ZINC000014268944 570846953 /nfs/dbraw/zinc/84/69/53/570846953.db2.gz HTSKDDGXVVPFKL-SCFJZMLDSA-N 0 0 362.517 5.841 40 0 FKABRN CC(C)Oc1ccc(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)cc1 ZINC000014269004 570846905 /nfs/dbraw/zinc/84/69/05/570846905.db2.gz HOHHMKWMDQDKKA-KRWDZBQOSA-N 0 0 352.478 5.105 40 0 FKABRN CC(C)Oc1ccc(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)cc1 ZINC000014269006 570846868 /nfs/dbraw/zinc/84/68/68/570846868.db2.gz HOHHMKWMDQDKKA-QGZVFWFLSA-N 0 0 352.478 5.105 40 0 FKABRN CCCOc1cccc(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)c1 ZINC000014269008 570846891 /nfs/dbraw/zinc/84/68/91/570846891.db2.gz HEZQPAUGFJJBCZ-KRWDZBQOSA-N 0 0 352.478 5.107 40 0 FKABRN CCCOc1cccc(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)c1 ZINC000014269010 570846902 /nfs/dbraw/zinc/84/69/02/570846902.db2.gz HEZQPAUGFJJBCZ-QGZVFWFLSA-N 0 0 352.478 5.107 40 0 FKABRN CCOC(=O)c1cccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)o2)c1 ZINC000014291402 570847869 /nfs/dbraw/zinc/84/78/69/570847869.db2.gz UYSONHUAMQLFOK-UHFFFAOYSA-N 0 0 369.804 5.029 40 0 FKABRN CCCc1nc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2s1 ZINC000014291705 220122026 /nfs/dbraw/zinc/12/20/26/220122026.db2.gz LNWHWERADOIGCX-UHFFFAOYSA-N 0 0 365.285 5.808 40 0 FKABRN COc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1C ZINC000014292027 220122525 /nfs/dbraw/zinc/12/25/25/220122525.db2.gz CSRWRNMOHXDTGW-UHFFFAOYSA-N 0 0 367.832 5.702 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3ccc(OC)c(C)c3)ccc21 ZINC000014292034 570847943 /nfs/dbraw/zinc/84/79/43/570847943.db2.gz QGWXMNJJMNIZJB-UHFFFAOYSA-N 0 0 358.441 5.384 40 0 FKABRN C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(Br)cc1 ZINC000014391431 206310182 /nfs/dbraw/zinc/31/01/82/206310182.db2.gz AHWYIFKROPPGGM-SECBINFHSA-N 0 0 373.077 5.247 40 0 FKABRN C[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(Br)cc1 ZINC000014391432 206310470 /nfs/dbraw/zinc/31/04/70/206310470.db2.gz AHWYIFKROPPGGM-VIFPVBQESA-N 0 0 373.077 5.247 40 0 FKABRN O=C(NC(c1ccccc1)c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000014396139 570848317 /nfs/dbraw/zinc/84/83/17/570848317.db2.gz FWTVFMUOHGCKFZ-UHFFFAOYSA-N 0 0 370.496 5.196 40 0 FKABRN Cc1ccc(OCCCC(=O)Nc2ccccc2Oc2ccccc2)cc1 ZINC000014396357 570848295 /nfs/dbraw/zinc/84/82/95/570848295.db2.gz DWBPVQYKOSMDGQ-UHFFFAOYSA-N 0 0 361.441 5.585 40 0 FKABRN COc1ccc(NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Cl ZINC000014396367 570848310 /nfs/dbraw/zinc/84/83/10/570848310.db2.gz DGAUXVZDPZWWCR-GFCCVEGCSA-N 0 0 368.260 5.025 40 0 FKABRN COc1ccc(NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Cl ZINC000014396369 220123894 /nfs/dbraw/zinc/12/38/94/220123894.db2.gz DGAUXVZDPZWWCR-LBPRGKRZSA-N 0 0 368.260 5.025 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2cccc3ccccc32)cc(C)c1Cl ZINC000014396404 570848226 /nfs/dbraw/zinc/84/82/26/570848226.db2.gz ORABSUYJONPPDX-OAHLLOKOSA-N 0 0 353.849 5.516 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2cccc3ccccc32)cc(C)c1Cl ZINC000014396406 570848274 /nfs/dbraw/zinc/84/82/74/570848274.db2.gz ORABSUYJONPPDX-HNNXBMFYSA-N 0 0 353.849 5.516 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000014396433 570848249 /nfs/dbraw/zinc/84/82/49/570848249.db2.gz BWCCTOKERDFRRR-GFCCVEGCSA-N 0 0 366.288 5.697 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000014396435 570848227 /nfs/dbraw/zinc/84/82/27/570848227.db2.gz BWCCTOKERDFRRR-LBPRGKRZSA-N 0 0 366.288 5.697 40 0 FKABRN O=C(CCCOc1ccccc1)N(Cc1ccccc1)Cc1ccccc1 ZINC000014396456 570848415 /nfs/dbraw/zinc/84/84/15/570848415.db2.gz HZDUJCSDOGCTHM-UHFFFAOYSA-N 0 0 359.469 5.075 40 0 FKABRN Cc1ccc(OCCCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 ZINC000014396680 570848379 /nfs/dbraw/zinc/84/83/79/570848379.db2.gz QGCRUKTYALXXBI-UHFFFAOYSA-N 0 0 372.679 5.753 40 0 FKABRN C[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000014396804 570848344 /nfs/dbraw/zinc/84/83/44/570848344.db2.gz REXKMGDIORWTSZ-OAHLLOKOSA-N 0 0 367.832 5.538 40 0 FKABRN C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000014396806 570848242 /nfs/dbraw/zinc/84/82/42/570848242.db2.gz REXKMGDIORWTSZ-HNNXBMFYSA-N 0 0 367.832 5.538 40 0 FKABRN Cc1ccc(NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Cl ZINC000014397231 570848393 /nfs/dbraw/zinc/84/83/93/570848393.db2.gz XOFOPEJLDXGBED-CYBMUJFWSA-N 0 0 352.261 5.325 40 0 FKABRN Cc1ccc(NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1Cl ZINC000014397233 220123491 /nfs/dbraw/zinc/12/34/91/220123491.db2.gz XOFOPEJLDXGBED-ZDUSSCGKSA-N 0 0 352.261 5.325 40 0 FKABRN C[C@@H](Oc1ccc(Cl)cc1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000014397269 570848758 /nfs/dbraw/zinc/84/87/58/570848758.db2.gz LMGVWMMVDNDJCT-MRXNPFEDSA-N 0 0 365.860 5.013 40 0 FKABRN C[C@H](Oc1ccc(Cl)cc1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000014397270 570848746 /nfs/dbraw/zinc/84/87/46/570848746.db2.gz LMGVWMMVDNDJCT-INIZCTEOSA-N 0 0 365.860 5.013 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000014397459 570848739 /nfs/dbraw/zinc/84/87/39/570848739.db2.gz FLWJNHRSZNIWPD-GFCCVEGCSA-N 0 0 366.288 5.697 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000014397461 220123007 /nfs/dbraw/zinc/12/30/07/220123007.db2.gz FLWJNHRSZNIWPD-LBPRGKRZSA-N 0 0 366.288 5.697 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000014397671 220123464 /nfs/dbraw/zinc/12/34/64/220123464.db2.gz QQPJSAIPXXUYMD-GFCCVEGCSA-N 0 0 368.260 5.025 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000014397672 220123751 /nfs/dbraw/zinc/12/37/51/220123751.db2.gz QQPJSAIPXXUYMD-LBPRGKRZSA-N 0 0 368.260 5.025 40 0 FKABRN Cc1cc(C)cc(OCC(=O)Nc2ccccc2Sc2ccccc2)c1 ZINC000014397674 570848756 /nfs/dbraw/zinc/84/87/56/570848756.db2.gz LVZFPXCPRVQQJB-UHFFFAOYSA-N 0 0 363.482 5.472 40 0 FKABRN C[C@@H](Oc1ccc(F)cc1)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000014397917 570848734 /nfs/dbraw/zinc/84/87/34/570848734.db2.gz MKCPUXHTJUDQJS-OAHLLOKOSA-N 0 0 367.445 5.383 40 0 FKABRN C[C@H](Oc1ccc(F)cc1)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000014397919 570848779 /nfs/dbraw/zinc/84/87/79/570848779.db2.gz MKCPUXHTJUDQJS-HNNXBMFYSA-N 0 0 367.445 5.383 40 0 FKABRN C[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1-c1ccccc1 ZINC000014398040 206311142 /nfs/dbraw/zinc/31/11/42/206311142.db2.gz SZSZEDSPNSRXOX-OAHLLOKOSA-N 0 0 351.833 5.413 40 0 FKABRN C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1-c1ccccc1 ZINC000014398041 220123818 /nfs/dbraw/zinc/12/38/18/220123818.db2.gz SZSZEDSPNSRXOX-HNNXBMFYSA-N 0 0 351.833 5.413 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)cc(C)c1Cl ZINC000014398248 206311612 /nfs/dbraw/zinc/31/16/12/206311612.db2.gz IIXGDKBXBNMOMY-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(Cl)cc2Cl)cc(C)c1Cl ZINC000014398249 220123680 /nfs/dbraw/zinc/12/36/80/220123680.db2.gz IIXGDKBXBNMOMY-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)cc(C)c1Cl ZINC000014398661 206311011 /nfs/dbraw/zinc/31/10/11/206311011.db2.gz UVALXJNBTWRYIT-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)cc(C)c1Cl ZINC000014398663 570849256 /nfs/dbraw/zinc/84/92/56/570849256.db2.gz UVALXJNBTWRYIT-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000014398731 570849197 /nfs/dbraw/zinc/84/91/97/570849197.db2.gz MYISFDLOEPVFHT-GFCCVEGCSA-N 0 0 366.288 5.697 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000014398733 206310628 /nfs/dbraw/zinc/31/06/28/206310628.db2.gz MYISFDLOEPVFHT-LBPRGKRZSA-N 0 0 366.288 5.697 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2cccc(Cl)c2Cl)cc(C)c1Cl ZINC000014398933 570849226 /nfs/dbraw/zinc/84/92/26/570849226.db2.gz VGGWMLWVYFWKSI-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2cccc(Cl)c2Cl)cc(C)c1Cl ZINC000014398935 570849231 /nfs/dbraw/zinc/84/92/31/570849231.db2.gz VGGWMLWVYFWKSI-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2cc(Cl)ccc2Cl)cc(C)c1Cl ZINC000014399050 570849145 /nfs/dbraw/zinc/84/91/45/570849145.db2.gz SIANHUOTSLMYKQ-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2cc(Cl)ccc2Cl)cc(C)c1Cl ZINC000014399052 570849273 /nfs/dbraw/zinc/84/92/73/570849273.db2.gz SIANHUOTSLMYKQ-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)[C@@H](C)Oc3cccc(C)c3)ccc21 ZINC000014399125 570849119 /nfs/dbraw/zinc/84/91/19/570849119.db2.gz TYLWCHNOVKBGGA-QGZVFWFLSA-N 0 0 372.468 5.529 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)[C@H](C)Oc3cccc(C)c3)ccc21 ZINC000014399127 570849219 /nfs/dbraw/zinc/84/92/19/570849219.db2.gz TYLWCHNOVKBGGA-KRWDZBQOSA-N 0 0 372.468 5.529 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000014399141 220123888 /nfs/dbraw/zinc/12/38/88/220123888.db2.gz KFDVFCBWZNQTDF-GFCCVEGCSA-N 0 0 366.288 5.697 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000014399143 220123133 /nfs/dbraw/zinc/12/31/33/220123133.db2.gz KFDVFCBWZNQTDF-LBPRGKRZSA-N 0 0 366.288 5.697 40 0 FKABRN O=C(CCCOc1ccc(Cl)cc1)Nc1ccccc1-c1ccccc1 ZINC000014399262 570849643 /nfs/dbraw/zinc/84/96/43/570849643.db2.gz HLJDJIVRPRIXAF-UHFFFAOYSA-N 0 0 365.860 5.805 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 ZINC000014399292 570849654 /nfs/dbraw/zinc/84/96/54/570849654.db2.gz ZTPRNBDCVFJPBC-LLVKDONJSA-N 0 0 357.759 5.073 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 ZINC000014399293 570849587 /nfs/dbraw/zinc/84/95/87/570849587.db2.gz ZTPRNBDCVFJPBC-NSHDSACASA-N 0 0 357.759 5.073 40 0 FKABRN O=C(CCCOc1ccc(Cl)cc1)Nc1ccc(Cl)cc1Cl ZINC000014399660 206311485 /nfs/dbraw/zinc/31/14/85/206311485.db2.gz XGWACQMHXQZGMY-UHFFFAOYSA-N 0 0 358.652 5.445 40 0 FKABRN O=C(Nc1ccccc1-c1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000014399869 570850171 /nfs/dbraw/zinc/85/01/71/570850171.db2.gz UGAMMYALAVSCIW-UHFFFAOYSA-N 0 0 356.469 5.596 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1 ZINC000014400325 570854630 /nfs/dbraw/zinc/85/46/30/570854630.db2.gz ZOALMULOUKDXTE-MRXNPFEDSA-N 0 0 359.897 5.705 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1 ZINC000014400327 570855039 /nfs/dbraw/zinc/85/50/39/570855039.db2.gz ZOALMULOUKDXTE-INIZCTEOSA-N 0 0 359.897 5.705 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000014400600 570854815 /nfs/dbraw/zinc/85/48/15/570854815.db2.gz BVWIKZJPFZZUIY-CYBMUJFWSA-N 0 0 365.395 5.409 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000014400601 570854950 /nfs/dbraw/zinc/85/49/50/570854950.db2.gz BVWIKZJPFZZUIY-ZDUSSCGKSA-N 0 0 365.395 5.409 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2cccc(OC(C)C)c2)cc(C)c1Cl ZINC000014400675 570854990 /nfs/dbraw/zinc/85/49/90/570854990.db2.gz RQRJMILYGHQYKD-OAHLLOKOSA-N 0 0 361.869 5.150 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2cccc(OC(C)C)c2)cc(C)c1Cl ZINC000014400676 570854984 /nfs/dbraw/zinc/85/49/84/570854984.db2.gz RQRJMILYGHQYKD-HNNXBMFYSA-N 0 0 361.869 5.150 40 0 FKABRN O=C(CCCOc1ccccc1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000014400901 570854906 /nfs/dbraw/zinc/85/49/06/570854906.db2.gz QFUXEUSEQUHIJE-UHFFFAOYSA-N 0 0 357.759 5.157 40 0 FKABRN Cc1ccc(OCC(=O)Nc2ccccc2Sc2ccccc2)cc1C ZINC000014401097 570853612 /nfs/dbraw/zinc/85/36/12/570853612.db2.gz BUMKPTDEUMDZLY-UHFFFAOYSA-N 0 0 363.482 5.472 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000014401113 206310794 /nfs/dbraw/zinc/31/07/94/206310794.db2.gz XPHKCZDWKGSIPL-CYBMUJFWSA-N 0 0 365.395 5.409 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000014401116 220123070 /nfs/dbraw/zinc/12/30/70/220123070.db2.gz XPHKCZDWKGSIPL-ZDUSSCGKSA-N 0 0 365.395 5.409 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 ZINC000014401142 570853617 /nfs/dbraw/zinc/85/36/17/570853617.db2.gz RZBVGJPWOBSYRO-QGZVFWFLSA-N 0 0 353.506 5.822 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1 ZINC000014401145 570853453 /nfs/dbraw/zinc/85/34/53/570853453.db2.gz RZBVGJPWOBSYRO-KRWDZBQOSA-N 0 0 353.506 5.822 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000014401179 570853487 /nfs/dbraw/zinc/85/34/87/570853487.db2.gz HBRQQYDJKAJWHW-CYBMUJFWSA-N 0 0 352.261 5.325 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000014401182 570853644 /nfs/dbraw/zinc/85/36/44/570853644.db2.gz HBRQQYDJKAJWHW-ZDUSSCGKSA-N 0 0 352.261 5.325 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000014401754 570854031 /nfs/dbraw/zinc/85/40/31/570854031.db2.gz ZAMYADAOMIFTED-GFCCVEGCSA-N 0 0 366.288 5.697 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000014401757 570853957 /nfs/dbraw/zinc/85/39/57/570853957.db2.gz ZAMYADAOMIFTED-LBPRGKRZSA-N 0 0 366.288 5.697 40 0 FKABRN O=C(Nc1ccccc1Oc1ccccc1)c1ccc(N2CCCCC2)cc1 ZINC000014402000 570853940 /nfs/dbraw/zinc/85/39/40/570853940.db2.gz PZUGAYSTBHWPAT-UHFFFAOYSA-N 0 0 372.468 5.722 40 0 FKABRN O=C(COc1ccc(Cl)cc1Cl)Nc1ccc(C(F)(F)F)cc1 ZINC000014410972 570854352 /nfs/dbraw/zinc/85/43/52/570854352.db2.gz JFGZYPBTOZHTER-UHFFFAOYSA-N 0 0 364.150 5.030 40 0 FKABRN O=C(Nc1ccc(F)c(F)c1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000014411282 570854572 /nfs/dbraw/zinc/85/45/72/570854572.db2.gz YTEZCYGBNCADJG-SFQUDFHCSA-N 0 0 369.798 5.798 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1)Nc1ccccc1Sc1ccccc1 ZINC000014411286 570854422 /nfs/dbraw/zinc/85/44/22/570854422.db2.gz VFLRTERRFOWNBO-NTCAYCPXSA-N 0 0 365.885 6.143 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1)Nc1ccc(C(F)(F)F)cc1 ZINC000014411867 570854493 /nfs/dbraw/zinc/85/44/93/570854493.db2.gz BQYVOACHVULSTK-UHFFFAOYSA-N 0 0 359.800 5.231 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)/C(=C/c1ccco1)c1ccccc1 ZINC000014412181 570854370 /nfs/dbraw/zinc/85/43/70/570854370.db2.gz RBNWMOCRKRRVRZ-FOWTUZBSSA-N 0 0 358.224 5.766 40 0 FKABRN O=C(Nc1cccc(Cl)c1Cl)/C(=C/c1ccccc1)c1ccccc1 ZINC000014412216 570854622 /nfs/dbraw/zinc/85/46/22/570854622.db2.gz NDPCHYRFESDQSO-SAPNQHFASA-N 0 0 368.263 6.173 40 0 FKABRN O=C(/C=C/c1ccccc1Cl)Nc1ccccc1Sc1ccccc1 ZINC000014412592 570854482 /nfs/dbraw/zinc/85/44/82/570854482.db2.gz RIEPKIHXVSWKTM-CCEZHUSRSA-N 0 0 365.885 6.143 40 0 FKABRN O=C(Nc1ccc(C(F)(F)F)cc1)/C(=C/c1ccco1)c1ccccc1 ZINC000014412720 570854488 /nfs/dbraw/zinc/85/44/88/570854488.db2.gz SHOVGBYMJSXTMM-QGOAFFKASA-N 0 0 357.331 5.478 40 0 FKABRN O=C(CSCc1ccccc1)Nc1ccccc1Sc1ccccc1 ZINC000014412883 570854393 /nfs/dbraw/zinc/85/43/93/570854393.db2.gz LMCXGTJXDYXGBH-UHFFFAOYSA-N 0 0 365.523 5.710 40 0 FKABRN COc1ccc(Br)cc1/C=C/C(=O)Nc1c(C)cc(C)cc1C ZINC000014426346 206311439 /nfs/dbraw/zinc/31/14/39/206311439.db2.gz ISEACLZZEIAUSU-VMPITWQZSA-N 0 0 374.278 5.035 40 0 FKABRN Cc1cc(C)c(NC(=O)c2sc3cc(Cl)ccc3c2Cl)c(C)c1 ZINC000014426551 571303574 /nfs/dbraw/zinc/30/35/74/571303574.db2.gz SOOSTTJZMRLIML-UHFFFAOYSA-N 0 0 364.297 6.386 40 0 FKABRN CCCOc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1OCC ZINC000014427002 220124539 /nfs/dbraw/zinc/12/45/39/220124539.db2.gz NZIXDRRRXFTXPL-UHFFFAOYSA-N 0 0 368.260 5.433 40 0 FKABRN O=C(Nc1cc(Cl)ccc1Cl)c1ccc(COc2ccccc2)o1 ZINC000014427093 570855276 /nfs/dbraw/zinc/85/52/76/570855276.db2.gz QUMMELGADJOXCD-UHFFFAOYSA-N 0 0 362.212 5.418 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1OC ZINC000014427179 570855266 /nfs/dbraw/zinc/85/52/66/570855266.db2.gz JDQCEJHSWOHGJT-UHFFFAOYSA-N 0 0 368.260 5.433 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2cccc(Cl)c2)cc1OC ZINC000014427500 220124529 /nfs/dbraw/zinc/12/45/29/220124529.db2.gz CDVLOBCKLWLTGJ-UHFFFAOYSA-N 0 0 354.233 5.043 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2ccc(Cl)cc2)cc1OC ZINC000014429311 570855278 /nfs/dbraw/zinc/85/52/78/570855278.db2.gz KOSLGWKUQTYFHG-UHFFFAOYSA-N 0 0 354.233 5.043 40 0 FKABRN COC(=O)CCCCCCCCCCCCCCCCCCCCCO ZINC000014449067 206763189 /nfs/dbraw/zinc/76/31/89/206763189.db2.gz NVNDMNDHEBYPQC-UHFFFAOYSA-N 0 0 370.618 6.954 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)c1cc(Br)ccc1Cl ZINC000014493080 570819680 /nfs/dbraw/zinc/81/96/80/570819680.db2.gz DBILKOACOSJPAE-UHFFFAOYSA-N 0 0 359.050 5.317 40 0 FKABRN CCCCCC[C@@H](O)C/C=C\CCCCCCCC(=O)OCCCC ZINC000014494893 220124801 /nfs/dbraw/zinc/12/48/01/220124801.db2.gz HGWAKQDTQVDVRP-OKULMJQMSA-N 0 0 354.575 6.338 40 0 FKABRN CCCCCC[C@H](O)C/C=C\CCCCCCCC(=O)OCCCC ZINC000014494895 207519371 /nfs/dbraw/zinc/51/93/71/207519371.db2.gz HGWAKQDTQVDVRP-MQGIHEMASA-N 0 0 354.575 6.338 40 0 FKABRN CCCCCC[C@@H](C/C=C\CCCCCCCC(=O)OC)OC(C)=O ZINC000014494916 211092512 /nfs/dbraw/zinc/09/25/12/211092512.db2.gz CMOYPQWMTBSLJK-QKQONQEDSA-N 0 0 354.531 5.739 40 0 in-vitro FKABRN CCCCOc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)cc1OC ZINC000014495819 570855048 /nfs/dbraw/zinc/85/50/48/570855048.db2.gz HUVXDEZFCOHKSH-UHFFFAOYSA-N 0 0 368.260 5.433 40 0 FKABRN O=C(Nc1nc(-c2ccc3ccccc3c2)cs1)c1cccnc1Cl ZINC000014580401 570855310 /nfs/dbraw/zinc/85/53/10/570855310.db2.gz GMVBGKXZTRSXNB-UHFFFAOYSA-N 0 0 365.845 5.264 40 0 FKABRN Cc1nn2c(c1-c1ccccc1)N=C(c1ccccc1)C[C@@H]2c1ccncc1 ZINC000014607112 220127365 /nfs/dbraw/zinc/12/73/65/220127365.db2.gz LJYGZLXLAYRCHW-JOCHJYFZSA-N 0 0 364.452 5.367 40 0 FKABRN Cc1nn2c(c1-c1ccccc1)N=C(c1ccccc1)C[C@H]2c1ccncc1 ZINC000014607113 220127184 /nfs/dbraw/zinc/12/71/84/220127184.db2.gz LJYGZLXLAYRCHW-QFIPXVFZSA-N 0 0 364.452 5.367 40 0 FKABRN Cc1nn2c(c1-c1ccc(F)cc1)N=C(C)C[C@@H]2c1cc(F)cc(F)c1 ZINC000014607130 206311066 /nfs/dbraw/zinc/31/10/66/206311066.db2.gz OJZLGNYAPDNIFA-GOSISDBHSA-N 0 0 355.363 5.361 40 0 FKABRN Cc1nn2c(c1-c1ccc(F)cc1)N=C(C)C[C@H]2c1cc(F)cc(F)c1 ZINC000014607131 220127274 /nfs/dbraw/zinc/12/72/74/220127274.db2.gz OJZLGNYAPDNIFA-SFHVURJKSA-N 0 0 355.363 5.361 40 0 FKABRN Cc1nn2c(c1-c1ccccc1)N=C(c1ccccc1)C[C@@H]2c1cccnc1 ZINC000014607594 220127098 /nfs/dbraw/zinc/12/70/98/220127098.db2.gz RCXZYLRPBDSIFK-JOCHJYFZSA-N 0 0 364.452 5.367 40 0 FKABRN Cc1nn2c(c1-c1ccccc1)N=C(c1ccccc1)C[C@H]2c1cccnc1 ZINC000014607595 220127738 /nfs/dbraw/zinc/12/77/38/220127738.db2.gz RCXZYLRPBDSIFK-QFIPXVFZSA-N 0 0 364.452 5.367 40 0 FKABRN CCc1nn2c(c1-c1ccccc1)N=C(c1ccco1)C[C@@H]2c1cccnc1 ZINC000014607648 220126813 /nfs/dbraw/zinc/12/68/13/220126813.db2.gz SUGQAFMTVIUKDP-HXUWFJFHSA-N 0 0 368.440 5.214 40 0 FKABRN CCc1nn2c(c1-c1ccccc1)N=C(c1ccco1)C[C@H]2c1cccnc1 ZINC000014607649 220127714 /nfs/dbraw/zinc/12/77/14/220127714.db2.gz SUGQAFMTVIUKDP-FQEVSTJZSA-N 0 0 368.440 5.214 40 0 FKABRN CC1=Nc2ccccc2N=C(NC(=O)Cc2cccs2)[C@@H]1c1ccccc1 ZINC000014607975 220128649 /nfs/dbraw/zinc/12/86/49/220128649.db2.gz ZRZFIELNGPFWMV-NRFANRHFSA-N 0 0 373.481 5.027 40 0 FKABRN CC1=Nc2ccccc2N=C(NC(=O)Cc2cccs2)[C@H]1c1ccccc1 ZINC000014607976 206313236 /nfs/dbraw/zinc/31/32/36/206313236.db2.gz ZRZFIELNGPFWMV-OAQYLSRUSA-N 0 0 373.481 5.027 40 0 FKABRN CCCC(=O)NC1=Nc2ccccc2N=C(CC)[C@@H]1c1ccc(F)cc1 ZINC000014608089 206313367 /nfs/dbraw/zinc/31/33/67/206313367.db2.gz XJMFFFYRDODLAI-FQEVSTJZSA-N 0 0 351.425 5.052 40 0 FKABRN CCCC(=O)NC1=Nc2ccccc2N=C(CC)[C@H]1c1ccc(F)cc1 ZINC000014608090 220128435 /nfs/dbraw/zinc/12/84/35/220128435.db2.gz XJMFFFYRDODLAI-HXUWFJFHSA-N 0 0 351.425 5.052 40 0 FKABRN CCCCC/C=C\C/C=C/CCCCCCCC(=O)NC1CCCCC1 ZINC000014616242 220128504 /nfs/dbraw/zinc/12/85/04/220128504.db2.gz OFSPDNIHQQKLPZ-IXWMQOLASA-N 0 0 361.614 7.249 40 0 FKABRN CCCCOc1ccc(Br)cc1C(=O)Nc1cccc(C)c1 ZINC000014649187 570856111 /nfs/dbraw/zinc/85/61/11/570856111.db2.gz SVCQZEYFWHZIFZ-UHFFFAOYSA-N 0 0 362.267 5.189 40 0 FKABRN CCCCOc1ccc(Br)cc1C(=O)Nc1ccc(F)cc1 ZINC000014649213 570856050 /nfs/dbraw/zinc/85/60/50/570856050.db2.gz RUDQVEWDSUSZDK-UHFFFAOYSA-N 0 0 366.230 5.019 40 0 FKABRN CCCCOc1ccc(Br)cc1C(=O)Nc1ccc(C)cc1 ZINC000014649265 570855994 /nfs/dbraw/zinc/85/59/94/570855994.db2.gz NUNFQLBUOMLRBO-UHFFFAOYSA-N 0 0 362.267 5.189 40 0 FKABRN CCCCOc1ccc(Br)cc1C(=O)Nc1ccccc1F ZINC000014649360 570856055 /nfs/dbraw/zinc/85/60/55/570856055.db2.gz GJKNDCYIUPAZEF-UHFFFAOYSA-N 0 0 366.230 5.019 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1cccc(Cl)c1 ZINC000014651582 570856196 /nfs/dbraw/zinc/85/61/96/570856196.db2.gz MAQYQWGBLLHTKE-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1ccccc1Cl ZINC000014651622 570856138 /nfs/dbraw/zinc/85/61/38/570856138.db2.gz IOLXWJHMSHBYKZ-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1ccc(Cl)cc1 ZINC000014651628 570856095 /nfs/dbraw/zinc/85/60/95/570856095.db2.gz JVGQGUXORGLIOM-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1ccc(C)c(C)c1 ZINC000014651631 570856153 /nfs/dbraw/zinc/85/61/53/570856153.db2.gz QEIZYVXQRYHZHX-UHFFFAOYSA-N 0 0 362.267 5.107 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1ccc(C)cc1C ZINC000014651637 570856079 /nfs/dbraw/zinc/85/60/79/570856079.db2.gz ADPWYLKCYILCLE-UHFFFAOYSA-N 0 0 362.267 5.107 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1cc(C)ccc1C ZINC000014651702 570856174 /nfs/dbraw/zinc/85/61/74/570856174.db2.gz BLJRJRDYQSYVIE-UHFFFAOYSA-N 0 0 362.267 5.107 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1cccc(C)c1C ZINC000014651857 570856087 /nfs/dbraw/zinc/85/60/87/570856087.db2.gz GHWAQXMAPBIKHY-UHFFFAOYSA-N 0 0 362.267 5.107 40 0 FKABRN CCOc1ccc(Br)cc1C(=O)Nc1cccc2ccccc21 ZINC000014654359 570856179 /nfs/dbraw/zinc/85/61/79/570856179.db2.gz PDVUFKSPQIXEDN-UHFFFAOYSA-N 0 0 370.246 5.253 40 0 FKABRN CCOc1ccc(Br)cc1C(=O)Nc1cccc(Cl)c1C ZINC000014654499 570856021 /nfs/dbraw/zinc/85/60/21/570856021.db2.gz ITOBVVOLXQDWRS-UHFFFAOYSA-N 0 0 368.658 5.062 40 0 FKABRN CCOc1ccc(Br)cc1C(=O)Nc1ccc(C)c(Cl)c1 ZINC000014654614 570855990 /nfs/dbraw/zinc/85/59/90/570855990.db2.gz VTDPIQVSWDGMSA-UHFFFAOYSA-N 0 0 368.658 5.062 40 0 FKABRN CCOc1ccc(Br)cc1C(=O)Nc1cc(Cl)ccc1C ZINC000014654744 570856003 /nfs/dbraw/zinc/85/60/03/570856003.db2.gz ADOOIRISVDSEFC-UHFFFAOYSA-N 0 0 368.658 5.062 40 0 FKABRN O=C(/C=C/C=C/CCCC/C=C/c1ccc2c(c1)OCO2)N1CCCCC1 ZINC000014658375 206313035 /nfs/dbraw/zinc/31/30/35/206313035.db2.gz BADLEYLQAILHPV-AZMZBSBOSA-N 0 0 367.489 5.114 40 0 endogenous,in-man FKABRN O=C(/C=C/CCCCCC/C=C/c1ccc2c(c1)OCO2)N1CCCCC1 ZINC000014658378 204584371 /nfs/dbraw/zinc/58/43/71/204584371.db2.gz CHOLQJRIMZGPNC-QHKWOANTSA-N 0 0 369.505 5.338 40 0 biogenic,in-vitro FKABRN CC(C)Oc1ccccc1C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000014664130 220129951 /nfs/dbraw/zinc/12/99/51/220129951.db2.gz RSDMLGKEGHTVAW-UHFFFAOYSA-N 0 0 361.441 5.305 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000014665275 570856006 /nfs/dbraw/zinc/85/60/06/570856006.db2.gz TYNXZWLRUIEUOH-LBPRGKRZSA-N 0 0 366.288 5.697 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(Cl)c1Cl ZINC000014665277 570856072 /nfs/dbraw/zinc/85/60/72/570856072.db2.gz TYNXZWLRUIEUOH-GFCCVEGCSA-N 0 0 366.288 5.697 40 0 FKABRN COc1ccc(NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1Cl ZINC000014665415 570856075 /nfs/dbraw/zinc/85/60/75/570856075.db2.gz XVVUAQRFDDRTNZ-ZDUSSCGKSA-N 0 0 361.869 5.052 40 0 FKABRN COc1ccc(NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1Cl ZINC000014665417 570856159 /nfs/dbraw/zinc/85/61/59/570856159.db2.gz XVVUAQRFDDRTNZ-CYBMUJFWSA-N 0 0 361.869 5.052 40 0 FKABRN CC(C)Oc1ccc(NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000014665481 570856046 /nfs/dbraw/zinc/85/60/46/570856046.db2.gz FUVMYWYHMAASKO-MRXNPFEDSA-N 0 0 355.478 5.177 40 0 FKABRN CC(C)Oc1ccc(NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000014665483 570856134 /nfs/dbraw/zinc/85/61/34/570856134.db2.gz FUVMYWYHMAASKO-INIZCTEOSA-N 0 0 355.478 5.177 40 0 FKABRN CCCSc1nnc2c(n1)n1c3c2c(C)c(C)cc3C(C)=CC1(C)C ZINC000014671885 570855986 /nfs/dbraw/zinc/85/59/86/570855986.db2.gz NOPCJYBPAPHKBH-UHFFFAOYSA-N 0 0 352.507 5.250 40 0 FKABRN Cc1ccc(CSc2nnc(NC(=O)c3ccc(C)cc3C)s2)cc1 ZINC000014696192 570822168 /nfs/dbraw/zinc/82/21/68/570822168.db2.gz JOKIKVJHXQJBFN-UHFFFAOYSA-N 0 0 369.515 5.008 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000014707104 570822346 /nfs/dbraw/zinc/82/23/46/570822346.db2.gz SMLLRAOTMLFTCB-LJQANCHMSA-N 0 0 373.496 5.485 40 0 FKABRN CCOc1ccc([C@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000014707105 220129411 /nfs/dbraw/zinc/12/94/11/220129411.db2.gz SMLLRAOTMLFTCB-IBGZPJMESA-N 0 0 373.496 5.485 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)c1cccc(OCc2ccccc2)c1 ZINC000014739251 211100385 /nfs/dbraw/zinc/10/03/85/211100385.db2.gz CHCZONQMYWXVTK-UHFFFAOYSA-N 0 0 359.469 5.950 40 0 FKABRN CSc1ccccc1NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000014771440 204586597 /nfs/dbraw/zinc/58/65/97/204586597.db2.gz WWTIBKBYMUJLRB-UHFFFAOYSA-N 0 0 372.877 5.288 40 0 FKABRN O=C(CCCCCCCCC(=O)NC1CCCCC1)NC1CCCCC1 ZINC000014775491 570823490 /nfs/dbraw/zinc/82/34/90/570823490.db2.gz CGIXSLUETKYERU-UHFFFAOYSA-N 0 0 364.574 5.005 40 0 FKABRN CC(C)c1ccccc1NC(=S)NC(=O)c1ccc(Cl)cc1Cl ZINC000014784316 570858103 /nfs/dbraw/zinc/85/81/03/570858103.db2.gz VRAWVDYOSGCROV-UHFFFAOYSA-N 0 0 367.301 5.244 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2)cc1)c1cc(Cl)cc(Cl)c1 ZINC000014784517 570857905 /nfs/dbraw/zinc/85/79/05/570857905.db2.gz KOMJBGSQLDRDFR-UHFFFAOYSA-N 0 0 358.224 6.038 40 0 FKABRN Cc1ccc(C(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)c(C)c1 ZINC000014792906 211102802 /nfs/dbraw/zinc/10/28/02/211102802.db2.gz YKUUNZKEKXHNLS-GOSISDBHSA-N 0 0 372.468 5.047 40 0 FKABRN Cc1ccc(C(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)c(C)c1 ZINC000014792907 570823446 /nfs/dbraw/zinc/82/34/46/570823446.db2.gz YKUUNZKEKXHNLS-SFHVURJKSA-N 0 0 372.468 5.047 40 0 FKABRN O=C(Nc1cccc2ccccc21)c1cccc(OCc2ccccc2)c1 ZINC000014796011 570823363 /nfs/dbraw/zinc/82/33/63/570823363.db2.gz YEKPBKTZOYMFGK-UHFFFAOYSA-N 0 0 353.421 5.671 40 0 FKABRN CC(C)Oc1cccc(NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000014796313 570858067 /nfs/dbraw/zinc/85/80/67/570858067.db2.gz KIFKWDBMFLZMCS-MRXNPFEDSA-N 0 0 355.478 5.177 40 0 FKABRN CC(C)Oc1cccc(NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000014796315 570858058 /nfs/dbraw/zinc/85/80/58/570858058.db2.gz KIFKWDBMFLZMCS-INIZCTEOSA-N 0 0 355.478 5.177 40 0 FKABRN CC(C)C(=O)Nc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1 ZINC000014831676 570858808 /nfs/dbraw/zinc/85/88/08/570858808.db2.gz JNPHEIFKLSHIQJ-UHFFFAOYSA-N 0 0 372.468 5.052 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000014914711 570859335 /nfs/dbraw/zinc/85/93/35/570859335.db2.gz AYNHTUZCRGMWBB-SECBINFHSA-N 0 0 360.693 5.766 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000014914712 571303592 /nfs/dbraw/zinc/30/35/92/571303592.db2.gz AYNHTUZCRGMWBB-VIFPVBQESA-N 0 0 360.693 5.766 40 0 FKABRN O=C(Nc1ccccn1)[C@H](CC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000014982606 204596292 /nfs/dbraw/zinc/59/62/92/204596292.db2.gz RFZWICAONXFLJJ-OAHLLOKOSA-N 0 0 363.288 5.691 40 0 FKABRN O=C(Nc1ccccn1)[C@@H](CC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000014982608 570827879 /nfs/dbraw/zinc/82/78/79/570827879.db2.gz RFZWICAONXFLJJ-HNNXBMFYSA-N 0 0 363.288 5.691 40 0 FKABRN CC(=C\c1ccccc1)/C=C1/SC(=O)N(Cc2ccccc2Cl)C1=O ZINC000015008845 211112674 /nfs/dbraw/zinc/11/26/74/211112674.db2.gz GGAVJWUCASHWMZ-JOEZZVDMSA-N 0 0 369.873 5.523 40 0 FKABRN O=C1S/C(=C/C=C/c2ccccc2)C(=O)N1Cc1c(F)cccc1Cl ZINC000015008908 207537564 /nfs/dbraw/zinc/53/75/64/207537564.db2.gz HUNLCIDQBKWWLN-BAGULLTOSA-N 0 0 373.836 5.272 40 0 FKABRN Cc1cc(C)n(-c2ccc(C(=O)Nc3cccc(Cl)c3Cl)cc2)n1 ZINC000015010927 220141216 /nfs/dbraw/zinc/14/12/16/220141216.db2.gz PMDQTKCBPQZMSQ-UHFFFAOYSA-N 0 0 360.244 5.048 40 0 FKABRN O=C1Nc2ccccc2/C1=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000015011353 220141768 /nfs/dbraw/zinc/14/17/68/220141768.db2.gz PQVXTSAJGXUMCR-GXDHUFHOSA-N 0 0 356.208 5.746 40 0 FKABRN Clc1ccc(Oc2ccc(I)cc2)cc1Cl ZINC000015020576 211114679 /nfs/dbraw/zinc/11/46/79/211114679.db2.gz ZOYZSKWILBNMGG-UHFFFAOYSA-N 0 0 364.997 5.390 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)Nc2c(Cl)cccc2Cl)cc1 ZINC000015028429 204599242 /nfs/dbraw/zinc/59/92/42/204599242.db2.gz HBDIEORVJGDMKJ-JTQLQIEISA-N 0 0 356.274 5.121 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)Nc2c(Cl)cccc2Cl)cc1 ZINC000015028430 211115245 /nfs/dbraw/zinc/11/52/45/211115245.db2.gz HBDIEORVJGDMKJ-SNVBAGLBSA-N 0 0 356.274 5.121 40 0 FKABRN Cc1cc(C)cc(NC(=O)c2cc(-c3ccncc3)nc3ccccc32)c1 ZINC000015076718 570831856 /nfs/dbraw/zinc/83/18/56/570831856.db2.gz KYGKLVNRLVZLCE-UHFFFAOYSA-N 0 0 353.425 5.166 40 0 FKABRN CC(C)=C=C(c1ccccc1)[P@]1(=O)O[C@@H](c2ccccc2)[C@H](C)N1C ZINC000015083164 220146698 /nfs/dbraw/zinc/14/66/98/220146698.db2.gz BPOMGMDTRYXISQ-QBFCQJJASA-N 0 0 353.402 5.878 40 0 FKABRN CC(C)=C=C(c1ccccc1)[P@@]1(=O)O[C@@H](c2ccccc2)[C@H](C)N1C ZINC000015083166 207546416 /nfs/dbraw/zinc/54/64/16/207546416.db2.gz BPOMGMDTRYXISQ-SMTRDTIPSA-N 0 0 353.402 5.878 40 0 FKABRN O=C(CSCc1ccccc1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000015186772 570861688 /nfs/dbraw/zinc/86/16/88/570861688.db2.gz GASAAZNWBUEBLZ-UHFFFAOYSA-N 0 0 359.800 5.231 40 0 FKABRN O=C(Nc1c(Cl)cccc1Cl)C1[C@H]2CC/C=C/CC/C=C\CC[C@H]12 ZINC000015188155 570835481 /nfs/dbraw/zinc/83/54/81/570835481.db2.gz IBBHEQXRACLNGJ-YZNXFKIBSA-N 0 0 364.316 6.261 40 0 FKABRN O=C(Nc1c(Cl)cccc1Cl)C1[C@@H]2CC/C=C/CC/C=C\CC[C@@H]12 ZINC000015188156 570835486 /nfs/dbraw/zinc/83/54/86/570835486.db2.gz IBBHEQXRACLNGJ-JKNWUDPLSA-N 0 0 364.316 6.261 40 0 FKABRN CC(C)=CCC/C(C)=C\CC[C@]1(C)C=Cc2c(=O)oc3ccccc3c2O1 ZINC000015215490 570835926 /nfs/dbraw/zinc/83/59/26/570835926.db2.gz JQLNFODDCYXPCO-ZBNYWDMLSA-N 0 0 364.485 6.430 40 0 FKABRN CC(C)=CCC/C(C)=C\CC[C@@]1(C)C=Cc2c(=O)oc3ccccc3c2O1 ZINC000015215492 211125479 /nfs/dbraw/zinc/12/54/79/211125479.db2.gz JQLNFODDCYXPCO-DTRCLPHYSA-N 0 0 364.485 6.430 40 0 FKABRN CSc1ccccc1NC(=O)c1cc(Br)ccc1Cl ZINC000015305994 220151283 /nfs/dbraw/zinc/15/12/83/220151283.db2.gz POAOZYRSHIGTJN-UHFFFAOYSA-N 0 0 356.672 5.077 40 0 FKABRN CCCCCC1=NO[C@@H](c2ccc([C@@H]3CC(CCCCC)=NO3)cc2)C1 ZINC000015319506 570837233 /nfs/dbraw/zinc/83/72/33/570837233.db2.gz RBNDAUCVIMURRL-SZPZYZBQSA-N 0 0 356.510 6.482 40 0 FKABRN O=C(Nc1cccc(F)c1)c1ccc(CSc2ccc(Cl)cc2)cc1 ZINC000015319750 570862466 /nfs/dbraw/zinc/86/24/66/570862466.db2.gz WTAIOBCWVKYNST-UHFFFAOYSA-N 0 0 371.864 6.024 40 0 FKABRN Cc1ccc([C@@H](NC(=O)CCSc2ccccc2)c2ccccc2)cc1 ZINC000015322053 211127301 /nfs/dbraw/zinc/12/73/01/211127301.db2.gz MXYIXGZOEAMPRB-QHCPKHFHSA-N 0 0 361.510 5.383 40 0 FKABRN Cc1ccc([C@H](NC(=O)CCSc2ccccc2)c2ccccc2)cc1 ZINC000015322055 204608386 /nfs/dbraw/zinc/60/83/86/204608386.db2.gz MXYIXGZOEAMPRB-HSZRJFAPSA-N 0 0 361.510 5.383 40 0 FKABRN Cc1ccc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000015331040 571303610 /nfs/dbraw/zinc/30/36/10/571303610.db2.gz RSHPZJYATALNJB-LLVKDONJSA-N 0 0 357.759 5.073 40 0 FKABRN Cc1ccc(O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000015331041 571303573 /nfs/dbraw/zinc/30/35/73/571303573.db2.gz RSHPZJYATALNJB-NSHDSACASA-N 0 0 357.759 5.073 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2ccccc2Cl)cc1OC ZINC000015408509 220153469 /nfs/dbraw/zinc/15/34/69/220153469.db2.gz XJWHCDDZBINKJH-UHFFFAOYSA-N 0 0 354.233 5.043 40 0 FKABRN CCOc1c(Cl)cc(C(=O)Nc2cc(Cl)ccc2Cl)cc1OC ZINC000015412175 570838580 /nfs/dbraw/zinc/83/85/80/570838580.db2.gz MSVUCSPJFIGCOS-UHFFFAOYSA-N 0 0 374.651 5.306 40 0 FKABRN Cc1ccc2nc(-c3ccc(NCc4cccc5[nH]ccc54)cc3)sc2c1 ZINC000015423624 220153318 /nfs/dbraw/zinc/15/33/18/220153318.db2.gz GORZISCSESCFOJ-UHFFFAOYSA-N 0 0 369.493 6.365 40 0 FKABRN Cc1ccc2nc(-c3ccc(NCc4ccc5[nH]ccc5c4)cc3)sc2c1 ZINC000015424279 570863405 /nfs/dbraw/zinc/86/34/05/570863405.db2.gz NVXGZEDFQFAUGK-UHFFFAOYSA-N 0 0 369.493 6.365 40 0 FKABRN CCOc1c(Cl)cc(C(=O)Nc2ccc(Cl)cc2Cl)cc1OC ZINC000015432009 570863354 /nfs/dbraw/zinc/86/33/54/570863354.db2.gz BAQKBLJSSNKOEU-UHFFFAOYSA-N 0 0 374.651 5.306 40 0 FKABRN O=C(Nc1ccc(Cl)cc1Cl)c1ccc(COc2ccccc2)o1 ZINC000015432055 570863285 /nfs/dbraw/zinc/86/32/85/570863285.db2.gz FGOZVSRMIDPOCR-UHFFFAOYSA-N 0 0 362.212 5.418 40 0 FKABRN COc1ccc(C(=O)/C=C\c2ccc(Cl)cc2)cc1Br ZINC000015440443 571067954 /nfs/dbraw/zinc/06/79/54/571067954.db2.gz DZNVIAPHQBORIN-YWEYNIOJSA-N 0 0 351.627 5.007 40 0 FKABRN CSc1sc(SC)c(-c2ccccc2)c(=O)c1-c1ccccc1 ZINC000015444004 207554885 /nfs/dbraw/zinc/55/48/85/207554885.db2.gz DAHAOYUEQTUWCG-UHFFFAOYSA-N 0 0 356.537 5.886 40 0 FKABRN S=c1sc(-c2ccccc2)ccc1-c1ccc(Br)cc1 ZINC000015444247 220154708 /nfs/dbraw/zinc/15/47/08/220154708.db2.gz TXZYFCUWWXEQPM-UHFFFAOYSA-N 0 0 359.313 6.574 40 0 FKABRN C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000015490233 571303616 /nfs/dbraw/zinc/30/36/16/571303616.db2.gz GSJZJYFFSRWGAG-LLVKDONJSA-N 0 0 373.827 5.619 40 0 FKABRN C[C@H](SCc1ccccc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000015490234 571303555 /nfs/dbraw/zinc/30/35/55/571303555.db2.gz GSJZJYFFSRWGAG-NSHDSACASA-N 0 0 373.827 5.619 40 0 FKABRN O=C(COc1ccc(Cl)cc1)Nc1ccc(C(F)(F)F)cc1Cl ZINC000015540398 571303562 /nfs/dbraw/zinc/30/35/62/571303562.db2.gz AOTRZFMENVSZQG-UHFFFAOYSA-N 0 0 364.150 5.030 40 0 FKABRN O=C(COc1ccccc1Cl)Nc1ccc(C(F)(F)F)cc1Cl ZINC000015543771 570850987 /nfs/dbraw/zinc/85/09/87/570850987.db2.gz HJKAABLWZBHXOJ-UHFFFAOYSA-N 0 0 364.150 5.030 40 0 FKABRN CC(C)c1ccc(NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)cc1 ZINC000015580430 570840543 /nfs/dbraw/zinc/84/05/43/570840543.db2.gz RCSDRCNXKKTSCT-UHFFFAOYSA-N 0 0 369.852 5.085 40 0 FKABRN O=C(/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)Nc1cccc(Cl)c1Cl ZINC000015587602 571303715 /nfs/dbraw/zinc/30/37/15/571303715.db2.gz VFQWNSHBYWTVMM-FNORWQNLSA-N 0 0 371.607 5.207 40 0 FKABRN O=C(Nc1cccc(Cl)c1Cl)c1ccc(COc2ccccc2)o1 ZINC000015587654 571303697 /nfs/dbraw/zinc/30/36/97/571303697.db2.gz QMSYQDQGPVADAS-UHFFFAOYSA-N 0 0 362.212 5.418 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2cccc(Cl)c2Cl)cc1OC ZINC000015587990 571303700 /nfs/dbraw/zinc/30/37/00/571303700.db2.gz MJSFSAZMEZFHMX-UHFFFAOYSA-N 0 0 368.260 5.433 40 0 FKABRN COc1ccc(OCCCC(=O)Nc2ccccc2-c2ccccc2)cc1 ZINC000015643702 571303716 /nfs/dbraw/zinc/30/37/16/571303716.db2.gz VYPMWBNKFCOTDE-UHFFFAOYSA-N 0 0 361.441 5.160 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccccc2-c2ccccc2)cc1OCC ZINC000015643791 207558495 /nfs/dbraw/zinc/55/84/95/207558495.db2.gz VNNOBCSVFUIUTD-UHFFFAOYSA-N 0 0 361.441 5.403 40 0 FKABRN CCc1cccc(CC)c1NC(=O)c1cccc(OCc2ccccc2)c1 ZINC000015960589 220173953 /nfs/dbraw/zinc/17/39/53/220173953.db2.gz CQZQCTNMUPCSCR-UHFFFAOYSA-N 0 0 359.469 5.643 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccccc2Oc2ccccc2)cc1OC ZINC000015963665 570864607 /nfs/dbraw/zinc/86/46/07/570864607.db2.gz ZRIBVUDRIOAXFY-UHFFFAOYSA-N 0 0 363.413 5.139 40 0 FKABRN COc1ccccc1[C@@H](C)NC(=O)CCCSc1ccc(Cl)cc1 ZINC000015966948 207576982 /nfs/dbraw/zinc/57/69/82/207576982.db2.gz SAIWPXJNNOIMNT-CQSZACIVSA-N 0 0 363.910 5.098 40 0 FKABRN COc1ccccc1[C@H](C)NC(=O)CCCSc1ccc(Cl)cc1 ZINC000015966949 220173677 /nfs/dbraw/zinc/17/36/77/220173677.db2.gz SAIWPXJNNOIMNT-AWEZNQCLSA-N 0 0 363.910 5.098 40 0 FKABRN CCc1ccc(-c2cs/c(=N\c3ccc(C)cc3)n2CC(C)C)cc1 ZINC000015980632 220174757 /nfs/dbraw/zinc/17/47/57/220174757.db2.gz VVFOALDTCQNMNM-FCQUAONHSA-N 0 0 350.531 5.976 40 0 FKABRN Cc1ccc(C23C[C@H]4C[C@H](CC(C(=O)NC5CCCCC5)(C4)C2)C3)cc1 ZINC000016134298 570851107 /nfs/dbraw/zinc/85/11/07/570851107.db2.gz VDTVOJSOMYUCQR-LHHMWQFHSA-N 0 0 351.534 5.282 40 0 FKABRN CN(C)/C=C(/C(=S)N(c1ccccc1)c1ccccc1)c1ccccc1 ZINC000016163009 571154666 /nfs/dbraw/zinc/15/46/66/571154666.db2.gz ANGSZHNSQHVGGM-RELWKKBWSA-N 0 0 358.510 5.755 40 0 FKABRN CN(C(=O)NC1CCCCC1)c1ccc(Cl)cc1C(=O)c1ccccc1 ZINC000016188742 570851926 /nfs/dbraw/zinc/85/19/26/570851926.db2.gz UXURCRYWRNAUSK-UHFFFAOYSA-N 0 0 370.880 5.050 40 0 FKABRN CN(c1ccc(C(=O)c2ccc(Br)cc2)s1)c1ccccc1 ZINC000016188816 211157191 /nfs/dbraw/zinc/15/71/91/211157191.db2.gz BYGUOLSXBOUGDM-UHFFFAOYSA-N 0 0 372.287 5.510 40 0 FKABRN COC(=O)c1ccc(N(c2ccccc2)c2ccc3ccccc3c2)s1 ZINC000016194246 220180056 /nfs/dbraw/zinc/18/00/56/220180056.db2.gz JQOBKWYCFZOYDA-UHFFFAOYSA-N 0 0 359.450 6.158 40 0 FKABRN COC(=O)c1ccc(N(c2ccccc2)c2cccc3ccccc32)s1 ZINC000016194250 220180346 /nfs/dbraw/zinc/18/03/46/220180346.db2.gz MDPGCBUVQISHKW-UHFFFAOYSA-N 0 0 359.450 6.158 40 0 FKABRN COC1C[C@H]2CC[C@@H](C1)C2C(=O)N1c2ccccc2C=Cc2ccccc21 ZINC000016194338 211157227 /nfs/dbraw/zinc/15/72/27/211157227.db2.gz KWPDRIQPPFKLTA-MAODHWIISA-N 0 0 359.469 5.286 40 0 FKABRN C[C@H]1C[C@@H]1c1ccc(/C=C/C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)o1 ZINC000016201288 206318069 /nfs/dbraw/zinc/31/80/69/206318069.db2.gz GMDCFVLYYICTLY-QWYCDTIGSA-N 0 0 363.379 5.094 40 0 FKABRN C[C@H]1C[C@H]1c1ccc(/C=C/C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)o1 ZINC000016201290 220180058 /nfs/dbraw/zinc/18/00/58/220180058.db2.gz GMDCFVLYYICTLY-RHPXVONCSA-N 0 0 363.379 5.094 40 0 FKABRN COc1cc2c(cc1NC(=O)c1cc(F)ccc1F)oc1ccccc12 ZINC000016215123 220180177 /nfs/dbraw/zinc/18/01/77/220180177.db2.gz LEPZFTYMSZBRCE-UHFFFAOYSA-N 0 0 353.324 5.125 40 0 FKABRN COC(=O)c1ccc(N(c2ccc(OC)cc2)c2ccc(OC)cc2)s1 ZINC000016216870 204632181 /nfs/dbraw/zinc/63/21/81/204632181.db2.gz OCSMJHBUYWSOBV-UHFFFAOYSA-N 0 0 369.442 5.022 40 0 FKABRN COc1ccc(Nc2ccc3ccc(Nc4ccc(OC)cc4)cc3c2)cc1 ZINC000016217185 220181559 /nfs/dbraw/zinc/18/15/59/220181559.db2.gz MIUXMEBOBUDWFB-UHFFFAOYSA-N 0 0 370.452 6.344 40 0 FKABRN Fc1ccc(NC(=S)Nc2ccc(Cl)cc2Cl)c(F)c1F ZINC000016221240 570852483 /nfs/dbraw/zinc/85/24/83/570852483.db2.gz JHJJPPAKVWYOFT-UHFFFAOYSA-N 0 0 351.180 5.220 40 0 FKABRN Fc1ccc(NC(=S)Nc2ccc(Cl)c(Cl)c2)c(F)c1F ZINC000016221244 220181274 /nfs/dbraw/zinc/18/12/74/220181274.db2.gz UNRRFJKJSKHGHE-UHFFFAOYSA-N 0 0 351.180 5.220 40 0 FKABRN Cc1ccc([C@@H](NC(=S)Nc2ccccc2Cl)c2ccccc2)cc1 ZINC000016243016 570852887 /nfs/dbraw/zinc/85/28/87/570852887.db2.gz MPOVDGUGQFBWDI-FQEVSTJZSA-N 0 0 366.917 5.724 40 0 FKABRN Cc1ccc([C@H](NC(=S)Nc2ccccc2Cl)c2ccccc2)cc1 ZINC000016243017 220180788 /nfs/dbraw/zinc/18/07/88/220180788.db2.gz MPOVDGUGQFBWDI-HXUWFJFHSA-N 0 0 366.917 5.724 40 0 FKABRN Cc1ccc([C@@H](NC(=S)Nc2ccc(F)cc2F)c2ccccc2)cc1 ZINC000016243024 211157792 /nfs/dbraw/zinc/15/77/92/211157792.db2.gz FBERIPNEWTXCDC-FQEVSTJZSA-N 0 0 368.452 5.349 40 0 FKABRN Cc1ccc([C@H](NC(=S)Nc2ccc(F)cc2F)c2ccccc2)cc1 ZINC000016243025 211156813 /nfs/dbraw/zinc/15/68/13/211156813.db2.gz FBERIPNEWTXCDC-HXUWFJFHSA-N 0 0 368.452 5.349 40 0 FKABRN COc1cccc(NC(=S)N[C@@H](c2ccccc2)c2ccc(C)cc2)c1 ZINC000016243026 204632342 /nfs/dbraw/zinc/63/23/42/204632342.db2.gz RXICCVLHRSCCFI-NRFANRHFSA-N 0 0 362.498 5.080 40 0 FKABRN COc1cccc(NC(=S)N[C@H](c2ccccc2)c2ccc(C)cc2)c1 ZINC000016243027 570852991 /nfs/dbraw/zinc/85/29/91/570852991.db2.gz RXICCVLHRSCCFI-OAQYLSRUSA-N 0 0 362.498 5.080 40 0 FKABRN Cc1ccc([C@@H](NC(=S)Nc2ccc(C)cc2C)c2ccccc2)cc1 ZINC000016243028 207580796 /nfs/dbraw/zinc/58/07/96/207580796.db2.gz QBLXYZRDVRROGD-QFIPXVFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1ccc([C@H](NC(=S)Nc2ccc(C)cc2C)c2ccccc2)cc1 ZINC000016243029 570852920 /nfs/dbraw/zinc/85/29/20/570852920.db2.gz QBLXYZRDVRROGD-JOCHJYFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1nc2ccccc2c(-c2ccccc2)c1Sc1ccc(Cl)cc1 ZINC000016249295 220181876 /nfs/dbraw/zinc/18/18/76/220181876.db2.gz QKDKUURAEIAKLF-UHFFFAOYSA-N 0 0 361.897 7.015 40 0 FKABRN Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)O[C@H](C)c1ccccc1 ZINC000016249825 220181409 /nfs/dbraw/zinc/18/14/09/220181409.db2.gz YYHRNRFWDJRYJT-GOSISDBHSA-N 0 0 367.448 6.128 40 0 FKABRN Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)O[C@@H](C)c1ccccc1 ZINC000016249827 570451026 /nfs/dbraw/zinc/45/10/26/570451026.db2.gz YYHRNRFWDJRYJT-SFHVURJKSA-N 0 0 367.448 6.128 40 0 FKABRN Cc1c(-c2ccccc2)cc(-c2ccc(F)cc2)nc1-c1ccc(F)cc1 ZINC000016249875 220181093 /nfs/dbraw/zinc/18/10/93/220181093.db2.gz WIKFPXYJDIFCQW-UHFFFAOYSA-N 0 0 357.403 6.669 40 0 FKABRN Cc1nc2ccccc2nc1CN(C(=O)Nc1ccccc1)c1ccccc1 ZINC000016265187 220181090 /nfs/dbraw/zinc/18/10/90/220181090.db2.gz ZLBOPDNVVOQUBX-UHFFFAOYSA-N 0 0 368.440 5.177 40 0 FKABRN COc1ccc2c(c1)oc(-c1nc3ccccc3nc1C)c2-c1ccccc1 ZINC000016265570 211158527 /nfs/dbraw/zinc/15/85/27/211158527.db2.gz KXTIIEQWAVXKEU-UHFFFAOYSA-N 0 0 366.420 6.027 40 0 FKABRN S=C(NCCc1cccs1)Nc1ccc(Oc2ccccc2)cc1 ZINC000016265651 570866285 /nfs/dbraw/zinc/86/62/85/570866285.db2.gz JSCOZERQRRIXTM-UHFFFAOYSA-N 0 0 354.500 5.070 40 0 FKABRN COc1ccc2nc3c(c(C)nn3-c3ccccc3)c(-c3ccccc3)c2c1 ZINC000016266089 211158443 /nfs/dbraw/zinc/15/84/43/211158443.db2.gz PSZMLPUDFWFNOI-UHFFFAOYSA-N 0 0 365.436 5.558 40 0 FKABRN Cc1nn(-c2ccccc2)c2nc3ccccc3c(-c3ccc(Cl)cc3)c12 ZINC000016266164 570853245 /nfs/dbraw/zinc/85/32/45/570853245.db2.gz PRNLUWCFDDFGIM-UHFFFAOYSA-N 0 0 369.855 6.203 40 0 FKABRN Cc1nc(C(=O)Nc2cccc3ccccc32)cc2c3ccccc3[nH]c21 ZINC000016266183 204633119 /nfs/dbraw/zinc/63/31/19/204633119.db2.gz BVGVYRJPNLSLEM-UHFFFAOYSA-N 0 0 351.409 5.430 40 0 FKABRN Cc1nn(-c2ccccc2)c2scc(-c3ccc(Br)cc3)c12 ZINC000016266200 570853405 /nfs/dbraw/zinc/85/34/05/570853405.db2.gz WJZWYCVHEIETSO-UHFFFAOYSA-N 0 0 369.287 5.825 40 0 FKABRN Cc1cc(Br)ccc1NC(=O)Nc1cccc2ccccc21 ZINC000016282581 206318692 /nfs/dbraw/zinc/31/86/92/206318692.db2.gz JKOQLONUXACDFC-UHFFFAOYSA-N 0 0 355.235 5.555 40 0 FKABRN Cc1c(Cl)cccc1NC(=S)NCc1cccc(C(F)(F)F)c1 ZINC000016283081 571303712 /nfs/dbraw/zinc/30/37/12/571303712.db2.gz XBDKGBRIRBPEOM-UHFFFAOYSA-N 0 0 358.816 5.154 40 0 FKABRN Cc1ccc(C)c(CSc2nc(-c3ccccc3)c(-c3ccccc3)o2)c1 ZINC000016285064 570853874 /nfs/dbraw/zinc/85/38/74/570853874.db2.gz KTGWKOAHHLJVNU-UHFFFAOYSA-N 0 0 371.505 6.918 40 0 FKABRN CC(=O)c1ccc2c(c1)N(C(=O)c1ccc(C)cc1)c1ccccc1S2 ZINC000016291943 570853841 /nfs/dbraw/zinc/85/38/41/570853841.db2.gz DRSVLBOUSUUMST-UHFFFAOYSA-N 0 0 359.450 5.641 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(C)cc3)c(C)c2)cc1 ZINC000016292038 211159789 /nfs/dbraw/zinc/15/97/89/211159789.db2.gz MIDGFURSOBWKCP-UHFFFAOYSA-N 0 0 358.441 5.116 40 0 FKABRN Cc1ccc(C2=NN(c3ccc(C)c(Cl)c3)[C@@H](c3ccccc3)C2)cc1 ZINC000016292169 211159468 /nfs/dbraw/zinc/15/94/68/211159468.db2.gz YZOSLKKJBHDDKE-HSZRJFAPSA-N 0 0 360.888 6.313 40 0 FKABRN Cc1ccc(C2=NN(c3ccc(C)c(Cl)c3)[C@H](c3ccccc3)C2)cc1 ZINC000016292171 211158459 /nfs/dbraw/zinc/15/84/59/211158459.db2.gz YZOSLKKJBHDDKE-QHCPKHFHSA-N 0 0 360.888 6.313 40 0 FKABRN Cc1ccc(N(Cc2nc3ccccc3nc2C)C(=O)c2ccccc2)cc1 ZINC000016292593 220182910 /nfs/dbraw/zinc/18/29/10/220182910.db2.gz KIUZPMJKGIOEIP-UHFFFAOYSA-N 0 0 367.452 5.094 40 0 FKABRN Cc1ccc(NC(=O)/C=C/c2ccc(-c3ccc(C)c(Cl)c3)o2)cc1 ZINC000016292986 570866212 /nfs/dbraw/zinc/86/62/12/570866212.db2.gz LMKWPNSNCOAIQW-ZRDIBKRKSA-N 0 0 351.833 5.869 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2Cl)cc1)c1cccnc1Cl ZINC000016303304 220182313 /nfs/dbraw/zinc/18/23/13/220182313.db2.gz PPJAPYKBVFKYIP-UHFFFAOYSA-N 0 0 359.212 5.433 40 0 FKABRN S=C(Nc1ccc2c(c1)Cc1ccccc1-2)Nc1ccccc1Cl ZINC000016306986 211158294 /nfs/dbraw/zinc/15/82/94/211158294.db2.gz OIJUMTZGVZMFIW-UHFFFAOYSA-N 0 0 350.874 5.720 40 0 FKABRN Cc1ccc(S(=O)(=O)N(c2ccccc2)c2cccc(Cl)c2)cc1 ZINC000016310026 570854292 /nfs/dbraw/zinc/85/42/92/570854292.db2.gz MWBXGCLQPROWAO-UHFFFAOYSA-N 0 0 357.862 5.175 40 0 FKABRN Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)Sc2ccccc2O3)cc1 ZINC000016310573 220182575 /nfs/dbraw/zinc/18/25/75/220182575.db2.gz JZRLNWHFRJUMEC-UHFFFAOYSA-N 0 0 369.467 5.053 40 0 FKABRN Cc1ccc(-c2ccn(-c3cccc(Br)c3)c(=S)n2)cc1 ZINC000016311145 570854133 /nfs/dbraw/zinc/85/41/33/570854133.db2.gz XWIPOTJVXJFASG-UHFFFAOYSA-N 0 0 357.276 5.340 40 0 FKABRN Cc1ccc(N2C(=N)S/C(=C/c3ccc(C(C)C)cc3)C2=O)cc1C ZINC000016312207 207584594 /nfs/dbraw/zinc/58/45/94/207584594.db2.gz BWSWOXKUONICPU-ZSNHWOOMSA-N 0 0 350.487 5.483 40 0 FKABRN COc1ccc(C(=O)C[C@@H](Nc2ccc(C)c(C)c2)c2ccccc2)cc1 ZINC000016312509 220182963 /nfs/dbraw/zinc/18/29/63/220182963.db2.gz BNNOMEAKOFKVPM-HSZRJFAPSA-N 0 0 359.469 5.738 40 0 FKABRN COc1ccc(C(=O)C[C@H](Nc2ccc(C)c(C)c2)c2ccccc2)cc1 ZINC000016312512 220182411 /nfs/dbraw/zinc/18/24/11/220182411.db2.gz BNNOMEAKOFKVPM-QHCPKHFHSA-N 0 0 359.469 5.738 40 0 FKABRN Cc1ccc(Nc2ncc(-c3nc4cc(Cl)ccc4o3)cn2)cc1C ZINC000016312561 211159017 /nfs/dbraw/zinc/15/90/17/211159017.db2.gz AGEUTFWRWGSYJI-UHFFFAOYSA-N 0 0 350.809 5.299 40 0 FKABRN Cc1ccc(N2N=C(c3ccc(F)cc3)C[C@@H]2c2ccccc2)cc1Cl ZINC000016312883 211158400 /nfs/dbraw/zinc/15/84/00/211158400.db2.gz OLXZUVIHEUBADB-JOCHJYFZSA-N 0 0 364.851 6.143 40 0 FKABRN Cc1ccc(N2N=C(c3ccc(F)cc3)C[C@H]2c2ccccc2)cc1Cl ZINC000016312886 570854693 /nfs/dbraw/zinc/85/46/93/570854693.db2.gz OLXZUVIHEUBADB-QFIPXVFZSA-N 0 0 364.851 6.143 40 0 FKABRN Cc1ccc(-c2ccc(/C=C/C(=O)NCc3ccccc3)o2)cc1Cl ZINC000016313033 570866151 /nfs/dbraw/zinc/86/61/51/570866151.db2.gz QQHDSQLFXBAZDO-ZRDIBKRKSA-N 0 0 351.833 5.238 40 0 FKABRN Cc1ccc(-c2ccc(/C=C/C(=O)Nc3ccc(Cl)cc3)o2)cc1Cl ZINC000016313097 570866331 /nfs/dbraw/zinc/86/63/31/570866331.db2.gz JCVYWGQZDSUSIB-PKNBQFBNSA-N 0 0 372.251 6.214 40 0 FKABRN Cc1ccc(-c2ccc(/C=C/C(=O)Nc3ccc(F)cc3)o2)cc1Cl ZINC000016313100 570866232 /nfs/dbraw/zinc/86/62/32/570866232.db2.gz IFOMTLRVIHCQEU-PKNBQFBNSA-N 0 0 355.796 5.699 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=S)Nc2ccc(C)c(C)c2)cc1OCC ZINC000016317287 211158683 /nfs/dbraw/zinc/15/86/83/211158683.db2.gz VVFOHHYFRUZZRQ-MRXNPFEDSA-N 0 0 372.534 5.148 40 0 FKABRN CCOc1ccc([C@H](C)NC(=S)Nc2ccc(C)c(C)c2)cc1OCC ZINC000016317288 211159184 /nfs/dbraw/zinc/15/91/84/211159184.db2.gz VVFOHHYFRUZZRQ-INIZCTEOSA-N 0 0 372.534 5.148 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=S)Nc2ccc(C)cc2C)cc1OCC ZINC000016317301 220182814 /nfs/dbraw/zinc/18/28/14/220182814.db2.gz ZHNXMMHWOZPDJA-MRXNPFEDSA-N 0 0 372.534 5.148 40 0 FKABRN CCOc1ccc([C@H](C)NC(=S)Nc2ccc(C)cc2C)cc1OCC ZINC000016317302 570854723 /nfs/dbraw/zinc/85/47/23/570854723.db2.gz ZHNXMMHWOZPDJA-INIZCTEOSA-N 0 0 372.534 5.148 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=S)Nc2cc(C)cc(C)c2)cc1OCC ZINC000016317309 211159245 /nfs/dbraw/zinc/15/92/45/211159245.db2.gz WUQBVTSXERUZQM-MRXNPFEDSA-N 0 0 372.534 5.148 40 0 FKABRN CCOc1ccc([C@H](C)NC(=S)Nc2cc(C)cc(C)c2)cc1OCC ZINC000016317310 570854715 /nfs/dbraw/zinc/85/47/15/570854715.db2.gz WUQBVTSXERUZQM-INIZCTEOSA-N 0 0 372.534 5.148 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=S)Nc2ccc(CC)cc2)cc1OCC ZINC000016317323 220182573 /nfs/dbraw/zinc/18/25/73/220182573.db2.gz UKMIRQUYUDFXEQ-OAHLLOKOSA-N 0 0 372.534 5.094 40 0 FKABRN CCOc1ccc([C@H](C)NC(=S)Nc2ccc(CC)cc2)cc1OCC ZINC000016317324 220182538 /nfs/dbraw/zinc/18/25/38/220182538.db2.gz UKMIRQUYUDFXEQ-HNNXBMFYSA-N 0 0 372.534 5.094 40 0 FKABRN CC(=O)c1cc(-c2ccccc2)c(N(c2ccccc2)c2ccccc2)s1 ZINC000016321889 570854756 /nfs/dbraw/zinc/85/47/56/570854756.db2.gz KSONDPWQLAMOBB-UHFFFAOYSA-N 0 0 369.489 7.088 40 0 FKABRN COc1ccc(NC(=O)/C=C/c2ccc(-c3ccc(C)c(Cl)c3)o2)cc1 ZINC000016346644 570866367 /nfs/dbraw/zinc/86/63/67/570866367.db2.gz LBVMLIIAJBIKLD-ZRDIBKRKSA-N 0 0 367.832 5.569 40 0 FKABRN Cc1ccc(-c2ccc(/C=C/C(=O)Nc3cccc(Cl)c3)o2)cc1Cl ZINC000016346756 570866198 /nfs/dbraw/zinc/86/61/98/570866198.db2.gz UPFKGNUOIWOQSU-CSKARUKUSA-N 0 0 372.251 6.214 40 0 FKABRN COc1cccc(NC(=O)/C=C/c2ccc(-c3ccc(C)c(Cl)c3)o2)c1 ZINC000016346769 570866341 /nfs/dbraw/zinc/86/63/41/570866341.db2.gz FPMDZMNCHQMMSX-PKNBQFBNSA-N 0 0 367.832 5.569 40 0 FKABRN Cc1ccc(-c2ccc(/C=C/C(=O)Nc3ccccc3Cl)o2)cc1Cl ZINC000016346824 570866364 /nfs/dbraw/zinc/86/63/64/570866364.db2.gz CHKPZUHOBQHANW-PKNBQFBNSA-N 0 0 372.251 6.214 40 0 FKABRN COc1ccccc1NC(=O)/C=C/c1ccc(-c2ccc(C)c(Cl)c2)o1 ZINC000016346826 570866362 /nfs/dbraw/zinc/86/63/62/570866362.db2.gz NQKFPSSWHCEEPS-ZRDIBKRKSA-N 0 0 367.832 5.569 40 0 FKABRN Cc1ccc2oc(-c3nc4ccccc4nc3C)c(-c3ccccc3)c2c1 ZINC000016348242 211158941 /nfs/dbraw/zinc/15/89/41/211158941.db2.gz JIUYHZKLHMTUOG-UHFFFAOYSA-N 0 0 350.421 6.327 40 0 FKABRN Cc1ccc2nc(-c3ccc(C)c(NC(=O)c4ccccc4F)c3)oc2c1 ZINC000016348557 220184059 /nfs/dbraw/zinc/18/40/59/220184059.db2.gz WRMOOTOIRHMGFM-UHFFFAOYSA-N 0 0 360.388 5.503 40 0 FKABRN Cc1ccc2nc(-c3ccc(CNC(=O)/C=C/c4ccccc4)cc3)oc2c1 ZINC000016348576 570866357 /nfs/dbraw/zinc/86/63/57/570866357.db2.gz ZSGQXURWMUSKSM-GXDHUFHOSA-N 0 0 368.436 5.133 40 0 FKABRN Cc1ccc2nc(NC(=S)Nc3cccc(C(F)(F)F)c3)sc2c1 ZINC000016348726 220184148 /nfs/dbraw/zinc/18/41/48/220184148.db2.gz LKMZMVSJPLNKGP-UHFFFAOYSA-N 0 0 367.421 5.432 40 0 FKABRN Cc1cccc(NC(=O)/C=C/c2ccc(-c3ccc(C)c(Cl)c3)o2)c1 ZINC000016349571 570866322 /nfs/dbraw/zinc/86/63/22/570866322.db2.gz MVRJSIDSVRBZCJ-PKNBQFBNSA-N 0 0 351.833 5.869 40 0 FKABRN Cc1ccc(-c2ccc(/C=C/C(=O)Nc3c(C)cccc3C)o2)cc1Cl ZINC000016362208 570866726 /nfs/dbraw/zinc/86/67/26/570866726.db2.gz XXLQCLLJWZPTPV-ZRDIBKRKSA-N 0 0 365.860 6.177 40 0 FKABRN Cc1cccc2nc(CSc3nc(-c4ccc(Cl)cc4)cs3)cn21 ZINC000016362510 570855126 /nfs/dbraw/zinc/85/51/26/570855126.db2.gz MMVYSIOACHJKDZ-UHFFFAOYSA-N 0 0 371.918 5.712 40 0 FKABRN S=C(Nc1ccc(Cl)cc1Cl)Nc1ncc(Cl)cc1Cl ZINC000016385100 570855228 /nfs/dbraw/zinc/85/52/28/570855228.db2.gz UFOLMVOCFQDGTQ-UHFFFAOYSA-N 0 0 367.088 5.504 40 0 FKABRN Oc1ccc(Cl)cc1Nc1ncc(-c2nc3cc(Cl)ccc3o2)cn1 ZINC000016385210 207587267 /nfs/dbraw/zinc/58/72/67/207587267.db2.gz PINFGWPDXCOTGL-UHFFFAOYSA-N 0 0 373.199 5.041 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)Nc1ncc(Cl)cc1Cl ZINC000016385463 570855260 /nfs/dbraw/zinc/85/52/60/570855260.db2.gz QWXHLTGAFFZJBA-UHFFFAOYSA-N 0 0 351.020 5.339 40 0 FKABRN O=C(Nc1nc2ccc(Cl)cc2s1)Nc1cccc(C(F)(F)F)c1 ZINC000016399370 220183944 /nfs/dbraw/zinc/18/39/44/220183944.db2.gz XFPLDTIHZPWWTA-UHFFFAOYSA-N 0 0 371.771 5.613 40 0 FKABRN O=C(COc1ccc(C2CCCCC2)cc1)NC1C2CC3CC(C2)CC1C3 ZINC000016401274 220184536 /nfs/dbraw/zinc/18/45/36/220184536.db2.gz IBRLKXYVFWNTFF-UHFFFAOYSA-N 0 0 367.533 5.054 40 0 FKABRN S=C(Nc1ccc(Cl)cc1)N(C1CCCCC1)C1CCCCC1 ZINC000016428533 570855889 /nfs/dbraw/zinc/85/58/89/570855889.db2.gz CSTJXRDQZKRGCR-UHFFFAOYSA-N 0 0 350.959 6.004 40 0 FKABRN O=C(Nc1nc2ccc(Cl)cc2s1)Nc1ccc(Cl)cc1Cl ZINC000016431200 211160805 /nfs/dbraw/zinc/16/08/05/211160805.db2.gz JMHSEWFKPXWPKD-UHFFFAOYSA-N 0 0 372.664 5.901 40 0 FKABRN O=Cc1ccccc1OCc1nc2ccccc2nc1-c1ccc(Cl)cc1 ZINC000016449505 220185434 /nfs/dbraw/zinc/18/54/34/220185434.db2.gz LVWXJOPMXGRMIB-UHFFFAOYSA-N 0 0 374.827 5.342 40 0 FKABRN O=C(OCc1ccccc1Cl)C1c2ccccc2Oc2ccccc21 ZINC000016449809 220185833 /nfs/dbraw/zinc/18/58/33/220185833.db2.gz IPAMQEJFKWVJSN-UHFFFAOYSA-N 0 0 350.801 5.321 40 0 FKABRN O=C(CSc1nc2c(c(-c3cccs3)n1)CCCC2)c1ccccc1 ZINC000016476594 570856707 /nfs/dbraw/zinc/85/67/07/570856707.db2.gz FOFPAQNSHKXRCY-UHFFFAOYSA-N 0 0 366.511 5.059 40 0 FKABRN O=C(c1ccc(N(c2ccccc2)c2ccccc2)s1)c1ccccc1 ZINC000016477022 211161193 /nfs/dbraw/zinc/16/11/93/211161193.db2.gz YMCJHSFDGPMWBH-UHFFFAOYSA-N 0 0 355.462 6.449 40 0 FKABRN O=C(Nc1ccccc1C(=O)c1ccccc1)Nc1cccc2ccccc21 ZINC000016477055 207584828 /nfs/dbraw/zinc/58/48/28/207584828.db2.gz CVKACSOKYLWUIN-UHFFFAOYSA-N 0 0 366.420 5.715 40 0 FKABRN O=C(Nc1ccccc1C(=O)c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000016477061 570856675 /nfs/dbraw/zinc/85/66/75/570856675.db2.gz ZEFJKENQLIBXKK-UHFFFAOYSA-N 0 0 370.235 5.477 40 0 FKABRN O=C(c1cnc(N(c2ccccc2)c2ccccc2)s1)c1ccccc1 ZINC000016477066 570856730 /nfs/dbraw/zinc/85/67/30/570856730.db2.gz JPYXQHPWRVQZPJ-UHFFFAOYSA-N 0 0 356.450 5.844 40 0 FKABRN c1ccc(C(SC2=NCCS2)(c2ccccc2)c2ccccc2)cc1 ZINC000016477633 211161619 /nfs/dbraw/zinc/16/16/19/211161619.db2.gz JKNGMQKMUJYFFK-UHFFFAOYSA-N 0 0 361.535 5.815 40 0 FKABRN c1ccc(C(SC2CCCCC2)(c2ccccc2)c2ccccc2)cc1 ZINC000016477636 570857206 /nfs/dbraw/zinc/85/72/06/570857206.db2.gz PCUCCCWMKZBAOR-UHFFFAOYSA-N 0 0 358.550 7.044 40 0 FKABRN O=C(Nc1cccc2ccccc21)N(Cc1ccccc1)c1ccccc1 ZINC000016479670 570857229 /nfs/dbraw/zinc/85/72/29/570857229.db2.gz YUAYJQDVYNGRIF-UHFFFAOYSA-N 0 0 352.437 6.079 40 0 FKABRN O=C(Nc1cccc(Cl)c1)N(c1ccccc1)c1cccc(Cl)c1 ZINC000016487916 220184831 /nfs/dbraw/zinc/18/48/31/220184831.db2.gz VMVBJGPNGXQQGW-UHFFFAOYSA-N 0 0 357.240 6.364 40 0 FKABRN O=C(Nc1cccc2ccccc21)N(c1ccccc1)c1cccc(Cl)c1 ZINC000016487922 570857036 /nfs/dbraw/zinc/85/70/36/570857036.db2.gz SGHSASVQMXWIQV-UHFFFAOYSA-N 0 0 372.855 6.863 40 0 FKABRN c1c(-c2nc3ccccc3nc2-c2ccccc2)oc2ccc3ccccc3c12 ZINC000016492098 220185711 /nfs/dbraw/zinc/18/57/11/220185711.db2.gz DCCKHEBKQFNGFE-UHFFFAOYSA-N 0 0 372.427 6.863 40 0 FKABRN c1ccc(-c2nnc(-c3nc4ccccc4nc3-c3ccccc3)s2)cc1 ZINC000016492109 570857138 /nfs/dbraw/zinc/85/71/38/570857138.db2.gz BSJWLHPNEXELJT-UHFFFAOYSA-N 0 0 366.449 5.482 40 0 FKABRN c1ccc(-c2nnc(-c3ccccc3-c3nnc(-c4ccccc4)o3)o2)cc1 ZINC000016493662 211163274 /nfs/dbraw/zinc/16/32/74/211163274.db2.gz PYRXTHWDCLZQFO-UHFFFAOYSA-N 0 0 366.380 5.121 40 0 FKABRN Nc1c2ccccc2oc1-c1nc2ccccc2nc1-c1ccc(Cl)cc1 ZINC000016525283 204636929 /nfs/dbraw/zinc/63/69/29/204636929.db2.gz HQMUIGQLZZSHTR-UHFFFAOYSA-N 0 0 371.827 5.946 40 0 FKABRN c1c2ccccc2oc1-c1nc2ccccc2nc1-c1cc2ccccc2o1 ZINC000016525741 211163476 /nfs/dbraw/zinc/16/34/76/211163476.db2.gz YSPIRIHOCVEHNW-UHFFFAOYSA-N 0 0 362.388 6.456 40 0 FKABRN Clc1ccc(-c2nc3ccccc3nc2-c2cc3ccccc3o2)cc1 ZINC000016525743 204636565 /nfs/dbraw/zinc/63/65/65/204636565.db2.gz CRXXFNYUWNXBLF-UHFFFAOYSA-N 0 0 356.812 6.363 40 0 FKABRN Brc1cccc2c(-c3nc4c(ccc5ccccc45)o3)cccc12 ZINC000016526140 211163431 /nfs/dbraw/zinc/16/34/31/211163431.db2.gz JCUDAYBMTXTCPC-UHFFFAOYSA-N 0 0 374.237 6.564 40 0 FKABRN O=C(Nc1nc2c(ccc3ccccc23)s1)Nc1ccc(F)cc1F ZINC000016526148 211162668 /nfs/dbraw/zinc/16/26/68/211162668.db2.gz BWGCUVLJVKVACX-UHFFFAOYSA-N 0 0 355.369 5.372 40 0 FKABRN O=C(Nc1ccc(C(F)(F)F)cc1Cl)Nc1cccc2ccccc21 ZINC000016544987 570858163 /nfs/dbraw/zinc/85/81/63/570858163.db2.gz YLJXXPLPKHTIHM-UHFFFAOYSA-N 0 0 364.754 6.156 40 0 FKABRN O=C(Nc1nc2ccc(Cl)cc2s1)Nc1cccc2ccccc21 ZINC000016545001 211162342 /nfs/dbraw/zinc/16/23/42/211162342.db2.gz YWCMIJUZENQOIR-UHFFFAOYSA-N 0 0 353.834 5.747 40 0 FKABRN Clc1cc(Cl)cc(-c2nccc(-c3ccc4ccccc4c3)n2)c1 ZINC000016545883 220186986 /nfs/dbraw/zinc/18/69/86/220186986.db2.gz AKMNUODRUABTKR-UHFFFAOYSA-N 0 0 351.236 6.271 40 0 FKABRN Clc1ccc(-c2csc(SCc3cn4ccccc4n3)n2)cc1 ZINC000016545916 570858167 /nfs/dbraw/zinc/85/81/67/570858167.db2.gz RFIMVZWQPCYEPL-UHFFFAOYSA-N 0 0 357.891 5.404 40 0 FKABRN CC(C)NC(=S)N1c2ccccc2Sc2ccc(C(F)(F)F)cc21 ZINC000016575456 570858091 /nfs/dbraw/zinc/85/80/91/570858091.db2.gz ISTNCFOWMUNVEV-UHFFFAOYSA-N 0 0 368.449 5.591 40 0 FKABRN CC(C)c1ccc2oc(-c3cc(Br)ccc3Cl)nc2c1 ZINC000016575965 571153318 /nfs/dbraw/zinc/15/33/18/571153318.db2.gz VNUAZYDJDPZKCS-UHFFFAOYSA-N 0 0 350.643 6.034 40 0 FKABRN C[C@@H](OC(=O)c1cccc(-c2nnc(-c3ccccc3)o2)c1)c1ccccc1 ZINC000016576989 220187241 /nfs/dbraw/zinc/18/72/41/220187241.db2.gz SMBOJCBQZICUNY-MRXNPFEDSA-N 0 0 370.408 5.322 40 0 FKABRN C[C@H](OC(=O)c1cccc(-c2nnc(-c3ccccc3)o2)c1)c1ccccc1 ZINC000016576992 220187433 /nfs/dbraw/zinc/18/74/33/220187433.db2.gz SMBOJCBQZICUNY-INIZCTEOSA-N 0 0 370.408 5.322 40 0 FKABRN C[C@]12CC3CC(NC(=O)Nc4ccc(Cl)c(Cl)c4)(C1)C[C@@](C)(C3)C2 ZINC000016605653 570858536 /nfs/dbraw/zinc/85/85/36/570858536.db2.gz IGSATVROEVOBFD-CMXJYWLISA-N 0 0 367.320 5.864 40 0 FKABRN C[C@@H]1CC(C)(C)N(C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc21 ZINC000016608510 570859035 /nfs/dbraw/zinc/85/90/35/570859035.db2.gz BPKUBHAACZQSOA-CYBMUJFWSA-N 0 0 362.395 6.030 40 0 FKABRN C[C@H]1CC(C)(C)N(C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc21 ZINC000016608512 570859188 /nfs/dbraw/zinc/85/91/88/570859188.db2.gz BPKUBHAACZQSOA-ZDUSSCGKSA-N 0 0 362.395 6.030 40 0 FKABRN CC1CCN(c2ccccc2NC(=O)COc2cccc3ccccc32)CC1 ZINC000016609343 570859071 /nfs/dbraw/zinc/85/90/71/570859071.db2.gz FAXUZDNMFTVJIR-UHFFFAOYSA-N 0 0 374.484 5.094 40 0 FKABRN CC[C@@]12CCC3=C(C1=CC[C@@H]2OC(C)=O)[C@@H](C)Cc1cc(OC)ccc13 ZINC000016611496 207590390 /nfs/dbraw/zinc/59/03/90/207590390.db2.gz GIYSITPKERYJBK-OAJKGFPOSA-N 0 0 352.474 5.093 40 0 FKABRN CC[C@]12CCC3=C(C1=CC[C@@H]2OC(C)=O)[C@@H](C)Cc1cc(OC)ccc13 ZINC000016611498 570859224 /nfs/dbraw/zinc/85/92/24/570859224.db2.gz GIYSITPKERYJBK-BKAZIGDYSA-N 0 0 352.474 5.093 40 0 FKABRN CCCC(=O)Nc1ccc(Sc2ccc(NC(=O)CCC)cc2)cc1 ZINC000016637204 570859105 /nfs/dbraw/zinc/85/91/05/570859105.db2.gz WLRBHFTXZPIXMU-UHFFFAOYSA-N 0 0 356.491 5.315 40 0 FKABRN CCCCCCc1ccc(NC(=O)Nc2cccc(C(F)(F)F)c2)cc1 ZINC000016638426 570859123 /nfs/dbraw/zinc/85/91/23/570859123.db2.gz HBYSDKIAZRGOHY-UHFFFAOYSA-N 0 0 364.411 6.472 40 0 FKABRN CCCCCCc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000016638449 570859215 /nfs/dbraw/zinc/85/92/15/570859215.db2.gz NAMSOJZIOYNNCB-UHFFFAOYSA-N 0 0 351.899 5.264 40 0 FKABRN CCOc1ccc(C(=O)c2cnc3ccccc3c2-c2ccccc2)cc1 ZINC000016691535 570860634 /nfs/dbraw/zinc/86/06/34/570860634.db2.gz LUGISAXLTLLWBV-UHFFFAOYSA-N 0 0 353.421 5.532 40 0 FKABRN Cc1c(Cl)cccc1NC(=S)NCc1ccc(C(F)(F)F)cc1 ZINC000016704789 570852873 /nfs/dbraw/zinc/85/28/73/570852873.db2.gz AQTWMTWCEXETKV-UHFFFAOYSA-N 0 0 358.816 5.154 40 0 FKABRN CCn1c(-c2ccc(C)cc2)cs/c1=N\c1cccc(C(F)(F)F)c1 ZINC000016711506 570861016 /nfs/dbraw/zinc/86/10/16/570861016.db2.gz VPWJWCCRKORTCG-NKFKGCMQSA-N 0 0 362.420 5.796 40 0 FKABRN CCn1c(-c2ccccc2)c(C)s/c1=N\c1cccc(C(F)(F)F)c1 ZINC000016711508 211168036 /nfs/dbraw/zinc/16/80/36/211168036.db2.gz YQSRSVBDZYZHNO-NKFKGCMQSA-N 0 0 362.420 5.796 40 0 FKABRN O=C(/N=c1\scc(-c2ccc(F)cc2)n1-c1ccccc1)c1ccccc1 ZINC000016740111 207596575 /nfs/dbraw/zinc/59/65/75/207596575.db2.gz LFAZCSDUYJKTJU-GYHWCHFESA-N 0 0 374.440 5.086 40 0 FKABRN CC(C)c1ccc(-c2cn3cc(-c4ccccc4)n4c3c2CCCC4)cc1 ZINC000016740132 220191914 /nfs/dbraw/zinc/19/19/14/220191914.db2.gz OZNIVNLVTZICDW-UHFFFAOYSA-N 0 0 354.497 6.535 40 0 FKABRN Cc1c(C(=O)Sc2nc3ccccc3s2)oc2c1C(=O)CC(C)(C)C2 ZINC000016740177 220192115 /nfs/dbraw/zinc/19/21/15/220192115.db2.gz NEWSKKSDAWCZKW-UHFFFAOYSA-N 0 0 371.483 5.285 40 0 FKABRN Cc1c(C(=O)Nc2c(Cl)cccc2Cl)oc2c1C(=O)CC(C)(C)C2 ZINC000016740204 220192508 /nfs/dbraw/zinc/19/25/08/220192508.db2.gz JRZYLSIHKWNZJR-UHFFFAOYSA-N 0 0 366.244 5.302 40 0 FKABRN Cc1c(C(=O)Oc2ccc(Cl)cc2Cl)oc2c1C(=O)CC(C)(C)C2 ZINC000016740206 570861407 /nfs/dbraw/zinc/86/14/07/570861407.db2.gz MZBCWKAGSNNQKT-UHFFFAOYSA-N 0 0 367.228 5.269 40 0 FKABRN Cc1c(C(=O)Nc2c(Cl)cccc2Cl)oc2c1[C@H](O)CC(C)(C)C2 ZINC000016740265 211168816 /nfs/dbraw/zinc/16/88/16/211168816.db2.gz SDPQNVZXKROATD-GFCCVEGCSA-N 0 0 368.260 5.153 40 0 FKABRN Cc1c(C(=O)Nc2c(Cl)cccc2Cl)oc2c1[C@@H](O)CC(C)(C)C2 ZINC000016740266 211168631 /nfs/dbraw/zinc/16/86/31/211168631.db2.gz SDPQNVZXKROATD-LBPRGKRZSA-N 0 0 368.260 5.153 40 0 FKABRN Cc1c(C(=O)Sc2nc3ccccc3s2)oc2c1[C@H](O)CC(C)(C)C2 ZINC000016740267 220192171 /nfs/dbraw/zinc/19/21/71/220192171.db2.gz SAVZTUWUBWEQFI-GFCCVEGCSA-N 0 0 373.499 5.136 40 0 FKABRN Cc1c(C(=O)Sc2nc3ccccc3s2)oc2c1[C@@H](O)CC(C)(C)C2 ZINC000016740268 220191771 /nfs/dbraw/zinc/19/17/71/220191771.db2.gz SAVZTUWUBWEQFI-LBPRGKRZSA-N 0 0 373.499 5.136 40 0 FKABRN Cc1c(C(=O)Nc2cccc(C(F)(F)F)c2)oc2c1C(=O)CC(C)(C)C2 ZINC000016740289 220192602 /nfs/dbraw/zinc/19/26/02/220192602.db2.gz YRQVVSDWCRZKOF-UHFFFAOYSA-N 0 0 365.351 5.014 40 0 FKABRN Cc1c(C(=O)Nc2cc(Cl)cc(Cl)c2)oc2c1C(=O)CC(C)(C)C2 ZINC000016740290 570861319 /nfs/dbraw/zinc/86/13/19/570861319.db2.gz BZCSNESPGXXCPV-UHFFFAOYSA-N 0 0 366.244 5.302 40 0 FKABRN Cc1c(C(=O)N(CC(C)C)CC(C)C)sc2nc(-c3ccccc3)cn12 ZINC000016740396 570861541 /nfs/dbraw/zinc/86/15/41/570861541.db2.gz CRWDECLECLGHKU-UHFFFAOYSA-N 0 0 369.534 5.125 40 0 FKABRN CCCCN(CCCC)C(=O)c1sc2nc(-c3ccccc3)cn2c1C ZINC000016740398 211168889 /nfs/dbraw/zinc/16/88/89/211168889.db2.gz RVTVXQQGGBXJCF-UHFFFAOYSA-N 0 0 369.534 5.414 40 0 FKABRN Cc1c(C(=O)Nc2ccc(Cl)cc2)sc2nc(-c3ccccc3)cn12 ZINC000016740405 204641356 /nfs/dbraw/zinc/64/13/56/204641356.db2.gz YGQNKTKQFYUQTR-UHFFFAOYSA-N 0 0 367.861 5.277 40 0 FKABRN CCCCN(CCCC)C(=O)c1cc(-c2ccccn2)nc2ccccc21 ZINC000016740428 211167719 /nfs/dbraw/zinc/16/77/19/211167719.db2.gz YJNICGSQSOBTFE-UHFFFAOYSA-N 0 0 361.489 5.339 40 0 FKABRN CCN(C(=O)c1cc(-c2ccccn2)nc2ccccc21)c1cccc(C)c1 ZINC000016740441 570861433 /nfs/dbraw/zinc/86/14/33/570861433.db2.gz ZCAUWAFKKKQNGN-UHFFFAOYSA-N 0 0 367.452 5.272 40 0 FKABRN CCN(C(=O)c1cc(-c2ccncc2)nc2ccccc21)c1cccc(C)c1 ZINC000016740468 220192340 /nfs/dbraw/zinc/19/23/40/220192340.db2.gz IKBNGRGMYQRVNJ-UHFFFAOYSA-N 0 0 367.452 5.272 40 0 FKABRN CCc1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc32)cc1 ZINC000016740472 570861485 /nfs/dbraw/zinc/86/14/85/570861485.db2.gz NBCQTCJSJDQDHY-UHFFFAOYSA-N 0 0 353.425 5.112 40 0 FKABRN CC[C@@H](C)c1ccc(Cn2c3ccccc3nc2Cc2ccccc2)cc1 ZINC000016740582 570861492 /nfs/dbraw/zinc/86/14/92/570861492.db2.gz NSVWLRIIRZJVKT-LJQANCHMSA-N 0 0 354.497 6.189 40 0 FKABRN CC[C@H](C)c1ccc(Cn2c3ccccc3nc2Cc2ccccc2)cc1 ZINC000016740583 211168742 /nfs/dbraw/zinc/16/87/42/211168742.db2.gz NSVWLRIIRZJVKT-IBGZPJMESA-N 0 0 354.497 6.189 40 0 FKABRN COc1ccc(Cc2nc3ccccc3n2Cc2cccc(Cl)c2)cc1 ZINC000016740586 570861296 /nfs/dbraw/zinc/86/12/96/570861296.db2.gz WXJKVUAIMAHVQF-UHFFFAOYSA-N 0 0 362.860 5.337 40 0 FKABRN Cc1ccccc1OCc1nc2ccccc2n1C/C=C/c1ccccc1 ZINC000016740591 211168652 /nfs/dbraw/zinc/16/86/52/211168652.db2.gz CAKJZFMTSBIUGH-UKTHLTGXSA-N 0 0 354.453 5.637 40 0 FKABRN CC[C@@H](C)c1ccc(Cn2c(COc3ccccc3)nc3ccccc32)cc1 ZINC000016740592 204641621 /nfs/dbraw/zinc/64/16/21/204641621.db2.gz GUHFKCWHKXREKT-LJQANCHMSA-N 0 0 370.496 6.177 40 0 FKABRN CC[C@H](C)c1ccc(Cn2c(COc3ccccc3)nc3ccccc32)cc1 ZINC000016740593 211167606 /nfs/dbraw/zinc/16/76/06/211167606.db2.gz GUHFKCWHKXREKT-IBGZPJMESA-N 0 0 370.496 6.177 40 0 FKABRN CCc1cc(-c2snc(C)c2-c2ccc(OC)cc2)c(O)cc1OC ZINC000016756725 220193600 /nfs/dbraw/zinc/19/36/00/220193600.db2.gz IKONQGGVOXGNSB-UHFFFAOYSA-N 0 0 355.459 5.071 40 0 FKABRN O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1ccoc1C(F)(F)F ZINC000016756803 571183416 /nfs/dbraw/zinc/18/34/16/571183416.db2.gz CWLLTWYAOOWGOI-UHFFFAOYSA-N 0 0 357.637 5.223 40 0 FKABRN CC[C@@H](C)Sc1ncnc2c1c(-c1ccccc1)cn2-c1ccccc1 ZINC000016757579 570862036 /nfs/dbraw/zinc/86/20/36/570862036.db2.gz OOWVXDUPSFFWBP-MRXNPFEDSA-N 0 0 359.498 5.978 40 0 FKABRN CC[C@H](C)Sc1ncnc2c1c(-c1ccccc1)cn2-c1ccccc1 ZINC000016757582 570861968 /nfs/dbraw/zinc/86/19/68/570861968.db2.gz OOWVXDUPSFFWBP-INIZCTEOSA-N 0 0 359.498 5.978 40 0 FKABRN CC(C)CSc1ncnc2c1c(-c1ccccc1)cn2-c1ccccc1 ZINC000016757585 207597065 /nfs/dbraw/zinc/59/70/65/207597065.db2.gz 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AKMAQZLYBFHOIO-BENRWUELSA-N 0 0 371.348 6.746 40 0 FKABRN Cc1ccc(/N=c2/sc3ccccc3nc2Nc2ccc(C)cc2)cc1 ZINC000017111369 211178938 /nfs/dbraw/zinc/17/89/38/211178938.db2.gz LQBBHNGDCLWFLL-ZNTNEXAZSA-N 0 0 357.482 5.889 40 0 FKABRN S=c1nc(-c2ccccc2)o/c(=N/C2CCCCC2)n1C1CCCCC1 ZINC000017126591 211181833 /nfs/dbraw/zinc/18/18/33/211181833.db2.gz QRHQIOYWEQJXOH-LSDHQDQOSA-N 0 0 369.534 5.611 40 0 FKABRN CCOP(=O)(OCC)O/C(=C\Cl)c1cc(Cl)ccc1Cl ZINC000017146774 570869818 /nfs/dbraw/zinc/86/98/18/570869818.db2.gz SRZOWOUWGAIUTI-WQLSENKSSA-N 0 0 359.573 5.728 40 0 FKABRN CCCCC/C=C\C/C=C\CCCCCCCC1=N[C@@](CC)(CO)CO1 ZINC000017148020 220207910 /nfs/dbraw/zinc/20/79/10/220207910.db2.gz XAJXPLMBNBLPIW-VGKWPVBQSA-N 0 0 363.586 6.370 40 0 FKABRN CCCCC/C=C/C/C=C\CCCCCCCC1=N[C@@](CC)(CO)CO1 ZINC000017148022 207614007 /nfs/dbraw/zinc/61/40/07/207614007.db2.gz XAJXPLMBNBLPIW-PUXKVJHDSA-N 0 0 363.586 6.370 40 0 FKABRN CC[C@@H](c1ccc(C(C)=O)c(O)c1)[C@H](CC)c1ccc(C(C)=O)c(O)c1 ZINC000017174588 570869844 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C[C@@H](OC(=O)c1ccccc1C(=O)O[C@@H](C)c1ccccc1)c1ccccc1 ZINC000017286857 571275670 /nfs/dbraw/zinc/27/56/70/571275670.db2.gz RZHCBUNQWKVGAW-HDICACEKSA-N 0 0 374.436 5.523 40 0 FKABRN C[C@@H]1O[P@](=O)(Nc2cc(Cl)ccc2Cl)O[C@@H]2CCCC[C@H]21 ZINC000017289448 570871694 /nfs/dbraw/zinc/87/16/94/570871694.db2.gz UARSWUVSJHAZAE-IOWMXKFDSA-N 0 0 350.182 5.508 40 0 FKABRN CCCOC(=O)C[C@@H](C(=O)OCCC)C(C)(C)/C=C(/C)C[C@@H](C)CCC ZINC000017300688 204654198 /nfs/dbraw/zinc/65/41/98/204654198.db2.gz AGNQUSDMKNHBPT-MTBGOMMXSA-N 0 0 368.558 5.698 40 0 FKABRN CC(C)CCC[C@@H](C)CC[N@@H+](CC[C@@H](C)CCCC(C)C)CC(=O)[O-] ZINC000017303032 570871622 /nfs/dbraw/zinc/87/16/22/570871622.db2.gz GDMLLXZOASVDBX-OYRHEFFESA-N 0 0 355.607 6.078 40 0 FKABRN CCCc1cc([C@H](CC)[C@H](CC)c2ccc(O)c(CCC)c2)ccc1O ZINC000017303447 204653921 /nfs/dbraw/zinc/65/39/21/204653921.db2.gz VIUBQLSSDPDWRH-SZPZYZBQSA-N 0 0 354.534 6.690 40 0 FKABRN CC[C@@H](c1ccc2c(c1)C[C@H](C)O2)[C@H](CC)c1ccc2c(c1)C[C@H](C)O2 ZINC000017303461 220211334 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SITHMOVLUSCACU-NNZQMTATSA-N 0 0 352.305 5.098 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1Cl ZINC000018051832 570874809 /nfs/dbraw/zinc/87/48/09/570874809.db2.gz WSWRJRIVRJMOOK-UHFFFAOYSA-N 0 0 367.832 5.783 40 0 FKABRN Cc1nc2cc(-c3ccc(Cl)cc3)nn2c(N2C[C@H](C)C[C@H](C)C2)c1C ZINC000018057017 132885646 /nfs/dbraw/zinc/88/56/46/132885646.db2.gz TWNBQWREYBVWAX-OKILXGFUSA-N 0 0 368.912 5.149 40 0 FKABRN O=C(Nc1cc2c3c(c1)[C@H]1CCC[C@@H]1CN3C[C@@H]1CCC[C@@H]21)c1ccccc1 ZINC000018102240 571319056 /nfs/dbraw/zinc/31/90/56/571319056.db2.gz MHYNSJVWRVYYJJ-NZXJAIKPSA-N 0 0 372.512 5.540 40 0 FKABRN Cc1ccc(C23C[C@H]4C[C@H](CC(C(=O)Nc5cccc(C)c5)(C4)C2)C3)cc1 ZINC000018113704 220223289 /nfs/dbraw/zinc/22/32/89/220223289.db2.gz QDAJPLFGAHNWPN-KVEMZPMDSA-N 0 0 359.513 5.780 40 0 FKABRN CCOc1ccc(/N=c2/ssc(SC)c2-c2ccccc2)cc1 ZINC000018114311 211192529 /nfs/dbraw/zinc/19/25/29/211192529.db2.gz PQSSRCHUVUXKLB-HTXNQAPBSA-N 0 0 359.541 5.830 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(OC)cc1 ZINC000018132186 211191407 /nfs/dbraw/zinc/19/14/07/211191407.db2.gz HDCGRIDCVCYMAJ-FZKQIMNGSA-N 0 0 363.910 5.097 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc(OC)cc1 ZINC000018132187 570875665 /nfs/dbraw/zinc/87/56/65/570875665.db2.gz HDCGRIDCVCYMAJ-ACJLOTCBSA-N 0 0 363.910 5.097 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(OC)cc1 ZINC000018132188 220225533 /nfs/dbraw/zinc/22/55/33/220225533.db2.gz HDCGRIDCVCYMAJ-SCLBCKFNSA-N 0 0 363.910 5.097 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc(OC)cc1 ZINC000018132189 570875549 /nfs/dbraw/zinc/87/55/49/570875549.db2.gz HDCGRIDCVCYMAJ-UGSOOPFHSA-N 0 0 363.910 5.097 40 0 FKABRN Cc1cc(C)c(NC(=O)C2[C@H]3CC[C@@H]4[C@H](CC[C@H]23)C4(Cl)Cl)c(C)c1 ZINC000018142010 220225050 /nfs/dbraw/zinc/22/50/50/220225050.db2.gz AJTJBLIFAGTZAF-UIJGJVKASA-N 0 0 366.332 5.406 40 0 FKABRN S=C(NCCSCc1ccccc1)Nc1ccc(Cl)cc1Cl ZINC000018162775 220225648 /nfs/dbraw/zinc/22/56/48/220225648.db2.gz QDFZOFJKIBWLOD-UHFFFAOYSA-N 0 0 371.358 5.213 40 0 FKABRN CC(=O)Nc1nc(C23C[C@@H]4C[C@H](C2)CC(c2ccc(C)cc2)(C4)C3)cs1 ZINC000018191462 570876891 /nfs/dbraw/zinc/87/68/91/570876891.db2.gz KGWXDKSOHBCQQJ-RGMRCXJASA-N 0 0 366.530 5.200 40 0 FKABRN Cc1sc(NC(=O)c2ccccn2)nc1-c1ccc(Cl)cc1Cl ZINC000018192520 206322609 /nfs/dbraw/zinc/32/26/09/206322609.db2.gz FTDRDGLQWKRINJ-UHFFFAOYSA-N 0 0 364.257 5.073 40 0 FKABRN O=C(Nc1cccc(Cl)c1)C1[C@H]2CC[C@@H]3[C@H](CC[C@H]12)C3(Cl)Cl ZINC000018205557 571294195 /nfs/dbraw/zinc/29/41/95/571294195.db2.gz RRSLLQLMRWNJBR-JZAZDWQXSA-N 0 0 358.696 5.135 40 0 FKABRN CCOc1ccccc1C(=O)Nc1ccc(Oc2ccccc2OC)cc1 ZINC000018238719 263373183 /nfs/dbraw/zinc/37/31/83/263373183.db2.gz MNDSQFWOLIBSEF-UHFFFAOYSA-N 0 0 363.413 5.139 40 0 FKABRN O=C(Nc1cc2c3c(c1)[C@H]1CCC[C@H]1CN3C[C@@H]1CCC[C@@H]21)c1ccccc1 ZINC000018255921 571294280 /nfs/dbraw/zinc/29/42/80/571294280.db2.gz MHYNSJVWRVYYJJ-JYAXBFRTSA-N 0 0 372.512 5.540 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2)cc1)c1ccc(C(F)(F)F)cc1 ZINC000019074409 570879870 /nfs/dbraw/zinc/87/98/70/570879870.db2.gz CIKDHLHLXDNQBX-UHFFFAOYSA-N 0 0 357.331 5.750 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3ccc(F)c(F)c3)ccc21 ZINC000019074424 207641358 /nfs/dbraw/zinc/64/13/58/207641358.db2.gz ILJNYBAGSHSULB-UHFFFAOYSA-N 0 0 350.368 5.345 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3cc(F)ccc3F)ccc21 ZINC000019074426 204666968 /nfs/dbraw/zinc/66/69/68/204666968.db2.gz JFJPLHFQFQRJLJ-UHFFFAOYSA-N 0 0 350.368 5.345 40 0 FKABRN Cc1cc2nc(NC(=S)Nc3cccc(C(F)(F)F)c3)[nH]c2cc1C ZINC000019074433 570879855 /nfs/dbraw/zinc/87/98/55/570879855.db2.gz BXWIJCFMKSLANZ-UHFFFAOYSA-N 0 0 364.396 5.007 40 0 FKABRN O=C(NCC1CCCCC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000019074462 571323392 /nfs/dbraw/zinc/32/33/92/571323392.db2.gz OEXUTFCCZGBMNE-UHFFFAOYSA-N 0 0 353.306 5.034 40 0 FKABRN S=C(NCc1cccc2ccccc21)Nc1ccc(Cl)cc1Cl ZINC000019074485 570880017 /nfs/dbraw/zinc/88/00/17/570880017.db2.gz VOGNAFDOFGOGMX-UHFFFAOYSA-N 0 0 361.297 5.633 40 0 FKABRN O=C(Nc1ccc2c(c1)Cc1ccccc1-2)Nc1cccc2ccccc21 ZINC000019075080 211201349 /nfs/dbraw/zinc/20/13/49/211201349.db2.gz DFZOBTHPSWEPFX-UHFFFAOYSA-N 0 0 350.421 6.055 40 0 FKABRN O=C(Nc1ccc2c(c1)Cc1ccccc1-2)Nc1ccc(Cl)c(Cl)c1 ZINC000019075086 211202148 /nfs/dbraw/zinc/20/21/48/211202148.db2.gz IXDFYFBKXBHXFO-UHFFFAOYSA-N 0 0 369.251 6.209 40 0 FKABRN O=C(Nc1cc(F)ccc1F)N1c2ccccc2Sc2ccccc21 ZINC000019075196 570879972 /nfs/dbraw/zinc/87/99/72/570879972.db2.gz YNTGVDQQMAKFPX-UHFFFAOYSA-N 0 0 354.381 5.800 40 0 FKABRN C[C@@]12C[C@@H](CC(C)(C)C1)N(C(=S)Nc1ccc(Cl)cc1Cl)C2 ZINC000019075257 220236253 /nfs/dbraw/zinc/23/62/53/220236253.db2.gz OTBFWMJIFLSYBW-SJKOYZFVSA-N 0 0 357.350 5.591 40 0 FKABRN C[C@]12C[C@H](CC(C)(C)C1)N(C(=S)Nc1ccc(Cl)cc1Cl)C2 ZINC000019075258 220235094 /nfs/dbraw/zinc/23/50/94/220235094.db2.gz OTBFWMJIFLSYBW-SJCJKPOMSA-N 0 0 357.350 5.591 40 0 FKABRN O=C(Nc1ccccc1)Nc1ccccc1COC(=O)Nc1ccccc1 ZINC000019075414 570879892 /nfs/dbraw/zinc/87/98/92/570879892.db2.gz JZRMGXUGDZADRF-UHFFFAOYSA-N 0 0 361.401 5.079 40 0 FKABRN Cc1cc2cc(CNc3cc(-c4ccccc4)ccc3O)c(=O)[nH]c2cc1C ZINC000019126184 570881033 /nfs/dbraw/zinc/88/10/33/570881033.db2.gz HBZGIKDGHSSEAJ-UHFFFAOYSA-N 0 0 370.452 5.130 40 0 FKABRN CCOc1ccc([C@H]2Oc3ccccc3[C@@H]3C[C@@H](c4ccccc4)NN32)cc1 ZINC000019171706 220238726 /nfs/dbraw/zinc/23/87/26/220238726.db2.gz NNUWRAGPZLVXPM-WPFOTENUSA-N 0 0 372.468 5.169 40 0 FKABRN CCOc1ccc([C@H]2Oc3ccccc3[C@H]3C[C@@H](c4ccccc4)NN32)cc1 ZINC000019171712 211204933 /nfs/dbraw/zinc/20/49/33/211204933.db2.gz NNUWRAGPZLVXPM-WMTXJRDZSA-N 0 0 372.468 5.169 40 0 FKABRN O=C(Nc1ccccc1Br)c1cc2cc(Cl)ccc2o1 ZINC000019179729 220239162 /nfs/dbraw/zinc/23/91/62/220239162.db2.gz NKNWPIOEWQKSST-UHFFFAOYSA-N 0 0 350.599 5.101 40 0 FKABRN O=C(Nc1ccc(Br)cc1F)c1cc2cc(Cl)ccc2o1 ZINC000019199268 571303865 /nfs/dbraw/zinc/30/38/65/571303865.db2.gz LLBRFAJDJAAIFN-UHFFFAOYSA-N 0 0 368.589 5.240 40 0 FKABRN Cc1ccc(NC(=O)c2cc3cc(Cl)ccc3o2)c(Br)c1 ZINC000019199962 220238843 /nfs/dbraw/zinc/23/88/43/220238843.db2.gz UUZHNUCGNKGLMT-UHFFFAOYSA-N 0 0 364.626 5.409 40 0 FKABRN Cc1ccc(-c2nnc([C@@H]3CCCN3Cc3cccc(Cl)c3)o2)s1 ZINC000019217737 570882563 /nfs/dbraw/zinc/88/25/63/570882563.db2.gz XQBHURWWXYDFLY-HNNXBMFYSA-N 0 0 359.882 5.097 40 0 FKABRN Cc1ccc(-c2nnc([C@H]3CCCN3Cc3cccc(Cl)c3)o2)s1 ZINC000019217739 211206037 /nfs/dbraw/zinc/20/60/37/211206037.db2.gz XQBHURWWXYDFLY-OAHLLOKOSA-N 0 0 359.882 5.097 40 0 FKABRN Cc1cc(Br)ccc1NCc1ccc(Br)cc1 ZINC000019232744 263374491 /nfs/dbraw/zinc/37/44/91/263374491.db2.gz ZDPAIFDFGPWOJT-UHFFFAOYSA-N 0 0 355.073 5.132 40 0 FKABRN Cc1cc(C(=O)N2CCC(c3cc4c(C)cccc4cn3)CC2)c(C2CC2)o1 ZINC000019236689 570883689 /nfs/dbraw/zinc/88/36/89/570883689.db2.gz VTJWADVKWMFJRG-UHFFFAOYSA-N 0 0 374.484 5.342 40 0 FKABRN Clc1cccc(CN[C@@H](Cc2cccs2)c2nccs2)c1Cl ZINC000019292623 220246160 /nfs/dbraw/zinc/24/61/60/220246160.db2.gz WHSZVMORPBBUSD-AWEZNQCLSA-N 0 0 369.342 5.585 40 0 FKABRN Clc1cccc(CN[C@H](Cc2cccs2)c2nccs2)c1Cl ZINC000019292624 220246647 /nfs/dbraw/zinc/24/66/47/220246647.db2.gz WHSZVMORPBBUSD-CQSZACIVSA-N 0 0 369.342 5.585 40 0 FKABRN Clc1cccc(CN[C@@H](Cc2ccsc2)c2nccs2)c1Cl ZINC000019292625 570884737 /nfs/dbraw/zinc/88/47/37/570884737.db2.gz VHOPMNVOBLUBFU-AWEZNQCLSA-N 0 0 369.342 5.585 40 0 FKABRN Clc1cccc(CN[C@H](Cc2ccsc2)c2nccs2)c1Cl ZINC000019292627 570884657 /nfs/dbraw/zinc/88/46/57/570884657.db2.gz VHOPMNVOBLUBFU-CQSZACIVSA-N 0 0 369.342 5.585 40 0 FKABRN Clc1ccc([C@@H]2N[C@H](c3nccs3)Cc3ccsc32)cc1Cl ZINC000019293160 220247174 /nfs/dbraw/zinc/24/71/74/220247174.db2.gz PRNYJYDRQQICCT-KBPBESRZSA-N 0 0 367.326 5.488 40 0 FKABRN Cc1cc(C2N(Cc3ccccc3)CCN2Cc2ccccc2)cc(C)c1O ZINC000019328270 204677718 /nfs/dbraw/zinc/67/77/18/204677718.db2.gz FBDKNXWFEWWSBA-UHFFFAOYSA-N 0 0 372.512 5.026 40 0 FKABRN Cc1ccccc1C1N(Cc2ccccc2)CCCN1Cc1ccccc1 ZINC000019328433 220249303 /nfs/dbraw/zinc/24/93/03/220249303.db2.gz RBBBKWBGJZJJBA-UHFFFAOYSA-N 0 0 356.513 5.402 40 0 FKABRN O=C(c1cccs1)N1CCCCC[C@H]1c1cc(-c2ccc(F)cc2)on1 ZINC000019342708 570886416 /nfs/dbraw/zinc/88/64/16/570886416.db2.gz HGJDPZNEVDYZIC-KRWDZBQOSA-N 0 0 370.449 5.300 40 0 FKABRN O=C(c1cccs1)N1CCCCC[C@@H]1c1cc(-c2ccc(F)cc2)on1 ZINC000019342712 570886357 /nfs/dbraw/zinc/88/63/57/570886357.db2.gz HGJDPZNEVDYZIC-QGZVFWFLSA-N 0 0 370.449 5.300 40 0 FKABRN Clc1ccc(CN[C@@H](Cc2cccs2)c2nccs2)cc1Cl ZINC000019343331 570886225 /nfs/dbraw/zinc/88/62/25/570886225.db2.gz WKEUMUWYJOFFRI-HNNXBMFYSA-N 0 0 369.342 5.585 40 0 FKABRN Clc1ccc(CN[C@H](Cc2cccs2)c2nccs2)cc1Cl ZINC000019343334 220250971 /nfs/dbraw/zinc/25/09/71/220250971.db2.gz WKEUMUWYJOFFRI-OAHLLOKOSA-N 0 0 369.342 5.585 40 0 FKABRN c1csc(CNc2ncc(-c3ccsc3)c(-c3nccs3)n2)c1 ZINC000019343778 220251325 /nfs/dbraw/zinc/25/13/25/220251325.db2.gz ZWGQVKRBSXLQIO-UHFFFAOYSA-N 0 0 356.501 5.002 40 0 FKABRN Clc1ccccc1CN1CCCC[C@@H]1c1nnc(-c2ccsc2)o1 ZINC000019349100 570886928 /nfs/dbraw/zinc/88/69/28/570886928.db2.gz QOSXHZPWCWDSAN-MRXNPFEDSA-N 0 0 359.882 5.179 40 0 FKABRN Clc1ccccc1CN1CCCC[C@H]1c1nnc(-c2ccsc2)o1 ZINC000019349102 211218632 /nfs/dbraw/zinc/21/86/32/211218632.db2.gz QOSXHZPWCWDSAN-INIZCTEOSA-N 0 0 359.882 5.179 40 0 FKABRN CC(C)Oc1ccc(CN[C@@H](Cc2cccs2)c2nccs2)cc1 ZINC000019450700 220258698 /nfs/dbraw/zinc/25/86/98/220258698.db2.gz IFUDGRWUZUNCHD-SFHVURJKSA-N 0 0 358.532 5.065 40 0 FKABRN CC(C)Oc1ccc(CN[C@H](Cc2cccs2)c2nccs2)cc1 ZINC000019450702 211221445 /nfs/dbraw/zinc/22/14/45/211221445.db2.gz IFUDGRWUZUNCHD-GOSISDBHSA-N 0 0 358.532 5.065 40 0 FKABRN CC(C)Oc1ccc(CN[C@@H](Cc2ccsc2)c2nccs2)cc1 ZINC000019450704 570889196 /nfs/dbraw/zinc/88/91/96/570889196.db2.gz ZTFIFVCIXCKXJJ-SFHVURJKSA-N 0 0 358.532 5.065 40 0 FKABRN CC(C)Oc1ccc(CN[C@H](Cc2ccsc2)c2nccs2)cc1 ZINC000019450706 570889120 /nfs/dbraw/zinc/88/91/20/570889120.db2.gz ZTFIFVCIXCKXJJ-GOSISDBHSA-N 0 0 358.532 5.065 40 0 FKABRN CC(C)Oc1cccc(CN[C@@H](Cc2ccsc2)c2nccs2)c1 ZINC000019450947 570889146 /nfs/dbraw/zinc/88/91/46/570889146.db2.gz UUCLUOYKZWYDGU-SFHVURJKSA-N 0 0 358.532 5.065 40 0 FKABRN CC(C)Oc1cccc(CN[C@H](Cc2ccsc2)c2nccs2)c1 ZINC000019450949 211222139 /nfs/dbraw/zinc/22/21/39/211222139.db2.gz UUCLUOYKZWYDGU-GOSISDBHSA-N 0 0 358.532 5.065 40 0 FKABRN CC(C)n1c(CN(Cc2ccccc2)Cc2ccncc2)nc2ccccc21 ZINC000019454726 570889739 /nfs/dbraw/zinc/88/97/39/570889739.db2.gz NRFYQNFXLVWKHD-UHFFFAOYSA-N 0 0 370.500 5.215 40 0 FKABRN COc1ccccc1C1(NCc2nc3ccccc3n2C(C)C)CCCC1 ZINC000019454755 220257333 /nfs/dbraw/zinc/25/73/33/220257333.db2.gz RFGTZIFRDOKIGZ-UHFFFAOYSA-N 0 0 363.505 5.185 40 0 FKABRN CCn1ncc(CN2CCCCC[C@@H]2c2cc(-c3cccs3)on2)c1C ZINC000019523966 211228133 /nfs/dbraw/zinc/22/81/33/211228133.db2.gz LAOZVECXVOAFLI-GOSISDBHSA-N 0 0 370.522 5.045 40 0 FKABRN CCn1ncc(CN2CCCCC[C@H]2c2cc(-c3cccs3)on2)c1C ZINC000019523967 211227672 /nfs/dbraw/zinc/22/76/72/211227672.db2.gz LAOZVECXVOAFLI-SFHVURJKSA-N 0 0 370.522 5.045 40 0 FKABRN CCn1cc(CN2CCCCC[C@@H]2c2cc(-c3cccs3)on2)c(C)n1 ZINC000019524558 570891533 /nfs/dbraw/zinc/89/15/33/570891533.db2.gz QCHUNCXZVBBTPT-GOSISDBHSA-N 0 0 370.522 5.045 40 0 FKABRN CCn1cc(CN2CCCCC[C@H]2c2cc(-c3cccs3)on2)c(C)n1 ZINC000019524559 211227268 /nfs/dbraw/zinc/22/72/68/211227268.db2.gz QCHUNCXZVBBTPT-SFHVURJKSA-N 0 0 370.522 5.045 40 0 FKABRN Cc1noc(-c2cn[nH]c2[C@@H]2CCCCN2Cc2cccc(Cl)c2)c1C ZINC000019557964 220270410 /nfs/dbraw/zinc/27/04/10/220270410.db2.gz QDYCPTDHDSMEQE-SFHVURJKSA-N 0 0 370.884 5.062 40 0 FKABRN Cc1noc(-c2cn[nH]c2[C@H]2CCCCN2Cc2cccc(Cl)c2)c1C ZINC000019557967 220270230 /nfs/dbraw/zinc/27/02/30/220270230.db2.gz QDYCPTDHDSMEQE-GOSISDBHSA-N 0 0 370.884 5.062 40 0 FKABRN Cc1noc(-c2cn[nH]c2[C@@H]2CCCCN2Cc2ccccc2Cl)c1C ZINC000019558000 211233130 /nfs/dbraw/zinc/23/31/30/211233130.db2.gz TYGCLWLFHILDJO-SFHVURJKSA-N 0 0 370.884 5.062 40 0 FKABRN Cc1noc(-c2cn[nH]c2[C@H]2CCCCN2Cc2ccccc2Cl)c1C ZINC000019558002 220270281 /nfs/dbraw/zinc/27/02/81/220270281.db2.gz TYGCLWLFHILDJO-GOSISDBHSA-N 0 0 370.884 5.062 40 0 FKABRN Cc1nc([C@@H](Cc2ccsc2)NCc2cccc(F)c2F)sc1C ZINC000019559913 570893228 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DVNRFDKOMVIBFA-UHFFFAOYSA-N 0 0 374.465 5.939 40 0 FKABRN COc1ccc2c(c1)Cc1sc(Nc3cccc(C(F)(F)F)c3)nc1-2 ZINC000019894582 211258518 /nfs/dbraw/zinc/25/85/18/211258518.db2.gz ULUAZBHOZOHEGR-UHFFFAOYSA-N 0 0 362.376 5.485 40 0 FKABRN CCn1c(SCc2ccccc2)nnc1-c1ccc(Br)cc1 ZINC000019927672 211261872 /nfs/dbraw/zinc/26/18/72/211261872.db2.gz MOOPRTOPDDXZHQ-UHFFFAOYSA-N 0 0 374.307 5.020 40 0 FKABRN Cc1ccc(OCc2nnc(SCc3ccc(Cl)cc3)o2)cc1C ZINC000019927985 525453078 /nfs/dbraw/zinc/45/30/78/525453078.db2.gz SUNHGWKRSYTGBN-UHFFFAOYSA-N 0 0 360.866 5.211 40 0 FKABRN Cc1ccc(OCc2nnc(SCc3ccccc3Cl)o2)cc1C ZINC000019927989 525452025 /nfs/dbraw/zinc/45/20/25/525452025.db2.gz XTOOWDLCQWBCQI-UHFFFAOYSA-N 0 0 360.866 5.211 40 0 FKABRN CC(C)(C)c1ccc(-c2nnc(CSc3nc4ccccc4o3)o2)cc1 ZINC000019928711 519008802 /nfs/dbraw/zinc/00/88/02/519008802.db2.gz RBZAAAXUUHYVMU-UHFFFAOYSA-N 0 0 365.458 5.468 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(Cl)c1C ZINC000019931612 570907362 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ZINC000019932337 527022677 /nfs/dbraw/zinc/02/26/77/527022677.db2.gz NCSYDYAKXASEEE-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN Cc1ccc(C)c(CC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c1 ZINC000019932363 570907120 /nfs/dbraw/zinc/90/71/20/570907120.db2.gz WYMPWOBEILVPER-UHFFFAOYSA-N 0 0 365.860 5.930 40 0 FKABRN CCSc1ccccc1NC(=O)CSCc1ccc(Cl)cc1 ZINC000019932716 521776167 /nfs/dbraw/zinc/77/61/67/521776167.db2.gz AVOZHQSVXIIWIR-UHFFFAOYSA-N 0 0 351.924 5.324 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000019933176 523043684 /nfs/dbraw/zinc/04/36/84/523043684.db2.gz RERPFPYLSSGKMP-OAQYLSRUSA-N 0 0 367.876 5.309 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000019933178 522877233 /nfs/dbraw/zinc/87/72/33/522877233.db2.gz RERPFPYLSSGKMP-NRFANRHFSA-N 0 0 367.876 5.309 40 0 FKABRN Cc1ccc(OCCCC(=O)N[C@@H](c2ccccc2)c2ccccc2C)cc1 ZINC000019933419 525405546 /nfs/dbraw/zinc/40/55/46/525405546.db2.gz NUWFGMMXFWYKFW-VWLOTQADSA-N 0 0 373.496 5.368 40 0 FKABRN Cc1ccc(OCCCC(=O)N[C@H](c2ccccc2)c2ccccc2C)cc1 ZINC000019933422 525405699 /nfs/dbraw/zinc/40/56/99/525405699.db2.gz NUWFGMMXFWYKFW-RUZDIDTESA-N 0 0 373.496 5.368 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000019933595 523079899 /nfs/dbraw/zinc/07/98/99/523079899.db2.gz HHDHSNRKOWJYLF-HNAYVOBHSA-N 0 0 361.938 5.705 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000019933598 522918556 /nfs/dbraw/zinc/91/85/56/522918556.db2.gz HHDHSNRKOWJYLF-KXBFYZLASA-N 0 0 361.938 5.705 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000019933600 523080042 /nfs/dbraw/zinc/08/00/42/523080042.db2.gz HHDHSNRKOWJYLF-DNVCBOLYSA-N 0 0 361.938 5.705 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000019933603 522918698 /nfs/dbraw/zinc/91/86/98/522918698.db2.gz HHDHSNRKOWJYLF-BEFAXECRSA-N 0 0 361.938 5.705 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000019933719 523045698 /nfs/dbraw/zinc/04/56/98/523045698.db2.gz HCPQUUAQERKTKT-LJQANCHMSA-N 0 0 369.848 5.298 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000019933721 522878607 /nfs/dbraw/zinc/87/86/07/522878607.db2.gz HCPQUUAQERKTKT-IBGZPJMESA-N 0 0 369.848 5.298 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)c2ccc(C(C)(C)C)cc2)cc1 ZINC000019933773 211261114 /nfs/dbraw/zinc/26/11/14/211261114.db2.gz XUKHUHNZUKFLGB-OAQYLSRUSA-N 0 0 353.506 5.510 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)c2ccc(C(C)(C)C)cc2)cc1 ZINC000019933776 211262131 /nfs/dbraw/zinc/26/21/31/211262131.db2.gz XUKHUHNZUKFLGB-NRFANRHFSA-N 0 0 353.506 5.510 40 0 FKABRN CN(C(=O)c1ccc(OCc2ccccc2Cl)cc1)C1CCCCC1 ZINC000019934112 220306978 /nfs/dbraw/zinc/30/69/78/220306978.db2.gz CGRXRDQVSCKFDI-UHFFFAOYSA-N 0 0 357.881 5.324 40 0 FKABRN CCOc1ccc(CCC(=O)Nc2c(C)cccc2C(C)C)cc1OCC ZINC000019934188 220306708 /nfs/dbraw/zinc/30/67/08/220306708.db2.gz ZMXMPOQMOKSDBO-UHFFFAOYSA-N 0 0 369.505 5.487 40 0 FKABRN Cc1ccc(CN(C)C(=O)CSCc2ccc(Cl)c(Cl)c2)cc1 ZINC000019934449 524364585 /nfs/dbraw/zinc/36/45/85/524364585.db2.gz XVBZUPZOMQARIQ-UHFFFAOYSA-N 0 0 368.329 5.194 40 0 FKABRN Cc1ccc(C)c(NC(=O)CSCc2ccc(Cl)c(Cl)c2)c1 ZINC000019934717 524137915 /nfs/dbraw/zinc/13/79/15/524137915.db2.gz CLZRJFNIFDZDHH-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN O=C(Cc1cccc(F)c1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000019934956 220306208 /nfs/dbraw/zinc/30/62/08/220306208.db2.gz VFYUWXIKTXJAEY-UHFFFAOYSA-N 0 0 355.796 5.453 40 0 FKABRN O=C(COc1ccc(F)cc1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000019935080 220307242 /nfs/dbraw/zinc/30/72/42/220307242.db2.gz QIWBPXWOWNLHNE-UHFFFAOYSA-N 0 0 371.795 5.289 40 0 FKABRN Clc1ccccc1CN1CN=C(c2ccccc2)N(c2ccccc2)C1 ZINC000019960602 132893540 /nfs/dbraw/zinc/89/35/40/132893540.db2.gz GJQLOORHCHIDJW-UHFFFAOYSA-N 0 0 361.876 5.024 40 0 FKABRN Clc1ccc(N2CN(Cc3ccccc3)CN=C2c2ccccc2)cc1 ZINC000019960684 132893693 /nfs/dbraw/zinc/89/36/93/132893693.db2.gz UXNNENUKYWWBIN-UHFFFAOYSA-N 0 0 361.876 5.024 40 0 FKABRN Clc1cccc(N2CN(Cc3ccccc3)CN=C2c2ccccc2)c1 ZINC000019960716 570908266 /nfs/dbraw/zinc/90/82/66/570908266.db2.gz CFMUQPXITTXVPX-UHFFFAOYSA-N 0 0 361.876 5.024 40 0 FKABRN Cc1ccc(CN(c2cccc(C)c2)c2nc(=O)c3ccccc3s2)cc1 ZINC000019960883 220308199 /nfs/dbraw/zinc/30/81/99/220308199.db2.gz LQBXVIXLKRLPQH-UHFFFAOYSA-N 0 0 372.493 5.612 40 0 FKABRN Cc1ccc(N2CN(CCc3ccccc3)CN=C2c2ccccc2)cc1C ZINC000019974121 132893646 /nfs/dbraw/zinc/89/36/46/132893646.db2.gz SEHBJVARDDTRCS-UHFFFAOYSA-N 0 0 369.512 5.030 40 0 FKABRN Cc1cc(C)cc(N2CN(CCc3ccccc3)CN=C2c2ccccc2)c1 ZINC000019974129 570908079 /nfs/dbraw/zinc/90/80/79/570908079.db2.gz SAAPNAGMESPSCV-UHFFFAOYSA-N 0 0 369.512 5.030 40 0 FKABRN Cc1ccc(C)c(N2CN(CCc3ccccc3)CN=C2c2ccccc2)c1 ZINC000019974136 570908151 /nfs/dbraw/zinc/90/81/51/570908151.db2.gz KBYHKIKQJUYHFM-UHFFFAOYSA-N 0 0 369.512 5.030 40 0 FKABRN Cc1ccc(N2CN(CCc3ccccc3)CN=C2c2ccccc2)c(C)c1 ZINC000019974144 570908083 /nfs/dbraw/zinc/90/80/83/570908083.db2.gz UZRBLDRQIAMJNG-UHFFFAOYSA-N 0 0 369.512 5.030 40 0 FKABRN Cc1cc(C)c(NC(=O)/C=C/c2c(Cl)cccc2Cl)c(Cl)c1 ZINC000020010429 220308224 /nfs/dbraw/zinc/30/82/24/220308224.db2.gz BGFZBXGGHGSVJT-VOTSOKGWSA-N 0 0 354.664 5.916 40 0 FKABRN CSc1ccc([C@@H](C)NC(=O)C(c2ccccc2)c2ccccc2)cc1 ZINC000020025314 526055941 /nfs/dbraw/zinc/05/59/41/526055941.db2.gz AMMCJGNGUJDFKT-QGZVFWFLSA-N 0 0 361.510 5.418 40 0 FKABRN CSc1ccc([C@H](C)NC(=O)C(c2ccccc2)c2ccccc2)cc1 ZINC000020025317 570908241 /nfs/dbraw/zinc/90/82/41/570908241.db2.gz AMMCJGNGUJDFKT-KRWDZBQOSA-N 0 0 361.510 5.418 40 0 FKABRN C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc(Br)c1 ZINC000020025381 570879157 /nfs/dbraw/zinc/87/91/57/570879157.db2.gz RXZDFQDYKKDGLR-SECBINFHSA-N 0 0 373.077 5.247 40 0 FKABRN C[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1cccc(Br)c1 ZINC000020025383 570879143 /nfs/dbraw/zinc/87/91/43/570879143.db2.gz RXZDFQDYKKDGLR-VIFPVBQESA-N 0 0 373.077 5.247 40 0 FKABRN O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1ccc(Cl)cc1Cl ZINC000020025393 570908247 /nfs/dbraw/zinc/90/82/47/570908247.db2.gz ISAPPNFHIRJDQE-UHFFFAOYSA-N 0 0 352.114 5.404 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)NCCCc1cccc(C)c1 ZINC000020034863 523054959 /nfs/dbraw/zinc/05/49/59/523054959.db2.gz YICQKFDMHROUFG-JOCHJYFZSA-N 0 0 361.485 5.055 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)NCCCc1cccc(C)c1 ZINC000020034867 522885857 /nfs/dbraw/zinc/88/58/57/522885857.db2.gz YICQKFDMHROUFG-QFIPXVFZSA-N 0 0 361.485 5.055 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000020035492 220310681 /nfs/dbraw/zinc/31/06/81/220310681.db2.gz KCQWDEFDQSQLJP-MRXNPFEDSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000020035495 570908684 /nfs/dbraw/zinc/90/86/84/570908684.db2.gz KCQWDEFDQSQLJP-INIZCTEOSA-N 0 0 351.368 5.118 40 0 FKABRN Cc1ccc(CC(=O)Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc1 ZINC000020035961 220310950 /nfs/dbraw/zinc/31/09/50/220310950.db2.gz OIRUDEPJKBNLMF-UHFFFAOYSA-N 0 0 359.513 5.644 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000020035971 523039818 /nfs/dbraw/zinc/03/98/18/523039818.db2.gz ZIZZRZOPQHQTDV-FCHUYYIVSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000020035974 522872563 /nfs/dbraw/zinc/87/25/63/522872563.db2.gz ZIZZRZOPQHQTDV-VXKWHMMOSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000020035978 523040739 /nfs/dbraw/zinc/04/07/39/523040739.db2.gz ZIZZRZOPQHQTDV-FGZHOGPDSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000020035981 522871295 /nfs/dbraw/zinc/87/12/95/522871295.db2.gz ZIZZRZOPQHQTDV-YADHBBJMSA-N 0 0 353.506 5.364 40 0 FKABRN Cc1ccccc1O[C@H](C)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000020036258 525321890 /nfs/dbraw/zinc/32/18/90/525321890.db2.gz RDBBUOFNAWJGAN-QGZVFWFLSA-N 0 0 363.482 5.552 40 0 FKABRN Cc1ccccc1O[C@@H](C)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000020036261 525318602 /nfs/dbraw/zinc/31/86/02/525318602.db2.gz RDBBUOFNAWJGAN-KRWDZBQOSA-N 0 0 363.482 5.552 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1C(F)(F)F ZINC000020036439 211266588 /nfs/dbraw/zinc/26/65/88/211266588.db2.gz GSZXMQHDWOVMIE-CQSZACIVSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1C(F)(F)F ZINC000020036443 570908534 /nfs/dbraw/zinc/90/85/34/570908534.db2.gz GSZXMQHDWOVMIE-AWEZNQCLSA-N 0 0 357.759 5.155 40 0 FKABRN O=C(Nc1ccc(F)cc1)c1ccc(OCCSc2ccccc2)cc1 ZINC000020036872 527203967 /nfs/dbraw/zinc/20/39/67/527203967.db2.gz WYQJIQCECUGEOR-UHFFFAOYSA-N 0 0 367.445 5.249 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)N[C@@H](CC(C)C)c1ccc(OC)cc1 ZINC000020036894 523048224 /nfs/dbraw/zinc/04/82/24/523048224.db2.gz DMGXWXJAUNOFCS-FCHUYYIVSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)N[C@@H](CC(C)C)c1ccc(OC)cc1 ZINC000020036897 522880374 /nfs/dbraw/zinc/88/03/74/522880374.db2.gz DMGXWXJAUNOFCS-VXKWHMMOSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)N[C@H](CC(C)C)c1ccc(OC)cc1 ZINC000020036901 523048857 /nfs/dbraw/zinc/04/88/57/523048857.db2.gz DMGXWXJAUNOFCS-FGZHOGPDSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)N[C@H](CC(C)C)c1ccc(OC)cc1 ZINC000020036906 522881563 /nfs/dbraw/zinc/88/15/63/522881563.db2.gz DMGXWXJAUNOFCS-YADHBBJMSA-N 0 0 369.505 5.065 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)c2ccccc2OCc2ccccc2)c(C)c1 ZINC000020036957 525717553 /nfs/dbraw/zinc/71/75/53/525717553.db2.gz QNKVXYDIGKLSOT-LJQANCHMSA-N 0 0 359.469 5.373 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)c2ccccc2OCc2ccccc2)c(C)c1 ZINC000020036960 525912696 /nfs/dbraw/zinc/91/26/96/525912696.db2.gz QNKVXYDIGKLSOT-IBGZPJMESA-N 0 0 359.469 5.373 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1ccc(CN2CCc3ccccc32)cc1 ZINC000020037639 570909132 /nfs/dbraw/zinc/90/91/32/570909132.db2.gz VNUYRSODRAEMAX-UHFFFAOYSA-N 0 0 362.860 5.155 40 0 FKABRN CC(C)C[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000020038449 570909018 /nfs/dbraw/zinc/90/90/18/570909018.db2.gz HFTCYRWSTHYXNA-MRXNPFEDSA-N 0 0 372.317 5.059 40 0 FKABRN CC(C)C[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000020038453 220309792 /nfs/dbraw/zinc/30/97/92/220309792.db2.gz HFTCYRWSTHYXNA-INIZCTEOSA-N 0 0 372.317 5.059 40 0 FKABRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)Nc2cc(Cl)cc(Cl)c2)c1 ZINC000020039067 570908998 /nfs/dbraw/zinc/90/89/98/570908998.db2.gz COMGOJVUUGDESX-CYBMUJFWSA-N 0 0 352.261 5.325 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)Nc2cc(Cl)cc(Cl)c2)c1 ZINC000020039070 570908920 /nfs/dbraw/zinc/90/89/20/570908920.db2.gz COMGOJVUUGDESX-ZDUSSCGKSA-N 0 0 352.261 5.325 40 0 FKABRN CCOc1ccc(CCC(=O)Nc2ccc(Cl)cc2C)cc1OCC ZINC000020039206 220311088 /nfs/dbraw/zinc/31/10/88/220311088.db2.gz FKTWEVCGQGHYDS-UHFFFAOYSA-N 0 0 361.869 5.017 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000020039450 570909112 /nfs/dbraw/zinc/90/91/12/570909112.db2.gz OUIRXSBMPFXTKA-MRXNPFEDSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000020039453 220310078 /nfs/dbraw/zinc/31/00/78/220310078.db2.gz OUIRXSBMPFXTKA-INIZCTEOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)NCCSC1CCCCC1 ZINC000020039504 523046478 /nfs/dbraw/zinc/04/64/78/523046478.db2.gz RORDGGVSJFDZNK-OAQYLSRUSA-N 0 0 371.546 5.179 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)NCCSC1CCCCC1 ZINC000020039508 522876408 /nfs/dbraw/zinc/87/64/08/522876408.db2.gz RORDGGVSJFDZNK-NRFANRHFSA-N 0 0 371.546 5.179 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000020039902 211265684 /nfs/dbraw/zinc/26/56/84/211265684.db2.gz QAJPHMMOBNICLB-MRXNPFEDSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000020039905 570909102 /nfs/dbraw/zinc/90/91/02/570909102.db2.gz QAJPHMMOBNICLB-INIZCTEOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1 ZINC000020039956 522758818 /nfs/dbraw/zinc/75/88/18/522758818.db2.gz MKPOIMOKRFLVRI-DYESRHJHSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1 ZINC000020039959 522490991 /nfs/dbraw/zinc/49/09/91/522490991.db2.gz MKPOIMOKRFLVRI-UTKZUKDTSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1 ZINC000020039962 522764395 /nfs/dbraw/zinc/76/43/95/522764395.db2.gz MKPOIMOKRFLVRI-LAUBAEHRSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(C)cc1 ZINC000020039965 522506027 /nfs/dbraw/zinc/50/60/27/522506027.db2.gz MKPOIMOKRFLVRI-UWJYYQICSA-N 0 0 353.506 5.327 40 0 FKABRN Cc1ccccc1NC(=O)c1ccc(OCCSc2ccccc2)cc1 ZINC000020040564 525264211 /nfs/dbraw/zinc/26/42/11/525264211.db2.gz PNJSSYVHNHTMCU-UHFFFAOYSA-N 0 0 363.482 5.418 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000020040588 523045742 /nfs/dbraw/zinc/04/57/42/523045742.db2.gz ISPUUMSGSPKGJV-FDDCHVKYSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000020040591 522878626 /nfs/dbraw/zinc/87/86/26/522878626.db2.gz ISPUUMSGSPKGJV-MBSDFSHPSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)CCc1ccccc1 ZINC000020040594 523045619 /nfs/dbraw/zinc/04/56/19/523045619.db2.gz ISPUUMSGSPKGJV-WZONZLPQSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)CCc1ccccc1 ZINC000020040597 522878165 /nfs/dbraw/zinc/87/81/65/522878165.db2.gz ISPUUMSGSPKGJV-JPYJTQIMSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1 ZINC000020040652 522785135 /nfs/dbraw/zinc/78/51/35/522785135.db2.gz NGCASULSWWPTEU-JOCHJYFZSA-N 0 0 361.510 5.860 40 0 FKABRN CC[C@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1 ZINC000020040655 522530829 /nfs/dbraw/zinc/53/08/29/522530829.db2.gz NGCASULSWWPTEU-QFIPXVFZSA-N 0 0 361.510 5.860 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1ccccc1C(F)(F)F ZINC000020041400 220311042 /nfs/dbraw/zinc/31/10/42/220311042.db2.gz KSIXIWPTXTUTLH-MRXNPFEDSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)Nc1ccccc1C(F)(F)F ZINC000020041403 220311098 /nfs/dbraw/zinc/31/10/98/220311098.db2.gz KSIXIWPTXTUTLH-INIZCTEOSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000020041678 523055534 /nfs/dbraw/zinc/05/55/34/523055534.db2.gz ICRJEAGMQJWQIT-HXUWFJFHSA-N 0 0 367.876 5.309 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000020041681 522886047 /nfs/dbraw/zinc/88/60/47/522886047.db2.gz ICRJEAGMQJWQIT-FQEVSTJZSA-N 0 0 367.876 5.309 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccccc1C(F)(F)F ZINC000020041796 211265528 /nfs/dbraw/zinc/26/55/28/211265528.db2.gz HEGFQMUNVXCSRB-OAHLLOKOSA-N 0 0 373.827 5.868 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccccc1C(F)(F)F ZINC000020041799 220310396 /nfs/dbraw/zinc/31/03/96/220310396.db2.gz HEGFQMUNVXCSRB-HNNXBMFYSA-N 0 0 373.827 5.868 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000020041811 523054376 /nfs/dbraw/zinc/05/43/76/523054376.db2.gz VROSTPNKRYMLLB-PGRDOPGGSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000020041814 522888631 /nfs/dbraw/zinc/88/86/31/522888631.db2.gz VROSTPNKRYMLLB-AVRDEDQJSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000020041817 523055678 /nfs/dbraw/zinc/05/56/78/523055678.db2.gz VROSTPNKRYMLLB-XMSQKQJNSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000020041821 522890277 /nfs/dbraw/zinc/89/02/77/522890277.db2.gz VROSTPNKRYMLLB-GCJKJVERSA-N 0 0 361.485 5.491 40 0 FKABRN Cc1ccc([C@@H](NC(=O)[C@@H](C)Oc2cccc(C)c2C)c2ccccc2)cc1 ZINC000020041836 525770251 /nfs/dbraw/zinc/77/02/51/525770251.db2.gz RPJFXTPTYXRAOY-YKSBVNFPSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1ccc([C@@H](NC(=O)[C@H](C)Oc2cccc(C)c2C)c2ccccc2)cc1 ZINC000020041839 525769720 /nfs/dbraw/zinc/76/97/20/525769720.db2.gz RPJFXTPTYXRAOY-RDPSFJRHSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1ccc([C@H](NC(=O)[C@@H](C)Oc2cccc(C)c2C)c2ccccc2)cc1 ZINC000020041842 525965869 /nfs/dbraw/zinc/96/58/69/525965869.db2.gz RPJFXTPTYXRAOY-HYBUGGRVSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1ccc([C@H](NC(=O)[C@H](C)Oc2cccc(C)c2C)c2ccccc2)cc1 ZINC000020041844 525968375 /nfs/dbraw/zinc/96/83/75/525968375.db2.gz RPJFXTPTYXRAOY-GBXCKJPGSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1cccc(NC(=O)c2ccc(OCCSc3ccccc3)cc2)c1 ZINC000020041926 524660054 /nfs/dbraw/zinc/66/00/54/524660054.db2.gz VZXLYSSZUAJHBC-UHFFFAOYSA-N 0 0 363.482 5.418 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000020042406 523080672 /nfs/dbraw/zinc/08/06/72/523080672.db2.gz LCFYUSPZKJCSKC-GOSISDBHSA-N 0 0 363.910 5.637 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000020042409 522919722 /nfs/dbraw/zinc/91/97/22/522919722.db2.gz LCFYUSPZKJCSKC-SFHVURJKSA-N 0 0 363.910 5.637 40 0 FKABRN CN(C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)C1CCCC1 ZINC000020042420 523932279 /nfs/dbraw/zinc/93/22/79/523932279.db2.gz UXAHSNCOGPAICI-UHFFFAOYSA-N 0 0 359.922 5.647 40 0 FKABRN Cc1ccc(OCCCC(=O)N[C@@H](c2ccccc2)c2ccc(C)cc2)cc1 ZINC000020042563 525406420 /nfs/dbraw/zinc/40/64/20/525406420.db2.gz VTICZPUMSDGLAY-VWLOTQADSA-N 0 0 373.496 5.368 40 0 FKABRN Cc1ccc(OCCCC(=O)N[C@H](c2ccccc2)c2ccc(C)cc2)cc1 ZINC000020042566 525406335 /nfs/dbraw/zinc/40/63/35/525406335.db2.gz VTICZPUMSDGLAY-RUZDIDTESA-N 0 0 373.496 5.368 40 0 FKABRN CC[C@@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccc(C)cc1 ZINC000020042895 522671535 /nfs/dbraw/zinc/67/15/35/522671535.db2.gz LRANFRBVIHFGLZ-XMMPIXPASA-N 0 0 357.497 5.785 40 0 FKABRN CC[C@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccc(C)cc1 ZINC000020042898 522368541 /nfs/dbraw/zinc/36/85/41/522368541.db2.gz LRANFRBVIHFGLZ-DEOSSOPVSA-N 0 0 357.497 5.785 40 0 FKABRN COc1ccc([C@@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000020043122 525131002 /nfs/dbraw/zinc/13/10/02/525131002.db2.gz JVTIIZXELNHDKM-GOSISDBHSA-N 0 0 359.469 5.095 40 0 FKABRN COc1ccc([C@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000020043125 525303620 /nfs/dbraw/zinc/30/36/20/525303620.db2.gz JVTIIZXELNHDKM-SFHVURJKSA-N 0 0 359.469 5.095 40 0 FKABRN CN(Cc1ccc(Cl)cc1)C(=O)/C=C/c1ccc(Cl)cc1Cl ZINC000020043396 523223312 /nfs/dbraw/zinc/22/33/12/523223312.db2.gz LFXBLZQJQJUFLD-WEVVVXLNSA-N 0 0 354.664 5.319 40 0 FKABRN CCc1cccc(C)c1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1 ZINC000020043672 211265893 /nfs/dbraw/zinc/26/58/93/211265893.db2.gz RURSQVBKYHDUMD-UHFFFAOYSA-N 0 0 367.470 5.151 40 0 FKABRN CC(C)C[C@@H](NC(=O)c1ccc(N2CCCCC2)cc1)c1ccccc1 ZINC000020043847 570909050 /nfs/dbraw/zinc/90/90/50/570909050.db2.gz HJXVHNYRIAYXNV-JOCHJYFZSA-N 0 0 350.506 5.194 40 0 FKABRN CC(C)C[C@H](NC(=O)c1ccc(N2CCCCC2)cc1)c1ccccc1 ZINC000020043850 570909008 /nfs/dbraw/zinc/90/90/08/570909008.db2.gz HJXVHNYRIAYXNV-QFIPXVFZSA-N 0 0 350.506 5.194 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](CC)Oc2ccc3ccccc3c2)cc1 ZINC000020044103 521282430 /nfs/dbraw/zinc/28/24/30/521282430.db2.gz UUORVCBWNZHBBD-HSZRJFAPSA-N 0 0 361.485 5.979 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](CC)Oc2ccc3ccccc3c2)cc1 ZINC000020044106 521283802 /nfs/dbraw/zinc/28/38/02/521283802.db2.gz UUORVCBWNZHBBD-QHCPKHFHSA-N 0 0 361.485 5.979 40 0 FKABRN CCSc1ccccc1NC(=O)CSCc1ccccc1Cl ZINC000020044305 521775282 /nfs/dbraw/zinc/77/52/82/521775282.db2.gz GKAUJRJATLRAFK-UHFFFAOYSA-N 0 0 351.924 5.324 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000020044314 523048204 /nfs/dbraw/zinc/04/82/04/523048204.db2.gz VWWXMADHFHOVDZ-OAQYLSRUSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000020044318 522880465 /nfs/dbraw/zinc/88/04/65/522880465.db2.gz VWWXMADHFHOVDZ-NRFANRHFSA-N 0 0 361.441 5.583 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)N2c3ccccc3Sc3ccccc32)c(C)c1 ZINC000020044415 570908945 /nfs/dbraw/zinc/90/89/45/570908945.db2.gz KTTNNIYXFJPNKD-QGZVFWFLSA-N 0 0 374.509 6.377 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)N2c3ccccc3Sc3ccccc32)c(C)c1 ZINC000020044418 570909117 /nfs/dbraw/zinc/90/91/17/570909117.db2.gz KTTNNIYXFJPNKD-KRWDZBQOSA-N 0 0 374.509 6.377 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1cccc(Cl)c1Cl ZINC000020044828 570908980 /nfs/dbraw/zinc/90/89/80/570908980.db2.gz QKJGLFYNBCHGIT-CYBMUJFWSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)Nc1cccc(Cl)c1Cl ZINC000020044831 570908935 /nfs/dbraw/zinc/90/89/35/570908935.db2.gz QKJGLFYNBCHGIT-ZDUSSCGKSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000020045381 570908977 /nfs/dbraw/zinc/90/89/77/570908977.db2.gz JZWQYKOSNNKZSH-MRXNPFEDSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000020045384 570909015 /nfs/dbraw/zinc/90/90/15/570909015.db2.gz JZWQYKOSNNKZSH-INIZCTEOSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)NCc1ccc(Cl)cc1Cl ZINC000020045881 523050154 /nfs/dbraw/zinc/05/01/54/523050154.db2.gz PCQVRRFLDWTGBK-QGZVFWFLSA-N 0 0 366.288 5.084 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)NCc1ccc(Cl)cc1Cl ZINC000020045885 522883859 /nfs/dbraw/zinc/88/38/59/522883859.db2.gz PCQVRRFLDWTGBK-KRWDZBQOSA-N 0 0 366.288 5.084 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000020046767 523054146 /nfs/dbraw/zinc/05/41/46/523054146.db2.gz IMSGKNIMRNROPT-GOSISDBHSA-N 0 0 369.848 5.298 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000020046769 522888723 /nfs/dbraw/zinc/88/87/23/522888723.db2.gz IMSGKNIMRNROPT-SFHVURJKSA-N 0 0 369.848 5.298 40 0 FKABRN CN(Cc1ccc(Cl)cc1)C(=O)CCSc1ccc(Cl)cc1 ZINC000020047009 523224354 /nfs/dbraw/zinc/22/43/54/523224354.db2.gz GFWFJBWAZDZKAF-UHFFFAOYSA-N 0 0 354.302 5.134 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000020047877 521925057 /nfs/dbraw/zinc/92/50/57/521925057.db2.gz VFMRFLAZKJDETI-CYFREDJKSA-N 0 0 373.496 5.231 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000020047880 521925045 /nfs/dbraw/zinc/92/50/45/521925045.db2.gz VFMRFLAZKJDETI-DVECYGJZSA-N 0 0 373.496 5.231 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000020047883 521925331 /nfs/dbraw/zinc/92/53/31/521925331.db2.gz VFMRFLAZKJDETI-YADARESESA-N 0 0 373.496 5.231 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000020047886 521924835 /nfs/dbraw/zinc/92/48/35/521924835.db2.gz VFMRFLAZKJDETI-NTKDMRAZSA-N 0 0 373.496 5.231 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(OC(C)C)c1 ZINC000020048038 523055584 /nfs/dbraw/zinc/05/55/84/523055584.db2.gz BVBAZKFPLCIYAJ-OAQYLSRUSA-N 0 0 363.457 5.423 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(OC(C)C)c1 ZINC000020048041 522888494 /nfs/dbraw/zinc/88/84/94/522888494.db2.gz BVBAZKFPLCIYAJ-NRFANRHFSA-N 0 0 363.457 5.423 40 0 FKABRN Cc1cccc(NC(=O)c2ccc(CN3CCCc4ccccc43)cc2)c1 ZINC000020048179 132894528 /nfs/dbraw/zinc/89/45/28/132894528.db2.gz QMHSFIFPROGGBV-UHFFFAOYSA-N 0 0 356.469 5.200 40 0 FKABRN CC(C)C[C@@H](NC(=O)CSCc1ccccc1Cl)c1ccccc1 ZINC000020048789 519239706 /nfs/dbraw/zinc/23/97/06/519239706.db2.gz PQXWLGKXVWWCGN-LJQANCHMSA-N 0 0 361.938 5.477 40 0 FKABRN CC(C)C[C@H](NC(=O)CSCc1ccccc1Cl)c1ccccc1 ZINC000020048792 519384759 /nfs/dbraw/zinc/38/47/59/519384759.db2.gz PQXWLGKXVWWCGN-IBGZPJMESA-N 0 0 361.938 5.477 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000020049008 570909563 /nfs/dbraw/zinc/90/95/63/570909563.db2.gz ABWHCDNTBIIDHL-OAHLLOKOSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000020049011 570909328 /nfs/dbraw/zinc/90/93/28/570909328.db2.gz ABWHCDNTBIIDHL-HNNXBMFYSA-N 0 0 371.786 5.463 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=O)c2cc3c(ccc4ccccc34)o2)cc1 ZINC000020049358 211265120 /nfs/dbraw/zinc/26/51/20/211265120.db2.gz XERIQMCVPUXIAV-OAHLLOKOSA-N 0 0 359.425 5.476 40 0 FKABRN CCOc1ccc([C@H](C)NC(=O)c2cc3c(ccc4ccccc34)o2)cc1 ZINC000020049361 211266794 /nfs/dbraw/zinc/26/67/94/211266794.db2.gz XERIQMCVPUXIAV-HNNXBMFYSA-N 0 0 359.425 5.476 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)/C=C/c2ccc(Cl)cc2)cc1 ZINC000020049578 211265996 /nfs/dbraw/zinc/26/59/96/211265996.db2.gz CATWMGGAZMPVHC-QARGNGGGSA-N 0 0 357.881 5.265 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)/C=C/c2ccc(Cl)cc2)cc1 ZINC000020049581 570909559 /nfs/dbraw/zinc/90/95/59/570909559.db2.gz CATWMGGAZMPVHC-JCRIEJSWSA-N 0 0 357.881 5.265 40 0 FKABRN CC[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(OC)cc1 ZINC000020049794 522678833 /nfs/dbraw/zinc/67/88/33/522678833.db2.gz NJSDQAASXYQIAK-GOSISDBHSA-N 0 0 363.910 5.098 40 0 FKABRN CC[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc(OC)cc1 ZINC000020049796 522377081 /nfs/dbraw/zinc/37/70/81/522377081.db2.gz NJSDQAASXYQIAK-SFHVURJKSA-N 0 0 363.910 5.098 40 0 FKABRN O=C(N[C@@H]1CCCc2ccccc21)c1ccccc1SCc1ccccc1 ZINC000020050126 526916215 /nfs/dbraw/zinc/91/62/15/526916215.db2.gz CXCVNQGCFJGKJC-JOCHJYFZSA-N 0 0 373.521 5.786 40 0 FKABRN O=C(N[C@H]1CCCc2ccccc21)c1ccccc1SCc1ccccc1 ZINC000020050128 527041872 /nfs/dbraw/zinc/04/18/72/527041872.db2.gz CXCVNQGCFJGKJC-QFIPXVFZSA-N 0 0 373.521 5.786 40 0 FKABRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)c1 ZINC000020050318 524250965 /nfs/dbraw/zinc/25/09/65/524250965.db2.gz NDBSMPAOSBQREV-TZIWHRDSSA-N 0 0 353.506 5.283 40 0 FKABRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)c1 ZINC000020050321 524251676 /nfs/dbraw/zinc/25/16/76/524251676.db2.gz NDBSMPAOSBQREV-CTNGQTDRSA-N 0 0 353.506 5.283 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)c1 ZINC000020050324 524249281 /nfs/dbraw/zinc/24/92/81/524249281.db2.gz NDBSMPAOSBQREV-PZJWPPBQSA-N 0 0 353.506 5.283 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)c1 ZINC000020050326 524250169 /nfs/dbraw/zinc/25/01/69/524250169.db2.gz NDBSMPAOSBQREV-FPOVZHCZSA-N 0 0 353.506 5.283 40 0 FKABRN O=C(CSCc1ccc(Cl)c(Cl)c1)NC1CCCCCCC1 ZINC000020050784 527022916 /nfs/dbraw/zinc/02/29/16/527022916.db2.gz JNRYTFWSINRSNS-UHFFFAOYSA-N 0 0 360.350 5.456 40 0 FKABRN Cc1ccc([C@@H](NC(=O)COc2ccc(C(C)C)cc2)c2ccccc2)cc1 ZINC000020051011 525768055 /nfs/dbraw/zinc/76/80/55/525768055.db2.gz LBUMJWQIDNKREL-VWLOTQADSA-N 0 0 373.496 5.403 40 0 FKABRN Cc1ccc([C@H](NC(=O)COc2ccc(C(C)C)cc2)c2ccccc2)cc1 ZINC000020051014 525966633 /nfs/dbraw/zinc/96/66/33/525966633.db2.gz LBUMJWQIDNKREL-RUZDIDTESA-N 0 0 373.496 5.403 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)NCCCc1ccc(C)cc1 ZINC000020104379 523054089 /nfs/dbraw/zinc/05/40/89/523054089.db2.gz UZOPWEMENBRCBE-JOCHJYFZSA-N 0 0 361.485 5.055 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)NCCCc1ccc(C)cc1 ZINC000020104381 522886627 /nfs/dbraw/zinc/88/66/27/522886627.db2.gz UZOPWEMENBRCBE-QFIPXVFZSA-N 0 0 361.485 5.055 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000020104720 211267455 /nfs/dbraw/zinc/26/74/55/211267455.db2.gz ODMYRNNIMQVGNW-OAHLLOKOSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000020104722 211268794 /nfs/dbraw/zinc/26/87/94/211268794.db2.gz ODMYRNNIMQVGNW-HNNXBMFYSA-N 0 0 358.652 5.443 40 0 FKABRN CSc1cccc(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)c1 ZINC000020104833 526134770 /nfs/dbraw/zinc/13/47/70/526134770.db2.gz AAEJEHWLQREBOJ-UHFFFAOYSA-N 0 0 374.509 5.224 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000020104998 211268946 /nfs/dbraw/zinc/26/89/46/211268946.db2.gz RQNUKOMSDPPWSQ-MRXNPFEDSA-N 0 0 370.301 5.511 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000020105000 522919963 /nfs/dbraw/zinc/91/99/63/522919963.db2.gz RQNUKOMSDPPWSQ-INIZCTEOSA-N 0 0 370.301 5.511 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](CC)c1ccc(C)cc1 ZINC000020105102 523080221 /nfs/dbraw/zinc/08/02/21/523080221.db2.gz DTRSFYDGWCQNLS-RBUKOAKNSA-N 0 0 361.938 5.787 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Sc1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000020105104 522509630 /nfs/dbraw/zinc/50/96/30/522509630.db2.gz DTRSFYDGWCQNLS-OALUTQOASA-N 0 0 361.938 5.787 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Sc1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000020105106 522757990 /nfs/dbraw/zinc/75/79/90/522757990.db2.gz DTRSFYDGWCQNLS-RTBURBONSA-N 0 0 361.938 5.787 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Sc1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000020105108 522767714 /nfs/dbraw/zinc/76/77/14/522767714.db2.gz DTRSFYDGWCQNLS-MOPGFXCFSA-N 0 0 361.938 5.787 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1c(Cl)cccc1Cl ZINC000020105266 211268929 /nfs/dbraw/zinc/26/89/29/211268929.db2.gz FDHAYDOYOFSUBV-QGZVFWFLSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1c(Cl)cccc1Cl ZINC000020105267 570909961 /nfs/dbraw/zinc/90/99/61/570909961.db2.gz FDHAYDOYOFSUBV-KRWDZBQOSA-N 0 0 374.267 5.943 40 0 FKABRN COc1cccc2cc(C(=O)N[C@@H](c3ccccc3)c3ccc(C)cc3)oc21 ZINC000020105363 570909837 /nfs/dbraw/zinc/90/98/37/570909837.db2.gz RQCLGSWKOHXHTI-QFIPXVFZSA-N 0 0 371.436 5.269 40 0 FKABRN COc1cccc2cc(C(=O)N[C@H](c3ccccc3)c3ccc(C)cc3)oc21 ZINC000020105364 207725138 /nfs/dbraw/zinc/72/51/38/207725138.db2.gz RQCLGSWKOHXHTI-JOCHJYFZSA-N 0 0 371.436 5.269 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000020105418 220313516 /nfs/dbraw/zinc/31/35/16/220313516.db2.gz LCIDOYAOKJOCTG-WWKNUYBVSA-N 0 0 363.501 5.082 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000020105420 570909873 /nfs/dbraw/zinc/90/98/73/570909873.db2.gz LCIDOYAOKJOCTG-MHZGPWMTSA-N 0 0 363.501 5.082 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc2ccccc2c1 ZINC000020105697 220312222 /nfs/dbraw/zinc/31/22/22/220312222.db2.gz MHZJVZIFKZNWDT-LJQANCHMSA-N 0 0 355.890 6.003 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc2ccccc2c1 ZINC000020105699 570909948 /nfs/dbraw/zinc/90/99/48/570909948.db2.gz MHZJVZIFKZNWDT-IBGZPJMESA-N 0 0 355.890 6.003 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000020105794 211268265 /nfs/dbraw/zinc/26/82/65/211268265.db2.gz ZMOOOPRPEOGFFH-YFZSMNHSSA-N 0 0 363.501 5.082 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)NC12CC3CC(CC(C3)C1)C2 ZINC000020105796 220312212 /nfs/dbraw/zinc/31/22/12/220312212.db2.gz ZMOOOPRPEOGFFH-IJBPVIJFSA-N 0 0 363.501 5.082 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000020105824 523046602 /nfs/dbraw/zinc/04/66/02/523046602.db2.gz CNKKFYZOZHOGLF-YCRPNKLZSA-N 0 0 351.421 5.014 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000020105826 522879022 /nfs/dbraw/zinc/87/90/22/522879022.db2.gz CNKKFYZOZHOGLF-BTYIYWSLSA-N 0 0 351.421 5.014 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000020105828 523046200 /nfs/dbraw/zinc/04/62/00/523046200.db2.gz CNKKFYZOZHOGLF-QVKFZJNVSA-N 0 0 351.421 5.014 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000020105830 522877788 /nfs/dbraw/zinc/87/77/88/522877788.db2.gz CNKKFYZOZHOGLF-VFNWGFHPSA-N 0 0 351.421 5.014 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000020105905 570909900 /nfs/dbraw/zinc/90/99/00/570909900.db2.gz XRGFYMMEDVQUFH-FQEVSTJZSA-N 0 0 370.279 5.821 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000020105907 570909970 /nfs/dbraw/zinc/90/99/70/570909970.db2.gz XRGFYMMEDVQUFH-HXUWFJFHSA-N 0 0 370.279 5.821 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000020106006 523054036 /nfs/dbraw/zinc/05/40/36/523054036.db2.gz FENZDMNUOUKVRK-PGRDOPGGSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000020106008 522885884 /nfs/dbraw/zinc/88/58/84/522885884.db2.gz FENZDMNUOUKVRK-AVRDEDQJSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000020106010 523055006 /nfs/dbraw/zinc/05/50/06/523055006.db2.gz FENZDMNUOUKVRK-XMSQKQJNSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000020106012 522889948 /nfs/dbraw/zinc/88/99/48/522889948.db2.gz FENZDMNUOUKVRK-GCJKJVERSA-N 0 0 361.485 5.491 40 0 FKABRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000020106201 524251664 /nfs/dbraw/zinc/25/16/64/524251664.db2.gz ALDDXRFFDFPDQU-RTBURBONSA-N 0 0 367.533 5.554 40 0 FKABRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000020106203 524250896 /nfs/dbraw/zinc/25/08/96/524250896.db2.gz ALDDXRFFDFPDQU-RBUKOAKNSA-N 0 0 367.533 5.554 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000020106205 524250046 /nfs/dbraw/zinc/25/00/46/524250046.db2.gz ALDDXRFFDFPDQU-MOPGFXCFSA-N 0 0 367.533 5.554 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000020106207 524249576 /nfs/dbraw/zinc/24/95/76/524249576.db2.gz ALDDXRFFDFPDQU-OALUTQOASA-N 0 0 367.533 5.554 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](C)Oc1cccc2ccccc21 ZINC000020106671 521777471 /nfs/dbraw/zinc/77/74/71/521777471.db2.gz JKXTZYPYSUDBBZ-OAHLLOKOSA-N 0 0 351.471 5.358 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](C)Oc1cccc2ccccc21 ZINC000020106673 521778783 /nfs/dbraw/zinc/77/87/83/521778783.db2.gz JKXTZYPYSUDBBZ-HNNXBMFYSA-N 0 0 351.471 5.358 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1C ZINC000020106729 220311871 /nfs/dbraw/zinc/31/18/71/220311871.db2.gz VSHNLGINHHDUTI-HXUWFJFHSA-N 0 0 353.849 5.598 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1C ZINC000020106730 570909894 /nfs/dbraw/zinc/90/98/94/570909894.db2.gz VSHNLGINHHDUTI-FQEVSTJZSA-N 0 0 353.849 5.598 40 0 FKABRN CC(C)C[C@@H](NC(=O)[C@@H](C)Oc1ccccc1C(C)C)c1ccccc1 ZINC000020106941 519243287 /nfs/dbraw/zinc/24/32/87/519243287.db2.gz BWJFDMUXQIDXLV-WIYYLYMNSA-N 0 0 353.506 5.481 40 0 FKABRN CC(C)C[C@H](NC(=O)[C@@H](C)Oc1ccccc1C(C)C)c1ccccc1 ZINC000020106943 519388833 /nfs/dbraw/zinc/38/88/33/519388833.db2.gz BWJFDMUXQIDXLV-NQIIRXRSSA-N 0 0 353.506 5.481 40 0 FKABRN CC(C)C[C@@H](NC(=O)[C@H](C)Oc1ccccc1C(C)C)c1ccccc1 ZINC000020106944 519244816 /nfs/dbraw/zinc/24/48/16/519244816.db2.gz BWJFDMUXQIDXLV-GHTZIAJQSA-N 0 0 353.506 5.481 40 0 FKABRN CC(C)C[C@H](NC(=O)[C@H](C)Oc1ccccc1C(C)C)c1ccccc1 ZINC000020106946 519390591 /nfs/dbraw/zinc/39/05/91/519390591.db2.gz BWJFDMUXQIDXLV-RXVVDRJESA-N 0 0 353.506 5.481 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)CSCc2c(Cl)cccc2Cl)cc1 ZINC000020107077 211267902 /nfs/dbraw/zinc/26/79/02/211267902.db2.gz LRTARXHXAGFRJZ-CYBMUJFWSA-N 0 0 368.329 5.412 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)CSCc2c(Cl)cccc2Cl)cc1 ZINC000020107079 220312827 /nfs/dbraw/zinc/31/28/27/220312827.db2.gz 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CC(C)Oc1ccc(CNC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000020111048 519779278 /nfs/dbraw/zinc/77/92/78/519779278.db2.gz OOQNDWAPTQOLRQ-UHFFFAOYSA-N 0 0 373.496 5.312 40 0 FKABRN Cc1ccc(CN(C)C(=O)c2ccc(CSc3ccccc3)cc2)cc1 ZINC000020111134 524381387 /nfs/dbraw/zinc/38/13/87/524381387.db2.gz QUPBAEKANOWNGA-UHFFFAOYSA-N 0 0 361.510 5.560 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000020111459 521777859 /nfs/dbraw/zinc/77/78/59/521777859.db2.gz KKTBPZWHMPRRIO-CQSZACIVSA-N 0 0 363.910 5.475 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000020111461 521777718 /nfs/dbraw/zinc/77/77/18/521777718.db2.gz KKTBPZWHMPRRIO-AWEZNQCLSA-N 0 0 363.910 5.475 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=O)/C=C/c2ccc(Cl)cc2Cl)cc1 ZINC000020111519 521216405 /nfs/dbraw/zinc/21/64/05/521216405.db2.gz XSCIFEIYUNKASR-SVTZGKHISA-N 0 0 364.272 5.283 40 0 FKABRN CCOc1ccc([C@H](C)NC(=O)/C=C/c2ccc(Cl)cc2Cl)cc1 ZINC000020111520 570910496 /nfs/dbraw/zinc/91/04/96/570910496.db2.gz 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/nfs/dbraw/zinc/22/62/44/523226244.db2.gz LVJOXVKMGCUUEK-UHFFFAOYSA-N 0 0 365.860 5.191 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2cc(-c3ccc(CO)o3)ccc2Cl)cc1 ZINC000020137631 570910947 /nfs/dbraw/zinc/91/09/47/570910947.db2.gz QEMNZEUHEXUYDK-UHFFFAOYSA-N 0 0 369.848 5.468 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccc(CO)o3)c2)cc1 ZINC000020137638 570910951 /nfs/dbraw/zinc/91/09/51/570910951.db2.gz ODHGZZDPFDVPFO-UHFFFAOYSA-N 0 0 369.848 5.468 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(-c3ccc(CO)o3)c(Cl)c2)cc1 ZINC000020137650 570910841 /nfs/dbraw/zinc/91/08/41/570910841.db2.gz SHSIQZDBHGEHNU-UHFFFAOYSA-N 0 0 369.848 5.468 40 0 FKABRN Cc1ccc(-c2ccc(CO)o2)cc1NC(=O)c1ccc(C(C)(C)C)cc1 ZINC000020137683 570910849 /nfs/dbraw/zinc/91/08/49/570910849.db2.gz ZXSWQYSSBITFJC-UHFFFAOYSA-N 0 0 363.457 5.297 40 0 FKABRN Cc1cc(NC(=O)c2ccc(C(C)(C)C)cc2)ccc1-c1ccc(CO)o1 ZINC000020137699 570910893 /nfs/dbraw/zinc/91/08/93/570910893.db2.gz IRJRNOQUQPHABG-UHFFFAOYSA-N 0 0 363.457 5.297 40 0 FKABRN O=C(Nc1cccc(-c2ccc(CO)o2)c1)c1ccc(-c2ccccc2)cc1 ZINC000020138867 527308656 /nfs/dbraw/zinc/30/86/56/527308656.db2.gz JWQOZVZTHJFGFD-UHFFFAOYSA-N 0 0 369.420 5.358 40 0 FKABRN O=C(Nc1ccc(-c2ccc(CO)o2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000020138885 220314210 /nfs/dbraw/zinc/31/42/10/220314210.db2.gz VVENAYRKIHEHPZ-UHFFFAOYSA-N 0 0 369.420 5.358 40 0 FKABRN Cc1ccc(-c2ccc(CO)o2)cc1NC(=O)c1cccc2ccccc21 ZINC000020138924 570911390 /nfs/dbraw/zinc/91/13/90/570911390.db2.gz KSHZNZRBLBBZIX-UHFFFAOYSA-N 0 0 357.409 5.153 40 0 FKABRN Cc1cc(NC(=O)c2cccc3ccccc32)ccc1-c1ccc(CO)o1 ZINC000020138941 220314230 /nfs/dbraw/zinc/31/42/30/220314230.db2.gz HSSUSBVWVOETTC-UHFFFAOYSA-N 0 0 357.409 5.153 40 0 FKABRN Cc1ccc(-c2ccc(CO)o2)cc1NC(=O)c1ccc2ccccc2c1 ZINC000020139130 570911470 /nfs/dbraw/zinc/91/14/70/570911470.db2.gz PRKYCXAVUQUIDI-UHFFFAOYSA-N 0 0 357.409 5.153 40 0 FKABRN Cc1cc(NC(=O)c2ccc3ccccc3c2)ccc1-c1ccc(CO)o1 ZINC000020139150 211268137 /nfs/dbraw/zinc/26/81/37/211268137.db2.gz NQBUJTJZDJSDJQ-UHFFFAOYSA-N 0 0 357.409 5.153 40 0 FKABRN O=C(Nc1cc(-c2ccc(CO)o2)ccc1Cl)c1cc2ccccc2o1 ZINC000020139664 570911372 /nfs/dbraw/zinc/91/13/72/570911372.db2.gz ABLLJNNSDWVXGK-UHFFFAOYSA-N 0 0 367.788 5.091 40 0 FKABRN O=C(Nc1ccc(Cl)c(-c2ccc(CO)o2)c1)c1cc2ccccc2o1 ZINC000020139668 211267319 /nfs/dbraw/zinc/26/73/19/211267319.db2.gz JNBRCLNIMGFPMW-UHFFFAOYSA-N 0 0 367.788 5.091 40 0 FKABRN O=C(Nc1ccc(-c2ccc(CO)o2)c(Cl)c1)c1cc2ccccc2o1 ZINC000020139676 570911383 /nfs/dbraw/zinc/91/13/83/570911383.db2.gz YBIUCFZJLVFNBL-UHFFFAOYSA-N 0 0 367.788 5.091 40 0 FKABRN Cc1ccc(-c2ccc(CO)o2)cc1NC(=O)/C=C/c1ccc(Cl)cc1 ZINC000020145064 220316042 /nfs/dbraw/zinc/31/60/42/220316042.db2.gz GOVOMZPLHJYKJV-VZUCSPMQSA-N 0 0 367.832 5.053 40 0 FKABRN Cc1cc(NC(=O)/C=C/c2ccc(Cl)cc2)ccc1-c1ccc(CO)o1 ZINC000020145076 211270995 /nfs/dbraw/zinc/27/09/95/211270995.db2.gz KFAAWQSKHASTCP-NYYWCZLTSA-N 0 0 367.832 5.053 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2cccc(-c3ccc(CO)o3)c2)cc1 ZINC000020145131 220315781 /nfs/dbraw/zinc/31/57/81/220315781.db2.gz YSBREKTVECQLID-MDWZMJQESA-N 0 0 361.441 5.214 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2ccc(-c3ccc(CO)o3)cc2)cc1 ZINC000020145143 263378173 /nfs/dbraw/zinc/37/81/73/263378173.db2.gz WGQQXVCMVQZZAD-LHHJGKSTSA-N 0 0 361.441 5.214 40 0 FKABRN Cc1cc2nc(-c3ccc4ccccc4c3)oc2c(Br)c1C ZINC000020156738 263379209 /nfs/dbraw/zinc/37/92/09/263379209.db2.gz HGGPWZPCTYSTJR-UHFFFAOYSA-N 0 0 352.231 6.027 40 0 FKABRN Cc1cc2nc(-c3cccc4ccccc43)oc2c(Br)c1C ZINC000020156743 210172568 /nfs/dbraw/zinc/17/25/68/210172568.db2.gz WSGJEXNAWXFSRW-UHFFFAOYSA-N 0 0 352.231 6.027 40 0 FKABRN Cc1cc2nc(-c3ccc(C(C)(C)C)cc3)oc2c(Br)c1C ZINC000020156766 263378373 /nfs/dbraw/zinc/37/83/73/263378373.db2.gz WQAOHWUFDSULIT-UHFFFAOYSA-N 0 0 358.279 6.172 40 0 FKABRN Cc1cc2nc(-c3ccc(Cl)cc3Cl)oc2c(Br)c1C ZINC000020156802 263379168 /nfs/dbraw/zinc/37/91/68/263379168.db2.gz XHIZPOZJSVPFCJ-UHFFFAOYSA-N 0 0 371.061 6.181 40 0 FKABRN Cc1cc2nc(-c3cc(Cl)ccc3Cl)oc2c(Br)c1C ZINC000020156805 263379034 /nfs/dbraw/zinc/37/90/34/263379034.db2.gz FHBZOZSBMNKLJS-UHFFFAOYSA-N 0 0 371.061 6.181 40 0 FKABRN Cc1ccc(-c2nc3cc(C)c(C)c(Br)c3o2)cc1Cl ZINC000020156816 263378670 /nfs/dbraw/zinc/37/86/70/263378670.db2.gz VKKGTTCJPNXERH-UHFFFAOYSA-N 0 0 350.643 5.836 40 0 FKABRN Cc1cc2nc(-c3ccc(Cl)c(Cl)c3)oc2c(Br)c1C ZINC000020156818 263378976 /nfs/dbraw/zinc/37/89/76/263378976.db2.gz CRCANVVCZAJBAM-UHFFFAOYSA-N 0 0 371.061 6.181 40 0 FKABRN COc1ccc(-c2nc3cc(C)c(C)c(Br)c3o2)cc1Cl ZINC000020156824 570873814 /nfs/dbraw/zinc/87/38/14/570873814.db2.gz XYZGZPSXLYKTEX-UHFFFAOYSA-N 0 0 366.642 5.536 40 0 FKABRN Cc1cc2nc(-c3cc(N)ccc3Cl)oc2c(Br)c1C ZINC000020156856 570873955 /nfs/dbraw/zinc/87/39/55/570873955.db2.gz ZPEBFXPUOHLIOJ-UHFFFAOYSA-N 0 0 351.631 5.110 40 0 FKABRN Cc1cc2nc(-c3ccc(Cl)c(N)c3)oc2c(Br)c1C ZINC000020156861 263378752 /nfs/dbraw/zinc/37/87/52/263378752.db2.gz DKTIRPJTBPHUDB-UHFFFAOYSA-N 0 0 351.631 5.110 40 0 FKABRN Cc1cc2nc(-c3ccc(N)cc3Cl)oc2c(Br)c1C ZINC000020156883 263379208 /nfs/dbraw/zinc/37/92/08/263379208.db2.gz IHSIGRNPKJBZBX-UHFFFAOYSA-N 0 0 351.631 5.110 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(O)c(-c3nc4ccccc4o3)c2)cc1 ZINC000020158393 263378339 /nfs/dbraw/zinc/37/83/39/263378339.db2.gz VBKQUTGXNAVDPA-UHFFFAOYSA-N 0 0 372.424 5.576 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(-c3nc4ccccc4o3)c(O)c2)cc1 ZINC000020158456 210171536 /nfs/dbraw/zinc/17/15/36/210171536.db2.gz ZOGRDWFJKFYPLW-UHFFFAOYSA-N 0 0 372.424 5.576 40 0 FKABRN Clc1ccc(-c2ccc(CNCc3ccco3)o2)c(Br)c1 ZINC000020158501 526932391 /nfs/dbraw/zinc/93/23/91/526932391.db2.gz MCDYCCNJAUJEFD-UHFFFAOYSA-N 0 0 366.642 5.245 40 0 FKABRN FC(F)(F)c1ccc(Cl)c(-c2ccc(CNCc3ccco3)o2)c1 ZINC000020158575 527682684 /nfs/dbraw/zinc/68/26/84/527682684.db2.gz QWSVRVLIYOKNDJ-UHFFFAOYSA-N 0 0 355.743 5.502 40 0 FKABRN Cc1sc2c(c1C)CN(C1CCCCC1)CN2C(=O)c1ccccc1 ZINC000020193355 211269444 /nfs/dbraw/zinc/26/94/44/211269444.db2.gz OIAYRGVQVIEBFT-UHFFFAOYSA-N 0 0 354.519 5.118 40 0 FKABRN Cc1ccccc1CSc1n[nH]c(-c2ccc(Cl)cc2Cl)n1 ZINC000020195554 525185863 /nfs/dbraw/zinc/18/58/63/525185863.db2.gz VGCNYEVIWINPSG-UHFFFAOYSA-N 0 0 350.274 5.379 40 0 FKABRN Cc1ccc(CSc2n[nH]c(-c3ccc(Cl)cc3Cl)n2)cc1 ZINC000020195556 570913480 /nfs/dbraw/zinc/91/34/80/570913480.db2.gz YCQARULYKSYUMM-UHFFFAOYSA-N 0 0 350.274 5.379 40 0 FKABRN Clc1cccc(CSc2n[nH]c(-c3ccc(Cl)cc3Cl)n2)c1 ZINC000020195584 526977782 /nfs/dbraw/zinc/97/77/82/526977782.db2.gz JJBHFSBKIXDJGH-UHFFFAOYSA-N 0 0 370.692 5.724 40 0 FKABRN Cc1ccccc1-c1nc(SCc2c(Cl)cccc2Cl)n[nH]1 ZINC000020195657 570913098 /nfs/dbraw/zinc/91/30/98/570913098.db2.gz LSEFKKNIOCRMBD-UHFFFAOYSA-N 0 0 350.274 5.379 40 0 FKABRN Cc1ccc(Cc2nnc(SCc3cccc4ccccc43)o2)cc1C ZINC000020196846 524695041 /nfs/dbraw/zinc/69/50/41/524695041.db2.gz BFGYIXSGKQMDPK-UHFFFAOYSA-N 0 0 360.482 5.723 40 0 FKABRN Cc1cc(C)cc(OCc2nnc(SCc3ccccc3Cl)o2)c1 ZINC000020196975 524454742 /nfs/dbraw/zinc/45/47/42/524454742.db2.gz SFMCVGBRJVMNBI-UHFFFAOYSA-N 0 0 360.866 5.211 40 0 FKABRN Cc1cc(C)cc(OCc2nnc(SCc3ccc(Cl)cc3)o2)c1 ZINC000020196978 524454620 /nfs/dbraw/zinc/45/46/20/524454620.db2.gz VTVULFDRPJEQTH-UHFFFAOYSA-N 0 0 360.866 5.211 40 0 FKABRN Cc1cc(C)cc(OCc2nnc(SCc3cccc(Cl)c3)o2)c1 ZINC000020197016 524455468 /nfs/dbraw/zinc/45/54/68/524455468.db2.gz NWMMMQNDQBPMGB-UHFFFAOYSA-N 0 0 360.866 5.211 40 0 FKABRN CCc1ccc(Cc2nnc(SCc3cccc4ccccc43)o2)cc1 ZINC000020197081 523952723 /nfs/dbraw/zinc/95/27/23/523952723.db2.gz SXPIFFSRCDTUKD-UHFFFAOYSA-N 0 0 360.482 5.668 40 0 FKABRN Cc1ccc(CSCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 ZINC000020237753 571304783 /nfs/dbraw/zinc/30/47/83/571304783.db2.gz DBQFBLDGQUEGRZ-UHFFFAOYSA-N 0 0 373.827 5.539 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)N2CCC(Cc3ccccc3)CC2)c1 ZINC000020237967 571304932 /nfs/dbraw/zinc/30/49/32/571304932.db2.gz YLHXHAUFJNGNTN-UHFFFAOYSA-N 0 0 367.558 5.018 40 0 FKABRN O=C(CSCc1ccccc1Cl)NCc1ccc(Cl)cc1Cl ZINC000020238001 571305011 /nfs/dbraw/zinc/30/50/11/571305011.db2.gz NTADZISQTWIVTO-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN O=C(CSCc1ccccc1Cl)N1CCC(Cc2ccccc2)CC1 ZINC000020238027 570861664 /nfs/dbraw/zinc/86/16/64/570861664.db2.gz XEQOZKOIWGAYTA-UHFFFAOYSA-N 0 0 373.949 5.055 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)NCc1ccc(Cl)cc1Cl ZINC000020238064 571305023 /nfs/dbraw/zinc/30/50/23/571305023.db2.gz AOPJBTXXLPZSPE-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)Nc1ccccc1C(F)(F)F ZINC000020238084 209612122 /nfs/dbraw/zinc/61/21/22/209612122.db2.gz SZJZIWGZHIQDGW-UHFFFAOYSA-N 0 0 359.800 5.231 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1 ZINC000020238105 263378644 /nfs/dbraw/zinc/37/86/44/263378644.db2.gz DYIPHJHRNSTNMB-UHFFFAOYSA-N 0 0 373.949 5.055 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1)NCc1ccc(Cl)cc1Cl ZINC000020238132 570861958 /nfs/dbraw/zinc/86/19/58/570861958.db2.gz JXTCZJRJDXBJRD-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000020238560 263379002 /nfs/dbraw/zinc/37/90/02/263379002.db2.gz QDWLSPQAFDNNLH-MRXNPFEDSA-N 0 0 373.949 5.302 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000020238563 263379058 /nfs/dbraw/zinc/37/90/58/263379058.db2.gz QDWLSPQAFDNNLH-INIZCTEOSA-N 0 0 373.949 5.302 40 0 FKABRN C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000020238750 571304962 /nfs/dbraw/zinc/30/49/62/571304962.db2.gz ZGLXTXMCWYZPIG-LLVKDONJSA-N 0 0 373.827 5.619 40 0 FKABRN C[C@H](SCc1ccccc1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000020238753 571304978 /nfs/dbraw/zinc/30/49/78/571304978.db2.gz ZGLXTXMCWYZPIG-NSHDSACASA-N 0 0 373.827 5.619 40 0 FKABRN O=C(c1ccc(CSc2ccccc2)cc1)N1CCc2ccccc2C1 ZINC000020238811 571304950 /nfs/dbraw/zinc/30/49/50/571304950.db2.gz FFPVDNYEJZPTLD-UHFFFAOYSA-N 0 0 359.494 5.177 40 0 FKABRN COc1ccc(C)cc1NC(=O)c1ccc(CSc2ccccc2)cc1 ZINC000020238834 263379005 /nfs/dbraw/zinc/37/90/05/263379005.db2.gz ZOYBPWUOJMWESQ-UHFFFAOYSA-N 0 0 363.482 5.548 40 0 FKABRN O=C(c1ccc(CSCc2ccccc2)cc1)N1CCc2ccccc2C1 ZINC000020238889 571304935 /nfs/dbraw/zinc/30/49/35/571304935.db2.gz PAWUMISUBCQJPX-UHFFFAOYSA-N 0 0 373.521 5.319 40 0 FKABRN Cc1ccc(CNC(=O)c2ccc(CSCc3ccccc3)cc2)cc1 ZINC000020238920 571304937 /nfs/dbraw/zinc/30/49/37/571304937.db2.gz QXRPSGBNQZRXIT-UHFFFAOYSA-N 0 0 361.510 5.358 40 0 FKABRN C[C@@H](NC(=O)c1ccc(CSCc2ccccc2)cc1)c1ccccc1 ZINC000020238926 571304953 /nfs/dbraw/zinc/30/49/53/571304953.db2.gz MJDUHJJKGGWLJR-GOSISDBHSA-N 0 0 361.510 5.611 40 0 FKABRN C[C@H](NC(=O)c1ccc(CSCc2ccccc2)cc1)c1ccccc1 ZINC000020238929 571304933 /nfs/dbraw/zinc/30/49/33/571304933.db2.gz MJDUHJJKGGWLJR-SFHVURJKSA-N 0 0 361.510 5.611 40 0 FKABRN CC(C)C(NC(=O)c1ccc(CSCc2ccccc2)cc1)C(C)C ZINC000020238950 570861895 /nfs/dbraw/zinc/86/18/95/570861895.db2.gz YVAODMFBZHPLBE-UHFFFAOYSA-N 0 0 355.547 5.530 40 0 FKABRN O=C(Nc1ccc(F)cc1)c1ccc(CSCc2ccccc2)cc1 ZINC000020238953 263378909 /nfs/dbraw/zinc/37/89/09/263378909.db2.gz ZZLUWTCXQJHCPS-UHFFFAOYSA-N 0 0 351.446 5.511 40 0 FKABRN O=C(NCCSCc1cccc(Cl)c1)c1ccc(Cl)cc1Cl ZINC000020240011 263379175 /nfs/dbraw/zinc/37/91/75/263379175.db2.gz OXKJJECGPNADNB-UHFFFAOYSA-N 0 0 374.720 5.310 40 0 FKABRN O=C(/C=C/c1ccccc1Cl)NCCSCc1ccccc1Cl ZINC000020240050 263378665 /nfs/dbraw/zinc/37/86/65/263378665.db2.gz KZPACPQDPPEAMM-MDZDMXLPSA-N 0 0 366.313 5.056 40 0 FKABRN O=C(/C=C/c1ccccc1Cl)NCCSCc1cccc(Cl)c1 ZINC000020240053 570862491 /nfs/dbraw/zinc/86/24/91/570862491.db2.gz UTMPMQJHLFNOOR-CMDGGOBGSA-N 0 0 366.313 5.056 40 0 FKABRN O=C(/C=C/c1ccccc1Cl)NCCSCc1ccc(Cl)cc1 ZINC000020240056 570862457 /nfs/dbraw/zinc/86/24/57/570862457.db2.gz ANQKSHFAIMFCCY-JXMROGBWSA-N 0 0 366.313 5.056 40 0 FKABRN CC(C)Oc1cccc(NC(=O)/C(=C/c2ccccc2)c2ccccc2)c1 ZINC000020241935 571304929 /nfs/dbraw/zinc/30/49/29/571304929.db2.gz SGSVFEJTYNDLQH-XQNSMLJCSA-N 0 0 357.453 5.653 40 0 FKABRN C[C@@H](Sc1ccccc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000020242057 571304976 /nfs/dbraw/zinc/30/49/76/571304976.db2.gz DSKHPJYXQLNIFF-SNVBAGLBSA-N 0 0 359.800 5.478 40 0 FKABRN C[C@H](Sc1ccccc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000020242059 571305015 /nfs/dbraw/zinc/30/50/15/571305015.db2.gz DSKHPJYXQLNIFF-JTQLQIEISA-N 0 0 359.800 5.478 40 0 FKABRN Cc1ccccc1NC(=O)Nc1ccccc1C(=O)Nc1ccccc1C ZINC000020246642 263379599 /nfs/dbraw/zinc/37/95/99/263379599.db2.gz KYNYCEXEHXKVBA-UHFFFAOYSA-N 0 0 359.429 5.200 40 0 FKABRN Cc1ccc(CN2CN(c3ccccc3)C(=S)N(c3ccccc3)C2)cc1 ZINC000020374893 132896002 /nfs/dbraw/zinc/89/60/02/132896002.db2.gz SMWLFQFCUZERKY-UHFFFAOYSA-N 0 0 373.525 5.024 40 0 FKABRN C[C@@H]1CCCC[C@@H]1N1CN(c2ccccc2)C(=S)N(c2ccccc2)C1 ZINC000020374907 132895882 /nfs/dbraw/zinc/89/58/82/132895882.db2.gz XDQUFZGDZXHXFK-NQIIRXRSSA-N 0 0 365.546 5.094 40 0 FKABRN C[C@H]1CCCC[C@@H]1N1CN(c2ccccc2)C(=S)N(c2ccccc2)C1 ZINC000020374911 570881426 /nfs/dbraw/zinc/88/14/26/570881426.db2.gz XDQUFZGDZXHXFK-RXVVDRJESA-N 0 0 365.546 5.094 40 0 FKABRN C[C@@H]1CCCC[C@H]1N1CN(c2ccccc2)C(=S)N(c2ccccc2)C1 ZINC000020374915 570881185 /nfs/dbraw/zinc/88/11/85/570881185.db2.gz XDQUFZGDZXHXFK-WIYYLYMNSA-N 0 0 365.546 5.094 40 0 FKABRN C[C@H]1CCCC[C@H]1N1CN(c2ccccc2)C(=S)N(c2ccccc2)C1 ZINC000020374919 570881268 /nfs/dbraw/zinc/88/12/68/570881268.db2.gz XDQUFZGDZXHXFK-GHTZIAJQSA-N 0 0 365.546 5.094 40 0 FKABRN CCCCn1c2c(-c3ccccc3)sc(=S)n2c2ccccc2c1=O ZINC000020378501 220324176 /nfs/dbraw/zinc/32/41/76/220324176.db2.gz OQHBADKAWCXKTG-UHFFFAOYSA-N 0 0 366.511 5.512 40 0 FKABRN CCCn1c2c(-c3ccccc3)sc(=S)n2c2ccccc2c1=O ZINC000020378510 571329016 /nfs/dbraw/zinc/32/90/16/571329016.db2.gz KZTGDWJQFBPVTP-UHFFFAOYSA-N 0 0 352.484 5.122 40 0 FKABRN CCn1c2c(-c3ccc(C)cc3)sc(=S)n2c2ccccc2c1=O ZINC000020378598 571328979 /nfs/dbraw/zinc/32/89/79/571328979.db2.gz VENQARTWWOGPGG-UHFFFAOYSA-N 0 0 352.484 5.041 40 0 FKABRN CCCn1c2c(-c3ccc(C)cc3)sc(=S)n2c2ccccc2c1=O ZINC000020378602 220323953 /nfs/dbraw/zinc/32/39/53/220323953.db2.gz UILDGXQUORMCNT-UHFFFAOYSA-N 0 0 366.511 5.431 40 0 FKABRN Cc1ccc(-c2sc(=S)n3c2n(C(C)C)c(=O)c2ccccc23)cc1 ZINC000020378610 211276348 /nfs/dbraw/zinc/27/63/48/211276348.db2.gz OZCBYVADEHGKBZ-UHFFFAOYSA-N 0 0 366.511 5.602 40 0 FKABRN CCn1c2c(-c3cccc(C)c3)sc(=S)n2c2ccccc2c1=O ZINC000020378654 571328973 /nfs/dbraw/zinc/32/89/73/571328973.db2.gz YNCVYDJJYJSEHG-UHFFFAOYSA-N 0 0 352.484 5.041 40 0 FKABRN CCCn1c2c(-c3cccc(C)c3)sc(=S)n2c2ccccc2c1=O ZINC000020378658 220323872 /nfs/dbraw/zinc/32/38/72/220323872.db2.gz YTBRJLHJNZRERL-UHFFFAOYSA-N 0 0 366.511 5.431 40 0 FKABRN CCn1c2c(-c3cccc(Cl)c3)sc(=S)n2c2ccccc2c1=O ZINC000020378702 571328966 /nfs/dbraw/zinc/32/89/66/571328966.db2.gz SIODFQTXFUWJNV-UHFFFAOYSA-N 0 0 372.902 5.385 40 0 FKABRN Cc1cccc(C(=O)Nc2cccc(NC(=O)c3cc4ccccc4o3)c2)c1 ZINC000020408017 220325541 /nfs/dbraw/zinc/32/55/41/220325541.db2.gz GQVFSAOTFVULFG-UHFFFAOYSA-N 0 0 370.408 5.246 40 0 FKABRN Cc1cccc(C(=O)Nc2ccc3oc(-c4ccc(C(C)C)cc4)nc3c2)c1 ZINC000020411167 206329944 /nfs/dbraw/zinc/32/99/44/206329944.db2.gz NCHACOSWROPOSQ-UHFFFAOYSA-N 0 0 370.452 6.179 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc3oc(-c4ccc(C(C)C)cc4)nc3c2)cc1 ZINC000020411168 220326157 /nfs/dbraw/zinc/32/61/57/220326157.db2.gz MSUZQKNFDUHDMR-UHFFFAOYSA-N 0 0 370.452 6.179 40 0 FKABRN CC(C)c1ccc(-c2nc3cc(NC(=O)c4ccccc4F)ccc3o2)cc1 ZINC000020411174 220326251 /nfs/dbraw/zinc/32/62/51/220326251.db2.gz KLMZZMINYSPFFU-UHFFFAOYSA-N 0 0 374.415 6.010 40 0 FKABRN CC(C)c1ccc(-c2nc3cc(NC(=O)c4cccc(F)c4)ccc3o2)cc1 ZINC000020411179 206330070 /nfs/dbraw/zinc/33/00/70/206330070.db2.gz IQBVHSNZTZGKSV-UHFFFAOYSA-N 0 0 374.415 6.010 40 0 FKABRN CC(C)c1ccc(-c2nc3cc(NC(=O)c4cccs4)ccc3o2)cc1 ZINC000020411256 220326164 /nfs/dbraw/zinc/32/61/64/220326164.db2.gz JQNGBCQMQBRYMV-UHFFFAOYSA-N 0 0 362.454 5.932 40 0 FKABRN CC(C)c1ccc(-c2nc3cc(NC(=O)/C=C/c4ccco4)ccc3o2)cc1 ZINC000020411261 206332662 /nfs/dbraw/zinc/33/26/62/206332662.db2.gz XDGXCFTYZSLKKZ-ZRDIBKRKSA-N 0 0 372.424 5.863 40 0 FKABRN CCCCCC(=O)Nc1ccc2oc(-c3ccc(OC)c(OC)c3)nc2c1 ZINC000020411968 263379722 /nfs/dbraw/zinc/37/97/22/263379722.db2.gz FPTGYEDNTSCTDT-UHFFFAOYSA-N 0 0 368.433 5.031 40 0 FKABRN Cc1cc(C)cc(C(=O)Nc2ccc(C(=O)OC3CCCCC3)cc2)c1 ZINC000020412085 220325336 /nfs/dbraw/zinc/32/53/36/220325336.db2.gz YJBRKLKDNIOWBC-UHFFFAOYSA-N 0 0 351.446 5.045 40 0 FKABRN O=C(Nc1ccc(C(=O)OC2CCCCC2)cc1)c1cccc2ccccc21 ZINC000020412142 220326123 /nfs/dbraw/zinc/32/61/23/220326123.db2.gz MIHFEJHSXRICBF-UHFFFAOYSA-N 0 0 373.452 5.582 40 0 FKABRN C(=C1C=CC=C1)c1ccc(N2N=C(c3ccccc3)C[C@H]2c2ccccc2)cc1 ZINC000020412957 206334605 /nfs/dbraw/zinc/33/46/05/206334605.db2.gz NMFNSRVZQCRWRG-MHZLTWQESA-N 0 0 374.487 6.552 40 0 FKABRN C(=C1C=CC=C1)c1ccc(N2N=C(c3ccccc3)C[C@@H]2c2ccccc2)cc1 ZINC000020412959 220326009 /nfs/dbraw/zinc/32/60/09/220326009.db2.gz NMFNSRVZQCRWRG-HHHXNRCGSA-N 0 0 374.487 6.552 40 0 FKABRN CCOc1ccc(CCC(=O)Nc2ccc(C(C)C)cc2)cc1OCC ZINC000020450126 204724833 /nfs/dbraw/zinc/72/48/33/204724833.db2.gz ZRCZDPSJGVMDFM-UHFFFAOYSA-N 0 0 355.478 5.179 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc(Cl)c1C ZINC000020450205 204724520 /nfs/dbraw/zinc/72/45/20/204724520.db2.gz IEALCOGTGUTOGW-MRXNPFEDSA-N 0 0 354.302 5.811 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc(Cl)c1C ZINC000020450206 570916460 /nfs/dbraw/zinc/91/64/60/570916460.db2.gz IEALCOGTGUTOGW-INIZCTEOSA-N 0 0 354.302 5.811 40 0 FKABRN CC(C)(C)c1ccc(C(=O)c2cccc(NC(=O)Nc3ccccc3)c2)cc1 ZINC000020450281 263380042 /nfs/dbraw/zinc/38/00/42/263380042.db2.gz UCAISKNDVAYSSE-UHFFFAOYSA-N 0 0 372.468 5.859 40 0 FKABRN COc1cc2ccccc2cc1C(=O)NCCSc1ccc(Cl)cc1 ZINC000020451131 523062133 /nfs/dbraw/zinc/06/21/33/523062133.db2.gz TUOVHAHWNVLWFR-UHFFFAOYSA-N 0 0 371.889 5.024 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)N[C@@H](CC(C)C)c1ccc(OC)cc1 ZINC000020451613 523058888 /nfs/dbraw/zinc/05/88/88/523058888.db2.gz UWFWMYMIOQJDBM-LEWJYISDSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N[C@@H](CC(C)C)c1ccc(OC)cc1 ZINC000020451615 522895409 /nfs/dbraw/zinc/89/54/09/522895409.db2.gz UWFWMYMIOQJDBM-SFTDATJTSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)N[C@H](CC(C)C)c1ccc(OC)cc1 ZINC000020451617 523059744 /nfs/dbraw/zinc/05/97/44/523059744.db2.gz UWFWMYMIOQJDBM-NHCUHLMSSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N[C@H](CC(C)C)c1ccc(OC)cc1 ZINC000020451619 522894760 /nfs/dbraw/zinc/89/47/60/522894760.db2.gz UWFWMYMIOQJDBM-RTWAWAEBSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(OC)cc1 ZINC000020451693 263380951 /nfs/dbraw/zinc/38/09/51/263380951.db2.gz FVIAOANOXXJRMP-ZZKIFARHSA-N 0 0 351.490 5.273 40 0 FKABRN CC[C@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(OC)cc1 ZINC000020451695 570916531 /nfs/dbraw/zinc/91/65/31/570916531.db2.gz FVIAOANOXXJRMP-JUALLIRVSA-N 0 0 351.490 5.273 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000020451746 570916692 /nfs/dbraw/zinc/91/66/92/570916692.db2.gz BCZREDWVXKKKMO-JTQLQIEISA-N 0 0 356.274 5.121 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000020451748 570916480 /nfs/dbraw/zinc/91/64/80/570916480.db2.gz BCZREDWVXKKKMO-SNVBAGLBSA-N 0 0 356.274 5.121 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)COc1ccc(C(C)C)cc1)c1ccccc1 ZINC000020451837 525369030 /nfs/dbraw/zinc/36/90/30/525369030.db2.gz IUFGRNCPTRPKOQ-VWLOTQADSA-N 0 0 373.496 5.403 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)COc1ccc(C(C)C)cc1)c1ccccc1 ZINC000020451839 525425566 /nfs/dbraw/zinc/42/55/66/525425566.db2.gz IUFGRNCPTRPKOQ-RUZDIDTESA-N 0 0 373.496 5.403 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000020452101 211281455 /nfs/dbraw/zinc/28/14/55/211281455.db2.gz RFHDYLORNUPXCU-CQSZACIVSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000020452103 570916541 /nfs/dbraw/zinc/91/65/41/570916541.db2.gz RFHDYLORNUPXCU-AWEZNQCLSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1c(C)cccc1C(C)C ZINC000020452143 570916667 /nfs/dbraw/zinc/91/66/67/570916667.db2.gz CPDQVRDQGYEPEF-GOSISDBHSA-N 0 0 361.938 6.281 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1c(C)cccc1C(C)C ZINC000020452145 570916635 /nfs/dbraw/zinc/91/66/35/570916635.db2.gz CPDQVRDQGYEPEF-SFHVURJKSA-N 0 0 361.938 6.281 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2ccc(CN3CCCc4ccccc43)cc2)c1 ZINC000020452160 570916537 /nfs/dbraw/zinc/91/65/37/570916537.db2.gz MSDMRMSGRLKYEG-UHFFFAOYSA-N 0 0 370.496 5.509 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000020452397 523040553 /nfs/dbraw/zinc/04/05/53/523040553.db2.gz HKXPYPWAXWTFMC-QGZVFWFLSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000020452399 522871115 /nfs/dbraw/zinc/87/11/15/522871115.db2.gz HKXPYPWAXWTFMC-KRWDZBQOSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@@H](NC(=O)c1ccc(CN2CCc3ccccc32)cc1)c1ccccc1 ZINC000020452475 522783714 /nfs/dbraw/zinc/78/37/14/522783714.db2.gz LJYHIHBENPOXEL-HSZRJFAPSA-N 0 0 370.496 5.130 40 0 FKABRN CC[C@H](NC(=O)c1ccc(CN2CCc3ccccc32)cc1)c1ccccc1 ZINC000020452477 522532119 /nfs/dbraw/zinc/53/21/19/522532119.db2.gz LJYHIHBENPOXEL-QHCPKHFHSA-N 0 0 370.496 5.130 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](CC)Oc2cccc3ccccc32)cc1 ZINC000020453507 521281806 /nfs/dbraw/zinc/28/18/06/521281806.db2.gz SWUNPDJDBVUCDO-JOCHJYFZSA-N 0 0 361.485 5.979 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](CC)Oc2cccc3ccccc32)cc1 ZINC000020453509 521284693 /nfs/dbraw/zinc/28/46/93/521284693.db2.gz SWUNPDJDBVUCDO-QFIPXVFZSA-N 0 0 361.485 5.979 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000020453645 523035552 /nfs/dbraw/zinc/03/55/52/523035552.db2.gz VMBAYMCLWUABRM-LEWJYISDSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000020453647 522867253 /nfs/dbraw/zinc/86/72/53/522867253.db2.gz VMBAYMCLWUABRM-SFTDATJTSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000020453649 523038620 /nfs/dbraw/zinc/03/86/20/523038620.db2.gz VMBAYMCLWUABRM-NHCUHLMSSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000020453651 522867054 /nfs/dbraw/zinc/86/70/54/522867054.db2.gz VMBAYMCLWUABRM-RTWAWAEBSA-N 0 0 353.506 5.364 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)c1C ZINC000020453836 524780019 /nfs/dbraw/zinc/78/00/19/524780019.db2.gz QFZFEAJAPRQRQH-GOSISDBHSA-N 0 0 361.441 5.502 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)c1C ZINC000020453838 524773956 /nfs/dbraw/zinc/77/39/56/524773956.db2.gz QFZFEAJAPRQRQH-SFHVURJKSA-N 0 0 361.441 5.502 40 0 FKABRN CC(C)Oc1ccc(CNC(=O)/C(=C/c2ccccc2)c2ccccc2)cc1 ZINC000020453875 519779182 /nfs/dbraw/zinc/77/91/82/519779182.db2.gz NIHXSJRAXPMYFP-JJIBRWJFSA-N 0 0 371.480 5.331 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000020454162 211281460 /nfs/dbraw/zinc/28/14/60/211281460.db2.gz HZGPHJJVYJUVPD-OAHLLOKOSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000020454164 570916651 /nfs/dbraw/zinc/91/66/51/570916651.db2.gz HZGPHJJVYJUVPD-HNNXBMFYSA-N 0 0 358.652 5.443 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](CC)Sc1ccc(Cl)cc1 ZINC000020454177 521777491 /nfs/dbraw/zinc/77/74/91/521777491.db2.gz AGJGERSSAGLPGA-MRXNPFEDSA-N 0 0 365.951 5.961 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](CC)Sc1ccc(Cl)cc1 ZINC000020454179 521778972 /nfs/dbraw/zinc/77/89/72/521778972.db2.gz AGJGERSSAGLPGA-INIZCTEOSA-N 0 0 365.951 5.961 40 0 FKABRN CC(C)C[C@@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000020454246 519244711 /nfs/dbraw/zinc/24/47/11/519244711.db2.gz BCXHQMBBDNSCEZ-XMSQKQJNSA-N 0 0 367.533 5.655 40 0 FKABRN CC(C)C[C@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000020454248 519388300 /nfs/dbraw/zinc/38/83/00/519388300.db2.gz BCXHQMBBDNSCEZ-GCJKJVERSA-N 0 0 367.533 5.655 40 0 FKABRN CC(C)C[C@@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000020454250 519244759 /nfs/dbraw/zinc/24/47/59/519244759.db2.gz BCXHQMBBDNSCEZ-PGRDOPGGSA-N 0 0 367.533 5.655 40 0 FKABRN CC(C)C[C@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000020454252 519390624 /nfs/dbraw/zinc/39/06/24/519390624.db2.gz BCXHQMBBDNSCEZ-AVRDEDQJSA-N 0 0 367.533 5.655 40 0 FKABRN CN(C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)C1CCCCC1 ZINC000020454281 523932705 /nfs/dbraw/zinc/93/27/05/523932705.db2.gz ZSFUTHVNFXZZCF-UHFFFAOYSA-N 0 0 373.949 6.037 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(Cl)c1C ZINC000020454653 523046855 /nfs/dbraw/zinc/04/68/55/523046855.db2.gz FBIYOUUZBPMLJJ-HXUWFJFHSA-N 0 0 353.849 5.598 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc(Cl)c1C ZINC000020454655 211281500 /nfs/dbraw/zinc/28/15/00/211281500.db2.gz FBIYOUUZBPMLJJ-FQEVSTJZSA-N 0 0 353.849 5.598 40 0 FKABRN CN(C(=O)/C(=C/c1ccccc1Cl)c1ccccc1)C1CCCCC1 ZINC000020454662 263380584 /nfs/dbraw/zinc/38/05/84/263380584.db2.gz VDCSNXXPIPALCN-CAPFRKAQSA-N 0 0 353.893 5.672 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccccc1C(F)(F)F ZINC000020454870 570916470 /nfs/dbraw/zinc/91/64/70/570916470.db2.gz APZYXWXMTFEJRK-OAHLLOKOSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccccc1C(F)(F)F ZINC000020454872 570916544 /nfs/dbraw/zinc/91/65/44/570916544.db2.gz APZYXWXMTFEJRK-HNNXBMFYSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@@H](Oc1ccc(F)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000020455025 523042351 /nfs/dbraw/zinc/04/23/51/523042351.db2.gz BDLNKYCBFVURGJ-MGPUTAFESA-N 0 0 357.469 5.158 40 0 FKABRN CC[C@H](Oc1ccc(F)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000020455026 522874775 /nfs/dbraw/zinc/87/47/75/522874775.db2.gz BDLNKYCBFVURGJ-YWZLYKJASA-N 0 0 357.469 5.158 40 0 FKABRN CC[C@@H](Oc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000020455027 523042024 /nfs/dbraw/zinc/04/20/24/523042024.db2.gz BDLNKYCBFVURGJ-FOIQADDNSA-N 0 0 357.469 5.158 40 0 FKABRN CC[C@H](Oc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000020455029 522874788 /nfs/dbraw/zinc/87/47/88/522874788.db2.gz BDLNKYCBFVURGJ-QRWLVFNGSA-N 0 0 357.469 5.158 40 0 FKABRN Cc1cc(C)cc(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)c1 ZINC000020455146 211281620 /nfs/dbraw/zinc/28/16/20/211281620.db2.gz UEENOMRRDUXXDG-UHFFFAOYSA-N 0 0 356.469 5.118 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000020455245 570916648 /nfs/dbraw/zinc/91/66/48/570916648.db2.gz UKWNDQVFMIKZTG-OAHLLOKOSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000020455247 211282176 /nfs/dbraw/zinc/28/21/76/211282176.db2.gz UKWNDQVFMIKZTG-HNNXBMFYSA-N 0 0 357.759 5.155 40 0 FKABRN C[C@@H](NC(=O)N1c2ccccc2Sc2ccccc21)c1ccc(F)cc1 ZINC000020456066 132896760 /nfs/dbraw/zinc/89/67/60/132896760.db2.gz JTKTZGREYCFSQK-CQSZACIVSA-N 0 0 364.445 5.899 40 0 FKABRN C[C@H](NC(=O)N1c2ccccc2Sc2ccccc21)c1ccc(F)cc1 ZINC000020456067 570917185 /nfs/dbraw/zinc/91/71/85/570917185.db2.gz JTKTZGREYCFSQK-AWEZNQCLSA-N 0 0 364.445 5.899 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)c2ccccc2CCc2ccccc2)c(C)c1 ZINC000020456134 525718793 /nfs/dbraw/zinc/71/87/93/525718793.db2.gz YITHMTSRXRHISR-HXUWFJFHSA-N 0 0 357.497 5.580 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)c2ccccc2CCc2ccccc2)c(C)c1 ZINC000020456135 525912363 /nfs/dbraw/zinc/91/23/63/525912363.db2.gz YITHMTSRXRHISR-FQEVSTJZSA-N 0 0 357.497 5.580 40 0 FKABRN CCOC(=O)c1cc(NC(=O)c2ccc(C(C)(C)C)cc2)ccc1Cl ZINC000020456348 263380756 /nfs/dbraw/zinc/38/07/56/263380756.db2.gz HWMVOFVKIPSRSJ-UHFFFAOYSA-N 0 0 359.853 5.067 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)c1C ZINC000020456379 524780402 /nfs/dbraw/zinc/78/04/02/524780402.db2.gz IBSSVBVQOXQCAV-GOSISDBHSA-N 0 0 361.441 5.502 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)c1C ZINC000020456380 524774421 /nfs/dbraw/zinc/77/44/21/524774421.db2.gz IBSSVBVQOXQCAV-SFHVURJKSA-N 0 0 361.441 5.502 40 0 FKABRN O=C(N[C@@H]1CCCc2ccccc21)c1ccccc1CCc1ccccc1 ZINC000020456471 570917195 /nfs/dbraw/zinc/91/71/95/570917195.db2.gz FGZVNLXNESYXQF-XMMPIXPASA-N 0 0 355.481 5.279 40 0 FKABRN O=C(N[C@H]1CCCc2ccccc21)c1ccccc1CCc1ccccc1 ZINC000020456472 570917140 /nfs/dbraw/zinc/91/71/40/570917140.db2.gz FGZVNLXNESYXQF-DEOSSOPVSA-N 0 0 355.481 5.279 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000020456637 523050671 /nfs/dbraw/zinc/05/06/71/523050671.db2.gz QMBQZPQXTIKCDR-JOCHJYFZSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000020456638 522885131 /nfs/dbraw/zinc/88/51/31/522885131.db2.gz QMBQZPQXTIKCDR-QFIPXVFZSA-N 0 0 373.496 5.367 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@@H](c1ccccc1)c1ccccc1C ZINC000020456665 521925392 /nfs/dbraw/zinc/92/53/92/521925392.db2.gz HPHQEKDRGHAPGH-CYFREDJKSA-N 0 0 373.496 5.231 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@@H](c1ccccc1)c1ccccc1C ZINC000020456666 521924072 /nfs/dbraw/zinc/92/40/72/521924072.db2.gz HPHQEKDRGHAPGH-DVECYGJZSA-N 0 0 373.496 5.231 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@H](c1ccccc1)c1ccccc1C ZINC000020456667 521925602 /nfs/dbraw/zinc/92/56/02/521925602.db2.gz HPHQEKDRGHAPGH-YADARESESA-N 0 0 373.496 5.231 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@H](c1ccccc1)c1ccccc1C ZINC000020456668 521925514 /nfs/dbraw/zinc/92/55/14/521925514.db2.gz HPHQEKDRGHAPGH-NTKDMRAZSA-N 0 0 373.496 5.231 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](CC)Sc2ccc(Cl)cc2)cc1 ZINC000020456768 521281578 /nfs/dbraw/zinc/28/15/78/521281578.db2.gz KHAYHVGLYNGNTR-LJQANCHMSA-N 0 0 361.938 6.192 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](CC)Sc2ccc(Cl)cc2)cc1 ZINC000020456769 521283401 /nfs/dbraw/zinc/28/34/01/521283401.db2.gz KHAYHVGLYNGNTR-IBGZPJMESA-N 0 0 361.938 6.192 40 0 FKABRN CN(Cc1ccc(Cl)cc1)C(=O)/C(=C/c1ccco1)c1ccccc1 ZINC000020456774 523222330 /nfs/dbraw/zinc/22/23/30/523222330.db2.gz IDUDGWOWDYRXPV-XSFVSMFZSA-N 0 0 351.833 5.132 40 0 FKABRN CC(C)C[C@@H](NC(=O)CSCc1cccc(Cl)c1)c1ccccc1 ZINC000020456781 519239914 /nfs/dbraw/zinc/23/99/14/519239914.db2.gz FTJXDGQXFCRHMK-LJQANCHMSA-N 0 0 361.938 5.477 40 0 FKABRN CC(C)C[C@H](NC(=O)CSCc1cccc(Cl)c1)c1ccccc1 ZINC000020456782 519383905 /nfs/dbraw/zinc/38/39/05/519383905.db2.gz FTJXDGQXFCRHMK-IBGZPJMESA-N 0 0 361.938 5.477 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000020456784 570916986 /nfs/dbraw/zinc/91/69/86/570916986.db2.gz QQNFAVLUDPBVSC-MRXNPFEDSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000020456785 211281185 /nfs/dbraw/zinc/28/11/85/211281185.db2.gz QQNFAVLUDPBVSC-INIZCTEOSA-N 0 0 351.368 5.118 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000020456816 570917065 /nfs/dbraw/zinc/91/70/65/570917065.db2.gz ZZBACKVQAOSJKR-JTQLQIEISA-N 0 0 372.679 5.615 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000020456817 570916967 /nfs/dbraw/zinc/91/69/67/570916967.db2.gz ZZBACKVQAOSJKR-SNVBAGLBSA-N 0 0 372.679 5.615 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)CCSc2ccccc2)cc1 ZINC000020457228 525173221 /nfs/dbraw/zinc/17/32/21/525173221.db2.gz WHLSFXOFQBIAJA-HXUWFJFHSA-N 0 0 357.519 5.081 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)CCSc2ccccc2)cc1 ZINC000020457230 525345773 /nfs/dbraw/zinc/34/57/73/525345773.db2.gz WHLSFXOFQBIAJA-FQEVSTJZSA-N 0 0 357.519 5.081 40 0 FKABRN Cc1c(Cl)cccc1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1 ZINC000020457340 211281790 /nfs/dbraw/zinc/28/17/90/211281790.db2.gz LICDDYRAHHHUEF-UHFFFAOYSA-N 0 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ZINC000020459082 527022897 /nfs/dbraw/zinc/02/28/97/527022897.db2.gz GEFKRJVSHCVRKW-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000020459157 525106345 /nfs/dbraw/zinc/10/63/45/525106345.db2.gz MHWFZQAXCBUOQA-HOTGVXAUSA-N 0 0 371.546 5.351 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000020459158 525111201 /nfs/dbraw/zinc/11/12/01/525111201.db2.gz MHWFZQAXCBUOQA-JKSUJKDBSA-N 0 0 371.546 5.351 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000020459159 525107251 /nfs/dbraw/zinc/10/72/51/525107251.db2.gz MHWFZQAXCBUOQA-CVEARBPZSA-N 0 0 371.546 5.351 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000020459161 525111988 /nfs/dbraw/zinc/11/19/88/525111988.db2.gz MHWFZQAXCBUOQA-HZPDHXFCSA-N 0 0 371.546 5.351 40 0 FKABRN COc1cc2ccccc2cc1C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000020459245 211281856 /nfs/dbraw/zinc/28/18/56/211281856.db2.gz 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ZINC000020460955 523059876 /nfs/dbraw/zinc/05/98/76/523059876.db2.gz TWZRDBXIBBARNY-ISKFKSNPSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N[C@H](c1ccccc1)c1ccccc1C ZINC000020460956 522893858 /nfs/dbraw/zinc/89/38/58/522893858.db2.gz TWZRDBXIBBARNY-LADGPHEKSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000020460982 523039691 /nfs/dbraw/zinc/03/96/91/523039691.db2.gz SDGAXYNCZRWQAC-HSZRJFAPSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000020460983 522872741 /nfs/dbraw/zinc/87/27/41/522872741.db2.gz SDGAXYNCZRWQAC-QHCPKHFHSA-N 0 0 373.496 5.367 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 ZINC000020461071 521778088 /nfs/dbraw/zinc/77/80/88/521778088.db2.gz GLVDHFRXWYLSKS-GFCCVEGCSA-N 0 0 351.924 5.571 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](C)Sc1ccc(Cl)cc1 ZINC000020461073 521778910 /nfs/dbraw/zinc/77/89/10/521778910.db2.gz GLVDHFRXWYLSKS-LBPRGKRZSA-N 0 0 351.924 5.571 40 0 FKABRN 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CC(C)(C)C(=O)Nc1ccccc1C(=O)Nc1c(Cl)cccc1Cl ZINC000020467853 220327679 /nfs/dbraw/zinc/32/76/79/220327679.db2.gz HWFXTYKXGNCZBL-UHFFFAOYSA-N 0 0 365.260 5.230 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc3c(c2)c2ccccc2n3CC)cc1 ZINC000020478747 211280665 /nfs/dbraw/zinc/28/06/65/211280665.db2.gz JUKQSMSKWZGHAH-UHFFFAOYSA-N 0 0 358.441 5.465 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3ccc(OC(C)C)cc3)ccc21 ZINC000020478827 263381750 /nfs/dbraw/zinc/38/17/50/263381750.db2.gz OBSOPTXHAAWSJQ-UHFFFAOYSA-N 0 0 372.468 5.854 40 0 FKABRN CC(C)C[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000020481155 519239894 /nfs/dbraw/zinc/23/98/94/519239894.db2.gz IOBXNODOXWMQRI-QGZVFWFLSA-N 0 0 366.288 5.276 40 0 FKABRN CC(C)C[C@H](NC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000020481157 519383673 /nfs/dbraw/zinc/38/36/73/519383673.db2.gz IOBXNODOXWMQRI-KRWDZBQOSA-N 0 0 366.288 5.276 40 0 FKABRN O=C(N[C@@H]1CCCc2ccccc21)c1ccc(CSc2ccccc2)cc1 ZINC000020481255 570917586 /nfs/dbraw/zinc/91/75/86/570917586.db2.gz QHDZZUGYTHHOHH-HSZRJFAPSA-N 0 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CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000020482824 523079876 /nfs/dbraw/zinc/07/98/76/523079876.db2.gz RCMRKIGQTXXUNB-HNAYVOBHSA-N 0 0 361.938 5.705 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000020482826 522918790 /nfs/dbraw/zinc/91/87/90/522918790.db2.gz RCMRKIGQTXXUNB-KXBFYZLASA-N 0 0 361.938 5.705 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000020482828 523080993 /nfs/dbraw/zinc/08/09/93/523080993.db2.gz RCMRKIGQTXXUNB-DNVCBOLYSA-N 0 0 361.938 5.705 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000020482830 522920263 /nfs/dbraw/zinc/92/02/63/522920263.db2.gz RCMRKIGQTXXUNB-BEFAXECRSA-N 0 0 361.938 5.705 40 0 FKABRN Cc1ccc(CN(C)C(=O)c2ccccc2SCc2ccccc2)cc1 ZINC000020484062 524382948 /nfs/dbraw/zinc/38/29/48/524382948.db2.gz SIGZSVXUBUVVGD-UHFFFAOYSA-N 0 0 361.510 5.560 40 0 FKABRN COc1cccc(O[C@@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1 ZINC000020484389 570917559 /nfs/dbraw/zinc/91/75/59/570917559.db2.gz 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Cc1cc(C)c(C)c(O[C@H](C)C(=O)NC(c2ccccc2)c2ccccc2)c1 ZINC000020491744 524251657 /nfs/dbraw/zinc/25/16/57/524251657.db2.gz DDCFWHZJOZIRBD-HXUWFJFHSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)NC(c2ccccc2)c2ccccc2)c1 ZINC000020491746 524249304 /nfs/dbraw/zinc/24/93/04/524249304.db2.gz DDCFWHZJOZIRBD-FQEVSTJZSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1ccc(CC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1 ZINC000020491894 220329301 /nfs/dbraw/zinc/32/93/01/220329301.db2.gz DIXQBPSAEXOWBW-UHFFFAOYSA-N 0 0 351.833 5.622 40 0 FKABRN C[C@@H](NC(=O)c1ccc(CN2CCCc3ccccc32)cc1)c1ccccc1 ZINC000020492009 525324224 /nfs/dbraw/zinc/32/42/24/525324224.db2.gz HNZXYPITZVDYEB-LJQANCHMSA-N 0 0 370.496 5.130 40 0 FKABRN C[C@H](NC(=O)c1ccc(CN2CCCc3ccccc32)cc1)c1ccccc1 ZINC000020492011 525211226 /nfs/dbraw/zinc/21/12/26/525211226.db2.gz HNZXYPITZVDYEB-IBGZPJMESA-N 0 0 370.496 5.130 40 0 FKABRN COc1ccc(SCC(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 ZINC000020492343 525102645 /nfs/dbraw/zinc/10/26/45/525102645.db2.gz 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/nfs/dbraw/zinc/07/46/63/525074663.db2.gz ZZUXKMLUGMGPSV-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000020492948 523080662 /nfs/dbraw/zinc/08/06/62/523080662.db2.gz NEECEUJQQHCPMD-HNAYVOBHSA-N 0 0 361.938 5.348 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000020492949 522919235 /nfs/dbraw/zinc/91/92/35/522919235.db2.gz NEECEUJQQHCPMD-KXBFYZLASA-N 0 0 361.938 5.348 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)CCc1ccccc1 ZINC000020492950 523080914 /nfs/dbraw/zinc/08/09/14/523080914.db2.gz NEECEUJQQHCPMD-DNVCBOLYSA-N 0 0 361.938 5.348 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)CCc1ccccc1 ZINC000020492951 522919419 /nfs/dbraw/zinc/91/94/19/522919419.db2.gz NEECEUJQQHCPMD-BEFAXECRSA-N 0 0 361.938 5.348 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000020493281 570918728 /nfs/dbraw/zinc/91/87/28/570918728.db2.gz TWJXKDSGEKTDRS-OAHLLOKOSA-N 0 0 374.720 6.156 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000020493282 570918680 /nfs/dbraw/zinc/91/86/80/570918680.db2.gz TWJXKDSGEKTDRS-HNNXBMFYSA-N 0 0 374.720 6.156 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000020493295 525922844 /nfs/dbraw/zinc/92/28/44/525922844.db2.gz VDHDMZJKWZHZEP-OAHLLOKOSA-N 0 0 359.897 5.063 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000020493296 525929635 /nfs/dbraw/zinc/92/96/35/525929635.db2.gz VDHDMZJKWZHZEP-HNNXBMFYSA-N 0 0 359.897 5.063 40 0 FKABRN CCOC(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)c(Cl)c1 ZINC000020493339 207740634 /nfs/dbraw/zinc/74/06/34/207740634.db2.gz BNHAWYDUAQOVIK-UHFFFAOYSA-N 0 0 359.853 5.067 40 0 FKABRN Cc1ccccc1C(=O)Nc1cccc(C(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000020493377 525064321 /nfs/dbraw/zinc/06/43/21/525064321.db2.gz JYCHXOMDKOLTGI-UHFFFAOYSA-N 0 0 371.480 5.776 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1cccc2ccccc21)c1ccc(C)cc1 ZINC000020493378 522757299 /nfs/dbraw/zinc/75/72/99/522757299.db2.gz QALVBDMHKZFCEW-FGZHOGPDSA-N 0 0 361.485 5.573 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](CC)c1ccc(C)cc1 ZINC000020493379 523054209 /nfs/dbraw/zinc/05/42/09/523054209.db2.gz QALVBDMHKZFCEW-FCHUYYIVSA-N 0 0 361.485 5.573 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1cccc2ccccc21)c1ccc(C)cc1 ZINC000020493380 522766260 /nfs/dbraw/zinc/76/62/60/522766260.db2.gz QALVBDMHKZFCEW-YADHBBJMSA-N 0 0 361.485 5.573 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1cccc2ccccc21)c1ccc(C)cc1 ZINC000020493381 522508992 /nfs/dbraw/zinc/50/89/92/522508992.db2.gz QALVBDMHKZFCEW-VXKWHMMOSA-N 0 0 361.485 5.573 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)CSCc2ccccc2C)cc1 ZINC000020493514 525175455 /nfs/dbraw/zinc/17/54/55/525175455.db2.gz ARIPYKLVXKVPMJ-OAQYLSRUSA-N 0 0 371.546 5.140 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)CSCc2ccccc2C)cc1 ZINC000020493515 525348308 /nfs/dbraw/zinc/34/83/08/525348308.db2.gz ARIPYKLVXKVPMJ-NRFANRHFSA-N 0 0 371.546 5.140 40 0 FKABRN CCSc1ccccc1NC(=O)CCSc1ccc(Cl)cc1 ZINC000020493607 521774443 /nfs/dbraw/zinc/77/44/43/521774443.db2.gz WWMZKXCMNCDFTL-UHFFFAOYSA-N 0 0 351.924 5.573 40 0 FKABRN Cc1cc(C)c(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)c(C)c1 ZINC000020493608 211283288 /nfs/dbraw/zinc/28/32/88/211283288.db2.gz GBKKRULMHJOORD-UHFFFAOYSA-N 0 0 367.470 5.205 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)CCCOc1ccccc1)c1ccccc1 ZINC000020493689 525369116 /nfs/dbraw/zinc/36/91/16/525369116.db2.gz DSOWPACCSDARKZ-DEOSSOPVSA-N 0 0 359.469 5.060 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)CCCOc1ccccc1)c1ccccc1 ZINC000020493690 525423138 /nfs/dbraw/zinc/42/31/38/525423138.db2.gz DSOWPACCSDARKZ-XMMPIXPASA-N 0 0 359.469 5.060 40 0 FKABRN O=C(N[C@@H]1CCCc2ccccc21)/C(=C/c1ccccc1)c1ccccc1 ZINC000020493755 570918832 /nfs/dbraw/zinc/91/88/32/570918832.db2.gz XGXSLKDUISRNPD-SGXRDAIWSA-N 0 0 353.465 5.421 40 0 FKABRN O=C(N[C@H]1CCCc2ccccc21)/C(=C/c1ccccc1)c1ccccc1 ZINC000020493756 570918820 /nfs/dbraw/zinc/91/88/20/570918820.db2.gz XGXSLKDUISRNPD-WLUIYZDRSA-N 0 0 353.465 5.421 40 0 FKABRN CC(C)C[C@@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000020493892 519240379 /nfs/dbraw/zinc/24/03/79/519240379.db2.gz WAEIQFQGXOGJDD-OAQYLSRUSA-N 0 0 353.506 5.267 40 0 FKABRN CC(C)C[C@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000020493894 519384296 /nfs/dbraw/zinc/38/42/96/519384296.db2.gz WAEIQFQGXOGJDD-NRFANRHFSA-N 0 0 353.506 5.267 40 0 FKABRN Cc1cccc(NC(=O)CSCc2ccc(Cl)c(Cl)c2)c1C ZINC000020494061 524602045 /nfs/dbraw/zinc/60/20/45/524602045.db2.gz IGCSBFNARKAPOX-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN CC[C@@H](NC(=O)c1ccccc1SCc1ccccc1)c1ccccc1 ZINC000020494064 522794262 /nfs/dbraw/zinc/79/42/62/522794262.db2.gz MFHLQVVYOIBZQU-OAQYLSRUSA-N 0 0 361.510 5.860 40 0 FKABRN CC[C@H](NC(=O)c1ccccc1SCc1ccccc1)c1ccccc1 ZINC000020494066 522543574 /nfs/dbraw/zinc/54/35/74/522543574.db2.gz MFHLQVVYOIBZQU-NRFANRHFSA-N 0 0 361.510 5.860 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000020494349 523055521 /nfs/dbraw/zinc/05/55/21/523055521.db2.gz UUUMTEFDDDQQFX-PGRDOPGGSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000020494353 522887196 /nfs/dbraw/zinc/88/71/96/522887196.db2.gz UUUMTEFDDDQQFX-AVRDEDQJSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)CCc1ccccc1 ZINC000020494355 523055201 /nfs/dbraw/zinc/05/52/01/523055201.db2.gz UUUMTEFDDDQQFX-XMSQKQJNSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)CCc1ccccc1 ZINC000020494359 522888674 /nfs/dbraw/zinc/88/86/74/522888674.db2.gz UUUMTEFDDDQQFX-GCJKJVERSA-N 0 0 361.485 5.135 40 0 FKABRN CSc1ccccc1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1 ZINC000020494417 211283362 /nfs/dbraw/zinc/28/33/62/211283362.db2.gz MFONUSTVJKEAAC-UHFFFAOYSA-N 0 0 371.483 5.002 40 0 FKABRN CN(Cc1ccc(Cl)cc1)C(=O)/C(=C/c1ccccc1)c1ccccc1 ZINC000020494501 523221600 /nfs/dbraw/zinc/22/16/00/523221600.db2.gz ODWBRZHCRZFSRZ-CJLVFECKSA-N 0 0 361.872 5.539 40 0 FKABRN Cc1ccc(SCC(=O)N[C@@H](c2ccccc2)c2ccccc2C)cc1 ZINC000020494551 525647723 /nfs/dbraw/zinc/64/77/23/525647723.db2.gz IKOJQQYKLOTLMF-QHCPKHFHSA-N 0 0 361.510 5.301 40 0 FKABRN Cc1ccc(SCC(=O)N[C@H](c2ccccc2)c2ccccc2C)cc1 ZINC000020494554 525647735 /nfs/dbraw/zinc/64/77/35/525647735.db2.gz IKOJQQYKLOTLMF-HSZRJFAPSA-N 0 0 361.510 5.301 40 0 FKABRN CCSc1ccccc1NC(=O)CSCc1c(F)cccc1Cl ZINC000020494815 521774785 /nfs/dbraw/zinc/77/47/85/521774785.db2.gz JQTYZJAIHTZEJG-UHFFFAOYSA-N 0 0 369.914 5.463 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)CCc3ccc(OC)cc3)ccc21 ZINC000020495530 211283410 /nfs/dbraw/zinc/28/34/10/211283410.db2.gz OZNVLFVZGYZTGE-UHFFFAOYSA-N 0 0 372.468 5.394 40 0 FKABRN CC(C)c1ccc(-c2nnc(NC(=O)/C=C/c3ccc(Cl)cc3)o2)cc1 ZINC000020495989 570918717 /nfs/dbraw/zinc/91/87/17/570918717.db2.gz PARPUQZLWKOWIP-LFYBBSHMSA-N 0 0 367.836 5.165 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)/C=C/c3ccc(F)cc3)ccc21 ZINC000020496587 263381558 /nfs/dbraw/zinc/38/15/58/263381558.db2.gz HCVMWPMXKPANFG-NTEUORMPSA-N 0 0 358.416 5.605 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)/C=C/c3ccc(C)cc3)ccc21 ZINC000020496631 263381543 /nfs/dbraw/zinc/38/15/43/263381543.db2.gz SFOVLASRAKAZNM-NTCAYCPXSA-N 0 0 354.453 5.775 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)/C=C/c3ccccc3OC)ccc21 ZINC000020501894 263381509 /nfs/dbraw/zinc/38/15/09/263381509.db2.gz NUZURRAHIPAVHU-NTCAYCPXSA-N 0 0 370.452 5.475 40 0 FKABRN Cc1ccc(-n2nc3ccc(NC(=O)c4ccc(C(C)C)cc4)cc3n2)cc1 ZINC000020609915 570921405 /nfs/dbraw/zinc/92/14/05/570921405.db2.gz KVYXRVSCCBMMBL-UHFFFAOYSA-N 0 0 370.456 5.105 40 0 FKABRN Cc1ccccc1C(=O)Nc1ccc2nn(-c3ccc(C(C)C)cc3)nc2c1 ZINC000020610454 570921298 /nfs/dbraw/zinc/92/12/98/570921298.db2.gz KNXUNIDKDCUBMS-UHFFFAOYSA-N 0 0 370.456 5.105 40 0 FKABRN Cc1cccc(C(=O)Nc2ccc3nn(-c4ccc(C(C)C)cc4)nc3c2)c1 ZINC000020610456 211289861 /nfs/dbraw/zinc/28/98/61/211289861.db2.gz OOOGYEVMGKRCCX-UHFFFAOYSA-N 0 0 370.456 5.105 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc3nn(-c4ccc(C(C)C)cc4)nc3c2)cc1 ZINC000020610458 220335907 /nfs/dbraw/zinc/33/59/07/220335907.db2.gz JYFMDSFRCKPIDM-UHFFFAOYSA-N 0 0 370.456 5.105 40 0 FKABRN CCCCCC(=O)Nc1ccc2nn(-c3ccc(C(C)C)cc3)nc2c1 ZINC000020610536 519938300 /nfs/dbraw/zinc/93/83/00/519938300.db2.gz QMCOGYDWDPEJKN-UHFFFAOYSA-N 0 0 350.466 5.063 40 0 FKABRN CC[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(OC)cc1 ZINC000020625088 211290948 /nfs/dbraw/zinc/29/09/48/211290948.db2.gz XBJURJGSEZVUDY-MRXNPFEDSA-N 0 0 368.424 5.152 40 0 FKABRN CC[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccc(OC)cc1 ZINC000020625090 570922328 /nfs/dbraw/zinc/92/23/28/570922328.db2.gz XBJURJGSEZVUDY-INIZCTEOSA-N 0 0 368.424 5.152 40 0 FKABRN CC(C)c1ccc([C@H]2Cc3c(cnn3-c3ccc(Cl)cc3)C(=O)C2)cc1 ZINC000020632750 211290828 /nfs/dbraw/zinc/29/08/28/211290828.db2.gz RFGIQPDTNQIMGK-KRWDZBQOSA-N 0 0 364.876 5.562 40 0 FKABRN CC(C)c1ccc([C@@H]2Cc3c(cnn3-c3ccc(Cl)cc3)C(=O)C2)cc1 ZINC000020632753 220337927 /nfs/dbraw/zinc/33/79/27/220337927.db2.gz RFGIQPDTNQIMGK-QGZVFWFLSA-N 0 0 364.876 5.562 40 0 FKABRN Cc1nn(-c2ccc(Cl)cc2)c2c1C(=O)C[C@@H](c1ccc(C)cc1)C2 ZINC000020632762 570922304 /nfs/dbraw/zinc/92/23/04/570922304.db2.gz SPDDCMCQHYXOMA-INIZCTEOSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2ccc(Cl)cc2)c2c1C(=O)C[C@H](c1ccc(C)cc1)C2 ZINC000020632765 220337369 /nfs/dbraw/zinc/33/73/69/220337369.db2.gz SPDDCMCQHYXOMA-MRXNPFEDSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2ccc(Cl)cc2)c2c1C(=O)C[C@H](c1ccc(Cl)cc1)C2 ZINC000020632780 570922334 /nfs/dbraw/zinc/92/23/34/570922334.db2.gz FNESPIOEBGXZBJ-CQSZACIVSA-N 0 0 371.267 5.400 40 0 FKABRN Cc1nn(-c2ccc(Cl)cc2)c2c1C(=O)C[C@@H](c1ccc(Cl)cc1)C2 ZINC000020632783 204732364 /nfs/dbraw/zinc/73/23/64/204732364.db2.gz FNESPIOEBGXZBJ-AWEZNQCLSA-N 0 0 371.267 5.400 40 0 FKABRN Cc1nn(-c2cccc(C)c2)c2c1C(=O)C[C@@H](c1ccc(C(C)C)cc1)C2 ZINC000020632869 570922173 /nfs/dbraw/zinc/92/21/73/570922173.db2.gz HAXFFVOPEKUGQN-FQEVSTJZSA-N 0 0 358.485 5.525 40 0 FKABRN Cc1nn(-c2cccc(C)c2)c2c1C(=O)C[C@H](c1ccc(C(C)C)cc1)C2 ZINC000020632872 570922287 /nfs/dbraw/zinc/92/22/87/570922287.db2.gz HAXFFVOPEKUGQN-HXUWFJFHSA-N 0 0 358.485 5.525 40 0 FKABRN Cc1nn(-c2cccc(C)c2)c2c1C(=O)C[C@@H](c1ccc(Cl)cc1)C2 ZINC000020632875 570922077 /nfs/dbraw/zinc/92/20/77/570922077.db2.gz OLGJOEDANMDRHU-INIZCTEOSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2cccc(C)c2)c2c1C(=O)C[C@H](c1ccc(Cl)cc1)C2 ZINC000020632878 207749622 /nfs/dbraw/zinc/74/96/22/207749622.db2.gz OLGJOEDANMDRHU-MRXNPFEDSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2cccc(C)c2)c2c1C(=O)C[C@@H](c1cccc(Cl)c1)C2 ZINC000020632893 570922335 /nfs/dbraw/zinc/92/23/35/570922335.db2.gz COIFOHPGGVIEDU-INIZCTEOSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2cccc(C)c2)c2c1C(=O)C[C@H](c1cccc(Cl)c1)C2 ZINC000020632896 207748328 /nfs/dbraw/zinc/74/83/28/207748328.db2.gz COIFOHPGGVIEDU-MRXNPFEDSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2ccc(C)cc2)c2c1C(=O)C[C@@H](c1ccc(C(C)C)cc1)C2 ZINC000020632991 207750093 /nfs/dbraw/zinc/75/00/93/207750093.db2.gz BYNNGUURCVJZRQ-FQEVSTJZSA-N 0 0 358.485 5.525 40 0 FKABRN Cc1nn(-c2ccc(C)cc2)c2c1C(=O)C[C@H](c1ccc(C(C)C)cc1)C2 ZINC000020632994 211291651 /nfs/dbraw/zinc/29/16/51/211291651.db2.gz BYNNGUURCVJZRQ-HXUWFJFHSA-N 0 0 358.485 5.525 40 0 FKABRN Cc1nn(-c2ccc(C)cc2)c2c1C(=O)C[C@@H](c1ccc(Cl)cc1)C2 ZINC000020633005 570922197 /nfs/dbraw/zinc/92/21/97/570922197.db2.gz AHCZRPUPWSDBBI-INIZCTEOSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2ccc(C)cc2)c2c1C(=O)C[C@H](c1ccc(Cl)cc1)C2 ZINC000020633008 211292206 /nfs/dbraw/zinc/29/22/06/211292206.db2.gz AHCZRPUPWSDBBI-MRXNPFEDSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2ccc(C)cc2)c2c1C(=O)C[C@@H](c1cccc(Cl)c1)C2 ZINC000020633023 570922141 /nfs/dbraw/zinc/92/21/41/570922141.db2.gz XQFUSIMJEMZTKN-INIZCTEOSA-N 0 0 350.849 5.055 40 0 FKABRN Cc1nn(-c2ccc(C)cc2)c2c1C(=O)C[C@H](c1cccc(Cl)c1)C2 ZINC000020633026 570922191 /nfs/dbraw/zinc/92/21/91/570922191.db2.gz XQFUSIMJEMZTKN-MRXNPFEDSA-N 0 0 350.849 5.055 40 0 FKABRN COc1ccc(-n2nc(C)c3c2C[C@H](c2ccc(C(C)C)cc2)CC3=O)cc1 ZINC000020633099 211291072 /nfs/dbraw/zinc/29/10/72/211291072.db2.gz FRMFAYQEONLEGL-IBGZPJMESA-N 0 0 374.484 5.225 40 0 FKABRN COc1ccc(-n2nc(C)c3c2C[C@@H](c2ccc(C(C)C)cc2)CC3=O)cc1 ZINC000020633102 220337175 /nfs/dbraw/zinc/33/71/75/220337175.db2.gz FRMFAYQEONLEGL-LJQANCHMSA-N 0 0 374.484 5.225 40 0 FKABRN Cc1c2c(nc3nc4ccccc4n31)C[C@H](c1ccc(C(C)C)cc1)CC2=O ZINC000020635338 570922599 /nfs/dbraw/zinc/92/25/99/570922599.db2.gz ZUNVBYVGJLBISW-SFHVURJKSA-N 0 0 369.468 5.227 40 0 FKABRN Cc1c2c(nc3nc4ccccc4n31)C[C@@H](c1ccc(C(C)C)cc1)CC2=O ZINC000020635341 570922836 /nfs/dbraw/zinc/92/28/36/570922836.db2.gz ZUNVBYVGJLBISW-GOSISDBHSA-N 0 0 369.468 5.227 40 0 FKABRN Cc1c(Cl)cccc1Nc1nn(-c2ccccc2)c2c1C(=O)CCC2 ZINC000020671868 570923245 /nfs/dbraw/zinc/92/32/45/570923245.db2.gz QTOMELLFXBQJJD-UHFFFAOYSA-N 0 0 351.837 5.097 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)CCC3)cc1Cl ZINC000020671874 211291571 /nfs/dbraw/zinc/29/15/71/211291571.db2.gz YUHMXILYPXDPCD-UHFFFAOYSA-N 0 0 351.837 5.097 40 0 FKABRN O=C1CCCc2c1c(Nc1ccc(Cl)c(Cl)c1)nn2-c1ccccc1 ZINC000020671877 220337930 /nfs/dbraw/zinc/33/79/30/220337930.db2.gz HVYDVGPZEMXWPF-UHFFFAOYSA-N 0 0 372.255 5.442 40 0 FKABRN O=C1CCCc2c1c(Nc1cc(Cl)cc(Cl)c1)nn2-c1ccccc1 ZINC000020671883 211291976 /nfs/dbraw/zinc/29/19/76/211291976.db2.gz IRJZODRAILKOGO-UHFFFAOYSA-N 0 0 372.255 5.442 40 0 FKABRN O=C1CCCc2c1c(Nc1ccc3ccccc3c1)nn2-c1ccccc1 ZINC000020671886 211292185 /nfs/dbraw/zinc/29/21/85/211292185.db2.gz RNOFWEWQZAHGPO-UHFFFAOYSA-N 0 0 353.425 5.288 40 0 FKABRN C[C@H]1Cc2c(c(Nc3ccc(Cl)cc3)nn2-c2ccccc2)C(=O)C1 ZINC000020671889 570923194 /nfs/dbraw/zinc/92/31/94/570923194.db2.gz UXIHSNIYSBRFDH-ZDUSSCGKSA-N 0 0 351.837 5.034 40 0 FKABRN C[C@@H]1Cc2c(c(Nc3ccc(Cl)cc3)nn2-c2ccccc2)C(=O)C1 ZINC000020671892 570923199 /nfs/dbraw/zinc/92/31/99/570923199.db2.gz UXIHSNIYSBRFDH-CYBMUJFWSA-N 0 0 351.837 5.034 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)C[C@@H](C)C3)c(Cl)c1 ZINC000020671913 207752264 /nfs/dbraw/zinc/75/22/64/207752264.db2.gz RJZDFSSNROLWLC-AWEZNQCLSA-N 0 0 365.864 5.343 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)C[C@H](C)C3)c(Cl)c1 ZINC000020671916 570923006 /nfs/dbraw/zinc/92/30/06/570923006.db2.gz RJZDFSSNROLWLC-CQSZACIVSA-N 0 0 365.864 5.343 40 0 FKABRN C[C@H]1Cc2c(c(Nc3cccc(Cl)c3)nn2-c2ccccc2)C(=O)C1 ZINC000020671931 211291670 /nfs/dbraw/zinc/29/16/70/211291670.db2.gz MLNMVUUDNHBHLH-ZDUSSCGKSA-N 0 0 351.837 5.034 40 0 FKABRN C[C@@H]1Cc2c(c(Nc3cccc(Cl)c3)nn2-c2ccccc2)C(=O)C1 ZINC000020671934 570922990 /nfs/dbraw/zinc/92/29/90/570922990.db2.gz MLNMVUUDNHBHLH-CYBMUJFWSA-N 0 0 351.837 5.034 40 0 FKABRN Cc1c(Cl)cccc1Nc1nn(-c2ccccc2)c2c1C(=O)C[C@@H](C)C2 ZINC000020671991 211291505 /nfs/dbraw/zinc/29/15/05/211291505.db2.gz BPBXAPMNFYLIPY-ZDUSSCGKSA-N 0 0 365.864 5.343 40 0 FKABRN Cc1c(Cl)cccc1Nc1nn(-c2ccccc2)c2c1C(=O)C[C@H](C)C2 ZINC000020671994 211291449 /nfs/dbraw/zinc/29/14/49/211291449.db2.gz BPBXAPMNFYLIPY-CYBMUJFWSA-N 0 0 365.864 5.343 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)C[C@@H](C)C3)cc1Cl ZINC000020672003 220337733 /nfs/dbraw/zinc/33/77/33/220337733.db2.gz SGVNKFBTVXRDFI-ZDUSSCGKSA-N 0 0 365.864 5.343 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)C[C@H](C)C3)cc1Cl ZINC000020672006 220337225 /nfs/dbraw/zinc/33/72/25/220337225.db2.gz SGVNKFBTVXRDFI-CYBMUJFWSA-N 0 0 365.864 5.343 40 0 FKABRN C[C@H]1Cc2c(c(Nc3ccc4ccccc4c3)nn2-c2ccccc2)C(=O)C1 ZINC000020672027 570923216 /nfs/dbraw/zinc/92/32/16/570923216.db2.gz INWWIJKUMGZHFS-INIZCTEOSA-N 0 0 367.452 5.534 40 0 FKABRN C[C@@H]1Cc2c(c(Nc3ccc4ccccc4c3)nn2-c2ccccc2)C(=O)C1 ZINC000020672030 211291951 /nfs/dbraw/zinc/29/19/51/211291951.db2.gz INWWIJKUMGZHFS-MRXNPFEDSA-N 0 0 367.452 5.534 40 0 FKABRN CC1(C)Cc2c(c(Nc3ccc(Cl)cc3)nn2-c2ccccc2)C(=O)C1 ZINC000020672033 570923036 /nfs/dbraw/zinc/92/30/36/570923036.db2.gz JGIWOVVMRYVNJU-UHFFFAOYSA-N 0 0 365.864 5.424 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)CC(C)(C)C3)c(C)c1 ZINC000020672042 220337934 /nfs/dbraw/zinc/33/79/34/220337934.db2.gz XUVVXRDDQHWANI-UHFFFAOYSA-N 0 0 359.473 5.388 40 0 FKABRN CC1(C)Cc2c(c(Nc3cccc(Cl)c3)nn2-c2ccccc2)C(=O)C1 ZINC000020672054 211291802 /nfs/dbraw/zinc/29/18/02/211291802.db2.gz OUZMBPDIRWLNPC-UHFFFAOYSA-N 0 0 365.864 5.424 40 0 FKABRN CCc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)CC(C)(C)C3)cc1 ZINC000020672063 570923189 /nfs/dbraw/zinc/92/31/89/570923189.db2.gz RTRHEZJYYMVBJK-UHFFFAOYSA-N 0 0 359.473 5.333 40 0 FKABRN CCc1ccccc1Nc1nn(-c2ccccc2)c2c1C(=O)CC(C)(C)C2 ZINC000020672078 220337642 /nfs/dbraw/zinc/33/76/42/220337642.db2.gz QLHIPZOWPOVFAG-UHFFFAOYSA-N 0 0 359.473 5.333 40 0 FKABRN Cc1cccc(Nc2nn(-c3ccccc3)c3c2C(=O)CC(C)(C)C3)c1C ZINC000020672081 220337289 /nfs/dbraw/zinc/33/72/89/220337289.db2.gz GOHDFLOTMWMAFV-UHFFFAOYSA-N 0 0 359.473 5.388 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccccc3)c3c2C(=O)CC(C)(C)C3)cc1C ZINC000020672087 570923159 /nfs/dbraw/zinc/92/31/59/570923159.db2.gz ARYNRFQQRJPJLM-UHFFFAOYSA-N 0 0 359.473 5.388 40 0 FKABRN Cc1cc(C)cc(Nc2nn(-c3ccccc3)c3c2C(=O)CC(C)(C)C3)c1 ZINC000020672096 207750516 /nfs/dbraw/zinc/75/05/16/207750516.db2.gz BLDJYURLTSIRIY-UHFFFAOYSA-N 0 0 359.473 5.388 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)CCC3)c(Cl)c1 ZINC000020672125 211291689 /nfs/dbraw/zinc/29/16/89/211291689.db2.gz GUCOHORBQXJZBS-UHFFFAOYSA-N 0 0 369.827 5.236 40 0 FKABRN Cc1c(Cl)cccc1Nc1nn(-c2ccc(F)cc2)c2c1C(=O)CCC2 ZINC000020672155 220337260 /nfs/dbraw/zinc/33/72/60/220337260.db2.gz XNOQGNVIRBGTER-UHFFFAOYSA-N 0 0 369.827 5.236 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)CCC3)cc1Cl ZINC000020672161 211292046 /nfs/dbraw/zinc/29/20/46/211292046.db2.gz NKWQTMNRRUUCLW-UHFFFAOYSA-N 0 0 369.827 5.236 40 0 FKABRN O=C1CCCc2c1c(Nc1ccc3ccccc3c1)nn2-c1ccc(F)cc1 ZINC000020672173 211291048 /nfs/dbraw/zinc/29/10/48/211291048.db2.gz XDPCPEPRXLIUNY-UHFFFAOYSA-N 0 0 371.415 5.427 40 0 FKABRN C[C@H]1Cc2c(c(Nc3ccc(Cl)cc3)nn2-c2ccc(F)cc2)C(=O)C1 ZINC000020672176 570923022 /nfs/dbraw/zinc/92/30/22/570923022.db2.gz IGSQOBDZICLFAR-LBPRGKRZSA-N 0 0 369.827 5.173 40 0 FKABRN C[C@@H]1Cc2c(c(Nc3ccc(Cl)cc3)nn2-c2ccc(F)cc2)C(=O)C1 ZINC000020672179 220337747 /nfs/dbraw/zinc/33/77/47/220337747.db2.gz IGSQOBDZICLFAR-GFCCVEGCSA-N 0 0 369.827 5.173 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@@H](C)C3)c(C)c1 ZINC000020672194 570923043 /nfs/dbraw/zinc/92/30/43/570923043.db2.gz VGRWZZIPHVCSBT-AWEZNQCLSA-N 0 0 363.436 5.137 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@H](C)C3)c(C)c1 ZINC000020672197 207750670 /nfs/dbraw/zinc/75/06/70/207750670.db2.gz VGRWZZIPHVCSBT-CQSZACIVSA-N 0 0 363.436 5.137 40 0 FKABRN C[C@H]1Cc2c(c(Nc3cccc(Cl)c3)nn2-c2ccc(F)cc2)C(=O)C1 ZINC000020672218 570922970 /nfs/dbraw/zinc/92/29/70/570922970.db2.gz YFBOHJLBOLZXKM-LBPRGKRZSA-N 0 0 369.827 5.173 40 0 FKABRN C[C@@H]1Cc2c(c(Nc3cccc(Cl)c3)nn2-c2ccc(F)cc2)C(=O)C1 ZINC000020672221 570923069 /nfs/dbraw/zinc/92/30/69/570923069.db2.gz YFBOHJLBOLZXKM-GFCCVEGCSA-N 0 0 369.827 5.173 40 0 FKABRN CCc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@H](C)C3)cc1 ZINC000020672235 220338087 /nfs/dbraw/zinc/33/80/87/220338087.db2.gz ILYKUWGWINETMX-CQSZACIVSA-N 0 0 363.436 5.082 40 0 FKABRN CCc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@@H](C)C3)cc1 ZINC000020672238 211290740 /nfs/dbraw/zinc/29/07/40/211290740.db2.gz ILYKUWGWINETMX-AWEZNQCLSA-N 0 0 363.436 5.082 40 0 FKABRN CCOc1ccc(-c2c3c(nn2-c2ccccc2)CC(C)(C)CC3=O)cc1 ZINC000020674321 570923487 /nfs/dbraw/zinc/92/34/87/570923487.db2.gz KRKXJKDXNPDUBH-UHFFFAOYSA-N 0 0 360.457 5.093 40 0 FKABRN Cc1ccccc1CSc1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000020759799 263381813 /nfs/dbraw/zinc/38/18/13/263381813.db2.gz WFQKWDIMBXWTJW-UHFFFAOYSA-N 0 0 351.258 5.644 40 0 FKABRN Cc1ccc(CSc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1 ZINC000020759802 263381483 /nfs/dbraw/zinc/38/14/83/263381483.db2.gz PXLVDKAILBVGHP-UHFFFAOYSA-N 0 0 351.258 5.644 40 0 FKABRN Clc1ccc(CSc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1 ZINC000020759806 263381882 /nfs/dbraw/zinc/38/18/82/263381882.db2.gz XCNWQCGOXXLXIN-UHFFFAOYSA-N 0 0 371.676 5.989 40 0 FKABRN Clc1ccc(-c2nc(SCc3c(Cl)cccc3Cl)n[nH]2)cc1 ZINC000020763719 263383141 /nfs/dbraw/zinc/38/31/41/263383141.db2.gz ASTSJKBEBFDPBO-UHFFFAOYSA-N 0 0 370.692 5.724 40 0 FKABRN Brc1ccc2[nH]c(SCc3cccc4ccccc43)nc2c1 ZINC000020765230 263382768 /nfs/dbraw/zinc/38/27/68/263382768.db2.gz IGGCCGPQCKXMLL-UHFFFAOYSA-N 0 0 369.287 5.771 40 0 FKABRN Clc1cccc(CSc2nc3cc(Br)ccc3[nH]2)c1 ZINC000020765363 263383184 /nfs/dbraw/zinc/38/31/84/263383184.db2.gz KSANDSWMQMVIQU-UHFFFAOYSA-N 0 0 353.672 5.271 40 0 FKABRN CCc1ccccc1Nc1nn(-c2ccc(F)cc2)c2c1C(=O)C[C@H](C)C2 ZINC000020796581 570925616 /nfs/dbraw/zinc/92/56/16/570925616.db2.gz CNPSUISKPIIVHC-CQSZACIVSA-N 0 0 363.436 5.082 40 0 FKABRN CCc1ccccc1Nc1nn(-c2ccc(F)cc2)c2c1C(=O)C[C@@H](C)C2 ZINC000020796585 211295041 /nfs/dbraw/zinc/29/50/41/211295041.db2.gz CNPSUISKPIIVHC-AWEZNQCLSA-N 0 0 363.436 5.082 40 0 FKABRN Cc1cccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@@H](C)C3)c1C ZINC000020796589 211295542 /nfs/dbraw/zinc/29/55/42/211295542.db2.gz WUBINLVNDQRTNA-ZDUSSCGKSA-N 0 0 363.436 5.137 40 0 FKABRN Cc1cccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@H](C)C3)c1C ZINC000020796593 220341772 /nfs/dbraw/zinc/34/17/72/220341772.db2.gz WUBINLVNDQRTNA-CYBMUJFWSA-N 0 0 363.436 5.137 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@@H](C)C3)cc1C ZINC000020796604 570925530 /nfs/dbraw/zinc/92/55/30/570925530.db2.gz MFHPJEJTPSKEJA-ZDUSSCGKSA-N 0 0 363.436 5.137 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@H](C)C3)cc1C ZINC000020796608 211295176 /nfs/dbraw/zinc/29/51/76/211295176.db2.gz MFHPJEJTPSKEJA-CYBMUJFWSA-N 0 0 363.436 5.137 40 0 FKABRN Cc1cc(C)cc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@@H](C)C3)c1 ZINC000020796629 211295638 /nfs/dbraw/zinc/29/56/38/211295638.db2.gz DHOFXVCQWSNQLU-HNNXBMFYSA-N 0 0 363.436 5.137 40 0 FKABRN Cc1cc(C)cc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)C[C@H](C)C3)c1 ZINC000020796632 220341428 /nfs/dbraw/zinc/34/14/28/220341428.db2.gz DHOFXVCQWSNQLU-OAHLLOKOSA-N 0 0 363.436 5.137 40 0 FKABRN Cc1ccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)CC(C)(C)C3)cc1 ZINC000020796659 220341401 /nfs/dbraw/zinc/34/14/01/220341401.db2.gz VRGIILFFCYBAHI-UHFFFAOYSA-N 0 0 363.436 5.219 40 0 FKABRN CC1(C)Cc2c(c(Nc3ccccc3F)nn2-c2ccc(F)cc2)C(=O)C1 ZINC000020796671 211296197 /nfs/dbraw/zinc/29/61/97/211296197.db2.gz MXEQHGPNSOJHDO-UHFFFAOYSA-N 0 0 367.399 5.049 40 0 FKABRN CC1(C)Cc2c(c(Nc3ccc(F)cc3)nn2-c2ccc(F)cc2)C(=O)C1 ZINC000020796686 211295204 /nfs/dbraw/zinc/29/52/04/211295204.db2.gz CXCVWVFUYBYXEI-UHFFFAOYSA-N 0 0 367.399 5.049 40 0 FKABRN Cc1cccc(Nc2nn(-c3ccc(F)cc3)c3c2C(=O)CC(C)(C)C3)c1 ZINC000020796697 220341479 /nfs/dbraw/zinc/34/14/79/220341479.db2.gz VQHMUGQHTYSFBB-UHFFFAOYSA-N 0 0 363.436 5.219 40 0 FKABRN Cc1ccccc1Nc1nn(-c2ccc(F)cc2)c2c1C(=O)CC(C)(C)C2 ZINC000020796705 570925580 /nfs/dbraw/zinc/92/55/80/570925580.db2.gz KWNCVDMMSUMXTR-UHFFFAOYSA-N 0 0 363.436 5.219 40 0 FKABRN O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccnc1Cl ZINC000020899698 220344012 /nfs/dbraw/zinc/34/40/12/220344012.db2.gz CUFSAOSNTBOYKN-UHFFFAOYSA-N 0 0 368.664 5.025 40 0 FKABRN Cc1ccc(NC(=O)C2=Cc3sc4c(c3CS2)CC[C@@H](C)C4)cc1C ZINC000020931593 211301678 /nfs/dbraw/zinc/30/16/78/211301678.db2.gz MXAFRKRTVYKPPZ-GFCCVEGCSA-N 0 0 369.555 5.716 40 0 FKABRN Cc1ccc(NC(=O)C2=Cc3sc4c(c3CS2)CC[C@H](C)C4)cc1C ZINC000020931599 220345622 /nfs/dbraw/zinc/34/56/22/220345622.db2.gz MXAFRKRTVYKPPZ-LBPRGKRZSA-N 0 0 369.555 5.716 40 0 FKABRN CC(C)CC(=O)Nc1ccc2oc(-c3ccc(-c4ccccc4)cc3)nc2c1 ZINC000020969729 263383002 /nfs/dbraw/zinc/38/30/02/263383002.db2.gz WSNWOUXLZWWIAC-UHFFFAOYSA-N 0 0 370.452 6.146 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccc(OC)cc4)nc3c2)cc1 ZINC000020971279 263382672 /nfs/dbraw/zinc/38/26/72/263382672.db2.gz YSFULFBZZDNYTI-UHFFFAOYSA-N 0 0 372.424 5.318 40 0 FKABRN CCCCC(=O)Nc1ccc2oc(-c3ccc(-c4ccccc4)cc3)nc2c1 ZINC000020971695 263383148 /nfs/dbraw/zinc/38/31/48/263383148.db2.gz LBVGAUNRSDBAKZ-UHFFFAOYSA-N 0 0 370.452 6.291 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc2oc(-c3cccc(Br)c3)nc2c1 ZINC000020973540 263382337 /nfs/dbraw/zinc/38/23/37/263382337.db2.gz HZIABFIDXXJEAK-UHFFFAOYSA-N 0 0 373.250 5.242 40 0 FKABRN CCCCCC(=O)Nc1cc2nn(-c3ccc(C(C)C)cc3)nc2cc1C ZINC000020976039 263382677 /nfs/dbraw/zinc/38/26/77/263382677.db2.gz SOAUHLJGYCCBTO-UHFFFAOYSA-N 0 0 364.493 5.371 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc2oc(-c3ccc(-c4ccccc4)cc3)nc2c1 ZINC000020977693 263382907 /nfs/dbraw/zinc/38/29/07/263382907.db2.gz LMYWELBOWQXUFP-UHFFFAOYSA-N 0 0 370.452 6.146 40 0 FKABRN Cc1cc(NC(=O)C(C)(C)C)cc(-c2nc3cc(C(C)C)ccc3o2)c1O ZINC000020980391 570884834 /nfs/dbraw/zinc/88/48/34/570884834.db2.gz HOUUWPXTXSOCTI-UHFFFAOYSA-N 0 0 366.461 5.617 40 0 FKABRN Cc1nn2c(nccc2-c2ccc(-c3ccccc3)cc2)c1-c1ccccc1 ZINC000021005819 570927675 /nfs/dbraw/zinc/92/76/75/570927675.db2.gz QIFHJAFCVSWXCF-UHFFFAOYSA-N 0 0 361.448 6.039 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)COc1ccc(C2CCCCC2)cc1 ZINC000021023921 263383088 /nfs/dbraw/zinc/38/30/88/263383088.db2.gz MAHLLBDUVVWDTD-UHFFFAOYSA-N 0 0 373.880 5.414 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)Nc2cccc(Cl)c2Cl)cc1 ZINC000021116750 211306859 /nfs/dbraw/zinc/30/68/59/211306859.db2.gz XOPRSLMWLHRBRR-JTQLQIEISA-N 0 0 356.274 5.121 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)Nc2cccc(Cl)c2Cl)cc1 ZINC000021116753 570928417 /nfs/dbraw/zinc/92/84/17/570928417.db2.gz XOPRSLMWLHRBRR-SNVBAGLBSA-N 0 0 356.274 5.121 40 0 FKABRN Cc1ccc2[nH]c(-c3ccc(NC(=O)c4ccccc4Cl)cc3)nc2c1 ZINC000021141816 207766204 /nfs/dbraw/zinc/76/62/04/207766204.db2.gz HRQSDWAJTNHPNS-UHFFFAOYSA-N 0 0 361.832 5.444 40 0 FKABRN Brc1ccc(-c2nnc(SC/C=C/c3ccccc3)o2)cc1 ZINC000021176570 211311870 /nfs/dbraw/zinc/31/18/70/211311870.db2.gz MHDVEIHWYLTGHY-QPJJXVBHSA-N 0 0 373.275 5.305 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2c(C)cccc2C)cc1OCC ZINC000021247414 220356561 /nfs/dbraw/zinc/35/65/61/220356561.db2.gz NSRQBXFINVUMFV-UHFFFAOYSA-N 0 0 361.869 5.397 40 0 FKABRN Oc1ccc(OCCCCCCCCCCOc2ccc(O)cc2)cc1 ZINC000021300002 211310470 /nfs/dbraw/zinc/31/04/70/211310470.db2.gz HNAJEYZSISWHLH-UHFFFAOYSA-N 0 0 358.478 5.676 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC000021311853 570929341 /nfs/dbraw/zinc/92/93/41/570929341.db2.gz MJPTYUDMPBDBJK-UHFFFAOYSA-N 0 0 351.368 5.155 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021311968 570929290 /nfs/dbraw/zinc/92/92/90/570929290.db2.gz QDISLZOKLMKUCF-ZDUSSCGKSA-N 0 0 351.368 5.235 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021311973 211311057 /nfs/dbraw/zinc/31/10/57/211311057.db2.gz QDISLZOKLMKUCF-CYBMUJFWSA-N 0 0 351.368 5.235 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC000021311979 570929481 /nfs/dbraw/zinc/92/94/81/570929481.db2.gz LWOIAGFCYHLCBM-AWEZNQCLSA-N 0 0 365.395 5.543 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC000021311984 211311040 /nfs/dbraw/zinc/31/10/40/211311040.db2.gz LWOIAGFCYHLCBM-CQSZACIVSA-N 0 0 365.395 5.543 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)ccc1Cl ZINC000021311989 220356352 /nfs/dbraw/zinc/35/63/52/220356352.db2.gz QAPKAAIAILCFIR-LLVKDONJSA-N 0 0 357.759 5.073 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)ccc1Cl ZINC000021311993 220356210 /nfs/dbraw/zinc/35/62/10/220356210.db2.gz QAPKAAIAILCFIR-NSHDSACASA-N 0 0 357.759 5.073 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)cc(C)c1Cl ZINC000021311998 568105485 /nfs/dbraw/zinc/10/54/85/568105485.db2.gz QZGHIPUDNMSTSM-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)cc(C)c1Cl ZINC000021312005 571305116 /nfs/dbraw/zinc/30/51/16/571305116.db2.gz QZGHIPUDNMSTSM-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312072 211311340 /nfs/dbraw/zinc/31/13/40/211311340.db2.gz NQEYNARXLIWKQC-QGZVFWFLSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312076 204751058 /nfs/dbraw/zinc/75/10/58/204751058.db2.gz NQEYNARXLIWKQC-KRWDZBQOSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312081 570929450 /nfs/dbraw/zinc/92/94/50/570929450.db2.gz DLQGYPSYSWXGMC-QGZVFWFLSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312086 211311386 /nfs/dbraw/zinc/31/13/86/211311386.db2.gz DLQGYPSYSWXGMC-KRWDZBQOSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312093 568105474 /nfs/dbraw/zinc/10/54/74/568105474.db2.gz HKUYCUKJLRUXLX-OAHLLOKOSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312098 568105470 /nfs/dbraw/zinc/10/54/70/568105470.db2.gz HKUYCUKJLRUXLX-HNNXBMFYSA-N 0 0 357.759 5.155 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1 ZINC000021312127 211311155 /nfs/dbraw/zinc/31/11/55/211311155.db2.gz HUPUIOAGIGEMFK-QGZVFWFLSA-N 0 0 351.368 5.064 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1 ZINC000021312131 211311821 /nfs/dbraw/zinc/31/18/21/211311821.db2.gz HUPUIOAGIGEMFK-KRWDZBQOSA-N 0 0 351.368 5.064 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312158 570929567 /nfs/dbraw/zinc/92/95/67/570929567.db2.gz WSLJUZKSGQKHKD-LJQANCHMSA-N 0 0 373.374 5.655 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312163 570929408 /nfs/dbraw/zinc/92/94/08/570929408.db2.gz WSLJUZKSGQKHKD-IBGZPJMESA-N 0 0 373.374 5.655 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312243 207768129 /nfs/dbraw/zinc/76/81/29/207768129.db2.gz VKVSHZWUQXXSOM-MRXNPFEDSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312247 211311683 /nfs/dbraw/zinc/31/16/83/211311683.db2.gz VKVSHZWUQXXSOM-INIZCTEOSA-N 0 0 371.786 5.463 40 0 FKABRN CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000021312340 211310480 /nfs/dbraw/zinc/31/04/80/211310480.db2.gz RXEGLQDBQQNEEP-UHFFFAOYSA-N 0 0 357.759 5.155 40 0 FKABRN O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)NC1CCCCCCC1 ZINC000021335027 211312957 /nfs/dbraw/zinc/31/29/57/211312957.db2.gz FSRXVKGGQOOBNE-UHFFFAOYSA-N 0 0 360.885 5.157 40 0 FKABRN COc1ccc(Oc2ccc(Cl)cc2NC(=O)Cc2cccs2)cc1 ZINC000021352043 220357204 /nfs/dbraw/zinc/35/72/04/220357204.db2.gz CMSYBTWLSLOVAF-UHFFFAOYSA-N 0 0 373.861 5.384 40 0 FKABRN CCOc1ccccc1-c1nnc(SCc2cccc3ccccc32)o1 ZINC000021545574 571305180 /nfs/dbraw/zinc/30/51/80/571305180.db2.gz RRDKPBZKXWEYSQ-UHFFFAOYSA-N 0 0 362.454 5.581 40 0 FKABRN O=C(Nc1ccc(N2CCCCC2)c(F)c1)c1ccc(-c2ccccc2)o1 ZINC000021576336 568135919 /nfs/dbraw/zinc/13/59/19/568135919.db2.gz SBRQLWSPQGEEAW-UHFFFAOYSA-N 0 0 364.420 5.328 40 0 FKABRN CC(C)COc1cccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)c1 ZINC000021576348 568135886 /nfs/dbraw/zinc/13/58/86/568135886.db2.gz WMWJZZAGFGACSO-UHFFFAOYSA-N 0 0 370.468 5.103 40 0 FKABRN CC[C@@H](C)Oc1cccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)c1 ZINC000021576352 568135930 /nfs/dbraw/zinc/13/59/30/568135930.db2.gz QOHYTDNCUJVLHC-MRXNPFEDSA-N 0 0 370.468 5.246 40 0 FKABRN CC[C@H](C)Oc1cccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)c1 ZINC000021576356 568135890 /nfs/dbraw/zinc/13/58/90/568135890.db2.gz QOHYTDNCUJVLHC-INIZCTEOSA-N 0 0 370.468 5.246 40 0 FKABRN CC(C)COc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000021576360 568135894 /nfs/dbraw/zinc/13/58/94/568135894.db2.gz ZNMYETRKYTTYLM-UHFFFAOYSA-N 0 0 370.468 5.103 40 0 FKABRN CC[C@@H](C)Oc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000021576364 568135926 /nfs/dbraw/zinc/13/59/26/568135926.db2.gz NMQLVNRAVNYZDI-MRXNPFEDSA-N 0 0 370.468 5.246 40 0 FKABRN CC[C@H](C)Oc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000021576368 568135889 /nfs/dbraw/zinc/13/58/89/568135889.db2.gz NMQLVNRAVNYZDI-INIZCTEOSA-N 0 0 370.468 5.246 40 0 FKABRN O=C(CC12CC3CC(CC(C3)C1)C2)Nc1ccc(N2CCCCC2)c(F)c1 ZINC000021576806 568136002 /nfs/dbraw/zinc/13/60/02/568136002.db2.gz YVTYIPYQSSPPKV-UHFFFAOYSA-N 0 0 370.512 5.361 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000021577035 568136068 /nfs/dbraw/zinc/13/60/68/568136068.db2.gz SZDBPLAUUSUWTA-UHFFFAOYSA-N 0 0 370.468 5.247 40 0 FKABRN CCCCOc1cccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)c1 ZINC000021577047 568136087 /nfs/dbraw/zinc/13/60/87/568136087.db2.gz XENHHRZZYCHUDT-UHFFFAOYSA-N 0 0 370.468 5.247 40 0 FKABRN CC(C)(C)c1ccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000021577764 568136303 /nfs/dbraw/zinc/13/63/03/568136303.db2.gz ZBXLHKDNWACKEK-UHFFFAOYSA-N 0 0 354.469 5.366 40 0 FKABRN O=C(Nc1ccc(N2CCCCC2)c(F)c1)c1cccc(Cl)c1Cl ZINC000021577793 568136284 /nfs/dbraw/zinc/13/62/84/568136284.db2.gz JLAHSBKZUFWWPV-UHFFFAOYSA-N 0 0 367.251 5.375 40 0 FKABRN O=C(Nc1ccc(N2CCCCC2)c(F)c1)c1ccc(Cl)c(Cl)c1 ZINC000021577796 568136280 /nfs/dbraw/zinc/13/62/80/568136280.db2.gz SVHDRJJGHFSBQP-UHFFFAOYSA-N 0 0 367.251 5.375 40 0 FKABRN O=C(Nc1ccc(N2CCCCC2)c(F)c1)c1ccc(Cl)cc1Cl ZINC000021577800 568136285 /nfs/dbraw/zinc/13/62/85/568136285.db2.gz NDMHBVGHMIVTJV-UHFFFAOYSA-N 0 0 367.251 5.375 40 0 FKABRN O=C(Nc1ccc(N2CCCCC2)c(F)c1)c1cc(Cl)ccc1Cl ZINC000021577804 568136332 /nfs/dbraw/zinc/13/63/32/568136332.db2.gz CTEUNDLQBLJEPW-UHFFFAOYSA-N 0 0 367.251 5.375 40 0 FKABRN O=C(Nc1ccc(N2CCCCC2)c(F)c1)c1ccc(-c2ccccc2)cc1 ZINC000021577857 568136369 /nfs/dbraw/zinc/13/63/69/568136369.db2.gz MVAWDJWYDWADNT-UHFFFAOYSA-N 0 0 374.459 5.735 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(N2CCCCC2)c(F)c1 ZINC000021577905 568136342 /nfs/dbraw/zinc/13/63/42/568136342.db2.gz XWTVIPLHCDCGJR-IZZDOVSWSA-N 0 0 358.844 5.121 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2ccc(N3CCCCC3)c(F)c2)cc1 ZINC000021577915 568136393 /nfs/dbraw/zinc/13/63/93/568136393.db2.gz OBJXVSYVPZVCJS-MDWZMJQESA-N 0 0 366.480 5.591 40 0 FKABRN Cc1ccc(-c2nc3cc(C)c(C)cc3o2)cc1NC(=O)c1ccccc1 ZINC000021578467 568136560 /nfs/dbraw/zinc/13/65/60/568136560.db2.gz HTRZNJMCTUBUKQ-UHFFFAOYSA-N 0 0 356.425 5.672 40 0 FKABRN Cc1ccc(-c2nc3cc(C)c(C)cc3o2)cc1NC(=O)c1ccccc1C ZINC000021578472 568136514 /nfs/dbraw/zinc/13/65/14/568136514.db2.gz UYCZPIYZXLXJCL-UHFFFAOYSA-N 0 0 370.452 5.981 40 0 FKABRN Cc1cc2nc(-c3ccc(C)c(NC(=O)c4cccc(F)c4)c3)oc2cc1C ZINC000021578503 568136538 /nfs/dbraw/zinc/13/65/38/568136538.db2.gz NYQJBMPYWYIGPB-UHFFFAOYSA-N 0 0 374.415 5.811 40 0 FKABRN Cc1ccc(-c2nc3cc(C)c(C)cc3o2)cc1NC(=O)c1ccc(F)cc1 ZINC000021578516 568136608 /nfs/dbraw/zinc/13/66/08/568136608.db2.gz CCISPNULWUHDLT-UHFFFAOYSA-N 0 0 374.415 5.811 40 0 FKABRN CCCCCC(=O)Nc1cc(-c2nc3cc(C)c(C)cc3o2)ccc1C ZINC000021578613 263384040 /nfs/dbraw/zinc/38/40/40/263384040.db2.gz BLZVXKXRQDTPJF-UHFFFAOYSA-N 0 0 350.462 5.939 40 0 FKABRN COc1cccc(-c2nc3cc(NC(=O)c4ccccc4C)ccc3o2)c1 ZINC000021579011 263383671 /nfs/dbraw/zinc/38/36/71/263383671.db2.gz QDKYJOAMRDWIIJ-UHFFFAOYSA-N 0 0 358.397 5.064 40 0 FKABRN COc1cccc(-c2nc3cc(NC(=O)c4ccc(C)cc4)ccc3o2)c1 ZINC000021579015 263383781 /nfs/dbraw/zinc/38/37/81/263383781.db2.gz OLCCTNNDSYQHQY-UHFFFAOYSA-N 0 0 358.397 5.064 40 0 FKABRN COc1cccc(-c2nc3cc(NC(=O)c4ccc(C)c(C)c4)ccc3o2)c1 ZINC000021579017 263383986 /nfs/dbraw/zinc/38/39/86/263383986.db2.gz YMGMITQZDSGZAN-UHFFFAOYSA-N 0 0 372.424 5.373 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4cccc(OC)c4)nc3c2)cc1 ZINC000021579021 263384015 /nfs/dbraw/zinc/38/40/15/263384015.db2.gz VHPIZLZNQTVORL-UHFFFAOYSA-N 0 0 372.424 5.318 40 0 FKABRN COc1ccc(-c2nc3ccccc3[nH]2)cc1NC(=O)c1ccc(C)c(C)c1 ZINC000021580243 263383994 /nfs/dbraw/zinc/38/39/94/263383994.db2.gz SARBZHRMTYPGPC-UHFFFAOYSA-N 0 0 371.440 5.108 40 0 FKABRN COc1ccc(-c2nc3ccccc3[nH]2)cc1NC(=O)c1cc(C)cc(C)c1 ZINC000021580247 263383958 /nfs/dbraw/zinc/38/39/58/263383958.db2.gz FDVASXFATAZZKK-UHFFFAOYSA-N 0 0 371.440 5.108 40 0 FKABRN CCc1ccc(C(=O)Nc2cc(-c3nc4ccccc4[nH]3)ccc2OC)cc1 ZINC000021580250 263383950 /nfs/dbraw/zinc/38/39/50/263383950.db2.gz TWOZDNSEFMMBMP-UHFFFAOYSA-N 0 0 371.440 5.053 40 0 FKABRN Cc1ccc(C(=O)Nc2cc(NC(=O)c3ccco3)ccc2C)c(Cl)c1 ZINC000021595371 263383884 /nfs/dbraw/zinc/38/38/84/263383884.db2.gz RQIQPDPRRRGWIQ-UHFFFAOYSA-N 0 0 368.820 5.054 40 0 FKABRN CC(C)(C)c1ccc(OC(C)(C)C(=O)Nc2ccc(F)c(Cl)c2)cc1 ZINC000021595832 263384055 /nfs/dbraw/zinc/38/40/55/263384055.db2.gz LLSLSTLPUQIPAA-UHFFFAOYSA-N 0 0 363.860 5.573 40 0 FKABRN CC(C)(C)c1ccc(OC(C)(C)C(=O)Nc2nc3ccccc3s2)cc1 ZINC000021595905 263383873 /nfs/dbraw/zinc/38/38/73/263383873.db2.gz UBEPEYVZYUVZCO-UHFFFAOYSA-N 0 0 368.502 5.390 40 0 FKABRN Cc1ccc(-c2ccc(/C=C/C(=O)Nc3cccnc3Cl)o2)cc1Cl ZINC000021595935 263383962 /nfs/dbraw/zinc/38/39/62/263383962.db2.gz WTGGCOYIXUOJJT-VQHVLOKHSA-N 0 0 373.239 5.609 40 0 FKABRN COc1c(Cl)cc(C(=O)Nc2cccc3nc(C)ccc32)cc1Cl ZINC000021596069 263383807 /nfs/dbraw/zinc/38/38/07/263383807.db2.gz HKWYTKVNUKHQHP-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN CCCCn1nc(NC(=O)c2ccccc2C)c2cc3cc(C)ccc3nc21 ZINC000021596590 570931216 /nfs/dbraw/zinc/93/12/16/570931216.db2.gz IAIAGXGQGCDLDK-UHFFFAOYSA-N 0 0 372.472 5.254 40 0 FKABRN CCCCn1nc(NC(=O)c2cccc(C)c2)c2cc3cc(C)ccc3nc21 ZINC000021596591 204754641 /nfs/dbraw/zinc/75/46/41/204754641.db2.gz ZKEUVXHLVDPIBK-UHFFFAOYSA-N 0 0 372.472 5.254 40 0 FKABRN CCCCn1nc(NC(=O)c2ccc(C)cc2)c2cc3cc(C)ccc3nc21 ZINC000021596592 204753452 /nfs/dbraw/zinc/75/34/52/204753452.db2.gz JBTXJOBFOAFCJD-UHFFFAOYSA-N 0 0 372.472 5.254 40 0 FKABRN CCCCn1nc(NC(=O)c2cccs2)c2cc3cc(C)ccc3nc21 ZINC000021596595 570931430 /nfs/dbraw/zinc/93/14/30/570931430.db2.gz OTXLFXQHQGKMCV-UHFFFAOYSA-N 0 0 364.474 5.007 40 0 FKABRN CC[C@@H](C)n1nc(NC(=O)c2ccccc2C)c2cc3cc(C)ccc3nc21 ZINC000021596598 204754227 /nfs/dbraw/zinc/75/42/27/204754227.db2.gz WAOXXRLPNLWHCJ-MRXNPFEDSA-N 0 0 372.472 5.425 40 0 FKABRN CC[C@H](C)n1nc(NC(=O)c2ccccc2C)c2cc3cc(C)ccc3nc21 ZINC000021596599 207774925 /nfs/dbraw/zinc/77/49/25/207774925.db2.gz WAOXXRLPNLWHCJ-INIZCTEOSA-N 0 0 372.472 5.425 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)Nc2ccc(Br)cc2F)cc1 ZINC000021601518 568137916 /nfs/dbraw/zinc/13/79/16/568137916.db2.gz BAMVYVJPRMGBOA-LLVKDONJSA-N 0 0 368.271 5.016 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)Nc2ccc(Br)cc2F)cc1 ZINC000021601520 568138001 /nfs/dbraw/zinc/13/80/01/568138001.db2.gz BAMVYVJPRMGBOA-NSHDSACASA-N 0 0 368.271 5.016 40 0 FKABRN Clc1ccc(CSc2nnc(Cc3c[nH]c4ccccc34)o2)cc1 ZINC000021682015 570932810 /nfs/dbraw/zinc/93/28/10/570932810.db2.gz VKLVWLRBTDTSLS-UHFFFAOYSA-N 0 0 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371.362 5.405 40 0 FKABRN Cc1cccc(Nc2ncccc2C(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC000022053594 570938308 /nfs/dbraw/zinc/93/83/08/570938308.db2.gz XQVGCSLYVFBRNH-UHFFFAOYSA-N 0 0 371.362 5.405 40 0 FKABRN Cc1ccccc1Nc1ncccc1C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000022053599 211338530 /nfs/dbraw/zinc/33/85/30/211338530.db2.gz JRKJOHLMBLSCSC-UHFFFAOYSA-N 0 0 371.362 5.405 40 0 FKABRN O=C(Nc1ccc(C(F)(F)F)cc1)c1cccnc1NC1CCCCC1 ZINC000022053636 220375488 /nfs/dbraw/zinc/37/54/88/220375488.db2.gz VKXYZZDRQVJWTI-UHFFFAOYSA-N 0 0 363.383 5.097 40 0 FKABRN O=C(Nc1ccccc1)c1cccnc1Nc1ccc(C(F)(F)F)cc1 ZINC000022053656 220375916 /nfs/dbraw/zinc/37/59/16/220375916.db2.gz UANASTJILHLWKS-UHFFFAOYSA-N 0 0 357.335 5.096 40 0 FKABRN O=C(Nc1ccccc1)c1cccnc1Nc1ccc(Cl)c(Cl)c1 ZINC000022053698 570938271 /nfs/dbraw/zinc/93/82/71/570938271.db2.gz PHKUGVVOUSSCEO-UHFFFAOYSA-N 0 0 358.228 5.384 40 0 FKABRN Cc1ccc(NC(=O)c2cccnc2Nc2cccc(C(F)(F)F)c2)cc1 ZINC000022053750 211337216 /nfs/dbraw/zinc/33/72/16/211337216.db2.gz 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Cc1ccccc1NC(=O)c1cccnc1Nc1ccc(C(F)(F)F)cc1 ZINC000022072480 570938557 /nfs/dbraw/zinc/93/85/57/570938557.db2.gz FVDVOKRIEQHRKA-UHFFFAOYSA-N 0 0 371.362 5.405 40 0 FKABRN Cc1ccccc1NC(=O)c1cccnc1Nc1ccc(Cl)c(Cl)c1 ZINC000022072512 220376168 /nfs/dbraw/zinc/37/61/68/220376168.db2.gz ZZLZEQYYPZYRHW-UHFFFAOYSA-N 0 0 372.255 5.693 40 0 FKABRN Cc1ccccc1NC(=O)c1cccnc1Nc1ccc(F)c(Cl)c1 ZINC000022072518 570938745 /nfs/dbraw/zinc/93/87/45/570938745.db2.gz LPRFYUMEABMOIT-UHFFFAOYSA-N 0 0 355.800 5.178 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)c1cccnc1Nc1ccccc1 ZINC000022072538 207796245 /nfs/dbraw/zinc/79/62/45/207796245.db2.gz JIHQBSGJWAILFY-UHFFFAOYSA-N 0 0 358.228 5.384 40 0 FKABRN Cc1ccc(Nc2ncccc2C(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000022072541 570938772 /nfs/dbraw/zinc/93/87/72/570938772.db2.gz OIVZQZDRYBEDCM-UHFFFAOYSA-N 0 0 372.255 5.693 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)c1cccnc1NCc1ccccc1 ZINC000022072545 220375597 /nfs/dbraw/zinc/37/55/97/220375597.db2.gz UNLMHKSPIYXYQM-UHFFFAOYSA-N 0 0 372.255 5.253 40 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359.763 5.009 40 0 FKABRN Cc1cccc(Nc2ncccc2C(=O)Nc2ccc(F)c(Cl)c2)c1 ZINC000022072732 570938571 /nfs/dbraw/zinc/93/85/71/570938571.db2.gz XJJWKDSAFXDAAL-UHFFFAOYSA-N 0 0 355.800 5.178 40 0 FKABRN Cc1ccccc1Nc1ncccc1C(=O)Nc1ccc(F)c(Cl)c1 ZINC000022072734 211338515 /nfs/dbraw/zinc/33/85/15/211338515.db2.gz OPFDUFOTLOVGRL-UHFFFAOYSA-N 0 0 355.800 5.178 40 0 FKABRN O=C(Nc1ccc(F)c(Cl)c1)c1cccnc1Nc1ccccc1F ZINC000022072746 570938587 /nfs/dbraw/zinc/93/85/87/570938587.db2.gz MSAXNOUMQCSFLD-UHFFFAOYSA-N 0 0 359.763 5.009 40 0 FKABRN Cc1cccc(C)c1Nc1ncccc1C(=O)Nc1ccc(F)c(Cl)c1 ZINC000022072756 204769950 /nfs/dbraw/zinc/76/99/50/204769950.db2.gz BVEZQBXKNCUBRI-UHFFFAOYSA-N 0 0 369.827 5.487 40 0 FKABRN O=C(Nc1cccc(Cl)c1)c1cccnc1Nc1ccc(Cl)cc1 ZINC000022072782 570938756 /nfs/dbraw/zinc/93/87/56/570938756.db2.gz LCIOLTKSSOTBKN-UHFFFAOYSA-N 0 0 358.228 5.384 40 0 FKABRN O=C(Nc1cccc(Cl)c1)c1cccnc1Nc1ccccc1Cl ZINC000022072786 220375618 /nfs/dbraw/zinc/37/56/18/220375618.db2.gz ICXBORBGCHDYAJ-UHFFFAOYSA-N 0 0 358.228 5.384 40 0 FKABRN O=C(Nc1cccc(Cl)c1)c1cccnc1Nc1cccc(Cl)c1 ZINC000022072800 220375103 /nfs/dbraw/zinc/37/51/03/220375103.db2.gz LJKGDNXVRSSKOG-UHFFFAOYSA-N 0 0 358.228 5.384 40 0 FKABRN CC(C)c1ccc(Nc2ncccc2C(=O)Nc2cccc(Cl)c2)cc1 ZINC000022072808 220375184 /nfs/dbraw/zinc/37/51/84/220375184.db2.gz ZUMAJFZTDUFTRM-UHFFFAOYSA-N 0 0 365.864 5.854 40 0 FKABRN Cc1cccc(C)c1Nc1ncccc1C(=O)Nc1cccc(Cl)c1 ZINC000022072812 570938815 /nfs/dbraw/zinc/93/88/15/570938815.db2.gz KNDITELACOIBDX-UHFFFAOYSA-N 0 0 351.837 5.348 40 0 FKABRN O=C(Nc1ccccc1F)c1cccnc1Nc1ccc(F)c(Cl)c1 ZINC000022072853 570938797 /nfs/dbraw/zinc/93/87/97/570938797.db2.gz NCZFFPUFSAXWTB-UHFFFAOYSA-N 0 0 359.763 5.009 40 0 FKABRN O=C(NC1CCCCC1)c1cccnc1Nc1ccc(Cl)c(Cl)c1 ZINC000022072940 207795431 /nfs/dbraw/zinc/79/54/31/207795431.db2.gz WBYOIKZHLMPXGT-UHFFFAOYSA-N 0 0 364.276 5.195 40 0 FKABRN COc1ccc(Nc2ncccc2C(=O)Nc2ccc(C(C)C)cc2)cc1 ZINC000022072973 207795273 /nfs/dbraw/zinc/79/52/73/207795273.db2.gz HOOHGTFPRPPNMZ-UHFFFAOYSA-N 0 0 361.445 5.210 40 0 FKABRN COc1cccc(Nc2ncccc2C(=O)Nc2ccc(C(C)C)cc2)c1 ZINC000022072975 570938600 /nfs/dbraw/zinc/93/86/00/570938600.db2.gz FDEWCCDEDRQCHD-UHFFFAOYSA-N 0 0 361.445 5.210 40 0 FKABRN COc1ccccc1Nc1ncccc1C(=O)Nc1ccc(C(C)C)cc1 ZINC000022072977 220376163 /nfs/dbraw/zinc/37/61/63/220376163.db2.gz KBLRMPVZSOMXSM-UHFFFAOYSA-N 0 0 361.445 5.210 40 0 FKABRN CC(C)c1ccc(NC(=O)c2cccnc2NCCc2ccccc2)cc1 ZINC000022072981 220375417 /nfs/dbraw/zinc/37/54/17/220375417.db2.gz DOXAICAZVRKOSN-UHFFFAOYSA-N 0 0 359.473 5.112 40 0 FKABRN CC(C)c1ccc(NC(=O)c2cccnc2Nc2ccc(Cl)cc2)cc1 ZINC000022072983 570938809 /nfs/dbraw/zinc/93/88/09/570938809.db2.gz HTTOREFPALZEFN-UHFFFAOYSA-N 0 0 365.864 5.854 40 0 FKABRN CC(C)c1ccc(NC(=O)c2cccnc2Nc2ccccc2Cl)cc1 ZINC000022072987 570938823 /nfs/dbraw/zinc/93/88/23/570938823.db2.gz AMAGVRWAVPOPEH-UHFFFAOYSA-N 0 0 365.864 5.854 40 0 FKABRN CC(C)c1ccc(NC(=O)c2cccnc2Nc2cccc(Cl)c2)cc1 ZINC000022073001 207795170 /nfs/dbraw/zinc/79/51/70/207795170.db2.gz JXTRFUISFFXYEH-UHFFFAOYSA-N 0 0 365.864 5.854 40 0 FKABRN CC(C)c1ccc(NC(=O)c2cccnc2Nc2ccc(C(C)C)cc2)cc1 ZINC000022073009 220375479 /nfs/dbraw/zinc/37/54/79/220375479.db2.gz WEDHAZOGJWOZPR-UHFFFAOYSA-N 0 0 373.500 6.324 40 0 FKABRN Cc1cccc(C)c1Nc1ncccc1C(=O)Nc1ccc(C(C)C)cc1 ZINC000022073013 211337867 /nfs/dbraw/zinc/33/78/67/211337867.db2.gz CLNXIOBYADNPBT-UHFFFAOYSA-N 0 0 359.473 5.818 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1cccnc1Nc1ccc(Cl)cc1 ZINC000022073098 570938495 /nfs/dbraw/zinc/93/84/95/570938495.db2.gz FYACXZMRIXBNNE-UHFFFAOYSA-N 0 0 351.837 5.348 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1cccnc1Nc1ccccc1Cl ZINC000022073102 220375968 /nfs/dbraw/zinc/37/59/68/220375968.db2.gz CCXFUVNVSOFDRY-UHFFFAOYSA-N 0 0 351.837 5.348 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1cccnc1Nc1ccc(F)c(Cl)c1 ZINC000022073114 211338469 /nfs/dbraw/zinc/33/84/69/211338469.db2.gz CWVSFZNZFNMWGX-UHFFFAOYSA-N 0 0 369.827 5.487 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1cccnc1Nc1cccc(Cl)c1 ZINC000022073116 220376022 /nfs/dbraw/zinc/37/60/22/220376022.db2.gz FPGBARBBIJVUMJ-UHFFFAOYSA-N 0 0 351.837 5.348 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1cccnc1Nc1ccc(C(C)C)cc1 ZINC000022073124 207795537 /nfs/dbraw/zinc/79/55/37/207795537.db2.gz QLQGFOJCULYECA-UHFFFAOYSA-N 0 0 359.473 5.818 40 0 FKABRN CCOC(=O)C(/C=C(\C)CCC=C(C)C)(C(=O)OCC)C1CCCCC1 ZINC000022113133 570939902 /nfs/dbraw/zinc/93/99/02/570939902.db2.gz PBTOZILCSCTOST-FBMGVBCBSA-N 0 0 364.526 5.372 40 0 FKABRN c1cc(-c2nnc(-c3ccccc3)o2)sc1-c1nnc(-c2ccccc2)o1 ZINC000022114948 570939770 /nfs/dbraw/zinc/93/97/70/570939770.db2.gz QWKSMDGOKDTCLG-UHFFFAOYSA-N 0 0 372.409 5.182 40 0 FKABRN Cc1cc(Br)ccc1NC(=O)c1cc(Cl)cc(Cl)c1 ZINC000022150722 263384795 /nfs/dbraw/zinc/38/47/95/263384795.db2.gz VBHJAWFZVHZDSF-UHFFFAOYSA-N 0 0 359.050 5.317 40 0 FKABRN CCn1cc(C(=O)Nc2c(C)cccc2C(C)C)c(=O)c2cc(C)ccc21 ZINC000022234720 211342276 /nfs/dbraw/zinc/34/22/76/211342276.db2.gz DHWJDSNHEMPKHT-UHFFFAOYSA-N 0 0 362.473 5.014 40 0 FKABRN Cc1nc(-c2cccnc2)sc1C(=O)Nc1cc(Cl)ccc1Cl ZINC000022237499 211344838 /nfs/dbraw/zinc/34/48/38/211344838.db2.gz SZMRCJUSUIXGAD-UHFFFAOYSA-N 0 0 364.257 5.073 40 0 FKABRN Cc1nc(-c2cccnc2)sc1C(=O)Nc1c(Cl)cccc1Cl ZINC000022237501 211345314 /nfs/dbraw/zinc/34/53/14/211345314.db2.gz QEQTZTAEDPDMJQ-UHFFFAOYSA-N 0 0 364.257 5.073 40 0 FKABRN Cc1nc(-c2cccnc2)sc1C(=O)Nc1c(C)cccc1C(C)C ZINC000022237564 211343797 /nfs/dbraw/zinc/34/37/97/211343797.db2.gz VWQLFNHPDFEGJX-UHFFFAOYSA-N 0 0 351.475 5.198 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1cccc(C)c1C ZINC000022237682 570941809 /nfs/dbraw/zinc/94/18/09/570941809.db2.gz MKJVQRDDOORKFA-UHFFFAOYSA-N 0 0 351.475 5.089 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1ccc(C)cc1C ZINC000022237684 211343781 /nfs/dbraw/zinc/34/37/81/211343781.db2.gz XLJPZPHSVCXWFK-UHFFFAOYSA-N 0 0 351.475 5.089 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1cc(C)ccc1C ZINC000022237686 204773230 /nfs/dbraw/zinc/77/32/30/204773230.db2.gz WAKJNQYZQUNMOY-UHFFFAOYSA-N 0 0 351.475 5.089 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1c(C)cccc1C ZINC000022237688 570941828 /nfs/dbraw/zinc/94/18/28/570941828.db2.gz YQPVOKKPXUSQSN-UHFFFAOYSA-N 0 0 351.475 5.089 40 0 FKABRN CCc1cccc(C)c1NC(=O)c1sc(N(C)c2ccccc2)nc1C ZINC000022237691 220380095 /nfs/dbraw/zinc/38/00/95/220380095.db2.gz UDUJTTHSYBQZGJ-UHFFFAOYSA-N 0 0 365.502 5.343 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1ccc(C)c(C)c1 ZINC000022237694 211343726 /nfs/dbraw/zinc/34/37/26/211343726.db2.gz AXDJBZDJMKTPHY-UHFFFAOYSA-N 0 0 351.475 5.089 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1cc(C)cc(C)c1 ZINC000022237696 211344499 /nfs/dbraw/zinc/34/44/99/211344499.db2.gz JGWLRVPAVMJSOL-UHFFFAOYSA-N 0 0 351.475 5.089 40 0 FKABRN CCc1ccccc1NC(=O)c1sc(N(C)c2ccccc2)nc1C ZINC000022237697 204772510 /nfs/dbraw/zinc/77/25/10/204772510.db2.gz OEXNXAOTBKHACU-UHFFFAOYSA-N 0 0 351.475 5.034 40 0 FKABRN CCc1ccc(NC(=O)c2sc(N(C)c3ccccc3)nc2C)cc1 ZINC000022237698 570941678 /nfs/dbraw/zinc/94/16/78/570941678.db2.gz CLUQQSPSMPXNFZ-UHFFFAOYSA-N 0 0 351.475 5.034 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1ccc(C(C)C)cc1 ZINC000022237699 211344454 /nfs/dbraw/zinc/34/44/54/211344454.db2.gz IFGNYOJPWWNTLO-UHFFFAOYSA-N 0 0 365.502 5.595 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1cccc2ccccc21 ZINC000022237701 570941706 /nfs/dbraw/zinc/94/17/06/570941706.db2.gz NOFMZJLKZZXRTD-UHFFFAOYSA-N 0 0 373.481 5.625 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1ccccc1Cl ZINC000022237709 211344906 /nfs/dbraw/zinc/34/49/06/211344906.db2.gz VDLVLPKTPILPPA-UHFFFAOYSA-N 0 0 357.866 5.125 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1cccc(Cl)c1 ZINC000022237710 211344535 /nfs/dbraw/zinc/34/45/35/211344535.db2.gz LZTVTHXTLRVNAV-UHFFFAOYSA-N 0 0 357.866 5.125 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1ccc(Cl)cc1 ZINC000022237712 220379712 /nfs/dbraw/zinc/37/97/12/220379712.db2.gz YCLIWQWLHKUSSS-UHFFFAOYSA-N 0 0 357.866 5.125 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1cccc(Cl)c1C ZINC000022237723 211344696 /nfs/dbraw/zinc/34/46/96/211344696.db2.gz DAGSOARPURKQIQ-UHFFFAOYSA-N 0 0 371.893 5.434 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1ccc(Cl)cc1C ZINC000022237724 570941838 /nfs/dbraw/zinc/94/18/38/570941838.db2.gz GLXBVBJIQREOIS-UHFFFAOYSA-N 0 0 371.893 5.434 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1cc(Cl)ccc1C ZINC000022237726 570941871 /nfs/dbraw/zinc/94/18/71/570941871.db2.gz YVLJQJMCFHMZOW-UHFFFAOYSA-N 0 0 371.893 5.434 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1ccc(C)c(Cl)c1 ZINC000022237727 220380224 /nfs/dbraw/zinc/38/02/24/220380224.db2.gz BUOKPWJDCFAQHE-UHFFFAOYSA-N 0 0 371.893 5.434 40 0 FKABRN CSc1cccc(NC(=O)c2sc(N(C)c3ccccc3)nc2C)c1 ZINC000022245353 220379656 /nfs/dbraw/zinc/37/96/56/220379656.db2.gz ZRTCFQHRHWMEGA-UHFFFAOYSA-N 0 0 369.515 5.194 40 0 FKABRN CSc1ccccc1NC(=O)c1sc(N(C)c2ccccc2)nc1C ZINC000022245475 204773889 /nfs/dbraw/zinc/77/38/89/204773889.db2.gz ALNPLECTJSTXQB-UHFFFAOYSA-N 0 0 369.515 5.194 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)Nc1c(C)cc(C)cc1C ZINC000022245485 220379540 /nfs/dbraw/zinc/37/95/40/220379540.db2.gz JQOPPWNYXNXZCY-UHFFFAOYSA-N 0 0 365.502 5.397 40 0 FKABRN Cc1nc(N(C)c2ccccc2)sc1C(=O)NC1CCCCCCC1 ZINC000022245534 204773898 /nfs/dbraw/zinc/77/38/98/204773898.db2.gz ZWOYCPOCCWJIKX-UHFFFAOYSA-N 0 0 357.523 5.062 40 0 FKABRN Cc1nc(Nc2ccc(F)cc2)sc1C(=O)Nc1c(C)cccc1C ZINC000022245755 220379739 /nfs/dbraw/zinc/37/97/39/220379739.db2.gz HVMJBNULHNNZKR-UHFFFAOYSA-N 0 0 355.438 5.203 40 0 FKABRN CCc1cccc(C)c1NC(=O)c1sc(Nc2ccc(F)cc2)nc1C ZINC000022245758 211343830 /nfs/dbraw/zinc/34/38/30/211343830.db2.gz OPYGLZUCFJOEAP-UHFFFAOYSA-N 0 0 369.465 5.457 40 0 FKABRN CCc1ccccc1NC(=O)c1sc(Nc2ccc(F)cc2)nc1C ZINC000022245767 220380077 /nfs/dbraw/zinc/38/00/77/220380077.db2.gz AKHXRTIOXXZZRH-UHFFFAOYSA-N 0 0 355.438 5.149 40 0 FKABRN Cc1nc(Nc2ccc(F)cc2)sc1C(=O)Nc1ccccc1Cl ZINC000022245789 570941880 /nfs/dbraw/zinc/94/18/80/570941880.db2.gz JYFWIVIKZRLXFH-UHFFFAOYSA-N 0 0 361.829 5.240 40 0 FKABRN CSc1ccccc1NC(=O)c1sc(Nc2ccc(F)cc2)nc1C ZINC000022246038 220380086 /nfs/dbraw/zinc/38/00/86/220380086.db2.gz BMFUGDUEGOPJGU-UHFFFAOYSA-N 0 0 373.478 5.308 40 0 FKABRN Cc1nc(Nc2ccc(F)cc2)sc1C(=O)Nc1c(C)cc(C)cc1C ZINC000022246046 570941834 /nfs/dbraw/zinc/94/18/34/570941834.db2.gz HRKWWHHJNMGRCX-UHFFFAOYSA-N 0 0 369.465 5.512 40 0 FKABRN Cc1nc(Nc2ccc(F)cc2)sc1C(=O)NC1CCCCCCC1 ZINC000022246092 220380026 /nfs/dbraw/zinc/38/00/26/220380026.db2.gz ABTGTXRZTIFVJY-UHFFFAOYSA-N 0 0 361.486 5.177 40 0 FKABRN Cc1nc(Nc2ccc(F)cc2)sc1C(=O)Nc1cc(F)ccc1C ZINC000022246183 211343805 /nfs/dbraw/zinc/34/38/05/211343805.db2.gz BKEWHFYMJMGCJQ-UHFFFAOYSA-N 0 0 359.401 5.034 40 0 FKABRN CCOc1ccc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1C ZINC000022250644 211345306 /nfs/dbraw/zinc/34/53/06/211345306.db2.gz KGOCSTYBGXCIMU-UHFFFAOYSA-N 0 0 358.652 5.606 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1C ZINC000022250670 220381154 /nfs/dbraw/zinc/38/11/54/220381154.db2.gz FVDLAKIGPDJROH-UHFFFAOYSA-N 0 0 357.759 5.318 40 0 FKABRN CCOc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1C ZINC000022250674 211343738 /nfs/dbraw/zinc/34/37/38/211343738.db2.gz HSPHVVYGQADOMA-UHFFFAOYSA-N 0 0 357.759 5.318 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1C ZINC000022250678 570941720 /nfs/dbraw/zinc/94/17/20/570941720.db2.gz NVHORSWCBFWUFP-UHFFFAOYSA-N 0 0 361.441 5.225 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1C ZINC000022250771 204773518 /nfs/dbraw/zinc/77/35/18/204773518.db2.gz MWJUXROYSGXGIG-UHFFFAOYSA-N 0 0 357.759 5.318 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc3c(c2)c2ccccc2n3CC)cc1C ZINC000022250775 220380943 /nfs/dbraw/zinc/38/09/43/220380943.db2.gz LUGAOZRRHOQUTH-UHFFFAOYSA-N 0 0 372.468 5.774 40 0 FKABRN O=C(Nc1cc(Cl)c(Cl)cc1Cl)c1cccc(C(F)(F)F)c1 ZINC000022250865 570942268 /nfs/dbraw/zinc/94/22/68/570942268.db2.gz KYCXZVPMAJPOHT-UHFFFAOYSA-N 0 0 368.569 5.918 40 0 FKABRN O=C(Nc1cc(Cl)c(Cl)cc1Cl)c1ccc(F)c(F)c1F ZINC000022250873 570942261 /nfs/dbraw/zinc/94/22/61/570942261.db2.gz DGJFLKOSAQYIFA-UHFFFAOYSA-N 0 0 354.542 5.316 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3ccc(F)c(F)c3F)ccc21 ZINC000022250877 220381277 /nfs/dbraw/zinc/38/12/77/220381277.db2.gz GFCSYFUZFVCZMU-UHFFFAOYSA-N 0 0 368.358 5.484 40 0 FKABRN O=C(Nc1cc(Cl)c(Cl)cc1Cl)c1ccccc1C(F)(F)F ZINC000022250884 211343456 /nfs/dbraw/zinc/34/34/56/211343456.db2.gz XKEALGZDFYEQLC-UHFFFAOYSA-N 0 0 368.569 5.918 40 0 FKABRN CCc1nc2ccc(NC(=O)C(c3ccccc3)c3ccccc3)cc2s1 ZINC000022254783 211344992 /nfs/dbraw/zinc/34/49/92/211344992.db2.gz GVLDMEJASYAGFU-UHFFFAOYSA-N 0 0 372.493 5.629 40 0 FKABRN CCc1nc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2s1 ZINC000022254813 570942281 /nfs/dbraw/zinc/94/22/81/570942281.db2.gz JOLRORDNRXWPBO-UHFFFAOYSA-N 0 0 351.258 5.418 40 0 FKABRN CCCc1nc2ccc(NC(=O)c3cc(Cl)ccc3OC)cc2s1 ZINC000022254843 220381384 /nfs/dbraw/zinc/38/13/84/220381384.db2.gz LCIANOOXMGTOHX-UHFFFAOYSA-N 0 0 360.866 5.163 40 0 FKABRN CCCc1nc2ccc(NC(=O)c3ccc(OCC)c(C)c3)cc2s1 ZINC000022254890 570942249 /nfs/dbraw/zinc/94/22/49/570942249.db2.gz QRSAHWATENSEIN-UHFFFAOYSA-N 0 0 354.475 5.208 40 0 FKABRN CCc1nc2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cc2s1 ZINC000022254911 220381088 /nfs/dbraw/zinc/38/10/88/220381088.db2.gz XDHIXEBJNGXEQO-UHFFFAOYSA-N 0 0 350.365 5.130 40 0 FKABRN CCCc1nc2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cc2s1 ZINC000022254915 220381068 /nfs/dbraw/zinc/38/10/68/220381068.db2.gz AQMUTUSJTSQNLH-UHFFFAOYSA-N 0 0 364.392 5.520 40 0 FKABRN CCc1nc2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2s1 ZINC000022254944 220380951 /nfs/dbraw/zinc/38/09/51/220380951.db2.gz JBVNZZDUOJMTHT-UHFFFAOYSA-N 0 0 350.365 5.130 40 0 FKABRN CCCc1nc2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2s1 ZINC000022254949 220380881 /nfs/dbraw/zinc/38/08/81/220380881.db2.gz ZEYKCBUHRGCJEV-UHFFFAOYSA-N 0 0 364.392 5.520 40 0 FKABRN Cc1cccc(NC(=O)c2cccc(OCc3ccccc3Cl)c2)c1C ZINC000022257977 570942193 /nfs/dbraw/zinc/94/21/93/570942193.db2.gz CUUOOAHGNSPSMQ-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN Cc1cc(C)cc(NC(=O)c2cccc(OCc3ccccc3Cl)c2)c1 ZINC000022257982 211343817 /nfs/dbraw/zinc/34/38/17/211343817.db2.gz BURLAQVEZKQRLJ-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN CCc1ccccc1NC(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258014 220381052 /nfs/dbraw/zinc/38/10/52/220381052.db2.gz OGMWCOANZKPVRZ-UHFFFAOYSA-N 0 0 365.860 5.734 40 0 FKABRN CCc1ccc(NC(=O)c2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000022258019 570942382 /nfs/dbraw/zinc/94/23/82/570942382.db2.gz JEBWKQKPENDYLV-UHFFFAOYSA-N 0 0 365.860 5.734 40 0 FKABRN COc1ccccc1NC(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258033 570942306 /nfs/dbraw/zinc/94/23/06/570942306.db2.gz SSIWBBOQPPKYPR-UHFFFAOYSA-N 0 0 367.832 5.180 40 0 FKABRN O=C(Nc1ccccc1F)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258076 220381098 /nfs/dbraw/zinc/38/10/98/220381098.db2.gz KRQKWPOEDMBKFK-UHFFFAOYSA-N 0 0 355.796 5.310 40 0 FKABRN O=C(Nc1cccc(F)c1)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258080 211344870 /nfs/dbraw/zinc/34/48/70/211344870.db2.gz SKOMCMVZBJISOK-UHFFFAOYSA-N 0 0 355.796 5.310 40 0 FKABRN O=C(Nc1ccc(F)cc1)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258085 220381715 /nfs/dbraw/zinc/38/17/15/220381715.db2.gz SWLGRJBSDWGPQS-UHFFFAOYSA-N 0 0 355.796 5.310 40 0 FKABRN O=C(Nc1ccc(F)cc1F)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258089 570942318 /nfs/dbraw/zinc/94/23/18/570942318.db2.gz UTLPKSUHNNXYHV-UHFFFAOYSA-N 0 0 373.786 5.450 40 0 FKABRN O=C(Nc1cccc(Cl)c1)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258094 220380830 /nfs/dbraw/zinc/38/08/30/220380830.db2.gz VANTVPKKOBMSOJ-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258097 204773772 /nfs/dbraw/zinc/77/37/72/204773772.db2.gz XXIJSVCKISMWHG-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN O=C(Nc1ccc(Cl)cn1)c1cccc(OCc2ccccc2Cl)c1 ZINC000022258194 570942313 /nfs/dbraw/zinc/94/23/13/570942313.db2.gz HMAGRIRXOVXKLR-UHFFFAOYSA-N 0 0 373.239 5.220 40 0 FKABRN Cc1ccc(CNC(=O)c2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000022258256 570942410 /nfs/dbraw/zinc/94/24/10/570942410.db2.gz DULVIUQZOTUJAS-UHFFFAOYSA-N 0 0 365.860 5.157 40 0 FKABRN CN(C(=O)c1cccc(OCc2ccccc2Cl)c1)c1ccccc1 ZINC000022258360 204773472 /nfs/dbraw/zinc/77/34/72/204773472.db2.gz UNMGCUWYVIBREC-UHFFFAOYSA-N 0 0 351.833 5.196 40 0 FKABRN Cc1ccc(NC(=O)c2cccc(OCc3ccccc3Cl)c2)c(C)c1 ZINC000022258387 204774363 /nfs/dbraw/zinc/77/43/63/204774363.db2.gz GAIHQEYFGPSDBA-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2cccc(OCc3ccccc3Cl)c2)c1 ZINC000022258408 570942370 /nfs/dbraw/zinc/94/23/70/570942370.db2.gz NYXDURVVNIEVDP-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN CC(C)c1ccc(S(=O)(=O)Nc2ccc(Nc3ccccc3)cc2)cc1 ZINC000022259174 220381282 /nfs/dbraw/zinc/38/12/82/220381282.db2.gz CEPQSMVJTMOGAP-UHFFFAOYSA-N 0 0 366.486 5.354 40 0 FKABRN O=C(Nc1ccccc1OC(F)F)c1ccc(-c2ccc(Cl)cc2)o1 ZINC000022399268 570863358 /nfs/dbraw/zinc/86/33/58/570863358.db2.gz XMEYZFZDVGKDHD-UHFFFAOYSA-N 0 0 363.747 5.454 40 0 FKABRN Cc1ccc(NC(=O)CCc2nc(-c3ccc(C(C)C)cc3)no2)cc1C ZINC000022409754 211349855 /nfs/dbraw/zinc/34/98/55/211349855.db2.gz OWCLDQXFLPRERV-UHFFFAOYSA-N 0 0 363.461 5.048 40 0 FKABRN Cc1cc(C)cc(NC(=O)CCc2nc(-c3ccc(C(C)C)cc3)no2)c1 ZINC000022411273 570943889 /nfs/dbraw/zinc/94/38/89/570943889.db2.gz OSKWDBODAKBVPB-UHFFFAOYSA-N 0 0 363.461 5.048 40 0 FKABRN Cc1cc(C)cc(OCCNC(=O)CC(c2ccccc2)c2ccccc2)c1 ZINC000022480070 220387081 /nfs/dbraw/zinc/38/70/81/220387081.db2.gz IZJRPCZMBUDGOL-UHFFFAOYSA-N 0 0 373.496 5.021 40 0 FKABRN Cc1cc(OCC(=O)N[C@H](CC(C)C)c2ccccc2)cc(C)c1Cl ZINC000022508943 220388191 /nfs/dbraw/zinc/38/81/91/220388191.db2.gz VYUVVSSQVQMOBY-LJQANCHMSA-N 0 0 359.897 5.239 40 0 FKABRN Cc1cc(OCC(=O)N[C@@H](CC(C)C)c2ccccc2)cc(C)c1Cl ZINC000022508947 207810618 /nfs/dbraw/zinc/81/06/18/207810618.db2.gz VYUVVSSQVQMOBY-IBGZPJMESA-N 0 0 359.897 5.239 40 0 FKABRN O=C(Nc1ccccc1F)c1ccc(OCCSc2ccccc2)cc1 ZINC000022509885 220388106 /nfs/dbraw/zinc/38/81/06/220388106.db2.gz BOMSGAOCVBOATF-UHFFFAOYSA-N 0 0 367.445 5.249 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)CCCOc2ccc(C)cc2)cc1 ZINC000022510200 220388868 /nfs/dbraw/zinc/38/88/68/220388868.db2.gz XIHJKTSDNBINCN-JOCHJYFZSA-N 0 0 369.505 5.066 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)CCCOc2ccc(C)cc2)cc1 ZINC000022510206 211352254 /nfs/dbraw/zinc/35/22/54/211352254.db2.gz XIHJKTSDNBINCN-QFIPXVFZSA-N 0 0 369.505 5.066 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000022510871 211352068 /nfs/dbraw/zinc/35/20/68/211352068.db2.gz ATVRCTXPEAKBHI-FDDCHVKYSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000022510876 211351824 /nfs/dbraw/zinc/35/18/24/211351824.db2.gz ATVRCTXPEAKBHI-MBSDFSHPSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000022510880 207810504 /nfs/dbraw/zinc/81/05/04/207810504.db2.gz ATVRCTXPEAKBHI-WZONZLPQSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000022510884 570944604 /nfs/dbraw/zinc/94/46/04/570944604.db2.gz ATVRCTXPEAKBHI-JPYJTQIMSA-N 0 0 361.485 5.491 40 0 FKABRN CC(C)C[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000022511303 220388336 /nfs/dbraw/zinc/38/83/36/220388336.db2.gz JYAORUZMINDOHI-JOCHJYFZSA-N 0 0 351.534 5.820 40 0 FKABRN CC(C)C[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000022511308 220388740 /nfs/dbraw/zinc/38/87/40/220388740.db2.gz JYAORUZMINDOHI-QFIPXVFZSA-N 0 0 351.534 5.820 40 0 FKABRN CC[C@@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccc(OC)cc1 ZINC000022511980 211352076 /nfs/dbraw/zinc/35/20/76/211352076.db2.gz HHKRKLFDWBNQTC-XMMPIXPASA-N 0 0 373.496 5.485 40 0 FKABRN CC[C@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccc(OC)cc1 ZINC000022511985 220388672 /nfs/dbraw/zinc/38/86/72/220388672.db2.gz HHKRKLFDWBNQTC-DEOSSOPVSA-N 0 0 373.496 5.485 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc2ccccc2c1)c1ccc(C)cc1 ZINC000022512040 220388319 /nfs/dbraw/zinc/38/83/19/220388319.db2.gz YCHZTOACCVVINN-DHIUTWEWSA-N 0 0 361.485 5.573 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](CC)c1ccc(C)cc1 ZINC000022512045 570944763 /nfs/dbraw/zinc/94/47/63/570944763.db2.gz YCHZTOACCVVINN-XZOQPEGZSA-N 0 0 361.485 5.573 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccc2ccccc2c1)c1ccc(C)cc1 ZINC000022512050 211352808 /nfs/dbraw/zinc/35/28/08/211352808.db2.gz YCHZTOACCVVINN-PKTZIBPZSA-N 0 0 361.485 5.573 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccc2ccccc2c1)c1ccc(C)cc1 ZINC000022512055 570944774 /nfs/dbraw/zinc/94/47/74/570944774.db2.gz YCHZTOACCVVINN-GOTSBHOMSA-N 0 0 361.485 5.573 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000022514855 570944985 /nfs/dbraw/zinc/94/49/85/570944985.db2.gz YANVTWLOPQUUJX-LEWJYISDSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000022514860 570944914 /nfs/dbraw/zinc/94/49/14/570944914.db2.gz YANVTWLOPQUUJX-SFTDATJTSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000022514865 570944964 /nfs/dbraw/zinc/94/49/64/570944964.db2.gz YANVTWLOPQUUJX-NHCUHLMSSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000022514869 220388685 /nfs/dbraw/zinc/38/86/85/220388685.db2.gz YANVTWLOPQUUJX-RTWAWAEBSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000022514929 220388361 /nfs/dbraw/zinc/38/83/61/220388361.db2.gz NYNPAHYWXDHZQK-MRXNPFEDSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000022514933 207810163 /nfs/dbraw/zinc/81/01/63/207810163.db2.gz NYNPAHYWXDHZQK-INIZCTEOSA-N 0 0 352.261 5.406 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=O)/C=C/c2ccc(C(C)(C)C)cc2)cc1 ZINC000022515482 211352230 /nfs/dbraw/zinc/35/22/30/211352230.db2.gz XKDQOLJAXIUEAV-JDZKTDJGSA-N 0 0 351.490 5.273 40 0 FKABRN CCOc1ccc([C@H](C)NC(=O)/C=C/c2ccc(C(C)(C)C)cc2)cc1 ZINC000022515488 570944936 /nfs/dbraw/zinc/94/49/36/570944936.db2.gz XKDQOLJAXIUEAV-NDCSFFLDSA-N 0 0 351.490 5.273 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)c(C)c1 ZINC000022515649 570945175 /nfs/dbraw/zinc/94/51/75/570945175.db2.gz IVAHHSZKXRAOMW-QZTJIDSGSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)c(C)c1 ZINC000022515653 220387986 /nfs/dbraw/zinc/38/79/86/220387986.db2.gz IVAHHSZKXRAOMW-ZWKOTPCHSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)c(C)c1 ZINC000022515658 220388479 /nfs/dbraw/zinc/38/84/79/220388479.db2.gz IVAHHSZKXRAOMW-MSOLQXFVSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)c(C)c1 ZINC000022515663 211353119 /nfs/dbraw/zinc/35/31/19/211353119.db2.gz IVAHHSZKXRAOMW-ROUUACIJSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)CSCc1ccc(Cl)c(Cl)c1 ZINC000022515848 207809075 /nfs/dbraw/zinc/80/90/75/207809075.db2.gz GOQMOUHOFRDMJT-UHFFFAOYSA-N 0 0 374.720 5.827 40 0 FKABRN O=C(Nc1cccc(F)c1)c1ccc(CN2CCCc3ccccc32)cc1 ZINC000022516035 570945006 /nfs/dbraw/zinc/94/50/06/570945006.db2.gz CYLWKTFJTGFLGX-UHFFFAOYSA-N 0 0 360.432 5.031 40 0 FKABRN CC[C@@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000022519121 220388677 /nfs/dbraw/zinc/38/86/77/220388677.db2.gz PLASDQOWLXXYEB-OAQYLSRUSA-N 0 0 365.404 5.414 40 0 FKABRN CC[C@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000022519127 570945058 /nfs/dbraw/zinc/94/50/58/570945058.db2.gz PLASDQOWLXXYEB-NRFANRHFSA-N 0 0 365.404 5.414 40 0 FKABRN Cc1cccc(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)c1C ZINC000022519807 570945091 /nfs/dbraw/zinc/94/50/91/570945091.db2.gz ROVGGPVUNZRBBO-UHFFFAOYSA-N 0 0 356.469 5.118 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1ccc(Cl)cc1Cl ZINC000022520839 211354611 /nfs/dbraw/zinc/35/46/11/211354611.db2.gz TUSXNWNBDDVBFR-MRXNPFEDSA-N 0 0 372.679 5.121 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)NCc1ccc(Cl)cc1Cl ZINC000022520843 220389476 /nfs/dbraw/zinc/38/94/76/220389476.db2.gz TUSXNWNBDDVBFR-INIZCTEOSA-N 0 0 372.679 5.121 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccccc1Cl ZINC000022522517 220390147 /nfs/dbraw/zinc/39/01/47/220390147.db2.gz KIRWFFDZYWBOPY-MRXNPFEDSA-N 0 0 354.302 5.181 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccccc1Cl ZINC000022522525 570945569 /nfs/dbraw/zinc/94/55/69/570945569.db2.gz KIRWFFDZYWBOPY-INIZCTEOSA-N 0 0 354.302 5.181 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000022522698 220389366 /nfs/dbraw/zinc/38/93/66/220389366.db2.gz XROZIDPHPNMZGC-OAHLLOKOSA-N 0 0 374.720 6.156 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000022522703 570945484 /nfs/dbraw/zinc/94/54/84/570945484.db2.gz XROZIDPHPNMZGC-HNNXBMFYSA-N 0 0 374.720 6.156 40 0 FKABRN CCOc1ccc(CCC(=O)Nc2ccc3ccccc3c2)cc1OCC ZINC000022523076 570945441 /nfs/dbraw/zinc/94/54/41/570945441.db2.gz ATQIFNCEBFTMAY-UHFFFAOYSA-N 0 0 363.457 5.209 40 0 FKABRN CCOc1ccc(CCC(=O)Nc2c(CC)cccc2CC)cc1OCC ZINC000022523222 211355071 /nfs/dbraw/zinc/35/50/71/211355071.db2.gz PCXPSOWGLCVLRY-UHFFFAOYSA-N 0 0 369.505 5.180 40 0 FKABRN CCc1ccccc1NC(=O)c1ccc(CN2CCCc3ccccc32)cc1 ZINC000022523508 570945511 /nfs/dbraw/zinc/94/55/11/570945511.db2.gz JVEIDHMIBLQYHE-UHFFFAOYSA-N 0 0 370.496 5.454 40 0 FKABRN O=C(N[C@@H]1CCCc2ccccc21)N1c2ccccc2Sc2ccccc21 ZINC000022525163 570945402 /nfs/dbraw/zinc/94/54/02/570945402.db2.gz ORSMJKYQTANMJT-GOSISDBHSA-N 0 0 372.493 6.077 40 0 FKABRN O=C(N[C@H]1CCCc2ccccc21)N1c2ccccc2Sc2ccccc21 ZINC000022525168 132905538 /nfs/dbraw/zinc/90/55/38/132905538.db2.gz ORSMJKYQTANMJT-SFHVURJKSA-N 0 0 372.493 6.077 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000022525523 211354538 /nfs/dbraw/zinc/35/45/38/211354538.db2.gz RASAWVRYMBTVBZ-JOCHJYFZSA-N 0 0 359.469 5.058 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000022525528 211353930 /nfs/dbraw/zinc/35/39/30/211353930.db2.gz RASAWVRYMBTVBZ-QFIPXVFZSA-N 0 0 359.469 5.058 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000022526096 220389467 /nfs/dbraw/zinc/38/94/67/220389467.db2.gz FNMPTBOHDJQAQJ-OAHLLOKOSA-N 0 0 374.720 6.156 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000022526100 570945445 /nfs/dbraw/zinc/94/54/45/570945445.db2.gz FNMPTBOHDJQAQJ-HNNXBMFYSA-N 0 0 374.720 6.156 40 0 FKABRN O=C(CSCc1ccc(F)cc1)Nc1ccc(Oc2ccccc2)cc1 ZINC000022526315 211353911 /nfs/dbraw/zinc/35/39/11/211353911.db2.gz RWSZFSSVWQBCKW-UHFFFAOYSA-N 0 0 367.445 5.490 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCCSc1ccccc1 ZINC000022526441 211354797 /nfs/dbraw/zinc/35/47/97/211354797.db2.gz UKTQMOXVMAECLD-QGZVFWFLSA-N 0 0 365.951 5.119 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCCSc1ccccc1 ZINC000022526445 220389482 /nfs/dbraw/zinc/38/94/82/220389482.db2.gz UKTQMOXVMAECLD-KRWDZBQOSA-N 0 0 365.951 5.119 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCCCc1ccc(F)cc1 ZINC000022526792 207809781 /nfs/dbraw/zinc/80/97/81/207809781.db2.gz MWHUNKXORCDLCP-GOSISDBHSA-N 0 0 365.901 5.099 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCCCc1ccc(F)cc1 ZINC000022526795 204780108 /nfs/dbraw/zinc/78/01/08/204780108.db2.gz MWHUNKXORCDLCP-SFHVURJKSA-N 0 0 365.901 5.099 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000022527604 207811850 /nfs/dbraw/zinc/81/18/50/207811850.db2.gz QPYGTSQKGCKTQP-ZDUSSCGKSA-N 0 0 351.368 5.235 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000022527606 211353936 /nfs/dbraw/zinc/35/39/36/211353936.db2.gz QPYGTSQKGCKTQP-CYBMUJFWSA-N 0 0 351.368 5.235 40 0 FKABRN CCSc1ccccc1NC(=O)c1cccc(OCc2ccccc2)c1 ZINC000022529768 220389738 /nfs/dbraw/zinc/38/97/38/220389738.db2.gz ZJRYAUIUUCYIRX-UHFFFAOYSA-N 0 0 363.482 5.630 40 0 FKABRN O=C(NC1CCCCCC1)c1ccc(CN2CCCc3ccccc32)cc1 ZINC000022530414 570945879 /nfs/dbraw/zinc/94/58/79/570945879.db2.gz DZOBNDYCPALLAF-UHFFFAOYSA-N 0 0 362.517 5.092 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000022530545 570946160 /nfs/dbraw/zinc/94/61/60/570946160.db2.gz MIDJTAZDRXKFSO-LJQANCHMSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000022530550 570946135 /nfs/dbraw/zinc/94/61/35/570946135.db2.gz MIDJTAZDRXKFSO-IBGZPJMESA-N 0 0 374.267 5.943 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000022530987 207811292 /nfs/dbraw/zinc/81/12/92/207811292.db2.gz CRYQNKXVAAEICB-LBPRGKRZSA-N 0 0 352.261 5.523 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000022530992 570946101 /nfs/dbraw/zinc/94/61/01/570946101.db2.gz CRYQNKXVAAEICB-GFCCVEGCSA-N 0 0 352.261 5.523 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000022531314 211355083 /nfs/dbraw/zinc/35/50/83/211355083.db2.gz LJJQYEXQTUKKBD-GOSISDBHSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000022531318 570945896 /nfs/dbraw/zinc/94/58/96/570945896.db2.gz LJJQYEXQTUKKBD-SFHVURJKSA-N 0 0 374.267 5.943 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000022531360 220389884 /nfs/dbraw/zinc/38/98/84/220389884.db2.gz YBOBKBUJHRJEOK-IRXDYDNUSA-N 0 0 353.506 5.191 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000022531363 570946068 /nfs/dbraw/zinc/94/60/68/570946068.db2.gz YBOBKBUJHRJEOK-DLBZAZTESA-N 0 0 353.506 5.191 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000022531367 220389397 /nfs/dbraw/zinc/38/93/97/220389397.db2.gz YBOBKBUJHRJEOK-SJORKVTESA-N 0 0 353.506 5.191 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000022531372 220389834 /nfs/dbraw/zinc/38/98/34/220389834.db2.gz YBOBKBUJHRJEOK-IAGOWNOFSA-N 0 0 353.506 5.191 40 0 FKABRN Cc1ccc(CN(C)C(=O)N2c3ccccc3Sc3ccccc32)cc1 ZINC000022531607 570946059 /nfs/dbraw/zinc/94/60/59/570946059.db2.gz NQAAVCHVGOQUJQ-UHFFFAOYSA-N 0 0 360.482 5.850 40 0 FKABRN O=C(Nc1cccc(F)c1)c1ccc(OCCSc2ccccc2)cc1 ZINC000022531832 570945987 /nfs/dbraw/zinc/94/59/87/570945987.db2.gz FARWJIGFTXOCLM-UHFFFAOYSA-N 0 0 367.445 5.249 40 0 FKABRN Cc1cc(C)c(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)c(C)c1 ZINC000022533197 570946442 /nfs/dbraw/zinc/94/64/42/570946442.db2.gz UIRNBYQOYXDLFB-UHFFFAOYSA-N 0 0 370.496 5.427 40 0 FKABRN CC(C)C[C@@H](NC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccccc1 ZINC000022533202 220390135 /nfs/dbraw/zinc/39/01/35/220390135.db2.gz PHFSTYNVGDGFSX-WZONZLPQSA-N 0 0 361.485 5.511 40 0 FKABRN CC(C)C[C@H](NC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccccc1 ZINC000022533207 570946262 /nfs/dbraw/zinc/94/62/62/570946262.db2.gz PHFSTYNVGDGFSX-JPYJTQIMSA-N 0 0 361.485 5.511 40 0 FKABRN CC(C)C[C@@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccccc1 ZINC000022533215 570946522 /nfs/dbraw/zinc/94/65/22/570946522.db2.gz PHFSTYNVGDGFSX-FDDCHVKYSA-N 0 0 361.485 5.511 40 0 FKABRN CC(C)C[C@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccccc1 ZINC000022533220 570946427 /nfs/dbraw/zinc/94/64/27/570946427.db2.gz PHFSTYNVGDGFSX-MBSDFSHPSA-N 0 0 361.485 5.511 40 0 FKABRN Cc1ccccc1NC(=O)c1ccc(CN2CCCc3ccccc32)cc1 ZINC000022533838 132905447 /nfs/dbraw/zinc/90/54/47/132905447.db2.gz JXBNQDLDEHCWCG-UHFFFAOYSA-N 0 0 356.469 5.200 40 0 FKABRN CC(C)c1ccc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)cc1 ZINC000022534172 211354823 /nfs/dbraw/zinc/35/48/23/211354823.db2.gz UQTCSIPZLZBSMN-UHFFFAOYSA-N 0 0 367.470 5.403 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)c1 ZINC000022534293 207812043 /nfs/dbraw/zinc/81/20/43/207812043.db2.gz 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/nfs/dbraw/zinc/35/58/33/211355833.db2.gz MZGLQDBMNQGFFM-UHFFFAOYSA-N 0 0 371.484 5.797 40 0 FKABRN Cc1ccccc1CSCC(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000022832158 571305272 /nfs/dbraw/zinc/30/52/72/571305272.db2.gz QLMRZZQZTNJUCV-UHFFFAOYSA-N 0 0 373.827 5.539 40 0 FKABRN Cc1cccc(C)c1NC(=O)CSCc1ccc(Cl)c(Cl)c1 ZINC000022921307 211372400 /nfs/dbraw/zinc/37/24/00/211372400.db2.gz WPKJUUFAYDBISN-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN Cc1ccc(C)c(NC(=O)CCc2nc(-c3ccc(C(C)C)cc3)no2)c1 ZINC000023389292 211386819 /nfs/dbraw/zinc/38/68/19/211386819.db2.gz DMQZXYJUQOTSQV-UHFFFAOYSA-N 0 0 363.461 5.048 40 0 FKABRN Cc1cccc(NC(=O)CCc2nc(-c3ccc(C(C)C)cc3)no2)c1C ZINC000023390684 570962750 /nfs/dbraw/zinc/96/27/50/570962750.db2.gz WEHDRSAHTSRDQF-UHFFFAOYSA-N 0 0 363.461 5.048 40 0 FKABRN Cc1ccc(NC(=O)CCc2nc(-c3ccc(C(C)C)cc3)no2)c(C)c1 ZINC000023390708 211386739 /nfs/dbraw/zinc/38/67/39/211386739.db2.gz LYHVCFUTGBMZQL-UHFFFAOYSA-N 0 0 363.461 5.048 40 0 FKABRN CC(C)c1ccc(-c2noc(CCC(=O)Nc3ccccc3Cl)n2)cc1 ZINC000023390828 220427202 /nfs/dbraw/zinc/42/72/02/220427202.db2.gz HZBDKNJXAYQSHA-UHFFFAOYSA-N 0 0 369.852 5.085 40 0 FKABRN CC(C)c1ccc(-c2noc(CCC(=O)Nc3ccc(Cl)cc3)n2)cc1 ZINC000023391203 570963143 /nfs/dbraw/zinc/96/31/43/570963143.db2.gz HESHFEYIMFHOKT-UHFFFAOYSA-N 0 0 369.852 5.085 40 0 FKABRN Cc1cccc(C)c1NC(=O)CCc1nc(-c2ccc(C(C)C)cc2)no1 ZINC000023403540 570963205 /nfs/dbraw/zinc/96/32/05/570963205.db2.gz CZTSBJOVDSNHJH-UHFFFAOYSA-N 0 0 363.461 5.048 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)Nc1c(Cl)cccc1Cl ZINC000023411032 571305260 /nfs/dbraw/zinc/30/52/60/571305260.db2.gz WBJUIXLFDGHICR-UHFFFAOYSA-N 0 0 360.693 5.519 40 0 FKABRN O=C(CSCc1ccccc1Cl)Nc1cccc(Cl)c1Cl ZINC000023411063 571305276 /nfs/dbraw/zinc/30/52/76/571305276.db2.gz IUGOOCMMIILXTA-UHFFFAOYSA-N 0 0 360.693 5.519 40 0 FKABRN O=C(Nc1ccc(-c2csc(-c3ccncc3)n2)cc1)c1ccccc1 ZINC000023623572 570965745 /nfs/dbraw/zinc/96/57/45/570965745.db2.gz PFQXADSXLVMYTA-UHFFFAOYSA-N 0 0 357.438 5.124 40 0 FKABRN O=C(Nc1ccccc1Cl)c1ccc(CSc2ccccc2)cc1 ZINC000023680016 571305199 /nfs/dbraw/zinc/30/51/99/571305199.db2.gz PBBSKPIBNGFLDE-UHFFFAOYSA-N 0 0 353.874 5.885 40 0 FKABRN CCc1cccc(C)c1NC(=O)c1ccc(CSc2ccccc2)cc1 ZINC000023680028 571305210 /nfs/dbraw/zinc/30/52/10/571305210.db2.gz BTIIEMVLWXJBFJ-UHFFFAOYSA-N 0 0 361.510 6.102 40 0 FKABRN CC(C)c1ccc(-c2noc(CCC(=O)Nc3cccc(Cl)c3)n2)cc1 ZINC000023680497 570966524 /nfs/dbraw/zinc/96/65/24/570966524.db2.gz ZVZZXDURCCRAKE-UHFFFAOYSA-N 0 0 369.852 5.085 40 0 FKABRN CCOc1ccccc1NC(=O)c1ccc(CSc2ccccc2)cc1 ZINC000023681139 571305211 /nfs/dbraw/zinc/30/52/11/571305211.db2.gz YXVYPWJJCRNMRU-UHFFFAOYSA-N 0 0 363.482 5.630 40 0 FKABRN Cc1cc(C)c(NC(=O)CSCc2ccc(Cl)c(Cl)c2)c(C)c1 ZINC000023742203 570967269 /nfs/dbraw/zinc/96/72/69/570967269.db2.gz BCRAVTTWTBFFRQ-UHFFFAOYSA-N 0 0 368.329 5.791 40 0 FKABRN O=C(CSCc1ccc(Cl)c(Cl)c1)Nc1c(F)cccc1F ZINC000023742230 570967274 /nfs/dbraw/zinc/96/72/74/570967274.db2.gz XDVSDCDOEUENND-UHFFFAOYSA-N 0 0 362.228 5.144 40 0 FKABRN C[C@@H](Oc1ccc(F)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000024107301 568452007 /nfs/dbraw/zinc/45/20/07/568452007.db2.gz LYNICCCGMVWLGV-MRVPVSSYSA-N 0 0 362.615 5.192 40 0 FKABRN C[C@H](Oc1ccc(F)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000024107304 568452005 /nfs/dbraw/zinc/45/20/05/568452005.db2.gz LYNICCCGMVWLGV-QMMMGPOBSA-N 0 0 362.615 5.192 40 0 FKABRN O=C(Nc1ccc(Cl)cc1Cl)c1cc(-c2ccc(Cl)cc2)on1 ZINC000024377285 211406085 /nfs/dbraw/zinc/40/60/85/211406085.db2.gz BVIPDYHIGCAZHE-UHFFFAOYSA-N 0 0 367.619 5.554 40 0 FKABRN O=C(OCc1cccc(Cl)c1)C1c2ccccc2Oc2ccccc21 ZINC000024522326 571147878 /nfs/dbraw/zinc/14/78/78/571147878.db2.gz SXPAQUHWXZPSPC-UHFFFAOYSA-N 0 0 350.801 5.321 40 0 FKABRN Cc1cccc(C(=O)Nc2cc(-c3cnc4ccccc4n3)ccc2C)c1 ZINC000024522649 220450142 /nfs/dbraw/zinc/45/01/42/220450142.db2.gz DZKGEHBMZULSJC-UHFFFAOYSA-N 0 0 353.425 5.166 40 0 FKABRN Cc1ccc(/C=C/c2nc(-c3ccccc3O)n(-c3ccccc3)n2)cc1 ZINC000024543493 571147970 /nfs/dbraw/zinc/14/79/70/571147970.db2.gz 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COc1ccc(C2=N[C@@H](c3ccc(Cl)cc3)N3[C@@H]2[C@@H]3c2ccccc2)cc1 ZINC000025504106 568565527 /nfs/dbraw/zinc/56/55/27/568565527.db2.gz IAPNQZCYNPAEIU-UTTOWIBESA-N 0 0 374.871 5.276 40 0 FKABRN CC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000025547216 209620693 /nfs/dbraw/zinc/62/06/93/209620693.db2.gz GFHOQCXDABGYAL-MHFBBLOWSA-N 0 0 360.538 5.166 40 0 FKABRN CC(=O)OC1=CC[C@H]2[C@H]3CC[C@H]([C@H](C)CCCC(C)C)[C@@]3(C)CC[C@H]2[C@H]1C ZINC000025549025 263388682 /nfs/dbraw/zinc/38/86/82/263388682.db2.gz SABPQGKCDGUYAI-OHSHNSDFSA-N 0 0 374.609 6.994 40 0 FKABRN COc1ccc([C@H]2N=C(c3ccc(Cl)cc3)[C@@H]3[C@@H](c4ccccc4)N32)cc1 ZINC000025586420 568573111 /nfs/dbraw/zinc/57/31/11/568573111.db2.gz HMZHNFLAEYLLKZ-FOMDFCNTSA-N 0 0 374.871 5.276 40 0 FKABRN COc1ccc([C@H]2N=C(c3ccc(Cl)cc3)[C@H]3[C@@H](c4ccccc4)N32)cc1 ZINC000025586431 568573233 /nfs/dbraw/zinc/57/32/33/568573233.db2.gz HMZHNFLAEYLLKZ-USDJYLPVSA-N 0 0 374.871 5.276 40 0 FKABRN Fc1cc2c(Br)cc1CSCc1cccc(c1)CSC2 ZINC000025691548 570999189 /nfs/dbraw/zinc/99/91/89/570999189.db2.gz STLRQSITKQNJIJ-UHFFFAOYSA-N 0 0 369.324 5.768 40 0 FKABRN COc1ccc2nc(C)c(C(=O)Nc3cc(Cl)ccc3Cl)cc2c1 ZINC000025765251 571000037 /nfs/dbraw/zinc/00/00/37/571000037.db2.gz SBZBEEHRUOEPSO-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN COc1ccc2nc(C)c(C(=O)Nc3ccc(Cl)cc3Cl)cc2c1 ZINC000025765401 571305242 /nfs/dbraw/zinc/30/52/42/571305242.db2.gz QDAQEJCXDWFUPY-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN COc1ccc2nc(C)c(C(=O)Nc3cccc(Cl)c3Cl)cc2c1 ZINC000025765760 568596061 /nfs/dbraw/zinc/59/60/61/568596061.db2.gz CYSWQQQSOVGSAQ-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN Clc1cccc(Cl)c1/C(=C/n1cncn1)OC1CCCCCC1 ZINC000026282536 571004124 /nfs/dbraw/zinc/00/41/24/571004124.db2.gz STCVFKBRXOEQRF-YBEGLDIGSA-N 0 0 352.265 5.280 40 0 in-vitro FKABRN CCOC(=O)c1sc2nc(-c3ccc(-c4ccccc4)cc3)cn2c1C ZINC000026441977 220513144 /nfs/dbraw/zinc/51/31/44/220513144.db2.gz VXQZHXYXFPDJMH-UHFFFAOYSA-N 0 0 362.454 5.215 40 0 FKABRN CCc1ccc(-c2cs/c(=N\c3ccccc3)n2-c2ccccc2)cc1 ZINC000026442274 220513043 /nfs/dbraw/zinc/51/30/43/220513043.db2.gz HHMNVIFHCNHWAQ-VHXPQNKSSA-N 0 0 356.494 6.001 40 0 FKABRN CC(C)(C)c1cc(-c2cn3c(n2)-c2ccccc2C3)cc(C(C)(C)C)c1O ZINC000026442290 571163099 /nfs/dbraw/zinc/16/30/99/571163099.db2.gz ZHXXTSVBTWGDAR-UHFFFAOYSA-N 0 0 360.501 5.879 40 0 FKABRN c1csc([C@H]2Nc3ccccc3[C@@H]3c4[nH]c5ccccc5c4CCN32)c1 ZINC000026456158 206441102 /nfs/dbraw/zinc/44/11/02/206441102.db2.gz NJSHLRGCECJNPJ-YADHBBJMSA-N 0 0 357.482 5.301 40 0 FKABRN c1csc([C@H]2Nc3ccccc3[C@H]3c4[nH]c5ccccc5c4CCN23)c1 ZINC000026456162 568658929 /nfs/dbraw/zinc/65/89/29/568658929.db2.gz NJSHLRGCECJNPJ-VXKWHMMOSA-N 0 0 357.482 5.301 40 0 FKABRN COc1ccc([C@@H](Nc2ccccn2)c2c(C)[nH]c3ccccc32)c(OC)c1 ZINC000026466153 571165880 /nfs/dbraw/zinc/16/58/80/571165880.db2.gz BVOZLOANEVAVJN-HSZRJFAPSA-N 0 0 373.456 5.090 40 0 FKABRN COc1ccc([C@H](Nc2ccccn2)c2c(C)[nH]c3ccccc32)c(OC)c1 ZINC000026466159 571166006 /nfs/dbraw/zinc/16/60/06/571166006.db2.gz BVOZLOANEVAVJN-QHCPKHFHSA-N 0 0 373.456 5.090 40 0 FKABRN Clc1ccc(Oc2ccc(Br)c(Br)c2)cc1 ZINC000026508294 210184136 /nfs/dbraw/zinc/18/41/36/210184136.db2.gz NOZZTTWTRBTMSU-UHFFFAOYSA-N 0 0 362.448 5.657 40 0 FKABRN CC(C)c1ccc(-c2noc(CCC(=O)NC3CCCCCCC3)n2)cc1 ZINC000026564439 204853075 /nfs/dbraw/zinc/85/30/75/204853075.db2.gz MQIOQXMIXKKCFN-UHFFFAOYSA-N 0 0 369.509 5.022 40 0 FKABRN CC(=O)Oc1ccc(-c2ccc(C(=O)Nc3c(C)cc(C)cc3C)cc2)cc1 ZINC000026779868 571168830 /nfs/dbraw/zinc/16/88/30/571168830.db2.gz HDFGCOVAABFMQX-UHFFFAOYSA-N 0 0 373.452 5.456 40 0 FKABRN CCCCCC[C@@H](C)NC(=O)c1cc(-c2ccsc2)nc2ccccc21 ZINC000026780134 571168796 /nfs/dbraw/zinc/16/87/96/571168796.db2.gz ASZHWGUCRYNQPX-MRXNPFEDSA-N 0 0 366.530 6.052 40 0 FKABRN CCCCCC[C@H](C)NC(=O)c1cc(-c2ccsc2)nc2ccccc21 ZINC000026780136 571169085 /nfs/dbraw/zinc/16/90/85/571169085.db2.gz ASZHWGUCRYNQPX-INIZCTEOSA-N 0 0 366.530 6.052 40 0 FKABRN CC(C)N(c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2)cc1 ZINC000026780158 571169072 /nfs/dbraw/zinc/16/90/72/571169072.db2.gz BBMILOGJRXUKSN-UHFFFAOYSA-N 0 0 364.876 6.139 40 0 FKABRN Cc1ccc(C(=O)Nc2cc(C(C)C)c(O)c(Br)c2C)cc1 ZINC000026787204 571008354 /nfs/dbraw/zinc/00/83/54/571008354.db2.gz BZGPTOXRQVILGC-UHFFFAOYSA-N 0 0 362.267 5.147 40 0 FKABRN Cc1cccc(NC(=O)CSC(=O)c2ccc(Cl)cc2Cl)c1C ZINC000026891889 571008544 /nfs/dbraw/zinc/00/85/44/571008544.db2.gz PWWISRIJZUYYPR-UHFFFAOYSA-N 0 0 368.285 5.122 40 0 FKABRN CCOC(=O)/C=C(C)/C=C/C=C(C)\C=C\c1c(C)cc(OC)c(C)c1C ZINC000026892371 571008806 /nfs/dbraw/zinc/00/88/06/571008806.db2.gz HQMNCQVAMBCHCO-SYOOQBRZSA-N 0 0 354.490 5.646 40 0 FKABRN CCOC(=O)C(C)(C)Cc1ccc(Oc2nc3ccc(Cl)cc3o2)cc1 ZINC000026893016 211455821 /nfs/dbraw/zinc/45/58/21/211455821.db2.gz IQSBETYCTANNPY-UHFFFAOYSA-N 0 0 373.836 5.405 40 0 FKABRN CCc1c(-c2ccc(OC)cc2)nn(-c2ccccc2)c1-c1ccccc1 ZINC000026897020 571008653 /nfs/dbraw/zinc/00/86/53/571008653.db2.gz IXEZMYFWLHAFAJ-UHFFFAOYSA-N 0 0 354.453 5.777 40 0 FKABRN CCc1c(-c2ccccc2)nn(-c2ccccc2)c1-c1ccc(OC)cc1 ZINC000026897022 571008604 /nfs/dbraw/zinc/00/86/04/571008604.db2.gz QYRFIGROWNTOHB-UHFFFAOYSA-N 0 0 354.453 5.777 40 0 FKABRN c1coc(-c2nc(-c3ccccn3)c3c(c2-c2ccco2)CCCCC3)c1 ZINC000026897043 571282150 /nfs/dbraw/zinc/28/21/50/571282150.db2.gz PQKNVUTYXQKBLY-UHFFFAOYSA-N 0 0 356.425 5.933 40 0 FKABRN c1coc(-c2cc(-c3ccccc3)c(-c3ccccn3)nc2-c2ccco2)c1 ZINC000026897047 571008825 /nfs/dbraw/zinc/00/88/25/571008825.db2.gz GJTKXPRFIGLAAA-UHFFFAOYSA-N 0 0 364.404 6.331 40 0 FKABRN CSc1c(-c2ccccc2)c(-c2ccccc2)nn1-c1ccc(F)cc1 ZINC000026897127 571008743 /nfs/dbraw/zinc/00/87/43/571008743.db2.gz ARRPVEFPZINITI-UHFFFAOYSA-N 0 0 360.457 6.067 40 0 FKABRN CSc1nn(-c2ccc(F)cc2)c(-c2ccccc2)c1-c1ccccc1 ZINC000026897137 571008579 /nfs/dbraw/zinc/00/85/79/571008579.db2.gz DMMPCUHTISOCEZ-UHFFFAOYSA-N 0 0 360.457 6.067 40 0 FKABRN COc1ccc(OCc2c(C)n(C(=O)OC(C)(C)C)c3ccccc32)cc1 ZINC000026897206 571202823 /nfs/dbraw/zinc/20/28/23/571202823.db2.gz 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Cc1nn2c(nc(C)cc2N2C[C@H](C)C[C@H](C)C2)c1-c1ccccc1Cl ZINC000027585523 571318117 /nfs/dbraw/zinc/31/81/17/571318117.db2.gz IERGYJYIMSHPLN-OKILXGFUSA-N 0 0 368.912 5.149 40 0 FKABRN Cc1nn2c(nc(C)cc2N2C[C@@H](C)C[C@H](C)C2)c1-c1ccccc1Cl ZINC000027585532 132916956 /nfs/dbraw/zinc/91/69/56/132916956.db2.gz IERGYJYIMSHPLN-KBPBESRZSA-N 0 0 368.912 5.149 40 0 FKABRN Cc1cc(C)cc(Nc2cc(C)nc3c(-c4ccccc4Cl)cnn32)c1 ZINC000027585597 207936544 /nfs/dbraw/zinc/93/65/44/207936544.db2.gz CPRVEXQXNHERKC-UHFFFAOYSA-N 0 0 362.864 5.719 40 0 FKABRN CCCCc1ccc(Nc2cc(C)nc3c(-c4ccc(C)cc4)cnn32)cc1 ZINC000027585875 571318131 /nfs/dbraw/zinc/31/81/31/571318131.db2.gz XBWDWYDYAYCDJH-UHFFFAOYSA-N 0 0 370.500 6.099 40 0 FKABRN c1nn2c(nc(-c3ccccc3)cc2NC2CCCCC2)c1-c1ccccc1 ZINC000027585967 571016104 /nfs/dbraw/zinc/01/61/04/571016104.db2.gz MZMOMQWVFCVBHW-UHFFFAOYSA-N 0 0 368.484 5.808 40 0 FKABRN CC(C)CCNc1cc(-c2ccccc2)nc2c(-c3ccccc3)cnn21 ZINC000027586046 571015910 /nfs/dbraw/zinc/01/59/10/571015910.db2.gz TWKUJYRRMPMLKS-UHFFFAOYSA-N 0 0 356.473 5.521 40 0 FKABRN CCCCCNc1cc(-c2ccccc2)nc2c(-c3ccccc3)cnn21 ZINC000027586062 211466597 /nfs/dbraw/zinc/46/65/97/211466597.db2.gz JPMZKSMYHQVTRG-UHFFFAOYSA-N 0 0 356.473 5.665 40 0 FKABRN CCOc1ccc(Nc2c(C)c(C)nc3c(-c4ccccc4)cnn32)cc1 ZINC000027586134 571016032 /nfs/dbraw/zinc/01/60/32/571016032.db2.gz QYZOQELTLIJZQQ-UHFFFAOYSA-N 0 0 358.445 5.155 40 0 FKABRN Cc1ccc(Nc2c(C)c(C)nc3c(-c4ccccc4)cnn32)cc1Cl ZINC000027586139 571318125 /nfs/dbraw/zinc/31/81/25/571318125.db2.gz ZBLMJFAEMFACET-UHFFFAOYSA-N 0 0 362.864 5.719 40 0 FKABRN CCCCc1ccc(Nc2c(C)c(C)nc3c(-c4ccccc4)cnn32)cc1 ZINC000027586196 571318129 /nfs/dbraw/zinc/31/81/29/571318129.db2.gz OCAHWBIALHIXFU-UHFFFAOYSA-N 0 0 370.500 6.099 40 0 FKABRN Cc1cc2occ(CC(=O)N3c4ccc(F)cc4CC[C@H]3C)c2c(C)c1 ZINC000027587308 571318149 /nfs/dbraw/zinc/31/81/49/571318149.db2.gz LRNOARJKPSCFDH-OAHLLOKOSA-N 0 0 351.421 5.099 40 0 FKABRN Cc1cc2occ(CC(=O)N3c4ccc(F)cc4CC[C@@H]3C)c2c(C)c1 ZINC000027587313 571318121 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/nfs/dbraw/zinc/05/11/63/571051163.db2.gz HGFWTGMCYFPYMA-UHFFFAOYSA-N 0 0 363.482 5.418 40 0 FKABRN CC(C)C[C@@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1 ZINC000030857708 571051203 /nfs/dbraw/zinc/05/12/03/571051203.db2.gz KEBKMWJCPFNZJR-RUZDIDTESA-N 0 0 371.524 6.112 40 0 FKABRN CC(C)C[C@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1 ZINC000030857714 208005660 /nfs/dbraw/zinc/00/56/60/208005660.db2.gz KEBKMWJCPFNZJR-VWLOTQADSA-N 0 0 371.524 6.112 40 0 FKABRN CC[C@@H](Oc1cccc(OC)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030857786 571051252 /nfs/dbraw/zinc/05/12/52/571051252.db2.gz CYGXLWZPHOACRL-HRAATJIYSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](Oc1cccc(OC)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030857793 571051166 /nfs/dbraw/zinc/05/11/66/571051166.db2.gz CYGXLWZPHOACRL-KKSFZXQISA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@@H](Oc1cccc(OC)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030857798 204912335 /nfs/dbraw/zinc/91/23/35/204912335.db2.gz CYGXLWZPHOACRL-IIBYNOLFSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](Oc1cccc(OC)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030857803 208005320 /nfs/dbraw/zinc/00/53/20/208005320.db2.gz CYGXLWZPHOACRL-IERDGZPVSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1c(C)cccc1C(C)C ZINC000030858745 571051275 /nfs/dbraw/zinc/05/12/75/571051275.db2.gz TWDWORLBPUOAIA-OAQYLSRUSA-N 0 0 361.485 6.068 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1c(C)cccc1C(C)C ZINC000030858751 208006253 /nfs/dbraw/zinc/00/62/53/208006253.db2.gz TWDWORLBPUOAIA-NRFANRHFSA-N 0 0 361.485 6.068 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)/C=C/c2ccccc2Cl)cc1 ZINC000030858817 571051267 /nfs/dbraw/zinc/05/12/67/571051267.db2.gz MCDXZEWAOQUWCE-XEDBTPMOSA-N 0 0 357.881 5.265 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)/C=C/c2ccccc2Cl)cc1 ZINC000030858824 571051170 /nfs/dbraw/zinc/05/11/70/571051170.db2.gz MCDXZEWAOQUWCE-YPNIWSFNSA-N 0 0 357.881 5.265 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000030859426 571051551 /nfs/dbraw/zinc/05/15/51/571051551.db2.gz RYUPMYMXABVYQW-RPWUZVMVSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000030859433 204913037 /nfs/dbraw/zinc/91/30/37/204913037.db2.gz RYUPMYMXABVYQW-ZEQRLZLVSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000030859439 211527765 /nfs/dbraw/zinc/52/77/65/211527765.db2.gz RYUPMYMXABVYQW-DNQXCXABSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000030859445 204912448 /nfs/dbraw/zinc/91/24/48/204912448.db2.gz RYUPMYMXABVYQW-BJKOFHAPSA-N 0 0 373.496 5.367 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 ZINC000030859481 208005615 /nfs/dbraw/zinc/00/56/15/208005615.db2.gz IJKKGIMSKCPTDA-OAHLLOKOSA-N 0 0 357.519 5.502 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1 ZINC000030859485 571051675 /nfs/dbraw/zinc/05/16/75/571051675.db2.gz IJKKGIMSKCPTDA-HNNXBMFYSA-N 0 0 357.519 5.502 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)N[C@@H](c1ccccc1)c1ccccc1C ZINC000030860198 208006363 /nfs/dbraw/zinc/00/63/63/208006363.db2.gz RCYLPAOURIMCQG-RPWUZVMVSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)N[C@@H](c1ccccc1)c1ccccc1C ZINC000030860203 571051438 /nfs/dbraw/zinc/05/14/38/571051438.db2.gz RCYLPAOURIMCQG-ZEQRLZLVSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)N[C@H](c1ccccc1)c1ccccc1C ZINC000030860209 208005371 /nfs/dbraw/zinc/00/53/71/208005371.db2.gz RCYLPAOURIMCQG-DNQXCXABSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)N[C@H](c1ccccc1)c1ccccc1C ZINC000030860215 208006676 /nfs/dbraw/zinc/00/66/76/208006676.db2.gz RCYLPAOURIMCQG-BJKOFHAPSA-N 0 0 373.496 5.367 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1C ZINC000030860325 208006300 /nfs/dbraw/zinc/00/63/00/208006300.db2.gz IPIZVRCZYLMVLX-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1C ZINC000030860331 571051677 /nfs/dbraw/zinc/05/16/77/571051677.db2.gz IPIZVRCZYLMVLX-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)N(Cc1ccccc1)Cc1ccccc1 ZINC000030860545 571051644 /nfs/dbraw/zinc/05/16/44/571051644.db2.gz PURFLSIAUPLBQN-HSZRJFAPSA-N 0 0 373.496 5.381 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N(Cc1ccccc1)Cc1ccccc1 ZINC000030860550 571051674 /nfs/dbraw/zinc/05/16/74/571051674.db2.gz PURFLSIAUPLBQN-QHCPKHFHSA-N 0 0 373.496 5.381 40 0 FKABRN CC[C@@H](NC(=O)/C(=C/c1ccccc1)c1ccccc1)c1ccc(OC)cc1 ZINC000030860642 571051567 /nfs/dbraw/zinc/05/15/67/571051567.db2.gz SKCIXHXWWRNVSO-SGXRDAIWSA-N 0 0 371.480 5.503 40 0 FKABRN CC[C@H](NC(=O)/C(=C/c1ccccc1)c1ccccc1)c1ccc(OC)cc1 ZINC000030860648 204912347 /nfs/dbraw/zinc/91/23/47/204912347.db2.gz SKCIXHXWWRNVSO-WLUIYZDRSA-N 0 0 371.480 5.503 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030860714 571051632 /nfs/dbraw/zinc/05/16/32/571051632.db2.gz AKJLRUUQPNXQKK-MGPUTAFESA-N 0 0 373.924 5.672 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030860720 220627878 /nfs/dbraw/zinc/62/78/78/220627878.db2.gz AKJLRUUQPNXQKK-YWZLYKJASA-N 0 0 373.924 5.672 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030860726 571051624 /nfs/dbraw/zinc/05/16/24/571051624.db2.gz AKJLRUUQPNXQKK-FOIQADDNSA-N 0 0 373.924 5.672 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030860736 571051665 /nfs/dbraw/zinc/05/16/65/571051665.db2.gz AKJLRUUQPNXQKK-QRWLVFNGSA-N 0 0 373.924 5.672 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000030860903 204913042 /nfs/dbraw/zinc/91/30/42/204913042.db2.gz SZSJSLIFWYCYEV-VWNXMTODSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000030860909 571051446 /nfs/dbraw/zinc/05/14/46/571051446.db2.gz SZSJSLIFWYCYEV-UPVQGACJSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000030860914 571051536 /nfs/dbraw/zinc/05/15/36/571051536.db2.gz SZSJSLIFWYCYEV-ISKFKSNPSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 ZINC000030860919 571051472 /nfs/dbraw/zinc/05/14/72/571051472.db2.gz SZSJSLIFWYCYEV-LADGPHEKSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000030861294 571051672 /nfs/dbraw/zinc/05/16/72/571051672.db2.gz FXCDZANAEPNVJT-OAHLLOKOSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000030861299 571051641 /nfs/dbraw/zinc/05/16/41/571051641.db2.gz FXCDZANAEPNVJT-HNNXBMFYSA-N 0 0 358.652 5.443 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000030862864 571051493 /nfs/dbraw/zinc/05/14/93/571051493.db2.gz AMTDVWRKJARRJN-LBPRGKRZSA-N 0 0 352.261 5.523 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000030862869 571051649 /nfs/dbraw/zinc/05/16/49/571051649.db2.gz AMTDVWRKJARRJN-GFCCVEGCSA-N 0 0 352.261 5.523 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)Nc1cccc(Cl)c1Cl ZINC000030863350 571051676 /nfs/dbraw/zinc/05/16/76/571051676.db2.gz NRAJZKQEYMMNKP-OAHLLOKOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)Nc1cccc(Cl)c1Cl ZINC000030863356 220627066 /nfs/dbraw/zinc/62/70/66/220627066.db2.gz NRAJZKQEYMMNKP-HNNXBMFYSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030863729 571051669 /nfs/dbraw/zinc/05/16/69/571051669.db2.gz SCKNKLKBOQHGEI-FXAWDEMLSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030863734 571051671 /nfs/dbraw/zinc/05/16/71/571051671.db2.gz SCKNKLKBOQHGEI-PXNSSMCTSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030863740 571051594 /nfs/dbraw/zinc/05/15/94/571051594.db2.gz SCKNKLKBOQHGEI-YLJYHZDGSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000030863745 571051423 /nfs/dbraw/zinc/05/14/23/571051423.db2.gz SCKNKLKBOQHGEI-XLIONFOSSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000030865083 208006560 /nfs/dbraw/zinc/00/65/60/208006560.db2.gz LATXOPQUEFSCAW-YVEFUNNKSA-N 0 0 351.874 5.227 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000030865088 211526938 /nfs/dbraw/zinc/52/69/38/211526938.db2.gz LATXOPQUEFSCAW-SJCJKPOMSA-N 0 0 351.874 5.227 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000030865090 571051955 /nfs/dbraw/zinc/05/19/55/571051955.db2.gz LATXOPQUEFSCAW-SJKOYZFVSA-N 0 0 351.874 5.227 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000030865092 220626811 /nfs/dbraw/zinc/62/68/11/220626811.db2.gz LATXOPQUEFSCAW-PXAZEXFGSA-N 0 0 351.874 5.227 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)[C@@H](C)Sc1ccccc1)c1ccccc1 ZINC000030865666 204913482 /nfs/dbraw/zinc/91/34/82/204913482.db2.gz VNAXYXHQSBLKHK-GCJKJVERSA-N 0 0 361.510 5.381 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)[C@H](C)Sc1ccccc1)c1ccccc1 ZINC000030865668 211527902 /nfs/dbraw/zinc/52/79/02/211527902.db2.gz VNAXYXHQSBLKHK-AVRDEDQJSA-N 0 0 361.510 5.381 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)[C@@H](C)Sc1ccccc1)c1ccccc1 ZINC000030865673 571051830 /nfs/dbraw/zinc/05/18/30/571051830.db2.gz VNAXYXHQSBLKHK-XMSQKQJNSA-N 0 0 361.510 5.381 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)[C@H](C)Sc1ccccc1)c1ccccc1 ZINC000030865676 211527395 /nfs/dbraw/zinc/52/73/95/211527395.db2.gz VNAXYXHQSBLKHK-PGRDOPGGSA-N 0 0 361.510 5.381 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccccc1SC ZINC000030866165 571051970 /nfs/dbraw/zinc/05/19/70/571051970.db2.gz IWEBGJFWJSCVIO-OAHLLOKOSA-N 0 0 351.924 5.571 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccccc1SC ZINC000030866171 571051945 /nfs/dbraw/zinc/05/19/45/571051945.db2.gz IWEBGJFWJSCVIO-HNNXBMFYSA-N 0 0 351.924 5.571 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(C)c(Cl)c1 ZINC000030867261 208005977 /nfs/dbraw/zinc/00/59/77/208005977.db2.gz STDXFQODRIDZJC-MRXNPFEDSA-N 0 0 354.302 5.811 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(C)c(Cl)c1 ZINC000030867268 204914240 /nfs/dbraw/zinc/91/42/40/204914240.db2.gz STDXFQODRIDZJC-INIZCTEOSA-N 0 0 354.302 5.811 40 0 FKABRN CCSc1ccccc1NC(=O)c1ccccc1OCc1ccccc1 ZINC000030867615 571051965 /nfs/dbraw/zinc/05/19/65/571051965.db2.gz JZZNDYQHOHCBFC-UHFFFAOYSA-N 0 0 363.482 5.630 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1c(Cl)cccc1Cl ZINC000030868659 571051787 /nfs/dbraw/zinc/05/17/87/571051787.db2.gz RPTGYFGRIOXWEZ-CQSZACIVSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)Nc1c(Cl)cccc1Cl ZINC000030868665 204913880 /nfs/dbraw/zinc/91/38/80/204913880.db2.gz RPTGYFGRIOXWEZ-AWEZNQCLSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@@H](NC(=O)c1cccc(OCc2ccccc2)c1)c1ccc(C)cc1 ZINC000030869604 204913429 /nfs/dbraw/zinc/91/34/29/204913429.db2.gz LXGJTOIGXLPTNE-HSZRJFAPSA-N 0 0 359.469 5.455 40 0 FKABRN CC[C@H](NC(=O)c1cccc(OCc2ccccc2)c1)c1ccc(C)cc1 ZINC000030869609 208006108 /nfs/dbraw/zinc/00/61/08/208006108.db2.gz LXGJTOIGXLPTNE-QHCPKHFHSA-N 0 0 359.469 5.455 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NCc3ccc(F)cc3)cc2)cc1 ZINC000030870248 208005932 /nfs/dbraw/zinc/00/59/32/208005932.db2.gz CQHVBRKNFTYJLP-UHFFFAOYSA-N 0 0 365.473 5.356 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)cc1 ZINC000030870547 571051740 /nfs/dbraw/zinc/05/17/40/571051740.db2.gz OAYCCXLKMMYPIG-JXFKEZNVSA-N 0 0 357.519 5.079 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)cc1 ZINC000030870554 571052187 /nfs/dbraw/zinc/05/21/87/571052187.db2.gz OAYCCXLKMMYPIG-UZLBHIALSA-N 0 0 357.519 5.079 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)cc1 ZINC000030870560 571052271 /nfs/dbraw/zinc/05/22/71/571052271.db2.gz OAYCCXLKMMYPIG-OXJNMPFZSA-N 0 0 357.519 5.079 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)cc1 ZINC000030870563 204913816 /nfs/dbraw/zinc/91/38/16/204913816.db2.gz OAYCCXLKMMYPIG-OXQOHEQNSA-N 0 0 357.519 5.079 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1c(Cl)cccc1Cl ZINC000030870998 571052411 /nfs/dbraw/zinc/05/24/11/571052411.db2.gz JBNIUBGPMMKYJZ-GOSISDBHSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1c(Cl)cccc1Cl ZINC000030871003 220628036 /nfs/dbraw/zinc/62/80/36/220628036.db2.gz JBNIUBGPMMKYJZ-SFHVURJKSA-N 0 0 374.267 5.943 40 0 FKABRN O=C(NC1CCCCCCC1)c1ccc(CN2CCc3ccccc32)cc1 ZINC000030871134 208006543 /nfs/dbraw/zinc/00/65/43/208006543.db2.gz ZCYATQMQQKKYFP-UHFFFAOYSA-N 0 0 362.517 5.092 40 0 FKABRN CC[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(OC)cc1 ZINC000030871490 208006341 /nfs/dbraw/zinc/00/63/41/208006341.db2.gz AZKOEMYJMAHZIN-JGZYNSJSSA-N 0 0 364.272 5.283 40 0 FKABRN CC[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc(OC)cc1 ZINC000030871498 208006247 /nfs/dbraw/zinc/00/62/47/208006247.db2.gz AZKOEMYJMAHZIN-DBEXCURXSA-N 0 0 364.272 5.283 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000030872520 208007766 /nfs/dbraw/zinc/00/77/66/208007766.db2.gz HNMFQSWIKDDVPD-FDDCHVKYSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000030872527 208008281 /nfs/dbraw/zinc/00/82/81/208008281.db2.gz HNMFQSWIKDDVPD-MBSDFSHPSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000030872534 571052306 /nfs/dbraw/zinc/05/23/06/571052306.db2.gz HNMFQSWIKDDVPD-WZONZLPQSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000030872541 204913415 /nfs/dbraw/zinc/91/34/15/204913415.db2.gz HNMFQSWIKDDVPD-JPYJTQIMSA-N 0 0 361.485 5.491 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)COc2ccc(C(C)C)cc2)cc1 ZINC000030872725 571052198 /nfs/dbraw/zinc/05/21/98/571052198.db2.gz LJIUTBSWHPGEKZ-JOCHJYFZSA-N 0 0 369.505 5.101 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)COc2ccc(C(C)C)cc2)cc1 ZINC000030872729 571052164 /nfs/dbraw/zinc/05/21/64/571052164.db2.gz LJIUTBSWHPGEKZ-QFIPXVFZSA-N 0 0 369.505 5.101 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1C ZINC000030873514 571052230 /nfs/dbraw/zinc/05/22/30/571052230.db2.gz VNYDABOUQXJHPA-MRXNPFEDSA-N 0 0 354.302 5.811 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1C ZINC000030873520 571052302 /nfs/dbraw/zinc/05/23/02/571052302.db2.gz VNYDABOUQXJHPA-INIZCTEOSA-N 0 0 354.302 5.811 40 0 FKABRN CCCCC/C=C\C/C=C\CCCCCc1cc(=O)c2ccccc2n1C ZINC000031168178 209847100 /nfs/dbraw/zinc/84/71/00/209847100.db2.gz ZVODRCBOPULJKJ-NQLNTKRDSA-N 0 0 365.561 6.724 40 0 biogenic,in-vitro FKABRN COc1cc(CCc2ccccc2)cc(O)c1C/C=C(\C)CCC=C(C)C ZINC000031169794 220635338 /nfs/dbraw/zinc/63/53/38/220635338.db2.gz ZDSBUUDXDQSCSK-DEDYPNTBSA-N 0 0 364.529 6.421 40 0 biogenic,in-vitro FKABRN CCCC[C@@H](CC)COC(=O)CSCC(=O)OC[C@@H](CC)CCCC ZINC000031332713 220636250 /nfs/dbraw/zinc/63/62/50/220636250.db2.gz KYWZILPIDASSGE-HDICACEKSA-N 0 0 374.587 5.239 40 0 FKABRN Clc1c(CN2CCOCC2)c(-c2ccccc2)oc1-c1ccccc1 ZINC000031628122 571054871 /nfs/dbraw/zinc/05/48/71/571054871.db2.gz RMMUVYUNHPHWEI-UHFFFAOYSA-N 0 0 353.849 5.099 40 0 FKABRN Clc1ccc([C@@H]2N[C@@H](c3ccccc3)c3c(ccc4ccccc43)O2)cc1 ZINC000031716554 570798557 /nfs/dbraw/zinc/79/85/57/570798557.db2.gz PTSGIYDZVYWRDZ-BJKOFHAPSA-N 0 0 371.867 6.263 40 0 FKABRN Clc1ccc([C@H]2N[C@@H](c3ccccc3)c3c(ccc4ccccc43)O2)cc1 ZINC000031716557 570798474 /nfs/dbraw/zinc/79/84/74/570798474.db2.gz PTSGIYDZVYWRDZ-ZEQRLZLVSA-N 0 0 371.867 6.263 40 0 FKABRN Clc1ccc([C@@H]2N[C@H](c3ccccc3)c3c(ccc4ccccc43)O2)cc1 ZINC000031716560 570798334 /nfs/dbraw/zinc/79/83/34/570798334.db2.gz PTSGIYDZVYWRDZ-DNQXCXABSA-N 0 0 371.867 6.263 40 0 FKABRN Clc1ccc([C@H]2N[C@H](c3ccccc3)c3c(ccc4ccccc43)O2)cc1 ZINC000031716562 570798544 /nfs/dbraw/zinc/79/85/44/570798544.db2.gz PTSGIYDZVYWRDZ-RPWUZVMVSA-N 0 0 371.867 6.263 40 0 FKABRN Clc1ccc2c(c1)[C@@H](N1CCOCC1)c1cc(Cl)cc(Cl)c1-2 ZINC000031716943 571055572 /nfs/dbraw/zinc/05/55/72/571055572.db2.gz ZSAJFHMQCNMWHR-QGZVFWFLSA-N 0 0 354.664 5.049 40 0 FKABRN Clc1ccc2c(c1)[C@H](N1CCOCC1)c1cc(Cl)cc(Cl)c1-2 ZINC000031716946 208016318 /nfs/dbraw/zinc/01/63/18/208016318.db2.gz ZSAJFHMQCNMWHR-KRWDZBQOSA-N 0 0 354.664 5.049 40 0 FKABRN CC(C)c1cc(C(C)C)c(S(=O)(=O)/C=C\c2ccccc2)c(C(C)C)c1 ZINC000031717101 571055421 /nfs/dbraw/zinc/05/54/21/571055421.db2.gz JDCBWDMWRVHKRK-SEYXRHQNSA-N 0 0 370.558 6.501 40 0 FKABRN Cc1cc2c(c3ncccc13)OCN(Cc1ccc(Cl)c(Cl)c1)C2 ZINC000031750087 208014895 /nfs/dbraw/zinc/01/48/95/208014895.db2.gz KDEITHYFXWZGMV-UHFFFAOYSA-N 0 0 359.256 5.202 40 0 FKABRN CCCCCCC1(/C=C\c2ccc(Cl)c(Cl)c2)OCC(C)(C)CO1 ZINC000031760242 571055628 /nfs/dbraw/zinc/05/56/28/571055628.db2.gz BNZIKIWRXIXSSB-BENRWUELSA-N 0 0 371.348 6.746 40 0 FKABRN O[C@@](/C=C\c1ccccc1)(Cc1cc(-c2ccccc2)n[nH]1)c1ccccc1 ZINC000031773093 571055674 /nfs/dbraw/zinc/05/56/74/571055674.db2.gz LEJPMTCEIUFHGJ-VCLNNIJQSA-N 0 0 366.464 5.220 40 0 FKABRN CC[C@@H]1C(C(=O)Nc2ccccc2C)=C(C)NC(C)=C1c1ccccc1C ZINC000031830009 571056099 /nfs/dbraw/zinc/05/60/99/571056099.db2.gz UDMSAUKWVVBPKY-IBGZPJMESA-N 0 0 360.501 5.577 40 0 FKABRN CC[C@H]1C(C(=O)Nc2ccccc2C)=C(C)NC(C)=C1c1ccccc1C ZINC000031830010 571056195 /nfs/dbraw/zinc/05/61/95/571056195.db2.gz UDMSAUKWVVBPKY-LJQANCHMSA-N 0 0 360.501 5.577 40 0 FKABRN NC1=CSC2=NC3=C(CCCC3=Cc3ccccc3)[C@@H](c3ccccc3)N12 ZINC000031841158 208019906 /nfs/dbraw/zinc/01/99/06/208019906.db2.gz ZFMXFZRSVPPFHE-GRHNRDKSSA-N 0 0 371.509 5.645 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000031866828 263392197 /nfs/dbraw/zinc/39/21/97/263392197.db2.gz ZQCNJFVFQJZNGP-GOSISDBHSA-N 0 0 361.510 5.381 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000031866829 263392149 /nfs/dbraw/zinc/39/21/49/263392149.db2.gz ZQCNJFVFQJZNGP-SFHVURJKSA-N 0 0 361.510 5.381 40 0 FKABRN Brc1cccc(Cn2c3ccccc3nc2-c2cccs2)c1 ZINC000031903316 571056068 /nfs/dbraw/zinc/05/60/68/571056068.db2.gz VHHYWZISGVJRCW-UHFFFAOYSA-N 0 0 369.287 5.576 40 0 FKABRN COc1ccc(OCCCn2c3ccccc3nc2-c2cccs2)cc1 ZINC000031903317 208020470 /nfs/dbraw/zinc/02/04/70/208020470.db2.gz QQDCDZJERFTRGZ-UHFFFAOYSA-N 0 0 364.470 5.243 40 0 FKABRN Brc1cccc(Cn2c3ccccc3nc2-c2ccco2)c1 ZINC000031903318 208019261 /nfs/dbraw/zinc/01/92/61/208019261.db2.gz QPOFPDFAEZRARX-UHFFFAOYSA-N 0 0 353.219 5.107 40 0 FKABRN CC[C@@H](C)c1ccc(Cn2c3ccccc3nc2-c2ccc(OC)cc2)cc1 ZINC000031903347 208019282 /nfs/dbraw/zinc/01/92/82/208019282.db2.gz SFVYAAMRTVAEHZ-GOSISDBHSA-N 0 0 370.496 6.274 40 0 FKABRN CC[C@H](C)c1ccc(Cn2c3ccccc3nc2-c2ccc(OC)cc2)cc1 ZINC000031903348 571294385 /nfs/dbraw/zinc/29/43/85/571294385.db2.gz SFVYAAMRTVAEHZ-SFHVURJKSA-N 0 0 370.496 6.274 40 0 FKABRN CC1(C)c2ccc(Br)cc2-c2ccc(Br)cc21 ZINC000032098762 204925567 /nfs/dbraw/zinc/92/55/67/204925567.db2.gz ASUQXIDYMVXFKU-UHFFFAOYSA-N 0 0 352.069 5.518 40 0 FKABRN ClC(Cl)(Cl)c1cc(C(Cl)(Cl)Cl)c2ccccc2n1 ZINC000032099673 211544324 /nfs/dbraw/zinc/54/43/24/211544324.db2.gz XITQDHMQIVKTSO-UHFFFAOYSA-N 0 0 363.886 5.888 40 0 FKABRN O=C(CSc1nc2ccccc2o1)Nc1ccc2oc3ccccc3c2c1 ZINC000032109769 208025541 /nfs/dbraw/zinc/02/55/41/208025541.db2.gz XBXLWJVCGLGMGU-UHFFFAOYSA-N 0 0 374.421 5.458 40 0 FKABRN Cc1ccc(Cl)cc1-c1ccc(/C=C2\SC(=O)N(C(C)C)C2=O)o1 ZINC000032109782 571056958 /nfs/dbraw/zinc/05/69/58/571056958.db2.gz JSIYDWTZNGDBJQ-SXGWCWSVSA-N 0 0 361.850 5.353 40 0 FKABRN S=C(Nc1ccc(Cc2ccncc2)cc1)Nc1ccc2ccccc2c1 ZINC000032109807 571056894 /nfs/dbraw/zinc/05/68/94/571056894.db2.gz YTRUMGAAXWCNSI-UHFFFAOYSA-N 0 0 369.493 5.635 40 0 FKABRN CCCCC(=O)Nc1ccc(NC(=O)c2ccc(C)c(Cl)c2)cc1OC ZINC000032114759 571057068 /nfs/dbraw/zinc/05/70/68/571057068.db2.gz MTFZFVAFUAUIGJ-UHFFFAOYSA-N 0 0 374.868 5.038 40 0 FKABRN CCCCC(=O)Nc1ccc(NC(=O)c2ccc(C)cc2Cl)cc1OC ZINC000032115041 571056743 /nfs/dbraw/zinc/05/67/43/571056743.db2.gz QRLRHGOHMMKYIJ-UHFFFAOYSA-N 0 0 374.868 5.038 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc3oc(-c4ccc(C)c(C)c4)nc3c2)cc1C ZINC000032116701 571057065 /nfs/dbraw/zinc/05/70/65/571057065.db2.gz WTDHORJOPOOCBA-UHFFFAOYSA-N 0 0 370.452 5.981 40 0 FKABRN CCc1ccc(C(=O)C[C@@H](Nc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000032117622 211544879 /nfs/dbraw/zinc/54/48/79/211544879.db2.gz JIYLUHOFIPDKKQ-HSZRJFAPSA-N 0 0 359.469 5.684 40 0 FKABRN CCc1ccc(C(=O)C[C@H](Nc2ccccc2)c2ccc(OC)cc2)cc1 ZINC000032117624 568351154 /nfs/dbraw/zinc/35/11/54/568351154.db2.gz JIYLUHOFIPDKKQ-QHCPKHFHSA-N 0 0 359.469 5.684 40 0 FKABRN Cc1nnc(SCc2ccc(C(=O)Nc3c(C)cccc3C)cc2)s1 ZINC000032117665 220656996 /nfs/dbraw/zinc/65/69/96/220656996.db2.gz KVZXGSATXCSCSK-UHFFFAOYSA-N 0 0 369.515 5.008 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1ccc(CSCc2ccco2)cc1 ZINC000032117667 568351132 /nfs/dbraw/zinc/35/11/32/568351132.db2.gz XZZXXDJGHOILPZ-UHFFFAOYSA-N 0 0 351.471 5.582 40 0 FKABRN CCCCc1ccc2nc(NC(=O)c3cccc(C)c3OC)sc2c1 ZINC000032118631 571056943 /nfs/dbraw/zinc/05/69/43/571056943.db2.gz IBFHHVWODRAQHJ-UHFFFAOYSA-N 0 0 354.475 5.208 40 0 FKABRN CCCCc1ccc2nc(NC(=O)COc3ccc(C)cc3C)sc2c1 ZINC000032118633 204926941 /nfs/dbraw/zinc/92/69/41/204926941.db2.gz LXKZVPKVZMFLLY-UHFFFAOYSA-N 0 0 368.502 5.273 40 0 FKABRN CCCCc1ccc2nc(NC(=O)/C=C/c3ccc(Cl)cc3)sc2c1 ZINC000032118645 571057094 /nfs/dbraw/zinc/05/70/94/571057094.db2.gz JDRGAHOBKQJSIH-XYOKQWHBSA-N 0 0 370.905 5.944 40 0 FKABRN CCCCc1ccc2nc(NC(=O)COc3ccc(Cl)cc3)sc2c1 ZINC000032118819 204927013 /nfs/dbraw/zinc/92/70/13/204927013.db2.gz RFIXSZBUJSBYMA-UHFFFAOYSA-N 0 0 374.893 5.310 40 0 FKABRN CCCCc1ccc2nc(NC(=O)c3ccc(C)c(Cl)c3)sc2c1 ZINC000032118917 571057072 /nfs/dbraw/zinc/05/70/72/571057072.db2.gz WXDSMQAIDXPXID-UHFFFAOYSA-N 0 0 358.894 5.853 40 0 FKABRN CCCCc1ccc2nc(NC(=O)COc3ccc(CC)cc3)sc2c1 ZINC000032118943 571057468 /nfs/dbraw/zinc/05/74/68/571057468.db2.gz OOHFJCKDVGPCTG-UHFFFAOYSA-N 0 0 368.502 5.219 40 0 FKABRN CCCCc1ccc2nc(NC(=O)COc3ccc(C)c(C)c3)sc2c1 ZINC000032119047 571057286 /nfs/dbraw/zinc/05/72/86/571057286.db2.gz SKNNRCNWMKRCPL-UHFFFAOYSA-N 0 0 368.502 5.273 40 0 FKABRN CCCCc1ccc2nc(NC(=O)COc3cc(C)cc(C)c3)sc2c1 ZINC000032119137 571057309 /nfs/dbraw/zinc/05/73/09/571057309.db2.gz KJAMBSTXWRHJQB-UHFFFAOYSA-N 0 0 368.502 5.273 40 0 FKABRN O=C(NC1C2CC3CC(C2)CC1C3)c1ccc(-c2cccc(Cl)c2)o1 ZINC000032119247 211544481 /nfs/dbraw/zinc/54/44/81/211544481.db2.gz XVZDLEAOFZRTMZ-UHFFFAOYSA-N 0 0 355.865 5.155 40 0 FKABRN CCOc1ccc(NCCC(=O)c2ccc3c(c2)Cc2ccccc2-3)cc1 ZINC000032119691 568351491 /nfs/dbraw/zinc/35/14/91/568351491.db2.gz KFIUFEFHZJTTIE-UHFFFAOYSA-N 0 0 357.453 5.341 40 0 FKABRN CCCCCC(=O)Nc1cccc(-c2nc3c(ccc4ccccc34)o2)c1 ZINC000032126346 571057430 /nfs/dbraw/zinc/05/74/30/571057430.db2.gz GWXFBODWYMNCHX-UHFFFAOYSA-N 0 0 358.441 6.167 40 0 FKABRN COc1cc2sc(NC(=O)c3ccc(C)c(Cl)c3)nc2cc1Cl ZINC000032127654 571057293 /nfs/dbraw/zinc/05/72/93/571057293.db2.gz LZAMYFPVXATMGX-UHFFFAOYSA-N 0 0 367.257 5.172 40 0 FKABRN Cc1sc(NC(=O)c2ccccc2)nc1-c1ccc(Cl)cc1Cl ZINC000032189117 571057382 /nfs/dbraw/zinc/05/73/82/571057382.db2.gz XBPWKIAVLDOZGW-UHFFFAOYSA-N 0 0 363.269 5.678 40 0 FKABRN CCC1CCC(C2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1 ZINC000032223378 571083347 /nfs/dbraw/zinc/08/33/47/571083347.db2.gz PBIFTROFCZATFC-UHFFFAOYSA-N 0 0 354.456 7.075 40 0 FKABRN O=C(CCCc1nc2ccccc2o1)Nc1ccc2c(c1)oc1ccccc12 ZINC000032252622 571057782 /nfs/dbraw/zinc/05/77/82/571057782.db2.gz QYJDPFAGSALYCM-UHFFFAOYSA-N 0 0 370.408 5.689 40 0 FKABRN O=C1CS[C@@H](c2ccc(Cl)cc2)N1c1nc(-c2ccccc2)cs1 ZINC000032597911 571058664 /nfs/dbraw/zinc/05/86/64/571058664.db2.gz CPKQKGVAOXXTBD-KRWDZBQOSA-N 0 0 372.902 5.242 40 0 FKABRN O=C1CS[C@H](c2ccc(Cl)cc2)N1c1nc(-c2ccccc2)cs1 ZINC000032597914 571058722 /nfs/dbraw/zinc/05/87/22/571058722.db2.gz CPKQKGVAOXXTBD-QGZVFWFLSA-N 0 0 372.902 5.242 40 0 FKABRN Fc1ccc(-c2nnc(SCc3cccc(Cl)c3)n2C2CC2)cc1 ZINC000032604182 568397246 /nfs/dbraw/zinc/39/72/46/568397246.db2.gz UUTOFQXCDQHEQJ-UHFFFAOYSA-N 0 0 359.857 5.365 40 0 FKABRN O=C(CSc1cccc2ccccc21)Nc1ccc(Cl)c(Cl)c1 ZINC000032691933 571305370 /nfs/dbraw/zinc/30/53/70/571305370.db2.gz WQNCIAHHIJLKFC-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN O=C(CSc1cccc2ccccc21)Nc1cc(Cl)cc(Cl)c1 ZINC000032692212 571305348 /nfs/dbraw/zinc/30/53/48/571305348.db2.gz XFBKXKWQTXWYJZ-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN O=C(CSc1ccc2ccccc2c1)Nc1ccc(Cl)cc1Cl ZINC000032692253 571083667 /nfs/dbraw/zinc/08/36/67/571083667.db2.gz NNZNOBGQWXXIBZ-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN O=C(CSc1cccc2ccccc21)Nc1ccc(Cl)cc1Cl ZINC000032692254 571083721 /nfs/dbraw/zinc/08/37/21/571083721.db2.gz QQSHTXLGWZJYTL-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN O=C(CSc1cccc2ccccc21)Nc1cc(Cl)ccc1Cl ZINC000032692273 571305402 /nfs/dbraw/zinc/30/54/02/571305402.db2.gz JBWGCOWZWMNPGK-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN O=C(CSc1cccc2ccccc21)Nc1ccc(Br)cc1 ZINC000032692527 570864533 /nfs/dbraw/zinc/86/45/33/570864533.db2.gz MJDXCGXXNHWSAH-UHFFFAOYSA-N 0 0 372.287 5.333 40 0 FKABRN O=C(CSc1ccc2ccccc2c1)Nc1cccc(Cl)c1Cl ZINC000032693358 571305313 /nfs/dbraw/zinc/30/53/13/571305313.db2.gz FTOADDZNEATACQ-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN O=C(CSc1cccc2ccccc21)Nc1cccc(Cl)c1Cl ZINC000032693359 571305536 /nfs/dbraw/zinc/30/55/36/571305536.db2.gz POEBTYPABFLNSN-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN O=C(CSc1cccc2ccccc21)Nc1c(Cl)cccc1Cl ZINC000032695747 571305488 /nfs/dbraw/zinc/30/54/88/571305488.db2.gz WDZCNVZKDGQDJM-UHFFFAOYSA-N 0 0 362.281 5.877 40 0 FKABRN CCOc1ccc2ccccc2c1/C=C(\C#N)C(=O)Nc1cc(C)ccc1C ZINC000032752550 571305500 /nfs/dbraw/zinc/30/55/00/571305500.db2.gz KMRKTLLWTDBWRD-XMHGGMMESA-N 0 0 370.452 5.401 40 0 FKABRN Cc1ccc(NCN2C(=O)S/C(=C/c3ccc(C(C)C)cc3)C2=O)cc1 ZINC000033347379 571305528 /nfs/dbraw/zinc/30/55/28/571305528.db2.gz CGIDRWMKGKVJTC-XDHOZWIPSA-N 0 0 366.486 5.224 40 0 FKABRN c1ccc(NN=C(N=Nc2nc3ccccc3s2)c2ccccc2)cc1 ZINC000033387420 571134188 /nfs/dbraw/zinc/13/41/88/571134188.db2.gz OPOMTHCDFJEKJO-JRZMRYEWSA-N 0 0 357.442 5.854 40 0 FKABRN CCCCC/C=C/C/C=C\CCCCCCCCCCCC(=O)OC ZINC000033416901 571065067 /nfs/dbraw/zinc/06/50/67/571065067.db2.gz UPIRHFZFPVEDCF-LFOHPMNASA-N 0 0 350.587 7.533 40 0 FKABRN CCCCC/C=C\C/C=C/CCCCCCCCCCCC(=O)OC ZINC000033416902 204969875 /nfs/dbraw/zinc/96/98/75/204969875.db2.gz UPIRHFZFPVEDCF-QEFCTBRHSA-N 0 0 350.587 7.533 40 0 FKABRN O=C(CSc1cccc2cccnc21)Nc1ccc(Cl)cc1Cl ZINC000033474899 263395582 /nfs/dbraw/zinc/39/55/82/263395582.db2.gz LOSXDHQYOGNBQC-UHFFFAOYSA-N 0 0 363.269 5.272 40 0 FKABRN Cc1ccc(CN(c2cc(C)cc(C)c2)S(=O)(=O)c2ccccc2)cc1 ZINC000033500368 571305529 /nfs/dbraw/zinc/30/55/29/571305529.db2.gz WCZJGUMIXBBUNJ-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccc(CC)cc4)nc3c2)cc1 ZINC000033505480 571305481 /nfs/dbraw/zinc/30/54/81/571305481.db2.gz RRVZFOQFTYSOMY-UHFFFAOYSA-N 0 0 370.452 5.872 40 0 FKABRN Cc1ccc(N(Cc2ccccc2C)S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000033526485 571305532 /nfs/dbraw/zinc/30/55/32/571305532.db2.gz YLFLBDSZEKVWQZ-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN CCCc1cc(Nc2ccc(Cl)cc2)n2nc3nc(C)cc(C)c3c2n1 ZINC000033544612 571065407 /nfs/dbraw/zinc/06/54/07/571065407.db2.gz HMYRWKUJICDMIV-UHFFFAOYSA-N 0 0 365.868 5.244 40 0 FKABRN Clc1ccc(OCc2ccccc2)c(CNc2ccccc2Cl)c1 ZINC000033546261 571305514 /nfs/dbraw/zinc/30/55/14/571305514.db2.gz JFIMAQDZFCCEIW-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Clc1cccc(COc2ccc(CNc3ccccc3Cl)cc2)c1 ZINC000033556282 571305505 /nfs/dbraw/zinc/30/55/05/571305505.db2.gz XPWWSHJTOBLQDT-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN COc1ccc(/C=C/c2nc3ccccc3nc2OCc2ccccc2)cc1 ZINC000033561555 571065921 /nfs/dbraw/zinc/06/59/21/571065921.db2.gz KGRQARDJXIZCPH-DTQAZKPQSA-N 0 0 368.436 5.388 40 0 FKABRN Cc1ccc(CN(c2cccc(C)c2C)S(=O)(=O)c2ccccc2)cc1 ZINC000033571672 571305495 /nfs/dbraw/zinc/30/54/95/571305495.db2.gz BLDSXZDFSYADOL-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cn1c(SCc2ccc(F)cc2)nnc1-c1cc2cc(Cl)ccc2o1 ZINC000033596097 571305484 /nfs/dbraw/zinc/30/54/84/571305484.db2.gz JRNRAASUOKIMIN-UHFFFAOYSA-N 0 0 373.840 5.313 40 0 FKABRN CC[C@@H](NC(=S)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 ZINC000033597032 571065945 /nfs/dbraw/zinc/06/59/45/571065945.db2.gz PUFBECYWDSUZHU-OAHLLOKOSA-N 0 0 372.843 5.797 40 0 FKABRN CC[C@H](NC(=S)Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 ZINC000033597033 208096252 /nfs/dbraw/zinc/09/62/52/208096252.db2.gz PUFBECYWDSUZHU-HNNXBMFYSA-N 0 0 372.843 5.797 40 0 FKABRN CC1CCN(C(=S)c2ccccc2OCc2ccccc2Cl)CC1 ZINC000033598121 263396596 /nfs/dbraw/zinc/39/65/96/263396596.db2.gz YZANOFGTBGCQLM-UHFFFAOYSA-N 0 0 359.922 5.326 40 0 FKABRN Cc1ccccc1N(Cc1cccc(Cl)c1)S(=O)(=O)c1ccccc1 ZINC000033601202 571305631 /nfs/dbraw/zinc/30/56/31/571305631.db2.gz QBXYYSHNRDCOHK-UHFFFAOYSA-N 0 0 371.889 5.044 40 0 FKABRN CC1CCN(C(=S)c2ccccc2OCc2ccc(Cl)cc2)CC1 ZINC000033603506 571305636 /nfs/dbraw/zinc/30/56/36/571305636.db2.gz SJGGSXBDDVMBQE-UHFFFAOYSA-N 0 0 359.922 5.326 40 0 FKABRN CC(C)(C)SCCNC(=S)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000033607736 571065942 /nfs/dbraw/zinc/06/59/42/571065942.db2.gz XXWMMHQHKVQZSJ-UHFFFAOYSA-N 0 0 370.893 5.177 40 0 FKABRN COc1ccccc1OCc1ccc(C(=O)Nc2ccc(C)cc2C)cc1 ZINC000033611877 571305651 /nfs/dbraw/zinc/30/56/51/571305651.db2.gz JKOIIBRLFPRCQS-UHFFFAOYSA-N 0 0 361.441 5.143 40 0 FKABRN O=C(c1cccs1)c1cn(Cc2c(F)cccc2Cl)c2ccccc12 ZINC000033619843 570865105 /nfs/dbraw/zinc/86/51/05/570865105.db2.gz YEOVLLOLEWVXKL-UHFFFAOYSA-N 0 0 369.848 5.775 40 0 FKABRN Cc1ccc(COc2ccc(Cl)cc2CNc2ccc(Cl)cc2)cc1 ZINC000033620800 263396516 /nfs/dbraw/zinc/39/65/16/263396516.db2.gz SKVZOHYOISYGOG-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCCC(=O)c1cn(CC(=O)Nc2cccc3ccccc32)c2ccccc12 ZINC000033621521 571305622 /nfs/dbraw/zinc/30/56/22/571305622.db2.gz WLEZGYFBNVXKIY-UHFFFAOYSA-N 0 0 370.452 5.416 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)Nc3ccc(Cl)cc3)cc2)cc1 ZINC000033633927 571305634 /nfs/dbraw/zinc/30/56/34/571305634.db2.gz DCQKNGRKPCUXTE-UHFFFAOYSA-N 0 0 367.901 6.193 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2ccc(CC)cc2)cc1OCC ZINC000033643933 571305661 /nfs/dbraw/zinc/30/56/61/571305661.db2.gz RVWHJUZJCNTKEQ-UHFFFAOYSA-N 0 0 361.869 5.342 40 0 FKABRN Cc1ccc(-c2ccc(C(=O)Nc3cc(Cl)cc(Cl)c3)o2)cc1C ZINC000033644800 571085125 /nfs/dbraw/zinc/08/51/25/571085125.db2.gz YZJKEAJITIYJKL-UHFFFAOYSA-N 0 0 360.240 6.123 40 0 FKABRN CCOc1cc(CNc2cccc(Cl)c2)ccc1OCc1ccccc1 ZINC000033649549 263396637 /nfs/dbraw/zinc/39/66/37/263396637.db2.gz YGMSDFVHLBXXKL-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN Clc1ccccc1COc1cccc(CNc2ccccc2Cl)c1 ZINC000033650937 571305607 /nfs/dbraw/zinc/30/56/07/571305607.db2.gz MUBZCMJOZXUUQN-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN O=C(O[C@@H](C(=O)c1ccccc1)c1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000033652617 571305627 /nfs/dbraw/zinc/30/56/27/571305627.db2.gz TWYZOCFOYYKDLN-HXUWFJFHSA-N 0 0 368.791 5.260 40 0 FKABRN O=C(O[C@H](C(=O)c1ccccc1)c1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000033652618 571305652 /nfs/dbraw/zinc/30/56/52/571305652.db2.gz TWYZOCFOYYKDLN-FQEVSTJZSA-N 0 0 368.791 5.260 40 0 FKABRN Cc1ccc(CN(c2ccc(C)cc2C)S(=O)(=O)c2ccccc2)cc1 ZINC000033652881 571305606 /nfs/dbraw/zinc/30/56/06/571305606.db2.gz URATVWWRBDSDLW-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Fc1ccccc1COc1ccc(C(=S)N2CCCCC2)cc1Cl ZINC000033653863 571305670 /nfs/dbraw/zinc/30/56/70/571305670.db2.gz GOMOMRPBEJYOQJ-UHFFFAOYSA-N 0 0 363.885 5.220 40 0 FKABRN Fc1ccc(COc2ccc(C(=S)N3CCCCC3)cc2Cl)cc1 ZINC000033654678 571305623 /nfs/dbraw/zinc/30/56/23/571305623.db2.gz LBNSMNXWODLJMQ-UHFFFAOYSA-N 0 0 363.885 5.220 40 0 FKABRN Cc1cccc(CN(c2c(C)cccc2C)S(=O)(=O)c2ccccc2)c1 ZINC000033654996 571085179 /nfs/dbraw/zinc/08/51/79/571085179.db2.gz QNEKGENUVBLMHE-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1ccc(C(=O)Nc2cccc(Cl)c2N2CCCCC2)cc1Cl ZINC000033655319 571305671 /nfs/dbraw/zinc/30/56/71/571305671.db2.gz XLJKPCXQVFHDSX-UHFFFAOYSA-N 0 0 363.288 5.544 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2cccc3ccccc32)cc1OC ZINC000033660471 571305626 /nfs/dbraw/zinc/30/56/26/571305626.db2.gz CRJWLSPSSWISET-UHFFFAOYSA-N 0 0 369.848 5.543 40 0 FKABRN S=C(c1ccc(OCc2ccc(Cl)cc2)c(Cl)c1)N1CCCC1 ZINC000033663159 571305794 /nfs/dbraw/zinc/30/57/94/571305794.db2.gz SKBYWAXMXFFAFO-UHFFFAOYSA-N 0 0 366.313 5.344 40 0 FKABRN CCCC(=O)c1cn(CCCOc2ccccc2Cl)c2ccccc12 ZINC000033663302 571305766 /nfs/dbraw/zinc/30/57/66/571305766.db2.gz FJIXKYRJDUBGBM-UHFFFAOYSA-N 0 0 355.865 5.747 40 0 FKABRN FC(F)(F)c1nc(SCc2cccc3ccccc32)nc2c1CCC2 ZINC000033663304 571305773 /nfs/dbraw/zinc/30/57/73/571305773.db2.gz DOMIZKXJIDVVPH-UHFFFAOYSA-N 0 0 360.404 5.430 40 0 FKABRN CCOc1cc(COc2ccc(C=O)cc2)ccc1OCc1ccccc1 ZINC000033666734 571305739 /nfs/dbraw/zinc/30/57/39/571305739.db2.gz PRMWCMJEWYLYLN-UHFFFAOYSA-N 0 0 362.425 5.056 40 0 FKABRN Cc1ccc(-c2ccc(C(=O)Nc3ccccc3Br)o2)cc1C ZINC000033668862 571305757 /nfs/dbraw/zinc/30/57/57/571305757.db2.gz OZZHGKZHHMZEPH-UHFFFAOYSA-N 0 0 370.246 5.578 40 0 FKABRN Fc1cccc(COc2ccc(C(=S)N3CCCCC3)cc2Cl)c1 ZINC000033668931 571305762 /nfs/dbraw/zinc/30/57/62/571305762.db2.gz NGIIOJRKSXFXHP-UHFFFAOYSA-N 0 0 363.885 5.220 40 0 FKABRN Cc1cccc(CN(c2cc(C)cc(C)c2)S(=O)(=O)c2ccccc2)c1 ZINC000033672269 571305787 /nfs/dbraw/zinc/30/57/87/571305787.db2.gz GFTRICKZPOFDAZ-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN COc1cc(CNc2cccc(Cl)c2)ccc1OCc1ccccc1F ZINC000033675892 570864905 /nfs/dbraw/zinc/86/49/05/570864905.db2.gz TYOODQPEVRPXSO-UHFFFAOYSA-N 0 0 371.839 5.679 40 0 FKABRN Cc1cccc(OCc2ccc(C(=O)Nc3cccc(Cl)c3C)cc2)c1 ZINC000033679849 571305745 /nfs/dbraw/zinc/30/57/45/571305745.db2.gz ZBTFNXDJPYLIRA-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN Clc1ccc(COc2ccccc2CNc2ccccc2Cl)cc1 ZINC000033680114 571085162 /nfs/dbraw/zinc/08/51/62/571085162.db2.gz JRFZREZVAWMQSY-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1cccc(N(Cc2cccc(Cl)c2)S(=O)(=O)c2ccccc2)c1 ZINC000033688421 571084976 /nfs/dbraw/zinc/08/49/76/571084976.db2.gz QCQILCXDQIMZCZ-UHFFFAOYSA-N 0 0 371.889 5.044 40 0 FKABRN Cc1ccc(C(=O)Nc2cccc(Cl)c2N2CCCCC2)c(Cl)c1 ZINC000033700810 571305769 /nfs/dbraw/zinc/30/57/69/571305769.db2.gz XEGNEWWPVYUPCJ-UHFFFAOYSA-N 0 0 363.288 5.544 40 0 FKABRN CCOc1cc(C(=O)Nc2ccccc2)ccc1OCc1ccc(C)cc1 ZINC000033704836 571305786 /nfs/dbraw/zinc/30/57/86/571305786.db2.gz PALUHDSPBWWIAW-UHFFFAOYSA-N 0 0 361.441 5.225 40 0 FKABRN O=C(CSCc1c(F)cccc1Cl)Nc1cccc2ccccc21 ZINC000033705778 571305724 /nfs/dbraw/zinc/30/57/24/571305724.db2.gz TWRMLZZKUBBLIB-UHFFFAOYSA-N 0 0 359.853 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356.450 5.471 40 0 FKABRN COc1ccccc1OCc1ccc(C(=O)Oc2ccc(Cl)cc2)cc1 ZINC000033731506 571305834 /nfs/dbraw/zinc/30/58/34/571305834.db2.gz DFVWGCWKZSEZGG-UHFFFAOYSA-N 0 0 368.816 5.147 40 0 FKABRN COc1ccccc1OCc1ccc(C(=O)Nc2ccccc2Cl)cc1 ZINC000033731510 571305904 /nfs/dbraw/zinc/30/59/04/571305904.db2.gz BZGDEAAEQYYMKG-UHFFFAOYSA-N 0 0 367.832 5.180 40 0 FKABRN Cc1cccc(CN(c2cccc(C)c2C)S(=O)(=O)c2ccccc2)c1 ZINC000033733658 570865587 /nfs/dbraw/zinc/86/55/87/570865587.db2.gz CMXPKVDHGIRUKK-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN COc1cc(C(=O)Nc2ccccc2C)ccc1OCc1ccc(C)cc1 ZINC000033733881 571305835 /nfs/dbraw/zinc/30/58/35/571305835.db2.gz NYIBOIUMGBSXBH-UHFFFAOYSA-N 0 0 361.441 5.143 40 0 FKABRN CC(C)(C)c1cc(SCC(=O)Nc2ccccc2)cc(C(C)(C)C)c1O ZINC000033736260 571305872 /nfs/dbraw/zinc/30/58/72/571305872.db2.gz VXZFTOHDUSYLSZ-UHFFFAOYSA-N 0 0 371.546 5.718 40 0 FKABRN O=C(Nc1cccc(Cl)c1N1CCCC1)c1ccc(Cl)cc1Cl ZINC000033737217 571305847 /nfs/dbraw/zinc/30/58/47/571305847.db2.gz 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ZINC000033869764 263397085 /nfs/dbraw/zinc/39/70/85/263397085.db2.gz XTMFCVWSUVRVNU-UHFFFAOYSA-N 0 0 361.297 6.051 40 0 FKABRN O=C1OC(c2ccc(F)cc2)=N/C1=C\c1ccc(-c2ccccc2Cl)o1 ZINC000033870295 571306025 /nfs/dbraw/zinc/30/60/25/571306025.db2.gz XBPWFBQCDHSJFG-BOPFTXTBSA-N 0 0 367.763 5.084 40 0 FKABRN CC(C)(COCc1cccc(Oc2ccccc2)c1)c1ccc(Cl)cc1 ZINC000033884466 571066997 /nfs/dbraw/zinc/06/69/97/571066997.db2.gz FKBIRPXIZSRYDA-UHFFFAOYSA-N 0 0 366.888 6.627 40 0 FKABRN CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC1CCCCC1 ZINC000033953220 519917009 /nfs/dbraw/zinc/91/70/09/519917009.db2.gz OFSPDNIHQQKLPZ-HZJYTTRNSA-N 0 0 361.614 7.249 40 0 in-man FKABRN CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CO ZINC000033954481 206763972 /nfs/dbraw/zinc/76/39/72/206763972.db2.gz YHTCXUSSQJMLQD-GIXZANJISA-N 0 0 358.610 7.851 40 0 FKABRN Cc1ccc2nc(-c3ccc(Nc4cc(Cl)nc(N)n4)cc3)sc2c1 ZINC000033998762 571067329 /nfs/dbraw/zinc/06/73/29/571067329.db2.gz DPNZREUERZPWND-UHFFFAOYSA-N 0 0 367.865 5.041 40 0 FKABRN c1csc([C@@H]2Nc3ccccc3[C@H]3c4[nH]c5ccccc5c4CCN23)c1 ZINC000034087038 571085623 /nfs/dbraw/zinc/08/56/23/571085623.db2.gz NJSHLRGCECJNPJ-FCHUYYIVSA-N 0 0 357.482 5.301 40 0 FKABRN c1csc([C@@H]2Nc3ccccc3[C@@H]3c4[nH]c5ccccc5c4CCN23)c1 ZINC000034087039 209860088 /nfs/dbraw/zinc/86/00/88/209860088.db2.gz NJSHLRGCECJNPJ-FGZHOGPDSA-N 0 0 357.482 5.301 40 0 FKABRN CC(=O)OC1=CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](OC(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000034096501 208102851 /nfs/dbraw/zinc/10/28/51/208102851.db2.gz IYRUIMPGYISENA-KHXQEATISA-N 0 0 374.521 5.018 40 0 FKABRN COC(=O)c1ccc(C(=O)Nc2ccc3c(c2)C(C)(C)CCC3(C)C)cc1 ZINC000034110887 571067533 /nfs/dbraw/zinc/06/75/33/571067533.db2.gz CBBXAIYXFKPCMD-UHFFFAOYSA-N 0 0 365.473 5.075 40 0 FKABRN CCCCC/C=C/C/C=C/C/C=C\C/C=C\CCCC(=O)N[C@H](C)CO ZINC000034131815 571067492 /nfs/dbraw/zinc/06/74/92/571067492.db2.gz SQKRUBZPTNJQEM-ZZVCKNSQSA-N 0 0 361.570 5.629 40 0 FKABRN C1SC2=C(S1)SC(=C1SC3=C(SCS3)S1)S2 ZINC000034140209 220756347 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CCOC(=O)c1ccc(Nc2ccnc3c2cccc3C(F)(F)F)cc1 ZINC000034925921 204986615 /nfs/dbraw/zinc/98/66/15/204986615.db2.gz WXUOAROMNPWKKC-UHFFFAOYSA-N 0 0 360.335 5.174 40 0 FKABRN CCOC(=O)c1cccc(Nc2ccnc3c2cccc3C(F)(F)F)c1 ZINC000034925930 570563736 /nfs/dbraw/zinc/56/37/36/570563736.db2.gz NRPWUZPETHJFHY-UHFFFAOYSA-N 0 0 360.335 5.174 40 0 FKABRN CCCOc1ccc(Br)cc1CNc1ccc(F)c(Cl)c1 ZINC000035018422 263397823 /nfs/dbraw/zinc/39/78/23/263397823.db2.gz JWXGMVAONLRXOS-UHFFFAOYSA-N 0 0 372.665 5.643 40 0 FKABRN COc1ccc(CNc2ccc(Cl)cc2Cl)cc1Br ZINC000035018444 571075512 /nfs/dbraw/zinc/07/55/12/571075512.db2.gz FDZAYOYALBTYQP-UHFFFAOYSA-N 0 0 361.066 5.377 40 0 FKABRN COc1cc(CNc2ccc(Br)cc2C)cc(Cl)c1OC ZINC000035018453 263397612 /nfs/dbraw/zinc/39/76/12/263397612.db2.gz YLWGHIQTNKOBKS-UHFFFAOYSA-N 0 0 370.674 5.040 40 0 FKABRN COc1ccc(CNc2ccc(Cl)c(Cl)c2)cc1Br ZINC000035038739 263397782 /nfs/dbraw/zinc/39/77/82/263397782.db2.gz NBGKBIZELWAZQB-UHFFFAOYSA-N 0 0 361.066 5.377 40 0 FKABRN CC[C@@H](C)Cn1c2ccccc2nc1[C@H](OC[C@@H](C)CC)c1ccccc1 ZINC000035099549 571075369 /nfs/dbraw/zinc/07/53/69/571075369.db2.gz BSQWVXZDAUXJLE-SELNLUPBSA-N 0 0 364.533 6.235 40 0 FKABRN CC[C@@H](C)Cn1c2ccccc2nc1[C@@H](OC[C@@H](C)CC)c1ccccc1 ZINC000035099552 211629659 /nfs/dbraw/zinc/62/96/59/211629659.db2.gz BSQWVXZDAUXJLE-MSYCTHLASA-N 0 0 364.533 6.235 40 0 FKABRN Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2c(C)cccc2C)c1 ZINC000035146726 263397765 /nfs/dbraw/zinc/39/77/65/263397765.db2.gz QRDLQUSBGMHURY-UHFFFAOYSA-N 0 0 358.441 5.116 40 0 FKABRN CCOc1c(Br)cc(CNc2cccc(Cl)c2)cc1OC ZINC000035160095 263397707 /nfs/dbraw/zinc/39/77/07/263397707.db2.gz AIVHSKDVPUNHCQ-UHFFFAOYSA-N 0 0 370.674 5.122 40 0 FKABRN COc1ccc(-c2nc(Nc3ccc(Cl)c(Cl)c3)sc2C)cc1 ZINC000035167025 263397646 /nfs/dbraw/zinc/39/76/46/263397646.db2.gz OSWFZGMKMPCFAX-UHFFFAOYSA-N 0 0 365.285 6.178 40 0 FKABRN O=C(Nc1nnc(CSc2ccc(Cl)cc2)s1)C1CCCCC1 ZINC000035167461 263397775 /nfs/dbraw/zinc/39/77/75/263397775.db2.gz DRQPPJDUZHDNPS-UHFFFAOYSA-N 0 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/nfs/dbraw/zinc/77/88/78/220778878.db2.gz JKWOHGHNCLECEC-UHFFFAOYSA-N 0 0 371.893 5.058 40 0 FKABRN O=C(c1ccccc1-c1ccccc1)N(Cc1ccco1)Cc1ccccn1 ZINC000035315224 204238077 /nfs/dbraw/zinc/23/80/77/204238077.db2.gz RKRATBIQFQFFDP-UHFFFAOYSA-N 0 0 368.436 5.184 40 0 FKABRN CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)NC1CCC(c2ccccc2)CC1 ZINC000035316304 570642096 /nfs/dbraw/zinc/64/20/96/570642096.db2.gz JAIMCRRHMZCMCC-AJTLQJAISA-N 0 0 366.332 5.420 40 0 FKABRN CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)NC1CCC(c2ccccc2)CC1 ZINC000035316306 207132521 /nfs/dbraw/zinc/13/25/21/207132521.db2.gz JAIMCRRHMZCMCC-UNGSAITNSA-N 0 0 366.332 5.420 40 0 FKABRN CC1(C)[C@H](C(=O)NC2CCC(c3ccccc3)CC2)[C@H]1C=C(Cl)Cl ZINC000035316307 204240203 /nfs/dbraw/zinc/24/02/03/204240203.db2.gz JAIMCRRHMZCMCC-IOTAOYMUSA-N 0 0 366.332 5.420 40 0 FKABRN CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)NC1CCC(c2ccccc2)CC1 ZINC000035316309 570642363 /nfs/dbraw/zinc/64/23/63/570642363.db2.gz JAIMCRRHMZCMCC-OBQMCRIKSA-N 0 0 366.332 5.420 40 0 FKABRN Cc1cccc(-n2c(Cc3ccccc3)nnc2SCc2ccccc2)c1 ZINC000035496648 570661648 /nfs/dbraw/zinc/66/16/48/570661648.db2.gz XCTJAVKFSVMULV-UHFFFAOYSA-N 0 0 371.509 5.459 40 0 FKABRN CCOP(=O)(OCC)[C@H](Nc1ccc(C)cc1)c1ccc(Cl)cc1 ZINC000035556164 208130273 /nfs/dbraw/zinc/13/02/73/208130273.db2.gz FHSAQAQSIRUJPP-SFHVURJKSA-N 0 0 367.813 6.025 40 0 FKABRN CCOP(=O)(OCC)[C@@H](Nc1ccc(C)cc1)c1ccc(Cl)cc1 ZINC000035556167 571077260 /nfs/dbraw/zinc/07/72/60/571077260.db2.gz FHSAQAQSIRUJPP-GOSISDBHSA-N 0 0 367.813 6.025 40 0 FKABRN Nc1cccc(OCCCCCCCCCCOc2cccc(N)c2)c1 ZINC000035585897 571077625 /nfs/dbraw/zinc/07/76/25/571077625.db2.gz MGJLTWUDKJWNTA-UHFFFAOYSA-N 0 0 356.510 5.430 40 0 FKABRN CCCCCCOc1ccc(-c2ncc(CCCCCC)c(C)n2)cc1 ZINC000035585929 204995439 /nfs/dbraw/zinc/99/54/39/204995439.db2.gz DZYYVTDTFXYZDB-UHFFFAOYSA-N 0 0 354.538 6.534 40 0 FKABRN CCOC(=O)c1sc(Nc2ccc(Oc3ccccc3)cc2)nc1C ZINC000035623063 220791669 /nfs/dbraw/zinc/79/16/69/220791669.db2.gz CUINMXUHRMLOPD-UHFFFAOYSA-N 0 0 354.431 5.164 40 0 FKABRN O=Cc1cc(Cl)cc(Cl)c1OCc1c(Cl)cccc1Cl ZINC000035662250 518202762 /nfs/dbraw/zinc/20/27/62/518202762.db2.gz WEVJSLPWBRBMBN-UHFFFAOYSA-N 0 0 350.028 5.692 40 0 FKABRN O=Cc1cc(Cl)cc(Cl)c1OCc1ccc(Cl)c(Cl)c1 ZINC000035662251 208133622 /nfs/dbraw/zinc/13/36/22/208133622.db2.gz OWNBQDWSGJBQOZ-UHFFFAOYSA-N 0 0 350.028 5.692 40 0 FKABRN O=Cc1cc(Cl)cc(Cl)c1OCc1ccc(Cl)cc1Cl ZINC000035662315 204346714 /nfs/dbraw/zinc/34/67/14/204346714.db2.gz FMXPTSRCKGIGCW-UHFFFAOYSA-N 0 0 350.028 5.692 40 0 FKABRN O=Cc1cc(Cl)cc(Cl)c1OCc1ccc(Br)cc1 ZINC000035662336 570688738 /nfs/dbraw/zinc/68/87/38/570688738.db2.gz PPDWTAHOGGNOQL-UHFFFAOYSA-N 0 0 360.034 5.147 40 0 FKABRN OCc1cc(Cl)cc(Cl)c1OCc1ccc(Cl)cc1Cl ZINC000035662545 570688717 /nfs/dbraw/zinc/68/87/17/570688717.db2.gz QSGHJJHPJNBWGW-UHFFFAOYSA-N 0 0 352.044 5.372 40 0 FKABRN OCc1cc(Cl)cc(Cl)c1OCc1c(Cl)cccc1Cl ZINC000035662691 204996769 /nfs/dbraw/zinc/99/67/69/204996769.db2.gz SJRUDSSRTJKENM-UHFFFAOYSA-N 0 0 352.044 5.372 40 0 FKABRN OCc1cc(Cl)cc(Cl)c1OCc1ccc(Cl)c(Cl)c1 ZINC000035662692 208133611 /nfs/dbraw/zinc/13/36/11/208133611.db2.gz WVOSAFLEIUIZTK-UHFFFAOYSA-N 0 0 352.044 5.372 40 0 FKABRN c1cnc2cc([C@H]3O[C@H]4CCCC[C@H]4c4cc5c(cc43)OCO5)ccc2c1 ZINC000035741617 208135464 /nfs/dbraw/zinc/13/54/64/208135464.db2.gz WQWAUEKHCKFPIR-ITSWEJNFSA-N 0 0 359.425 5.109 40 0 FKABRN c1cnc2cc([C@H]3O[C@H]4CCCC[C@@H]4c4cc5c(cc43)OCO5)ccc2c1 ZINC000035741618 571078478 /nfs/dbraw/zinc/07/84/78/571078478.db2.gz WQWAUEKHCKFPIR-NIJIEXERSA-N 0 0 359.425 5.109 40 0 FKABRN CC1(C)C(C(=O)c2cn(CCCC(F)(F)F)c3ccccc23)C1(C)C ZINC000035813765 571205007 /nfs/dbraw/zinc/20/50/07/571205007.db2.gz PEXYKZYTXIEEOB-UHFFFAOYSA-N 0 0 351.412 5.849 40 0 in-vitro FKABRN FC(Cl)(Cl)C(F)(F)N1c2ccccc2Sc2ccccc21 ZINC000035930555 571079136 /nfs/dbraw/zinc/07/91/36/571079136.db2.gz VVPSXDGTSPZADO-UHFFFAOYSA-N 0 0 350.192 5.983 40 0 FKABRN COC(=O)c1c(CCCc2cc(C(C)(C)C)ccc2C)cccc1OC ZINC000035973511 208139156 /nfs/dbraw/zinc/13/91/56/208139156.db2.gz GYQONYAUNCSQNS-UHFFFAOYSA-N 0 0 354.490 5.263 40 0 FKABRN COC(=O)c1c(O)cccc1CC[C@@H]1c2ccccc2C[C@H]2CCCC[C@@H]21 ZINC000035973651 208138741 /nfs/dbraw/zinc/13/87/41/208138741.db2.gz OUPDCYDORAMWNW-HLAWJBBLSA-N 0 0 364.485 5.258 40 0 FKABRN COC(=O)c1c(O)cccc1CC[C@H]1c2ccccc2C[C@H]2CCCC[C@@H]21 ZINC000035973652 571106560 /nfs/dbraw/zinc/10/65/60/571106560.db2.gz OUPDCYDORAMWNW-GIVPXCGWSA-N 0 0 364.485 5.258 40 0 FKABRN COC(=O)c1c(O)cccc1CC[C@@H]1c2ccccc2C[C@@H]2CCCC[C@@H]21 ZINC000035973653 571169832 /nfs/dbraw/zinc/16/98/32/571169832.db2.gz OUPDCYDORAMWNW-SESVDKBCSA-N 0 0 364.485 5.258 40 0 FKABRN COC(=O)c1c(O)cccc1CC[C@H]1c2ccccc2C[C@@H]2CCCC[C@H]12 ZINC000035973654 571106617 /nfs/dbraw/zinc/10/66/17/571106617.db2.gz OUPDCYDORAMWNW-JBACZVJFSA-N 0 0 364.485 5.258 40 0 FKABRN Cc1ccc(/C=C2/C[C@@H]3[C@H]4CC[C@@H]5CCCC[C@]5(C)[C@@H]4CC[C@]3(C)C2=O)o1 ZINC000036094437 571306132 /nfs/dbraw/zinc/30/61/32/571306132.db2.gz FAXCDVZHMMFRAL-HKQOJQLISA-N 0 0 366.545 6.583 40 0 FKABRN O=C(Cc1ccc(-c2csc(-c3ccncc3)n2)cc1)Nc1ccccc1 ZINC000036182145 571079568 /nfs/dbraw/zinc/07/95/68/571079568.db2.gz PPUONTXUQSSGNH-UHFFFAOYSA-N 0 0 371.465 5.053 40 0 FKABRN Cc1cccc(N(Cc2ccc(Cl)cc2)S(=O)(=O)c2ccccc2)c1 ZINC000036246365 571306175 /nfs/dbraw/zinc/30/61/75/571306175.db2.gz BOYDXJQAFZNRSW-UHFFFAOYSA-N 0 0 371.889 5.044 40 0 FKABRN CCOc1ccc([C@H]2Oc3ccccc3[C@@H]3C[C@H](c4ccccc4)NN32)cc1 ZINC000036286711 571177974 /nfs/dbraw/zinc/17/79/74/571177974.db2.gz NNUWRAGPZLVXPM-AOHZBQACSA-N 0 0 372.468 5.169 40 0 FKABRN Cc1ccc(-c2nc(N3CCCCC3)sc2C(=O)c2ccccc2)cc1 ZINC000036293499 205009069 /nfs/dbraw/zinc/00/90/69/205009069.db2.gz BQVVTRJNONOVJU-UHFFFAOYSA-N 0 0 362.498 5.340 40 0 FKABRN CCCCCn1cc(C(=O)c2cccc3ccccc32)cc1-c1ccccc1 ZINC000036294590 571246954 /nfs/dbraw/zinc/24/69/54/571246954.db2.gz JLXYYSHMURZHKI-UHFFFAOYSA-N 0 0 367.492 6.730 40 0 in-vivo FKABRN Cc1cc(Br)cn2cc(-c3ccc(Cl)c(Cl)c3)nc12 ZINC000036318662 207259159 /nfs/dbraw/zinc/25/91/59/207259159.db2.gz CATVVNVXOIDWST-UHFFFAOYSA-N 0 0 356.050 5.379 40 0 FKABRN CC(=O)OC1=CC[C@H]2[C@H]3CC[C@H]([C@H](C)CCCC(C)C)[C@]3(C)CC[C@H]2[C@H]1C ZINC000036371224 570696562 /nfs/dbraw/zinc/69/65/62/570696562.db2.gz SABPQGKCDGUYAI-XYCZTLEKSA-N 0 0 374.609 6.994 40 0 FKABRN CC(=O)OC1=CC[C@H]2[C@H]3CC[C@H]([C@H](C)CCCC(C)C)[C@]3(C)CC[C@@H]2[C@H]1C ZINC000036371225 570696725 /nfs/dbraw/zinc/69/67/25/570696725.db2.gz SABPQGKCDGUYAI-APIATHGVSA-N 0 0 374.609 6.994 40 0 FKABRN CC(=O)OC1=CC[C@H]2[C@H]3CC[C@H]([C@H](C)CCCC(C)C)[C@@]3(C)CC[C@@H]2[C@H]1C ZINC000036371226 570696691 /nfs/dbraw/zinc/69/66/91/570696691.db2.gz SABPQGKCDGUYAI-HYEUEBQFSA-N 0 0 374.609 6.994 40 0 FKABRN c1ccc(COP(OCc2ccccc2)OCc2ccccc2)cc1 ZINC000036453107 211668068 /nfs/dbraw/zinc/66/80/68/211668068.db2.gz KKFOMYPMTJLQGA-UHFFFAOYSA-N 0 0 352.370 5.864 40 0 FKABRN Nc1cccc(Oc2ccc(-c3ccc(Oc4cccc(N)c4)cc3)cc2)c1 ZINC000036453472 208163998 /nfs/dbraw/zinc/16/39/98/208163998.db2.gz UCQABCHSIIXVOY-UHFFFAOYSA-N 0 0 368.436 6.103 40 0 FKABRN Cc1ccc(-c2cc(-c3ccc(C)cc3)n(Cc3ccccc3F)n2)cc1 ZINC000036611251 570834773 /nfs/dbraw/zinc/83/47/73/570834773.db2.gz WYUJTBPQVOVGKQ-UHFFFAOYSA-N 0 0 356.444 6.021 40 0 FKABRN CCOc1cc([C@@H]2CC(=O)Nc3ccc4ccccc4c32)c(Cl)cc1O ZINC000036612587 207549729 /nfs/dbraw/zinc/54/97/29/207549729.db2.gz FVIJOINFORLWCZ-HNNXBMFYSA-N 0 0 367.832 5.072 40 0 FKABRN CCOc1cc([C@H]2CC(=O)Nc3ccc4ccccc4c32)c(Cl)cc1O ZINC000036612588 570835526 /nfs/dbraw/zinc/83/55/26/570835526.db2.gz FVIJOINFORLWCZ-OAHLLOKOSA-N 0 0 367.832 5.072 40 0 FKABRN Cc1ccc(-c2cc(C(F)(F)F)nc(NC3CCCCCC3)n2)s1 ZINC000036613620 570834629 /nfs/dbraw/zinc/83/46/29/570834629.db2.gz WGTMMIMTJZAHRF-UHFFFAOYSA-N 0 0 355.429 5.667 40 0 FKABRN CC[C@@H](C)c1ccc([C@@H](CC)NC(=O)c2cc(C)nc3onc(C)c32)cc1 ZINC000036613778 570835094 /nfs/dbraw/zinc/83/50/94/570835094.db2.gz ZKJWUJGXYDNURJ-BFUOFWGJSA-N 0 0 365.477 5.234 40 0 FKABRN CC[C@@H](NC(=O)c1cc(C)nc2onc(C)c21)c1ccc([C@@H](C)CC)cc1 ZINC000036613779 220821830 /nfs/dbraw/zinc/82/18/30/220821830.db2.gz ZKJWUJGXYDNURJ-ORAYPTAESA-N 0 0 365.477 5.234 40 0 FKABRN CC[C@@H](C)c1ccc([C@H](CC)NC(=O)c2cc(C)nc3onc(C)c32)cc1 ZINC000036613780 570835085 /nfs/dbraw/zinc/83/50/85/570835085.db2.gz ZKJWUJGXYDNURJ-YJYMSZOUSA-N 0 0 365.477 5.234 40 0 FKABRN CC[C@H](C)c1ccc([C@H](CC)NC(=O)c2cc(C)nc3onc(C)c32)cc1 ZINC000036613781 211124075 /nfs/dbraw/zinc/12/40/75/211124075.db2.gz ZKJWUJGXYDNURJ-DJJJIMSYSA-N 0 0 365.477 5.234 40 0 FKABRN CCCN(C(=O)CCc1ccc(C(C)C)cc1)c1nc(C)c(C(C)=O)s1 ZINC000036613881 570835105 /nfs/dbraw/zinc/83/51/05/570835105.db2.gz GTSHMCIRBAIQFU-UHFFFAOYSA-N 0 0 372.534 5.153 40 0 FKABRN COc1ccc2c(c1)CC[C@@H]1[C@@H]3C/C(=C\c4ccccc4)[C@H](O)[C@]3(C)CC[C@H]21 ZINC000036614389 205017432 /nfs/dbraw/zinc/01/74/32/205017432.db2.gz XBBFULYUUHIPON-YLWWUGQOSA-N 0 0 374.524 5.606 40 0 FKABRN COc1ccc2c(c1)CC[C@@H]1[C@@H]3C/C(=C\c4ccccc4)[C@H](O)[C@@]3(C)CC[C@H]21 ZINC000036614390 208165796 /nfs/dbraw/zinc/16/57/96/208165796.db2.gz XBBFULYUUHIPON-QKPUKAHCSA-N 0 0 374.524 5.606 40 0 FKABRN c1ccc(S[C@@H]2CSc3nc4ccccc4n3[C@@H]2c2ccccc2)cc1 ZINC000036624787 571080642 /nfs/dbraw/zinc/08/06/42/571080642.db2.gz VKOWNSAQOQYERQ-NHCUHLMSSA-N 0 0 374.534 5.892 40 0 FKABRN c1ccc(S[C@@H]2CSc3nc4ccccc4n3[C@H]2c2ccccc2)cc1 ZINC000036624788 205018773 /nfs/dbraw/zinc/01/87/73/205018773.db2.gz VKOWNSAQOQYERQ-RTWAWAEBSA-N 0 0 374.534 5.892 40 0 FKABRN c1ccc(S[C@H]2CSc3nc4ccccc4n3[C@@H]2c2ccccc2)cc1 ZINC000036624789 205018242 /nfs/dbraw/zinc/01/82/42/205018242.db2.gz VKOWNSAQOQYERQ-LEWJYISDSA-N 0 0 374.534 5.892 40 0 FKABRN c1ccc(S[C@H]2CSc3nc4ccccc4n3[C@H]2c2ccccc2)cc1 ZINC000036624790 571080532 /nfs/dbraw/zinc/08/05/32/571080532.db2.gz VKOWNSAQOQYERQ-SFTDATJTSA-N 0 0 374.534 5.892 40 0 FKABRN [O-]c1c(-c2ccccc2)[s+]n2nc(-c3ccccc3)c3ccccc3c12 ZINC000036625087 571080653 /nfs/dbraw/zinc/08/06/53/571080653.db2.gz JXZXZAQQZWXZHK-UHFFFAOYSA-O 0 0 355.442 5.075 40 0 FKABRN Cc1ccc(-c2sc3nc(-c4ccc5c(c4)OCO5)ccc3c2N)cc1 ZINC000036631345 208167559 /nfs/dbraw/zinc/16/75/59/208167559.db2.gz TYNKORTXHQVWSJ-UHFFFAOYSA-N 0 0 360.438 5.250 40 0 FKABRN COc1ccccc1-c1cc2nc(C)cc(Nc3ccc(C)c(C)c3)n2n1 ZINC000036631424 571080432 /nfs/dbraw/zinc/08/04/32/571080432.db2.gz XAYFHVMBAHKZCD-UHFFFAOYSA-N 0 0 358.445 5.074 40 0 FKABRN CCCCC(=O)Nc1nc(C)c(Cc2cccc(C(F)(F)F)c2)s1 ZINC000036639205 220823769 /nfs/dbraw/zinc/82/37/69/220823769.db2.gz USPXHDOMJRRRBY-UHFFFAOYSA-N 0 0 356.413 5.190 40 0 FKABRN CC(C)c1ccc(NC[C@H](O)Cn2c3ccccc3c3ccccc32)cc1 ZINC000036640162 206765327 /nfs/dbraw/zinc/76/53/27/206765327.db2.gz JCFKVKHGFIMUIC-FQEVSTJZSA-N 0 0 358.485 5.391 40 0 FKABRN CC(C)c1ccc(NC[C@@H](O)Cn2c3ccccc3c3ccccc32)cc1 ZINC000036640163 210186128 /nfs/dbraw/zinc/18/61/28/210186128.db2.gz JCFKVKHGFIMUIC-HXUWFJFHSA-N 0 0 358.485 5.391 40 0 FKABRN S=C1N=NC(c2cc3cc(Cl)ccc3[nH]2)N1c1ccc(Cl)cc1 ZINC000036640164 208168870 /nfs/dbraw/zinc/16/88/70/208168870.db2.gz CVERLXIPUSPYIM-UHFFFAOYSA-N 0 0 361.257 5.011 40 0 FKABRN CCCCCCOc1ccc2c(c1)CC[C@H]1[C@H]3CCC(=O)[C@@]3(C)CC[C@H]21 ZINC000036640206 208169783 /nfs/dbraw/zinc/16/97/83/208169783.db2.gz ZEZHPTYTCOOIMP-AZKZNFPZSA-N 0 0 354.534 6.071 40 0 FKABRN CCCCCCOc1ccc2c(c1)CC[C@@H]1[C@H]3CCC(=O)[C@@]3(C)CC[C@H]21 ZINC000036640207 571081014 /nfs/dbraw/zinc/08/10/14/571081014.db2.gz ZEZHPTYTCOOIMP-GBAAUQCPSA-N 0 0 354.534 6.071 40 0 FKABRN CCCCCCOc1ccc2c(c1)CC[C@H]1[C@H]3CCC(=O)[C@@]3(C)CC[C@@H]21 ZINC000036640208 571080870 /nfs/dbraw/zinc/08/08/70/571080870.db2.gz ZEZHPTYTCOOIMP-NXYDZRKXSA-N 0 0 354.534 6.071 40 0 FKABRN CCCCCCOc1ccc2c(c1)CC[C@@H]1[C@H]3CCC(=O)[C@@]3(C)CC[C@@H]21 ZINC000036640209 571080995 /nfs/dbraw/zinc/08/09/95/571080995.db2.gz ZEZHPTYTCOOIMP-YCSHWKNNSA-N 0 0 354.534 6.071 40 0 FKABRN Cc1cccc(NC(=O)c2ccc(CSc3nc4ccccc4o3)cc2)c1 ZINC000036646428 208168982 /nfs/dbraw/zinc/16/89/82/208168982.db2.gz BIOQAKNWWGAQGF-UHFFFAOYSA-N 0 0 374.465 5.681 40 0 FKABRN Cc1ccc(C)c2sc(NC(=O)C(C)(C)Oc3ccc(Cl)cc3)nc21 ZINC000036695165 570697025 /nfs/dbraw/zinc/69/70/25/570697025.db2.gz FSAZXRZAWZCUQC-UHFFFAOYSA-N 0 0 374.893 5.363 40 0 FKABRN COc1cc(CNc2cc(Cl)ccc2C)cc(Br)c1OC ZINC000036815581 570698971 /nfs/dbraw/zinc/69/89/71/570698971.db2.gz SISCCHZGVODPOP-UHFFFAOYSA-N 0 0 370.674 5.040 40 0 FKABRN COc1cc(CNc2cccc(Cl)c2C)cc(Br)c1OC ZINC000036815592 570699070 /nfs/dbraw/zinc/69/90/70/570699070.db2.gz RIPQNWOJTHJEFX-UHFFFAOYSA-N 0 0 370.674 5.040 40 0 FKABRN CCCOc1ccc(Br)cc1CNc1cc(Cl)ccc1C ZINC000037184652 570778409 /nfs/dbraw/zinc/77/84/09/570778409.db2.gz BDQAZMINJUVLRX-UHFFFAOYSA-N 0 0 368.702 5.812 40 0 FKABRN CCCOc1ccc(Br)cc1CNc1ccc(C)c(Cl)c1 ZINC000037188444 570778261 /nfs/dbraw/zinc/77/82/61/570778261.db2.gz NVAVOPDWCOOKKO-UHFFFAOYSA-N 0 0 368.702 5.812 40 0 FKABRN CCCOc1ccc(Br)cc1CNc1cccc(Cl)c1C ZINC000037196602 570779610 /nfs/dbraw/zinc/77/96/10/570779610.db2.gz DYAUYNQSSXXOAU-UHFFFAOYSA-N 0 0 368.702 5.812 40 0 FKABRN CCCOc1ccc(Br)cc1CNc1ccccc1Cl ZINC000037210738 570779894 /nfs/dbraw/zinc/77/98/94/570779894.db2.gz AJNDGFONDIHZAG-UHFFFAOYSA-N 0 0 354.675 5.503 40 0 FKABRN CC1=C2CC[C@@H]3[C@@H]4CC[C@H](C(=O)c5ccccc5)[C@@]4(C)CC[C@@H]3[C@]2(C)CC1 ZINC000037246047 570806571 /nfs/dbraw/zinc/80/65/71/570806571.db2.gz YKMWBUJFIQUVEI-NNPCXGTQSA-N 0 0 362.557 6.838 40 0 FKABRN COc1ccc(Br)cc1CNc1ccc(Cl)cc1Cl ZINC000037301387 570821005 /nfs/dbraw/zinc/82/10/05/570821005.db2.gz NXFFGSHCPVDHAS-UHFFFAOYSA-N 0 0 361.066 5.377 40 0 FKABRN CC(C)Oc1ccc(NC(=O)c2cc(Br)ccc2Cl)cc1 ZINC000037991490 570939709 /nfs/dbraw/zinc/93/97/09/570939709.db2.gz ZTCIQXQJTLBGPU-UHFFFAOYSA-N 0 0 368.658 5.142 40 0 FKABRN O=C1S/C(=C/c2c[nH]c3ccccc23)C(=O)N1c1ccc(Cl)cc1 ZINC000038183529 263399335 /nfs/dbraw/zinc/39/93/35/263399335.db2.gz XCOFEAMWFGBQGC-CXUHLZMHSA-N 0 0 354.818 5.062 40 0 FKABRN O=C1S/C(=C/c2c[nH]c3ccccc23)C(=O)N1c1cccc(Cl)c1 ZINC000038183530 263399753 /nfs/dbraw/zinc/39/97/53/263399753.db2.gz FRFACSKCYHYQIY-LZYBPNLTSA-N 0 0 354.818 5.062 40 0 FKABRN CCCOC(=O)C[C@@H](C(=O)OCCC)C(C)(C)/C=C(\C)C[C@H](C)CCC ZINC000038192177 208202298 /nfs/dbraw/zinc/20/22/98/208202298.db2.gz AGNQUSDMKNHBPT-YJCNWBTDSA-N 0 0 368.558 5.698 40 0 FKABRN c1ccc(OP2Oc3cccc4c3C3(CC4)CCc4cccc(c43)O2)cc1 ZINC000038209057 571359598 /nfs/dbraw/zinc/35/95/98/571359598.db2.gz JVANYVSBBJFGMW-UHFFFAOYSA-N 0 0 374.376 5.942 40 0 FKABRN CCOP(=O)(OCC)OCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 ZINC000038215049 208201069 /nfs/dbraw/zinc/20/10/69/208201069.db2.gz OQLRBFNNEQUJPK-UHFFFAOYSA-N 0 0 372.442 5.685 40 0 FKABRN COc1ccc(C)cc1[C@@H](CC(=O)N(C(C)C)C(C)C)c1ccccc1 ZINC000038278827 205039988 /nfs/dbraw/zinc/03/99/88/205039988.db2.gz BXYCIYQHBLEYJW-FQEVSTJZSA-N 0 0 353.506 5.171 40 0 FKABRN COc1ccc(C)cc1[C@H](CC(=O)N(C(C)C)C(C)C)c1ccccc1 ZINC000038278828 571084941 /nfs/dbraw/zinc/08/49/41/571084941.db2.gz BXYCIYQHBLEYJW-HXUWFJFHSA-N 0 0 353.506 5.171 40 0 FKABRN CC(=O)O[C@@H]1CC[C@@]2(C)[C@H](CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000038494893 220852118 /nfs/dbraw/zinc/85/21/18/220852118.db2.gz GFHOQCXDABGYAL-LEQCJQSISA-N 0 0 360.538 5.166 40 0 FKABRN COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000038544551 571002884 /nfs/dbraw/zinc/00/28/84/571002884.db2.gz YHTRVWPOAJKWBV-ZXKBGTPZSA-N 0 0 374.609 6.625 40 0 FKABRN O=C(Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1)c1ccccn1 ZINC000038551363 220854660 /nfs/dbraw/zinc/85/46/60/220854660.db2.gz NYOMAILEACFAGH-UHFFFAOYSA-N 0 0 357.438 5.124 40 0 FKABRN CC(=O)O[C@@]1(C(C)=O)CC[C@H]2[C@@H]3C[C@H](C)C4=CCCC[C@]4(C)[C@H]3CC[C@@]21C ZINC000038609663 571085425 /nfs/dbraw/zinc/08/54/25/571085425.db2.gz KDLNOQQQEBKBQM-ZCPNKVFMSA-N 0 0 372.549 5.476 40 0 FKABRN CC(C)CCCCCCCOP(Oc1ccccc1)Oc1ccccc1 ZINC000038654471 571085528 /nfs/dbraw/zinc/08/55/28/571085528.db2.gz ADRNSOYXKABLGT-UHFFFAOYSA-N 0 0 374.461 7.385 40 0 FKABRN CCOP(=O)(OCC)[C@H](NCc1ccccc1)c1ccc(Cl)cc1 ZINC000038698551 208203402 /nfs/dbraw/zinc/20/34/02/208203402.db2.gz AOKOJVXMVZNASX-SFHVURJKSA-N 0 0 367.813 5.395 40 0 FKABRN CCOP(=O)(OCC)[C@@H](NCc1ccccc1)c1ccc(Cl)cc1 ZINC000038698553 208203906 /nfs/dbraw/zinc/20/39/06/208203906.db2.gz AOKOJVXMVZNASX-GOSISDBHSA-N 0 0 367.813 5.395 40 0 FKABRN Cc1ccc(NC(=O)c2ccc(CN3CCCc4ccccc43)cc2)cc1C ZINC000038752511 132944115 /nfs/dbraw/zinc/94/41/15/132944115.db2.gz MGLDDWFRFGGZDA-UHFFFAOYSA-N 0 0 370.496 5.509 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](CC)Oc1ccc2ccccc2c1 ZINC000038752535 208205452 /nfs/dbraw/zinc/20/54/52/208205452.db2.gz UGSGKWNCONRVJL-FQEVSTJZSA-N 0 0 365.498 5.748 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](CC)Oc1ccc2ccccc2c1 ZINC000038752537 205041647 /nfs/dbraw/zinc/04/16/47/205041647.db2.gz UGSGKWNCONRVJL-HXUWFJFHSA-N 0 0 365.498 5.748 40 0 FKABRN CCCOc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccccc2C)cc1 ZINC000038752722 571085809 /nfs/dbraw/zinc/08/58/09/571085809.db2.gz WCTVDINCOWTDOI-QHCPKHFHSA-N 0 0 359.469 5.303 40 0 FKABRN CCCOc1ccc(C(=O)N[C@H](c2ccccc2)c2ccccc2C)cc1 ZINC000038752724 208205396 /nfs/dbraw/zinc/20/53/96/208205396.db2.gz WCTVDINCOWTDOI-HSZRJFAPSA-N 0 0 359.469 5.303 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000038752737 571085830 /nfs/dbraw/zinc/08/58/30/571085830.db2.gz OJVWZLINFZTUIJ-HSZRJFAPSA-N 0 0 357.497 5.812 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)c1ccccc1 ZINC000038752740 208205127 /nfs/dbraw/zinc/20/51/27/208205127.db2.gz OJVWZLINFZTUIJ-QHCPKHFHSA-N 0 0 357.497 5.812 40 0 FKABRN C[C@H](NC(=O)c1ccccc1SCc1ccccc1)c1ccc(F)cc1 ZINC000038753062 208206588 /nfs/dbraw/zinc/20/65/88/208206588.db2.gz NQVGADJMHFWEHH-INIZCTEOSA-N 0 0 365.473 5.609 40 0 FKABRN C[C@@H](NC(=O)c1ccccc1SCc1ccccc1)c1ccc(F)cc1 ZINC000038753064 571085769 /nfs/dbraw/zinc/08/57/69/571085769.db2.gz NQVGADJMHFWEHH-MRXNPFEDSA-N 0 0 365.473 5.609 40 0 FKABRN CSc1ccccc1NC(=O)CSCc1ccc(Cl)c(Cl)c1 ZINC000038753241 571085882 /nfs/dbraw/zinc/08/58/82/571085882.db2.gz WNPLIHZJUYKOAO-UHFFFAOYSA-N 0 0 372.342 5.587 40 0 FKABRN C[C@H](NC(=O)CSCc1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 ZINC000038753803 205041305 /nfs/dbraw/zinc/04/13/05/205041305.db2.gz CYVYBUQMJNFQHG-NSHDSACASA-N 0 0 372.292 5.243 40 0 FKABRN C[C@@H](NC(=O)CSCc1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 ZINC000038753805 208206742 /nfs/dbraw/zinc/20/67/42/208206742.db2.gz CYVYBUQMJNFQHG-LLVKDONJSA-N 0 0 372.292 5.243 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)/C=C/c1ccccc1Cl)c1ccccc1 ZINC000038754044 571085834 /nfs/dbraw/zinc/08/58/34/571085834.db2.gz BZGKJNROFGXRJS-POICXBNUSA-N 0 0 361.872 5.567 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)/C=C/c1ccccc1Cl)c1ccccc1 ZINC000038754046 571085928 /nfs/dbraw/zinc/08/59/28/571085928.db2.gz BZGKJNROFGXRJS-TVXVBNPNSA-N 0 0 361.872 5.567 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000038754148 571085775 /nfs/dbraw/zinc/08/57/75/571085775.db2.gz VPINTKQKBGMROJ-AWEZNQCLSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000038754150 571085765 /nfs/dbraw/zinc/08/57/65/571085765.db2.gz VPINTKQKBGMROJ-CQSZACIVSA-N 0 0 358.652 5.443 40 0 FKABRN COc1ccc(S[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1OC ZINC000038754456 208206240 /nfs/dbraw/zinc/20/62/40/208206240.db2.gz BKUDDTPTGNYWBO-OAHLLOKOSA-N 0 0 373.518 5.255 40 0 FKABRN COc1ccc(S[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1OC ZINC000038754458 208205520 /nfs/dbraw/zinc/20/55/20/208205520.db2.gz BKUDDTPTGNYWBO-HNNXBMFYSA-N 0 0 373.518 5.255 40 0 FKABRN Cc1ccc(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)cc1C ZINC000038754595 208205269 /nfs/dbraw/zinc/20/52/69/208205269.db2.gz YDGOAOKFCAMHCU-UHFFFAOYSA-N 0 0 356.469 5.118 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000038754852 208206801 /nfs/dbraw/zinc/20/68/01/208206801.db2.gz HFKWYYFZRLVGMH-HNNXBMFYSA-N 0 0 373.827 5.868 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000038754854 571085821 /nfs/dbraw/zinc/08/58/21/571085821.db2.gz HFKWYYFZRLVGMH-OAHLLOKOSA-N 0 0 373.827 5.868 40 0 FKABRN Cc1ccc([C@H](NC(=O)COc2cc(C)cc(C)c2C)c2ccccc2)cc1 ZINC000038754933 571085901 /nfs/dbraw/zinc/08/59/01/571085901.db2.gz ODTYOOIEWQQTIK-RUZDIDTESA-N 0 0 373.496 5.205 40 0 FKABRN Cc1ccc([C@@H](NC(=O)COc2cc(C)cc(C)c2C)c2ccccc2)cc1 ZINC000038754935 205042170 /nfs/dbraw/zinc/04/21/70/205042170.db2.gz ODTYOOIEWQQTIK-VWLOTQADSA-N 0 0 373.496 5.205 40 0 FKABRN CC(C)C[C@H](NC(=O)c1ccccc1OCc1ccccc1)c1ccccc1 ZINC000038755054 571085784 /nfs/dbraw/zinc/08/57/84/571085784.db2.gz PJNRJLIIRAJKNX-QHCPKHFHSA-N 0 0 373.496 5.783 40 0 FKABRN CC(C)C[C@@H](NC(=O)c1ccccc1OCc1ccccc1)c1ccccc1 ZINC000038755056 571085837 /nfs/dbraw/zinc/08/58/37/571085837.db2.gz PJNRJLIIRAJKNX-HSZRJFAPSA-N 0 0 373.496 5.783 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC000038755468 571085793 /nfs/dbraw/zinc/08/57/93/571085793.db2.gz DKINTWLOWQCZCB-AWEZNQCLSA-N 0 0 351.368 5.037 40 0 FKABRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)c1 ZINC000038755470 571086340 /nfs/dbraw/zinc/08/63/40/571086340.db2.gz DKINTWLOWQCZCB-CQSZACIVSA-N 0 0 351.368 5.037 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(OC)cc1 ZINC000038755482 211701985 /nfs/dbraw/zinc/70/19/85/211701985.db2.gz IUCGYBHLOYNMNR-IERDGZPVSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(OC)cc1 ZINC000038755484 208205343 /nfs/dbraw/zinc/20/53/43/208205343.db2.gz IUCGYBHLOYNMNR-IIBYNOLFSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(OC)cc1 ZINC000038755486 571086317 /nfs/dbraw/zinc/08/63/17/571086317.db2.gz IUCGYBHLOYNMNR-KKSFZXQISA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)c1ccc(OC)cc1 ZINC000038755488 205041724 /nfs/dbraw/zinc/04/17/24/205041724.db2.gz IUCGYBHLOYNMNR-HRAATJIYSA-N 0 0 369.505 5.028 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)CSCc1ccccc1)c1ccccc1 ZINC000038755578 220856175 /nfs/dbraw/zinc/85/61/75/220856175.db2.gz MPFDXDXNINAQOH-HSZRJFAPSA-N 0 0 361.510 5.134 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)CSCc1ccccc1)c1ccccc1 ZINC000038755580 205041104 /nfs/dbraw/zinc/04/11/04/205041104.db2.gz MPFDXDXNINAQOH-QHCPKHFHSA-N 0 0 361.510 5.134 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)N(Cc2ccccc2)Cc2ccccc2)c1C ZINC000038755660 220855285 /nfs/dbraw/zinc/85/52/85/220855285.db2.gz QZHJLHIBSZONJQ-NRFANRHFSA-N 0 0 373.496 5.300 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)N(Cc2ccccc2)Cc2ccccc2)c1C ZINC000038755662 208205866 /nfs/dbraw/zinc/20/58/66/208205866.db2.gz QZHJLHIBSZONJQ-OAQYLSRUSA-N 0 0 373.496 5.300 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1cc(Cl)ccc1C ZINC000038755831 571086236 /nfs/dbraw/zinc/08/62/36/571086236.db2.gz SODCZNIWPMZPLD-IBGZPJMESA-N 0 0 353.849 5.598 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cc(Cl)ccc1C ZINC000038755833 571086227 /nfs/dbraw/zinc/08/62/27/571086227.db2.gz SODCZNIWPMZPLD-LJQANCHMSA-N 0 0 353.849 5.598 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)N[C@H](c2ccccc2)c2ccccc2C)c1C ZINC000038756137 208204862 /nfs/dbraw/zinc/20/48/62/208204862.db2.gz AQLKXKKWJFFYFN-HYBUGGRVSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)N[C@@H](c2ccccc2)c2ccccc2C)c1C ZINC000038756139 211701526 /nfs/dbraw/zinc/70/15/26/211701526.db2.gz AQLKXKKWJFFYFN-YKSBVNFPSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)N[C@H](c2ccccc2)c2ccccc2C)c1C ZINC000038756141 571086222 /nfs/dbraw/zinc/08/62/22/571086222.db2.gz AQLKXKKWJFFYFN-GBXCKJPGSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)N[C@@H](c2ccccc2)c2ccccc2C)c1C ZINC000038756143 211702537 /nfs/dbraw/zinc/70/25/37/211702537.db2.gz AQLKXKKWJFFYFN-RDPSFJRHSA-N 0 0 373.496 5.285 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1C ZINC000038756569 211701877 /nfs/dbraw/zinc/70/18/77/211701877.db2.gz VJGOXPKWZMVTKG-ROUUACIJSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1C ZINC000038756571 205042368 /nfs/dbraw/zinc/04/23/68/205042368.db2.gz VJGOXPKWZMVTKG-ZWKOTPCHSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1C ZINC000038756573 571086322 /nfs/dbraw/zinc/08/63/22/571086322.db2.gz VJGOXPKWZMVTKG-MSOLQXFVSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1C ZINC000038756575 208205908 /nfs/dbraw/zinc/20/59/08/208205908.db2.gz VJGOXPKWZMVTKG-QZTJIDSGSA-N 0 0 353.506 5.246 40 0 FKABRN CN(Cc1ccc(Cl)cc1)C(=O)CC(c1ccccc1)c1ccccc1 ZINC000038756866 571086278 /nfs/dbraw/zinc/08/62/78/571086278.db2.gz RLPDTFXKXBYYMR-UHFFFAOYSA-N 0 0 363.888 5.521 40 0 FKABRN CC[C@H](NC(=O)c1ccccc1CCc1ccccc1)c1ccc(C)cc1 ZINC000038757181 208205782 /nfs/dbraw/zinc/20/57/82/208205782.db2.gz ACYKEJCBMKSCGQ-DEOSSOPVSA-N 0 0 357.497 5.661 40 0 FKABRN CC[C@@H](NC(=O)c1ccccc1CCc1ccccc1)c1ccc(C)cc1 ZINC000038757183 208205768 /nfs/dbraw/zinc/20/57/68/208205768.db2.gz ACYKEJCBMKSCGQ-XMMPIXPASA-N 0 0 357.497 5.661 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl ZINC000038771141 220855971 /nfs/dbraw/zinc/85/59/71/220855971.db2.gz REVBJKQBBNSQSS-LBPRGKRZSA-N 0 0 352.261 5.523 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)Nc1cccc(Cl)c1Cl ZINC000038771143 571086330 /nfs/dbraw/zinc/08/63/30/571086330.db2.gz REVBJKQBBNSQSS-GFCCVEGCSA-N 0 0 352.261 5.523 40 0 FKABRN Cc1ccc(NC(=O)c2ccc(CN3CCCc4ccccc43)cc2)cc1 ZINC000038771688 571086668 /nfs/dbraw/zinc/08/66/68/571086668.db2.gz FBEXATAMNYXOFW-UHFFFAOYSA-N 0 0 356.469 5.200 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000038771839 571086665 /nfs/dbraw/zinc/08/66/65/571086665.db2.gz FKENDZCWPDTSKT-RXVVDRJESA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000038771842 571086572 /nfs/dbraw/zinc/08/65/72/571086572.db2.gz FKENDZCWPDTSKT-GHTZIAJQSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000038771845 211702073 /nfs/dbraw/zinc/70/20/73/211702073.db2.gz FKENDZCWPDTSKT-NQIIRXRSSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000038771848 571086649 /nfs/dbraw/zinc/08/66/49/571086649.db2.gz FKENDZCWPDTSKT-WIYYLYMNSA-N 0 0 367.533 5.636 40 0 FKABRN Cc1ccc([C@H](NC(=O)CCCOc2ccccc2)c2ccccc2)cc1 ZINC000038772295 571086646 /nfs/dbraw/zinc/08/66/46/571086646.db2.gz VDRCJLLYAJLBHC-XMMPIXPASA-N 0 0 359.469 5.060 40 0 FKABRN Cc1ccc([C@@H](NC(=O)CCCOc2ccccc2)c2ccccc2)cc1 ZINC000038772296 571086626 /nfs/dbraw/zinc/08/66/26/571086626.db2.gz VDRCJLLYAJLBHC-DEOSSOPVSA-N 0 0 359.469 5.060 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)NCc1ccc(Cl)cc1Cl ZINC000038772572 571086747 /nfs/dbraw/zinc/08/67/47/571086747.db2.gz BOFMNCCDDVWEEB-ZDUSSCGKSA-N 0 0 366.288 5.201 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)NCc1ccc(Cl)cc1Cl ZINC000038772574 208205087 /nfs/dbraw/zinc/20/50/87/208205087.db2.gz BOFMNCCDDVWEEB-CYBMUJFWSA-N 0 0 366.288 5.201 40 0 FKABRN Cc1ccc(CC(=O)Nc2ccc(CSc3ccccc3)cc2C)cc1 ZINC000038772625 220857414 /nfs/dbraw/zinc/85/74/14/220857414.db2.gz ZDGIWUXZJFKILF-UHFFFAOYSA-N 0 0 361.510 5.777 40 0 FKABRN CC(C)(C)c1ccc(C(=O)c2cccc(NC(=O)Cc3ccccc3)c2)cc1 ZINC000038772709 205042490 /nfs/dbraw/zinc/04/24/90/205042490.db2.gz HTIAPERBDZPECW-UHFFFAOYSA-N 0 0 371.480 5.396 40 0 FKABRN CC[C@H](NC(=O)c1ccccc1OCc1ccccc1)c1ccc(C)cc1 ZINC000038772821 205042760 /nfs/dbraw/zinc/04/27/60/205042760.db2.gz UPTGDMRQOKYSCF-QFIPXVFZSA-N 0 0 359.469 5.455 40 0 FKABRN CC[C@@H](NC(=O)c1ccccc1OCc1ccccc1)c1ccc(C)cc1 ZINC000038772823 571086662 /nfs/dbraw/zinc/08/66/62/571086662.db2.gz UPTGDMRQOKYSCF-JOCHJYFZSA-N 0 0 359.469 5.455 40 0 FKABRN Cc1cccc([C@@H]2Nc3ccc(Br)cc3[C@H]3OCCC[C@H]23)c1 ZINC000038773523 570989670 /nfs/dbraw/zinc/98/96/70/570989670.db2.gz MRZKWLTZYIIJDP-MNEFBYGVSA-N 0 0 358.279 5.392 40 0 FKABRN Fc1cccc([C@@H]2Nc3ccc(Br)cc3[C@H]3OCCC[C@H]23)c1 ZINC000038773526 570990200 /nfs/dbraw/zinc/99/02/00/570990200.db2.gz ROQBYUBBWZYQQL-JLSDUUJJSA-N 0 0 362.242 5.223 40 0 FKABRN Nc1ccc(-c2cc(-c3ccc(N)cc3)cc(-c3ccc(N)cc3)c2)cc1 ZINC000038844043 570956633 /nfs/dbraw/zinc/95/66/33/570956633.db2.gz QHQSCKLPDVSEBJ-UHFFFAOYSA-N 0 0 351.453 5.434 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)c1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000038849588 571087637 /nfs/dbraw/zinc/08/76/37/571087637.db2.gz DLSSWLGWABVAPW-UHFFFAOYSA-N 0 0 356.897 5.133 40 0 FKABRN CCCCn1cc(C(=O)c2ccc(OC)c3ccccc23)c2ccccc21 ZINC000039008665 205044842 /nfs/dbraw/zinc/04/48/42/205044842.db2.gz PGOAKRPGOLHODL-UHFFFAOYSA-N 0 0 357.453 5.834 40 0 in-vitro FKABRN CCCCCCOP(=O)(CC(=O)N(CC)CC)OCCCCCC ZINC000039319500 208208207 /nfs/dbraw/zinc/20/82/07/208208207.db2.gz MSULAAVSYZOTHM-UHFFFAOYSA-N 0 0 363.479 5.242 40 0 FKABRN CC(C)(C)c1[nH]c2c(cc(C(C)(C)C)cc2C(C)(C)C)c1C[C@H]([NH3+])C(=O)[O-] ZINC000039414687 571089199 /nfs/dbraw/zinc/08/91/99/571089199.db2.gz IQMAPACPGQFJNG-KRWDZBQOSA-N 0 0 372.553 5.015 40 0 FKABRN CC(C)(C)c1[nH]c2c(cc(C(C)(C)C)cc2C(C)(C)C)c1C[C@@H]([NH3+])C(=O)[O-] ZINC000039414688 208310995 /nfs/dbraw/zinc/31/09/95/208310995.db2.gz IQMAPACPGQFJNG-QGZVFWFLSA-N 0 0 372.553 5.015 40 0 FKABRN O=C1S/C(=C\c2ccc(-c3ccccc3)o2)C(=O)N1Cc1ccccc1 ZINC000039795142 571024028 /nfs/dbraw/zinc/02/40/28/571024028.db2.gz IXAYBOFHCZDZNZ-UYRXBGFRSA-N 0 0 361.422 5.183 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(COc2ccccc2)o1 ZINC000039851056 571024182 /nfs/dbraw/zinc/02/41/82/571024182.db2.gz NMMDMHKWTQZICZ-UHFFFAOYSA-N 0 0 362.212 5.418 40 0 FKABRN O=C(Nc1cc(Cl)cc(Cl)c1)c1ccc(COc2ccccc2)o1 ZINC000039851060 571023949 /nfs/dbraw/zinc/02/39/49/571023949.db2.gz FIVUZEHZEHHZBO-UHFFFAOYSA-N 0 0 362.212 5.418 40 0 FKABRN COc1ccccc1N1C(=O)S/C(=C\c2ccc(C(C)C)cc2)C1=O ZINC000039857512 571024589 /nfs/dbraw/zinc/02/45/89/571024589.db2.gz ZXEPQHKOHMANQV-PDGQHHTCSA-N 0 0 353.443 5.060 40 0 FKABRN COc1ccccc1N1C(=O)S/C(=C\c2cccc3ccccc23)C1=O ZINC000039857531 571024437 /nfs/dbraw/zinc/02/44/37/571024437.db2.gz DIJXENOQUDBSKK-UYRXBGFRSA-N 0 0 361.422 5.089 40 0 FKABRN CC(=C\c1ccccc1)/C=C1\SC(=O)N(c2cccc(Cl)c2)C1=O ZINC000039860628 571024578 /nfs/dbraw/zinc/02/45/78/571024578.db2.gz IDBJWUIKUBHTFS-NEOBQEPSSA-N 0 0 355.846 5.527 40 0 FKABRN O=C1S/C(=C\c2cccc3ccccc23)C(=O)N1c1cccc(Cl)c1 ZINC000039860631 571024542 /nfs/dbraw/zinc/02/45/42/571024542.db2.gz QABTZCIEXUEQEU-WQRHYEAKSA-N 0 0 365.841 5.734 40 0 FKABRN CC(C)c1ccc(/C=C2\SC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000039860680 571024441 /nfs/dbraw/zinc/02/44/41/571024441.db2.gz CJQFQZHLJVBQNE-BOPFTXTBSA-N 0 0 357.862 5.704 40 0 FKABRN O=C1S/C(=C\c2ccccc2Cl)C(=O)N1c1ccc(Cl)cc1 ZINC000039860684 571024567 /nfs/dbraw/zinc/02/45/67/571024567.db2.gz QIHZTHLPDAXQIQ-ZROIWOOFSA-N 0 0 350.226 5.234 40 0 FKABRN O=C1S/C(=C\c2ccc(Cl)cc2)C(=O)N1c1ccc(Cl)cc1 ZINC000039860685 571024510 /nfs/dbraw/zinc/02/45/10/571024510.db2.gz ZRUHFZRAXXFQSF-ZROIWOOFSA-N 0 0 350.226 5.234 40 0 FKABRN O=C1S/C(=C\c2cccc3ccccc23)C(=O)N1c1ccc(Cl)cc1 ZINC000039860702 571024531 /nfs/dbraw/zinc/02/45/31/571024531.db2.gz ZQYDPQMARFDESN-PDGQHHTCSA-N 0 0 365.841 5.734 40 0 FKABRN O=C(Nc1ccc(Br)cc1)c1cc2cc(Cl)ccc2o1 ZINC000039897553 571024555 /nfs/dbraw/zinc/02/45/55/571024555.db2.gz ZUIJVMZKIYNYEK-UHFFFAOYSA-N 0 0 350.599 5.101 40 0 FKABRN O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1ccc2c(c1)CCCC2 ZINC000039897733 571089812 /nfs/dbraw/zinc/08/98/12/571089812.db2.gz CEWCSZWABSMJQZ-UHFFFAOYSA-N 0 0 353.771 5.490 40 0 FKABRN O=C(Nc1ccccc1C(=O)c1ccccc1)c1ccc2c(c1)CCCC2 ZINC000039897758 208214225 /nfs/dbraw/zinc/21/42/25/208214225.db2.gz BOVKYRKWCZGTMX-UHFFFAOYSA-N 0 0 355.437 5.049 40 0 FKABRN CC[C@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(C)cc1C ZINC000039968752 208216495 /nfs/dbraw/zinc/21/64/95/208216495.db2.gz FBMZNTANRAHSQX-KRWDZBQOSA-N 0 0 350.890 5.534 40 0 FKABRN CC[C@@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(C)cc1C ZINC000039968753 571090262 /nfs/dbraw/zinc/09/02/62/571090262.db2.gz FBMZNTANRAHSQX-QGZVFWFLSA-N 0 0 350.890 5.534 40 0 FKABRN CC[C@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(C)c(C)c1 ZINC000039968754 571090190 /nfs/dbraw/zinc/09/01/90/571090190.db2.gz LXIXZORUNXNDKZ-KRWDZBQOSA-N 0 0 350.890 5.534 40 0 FKABRN CC[C@@H](NC(=S)Nc1ccc(F)c(Cl)c1)c1ccc(C)c(C)c1 ZINC000039968755 571090281 /nfs/dbraw/zinc/09/02/81/571090281.db2.gz LXIXZORUNXNDKZ-QGZVFWFLSA-N 0 0 350.890 5.534 40 0 FKABRN COc1ccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1Cl ZINC000040114379 571090088 /nfs/dbraw/zinc/09/00/88/571090088.db2.gz IAFYINLFLXMSRT-UHFFFAOYSA-N 0 0 364.150 5.273 40 0 FKABRN CCc1ccc(-c2cn3cc(-c4ccc(Cl)cc4)n4c3c2CCCC4)cc1 ZINC000040163759 571026441 /nfs/dbraw/zinc/02/64/41/571026441.db2.gz IFNSSQZMDAZRMQ-UHFFFAOYSA-N 0 0 374.915 6.627 40 0 FKABRN CCOC(=O)c1ccc(Nc2ccnc3cc(C(F)(F)F)ccc32)cc1 ZINC000040164045 205061695 /nfs/dbraw/zinc/06/16/95/205061695.db2.gz VVNSORIEQFTJIC-UHFFFAOYSA-N 0 0 360.335 5.174 40 0 FKABRN CCOC(=O)c1cccc(Nc2ccnc3cc(C(F)(F)F)ccc32)c1 ZINC000040164047 208242176 /nfs/dbraw/zinc/24/21/76/208242176.db2.gz CVVKEHMVAFCPKJ-UHFFFAOYSA-N 0 0 360.335 5.174 40 0 FKABRN CCOC(=O)c1ccc(Nc2ccnc3ccc(C(F)(F)F)cc32)cc1 ZINC000040175523 205061857 /nfs/dbraw/zinc/06/18/57/205061857.db2.gz SAYFTTXMJPBKOF-UHFFFAOYSA-N 0 0 360.335 5.174 40 0 FKABRN CCOC(=O)c1cccc(Nc2ccnc3ccc(C(F)(F)F)cc32)c1 ZINC000040175526 208241010 /nfs/dbraw/zinc/24/10/10/208241010.db2.gz YLCUZTJTPVRTIE-UHFFFAOYSA-N 0 0 360.335 5.174 40 0 FKABRN CCCCc1ccc(Nc2nc(Nc3ccc(C)cc3)nc3nc[nH]c32)cc1 ZINC000040227592 205063043 /nfs/dbraw/zinc/06/30/43/205063043.db2.gz BZTQEEPKNGVKQJ-UHFFFAOYSA-N 0 0 372.476 5.491 40 0 FKABRN Clc1ccc(OCCCn2c3ccccc3nc2-c2ccco2)cc1 ZINC000040239040 220896511 /nfs/dbraw/zinc/89/65/11/220896511.db2.gz RRYXDLVTBDFQJN-UHFFFAOYSA-N 0 0 352.821 5.419 40 0 FKABRN Clc1ccccc1OCCCn1c2ccccc2nc1-c1cccs1 ZINC000040239143 208242919 /nfs/dbraw/zinc/24/29/19/208242919.db2.gz TXDIFQSLZGNAND-UHFFFAOYSA-N 0 0 368.889 5.887 40 0 FKABRN C(\c1ccccc1)=C1\CCCc2c(-c3ccccc3)nc(N3CCCC3)nc21 ZINC000040385500 571090973 /nfs/dbraw/zinc/09/09/73/571090973.db2.gz FMXJEMCYLVBKHM-DYTRJAOYSA-N 0 0 367.496 5.621 40 0 FKABRN Cc1cc2nc(-c3ccccc3Br)oc2c(Br)c1 ZINC000040542301 210186537 /nfs/dbraw/zinc/18/65/37/210186537.db2.gz XPFLAABALVJDPK-UHFFFAOYSA-N 0 0 367.040 5.328 40 0 FKABRN Cc1cc2nc(-c3cccc(Br)c3)oc2c(Br)c1 ZINC000040542303 571018856 /nfs/dbraw/zinc/01/88/56/571018856.db2.gz ZGLNVJJPURBQNV-UHFFFAOYSA-N 0 0 367.040 5.328 40 0 FKABRN Cc1cc2nc(-c3ccc(Br)cc3)oc2c(Br)c1 ZINC000040542309 571018999 /nfs/dbraw/zinc/01/89/99/571018999.db2.gz ZWXGMOJBQOJMAP-UHFFFAOYSA-N 0 0 367.040 5.328 40 0 FKABRN Cc1cc2nc(-c3cc(Cl)ccc3Cl)oc2c(Br)c1 ZINC000040542317 571018886 /nfs/dbraw/zinc/01/88/86/571018886.db2.gz MVZGOOJNRAYINC-UHFFFAOYSA-N 0 0 357.034 5.873 40 0 FKABRN Cc1cc2nc(-c3ccc(Cl)c(Cl)c3)oc2c(Br)c1 ZINC000040542323 571015825 /nfs/dbraw/zinc/01/58/25/571015825.db2.gz PGNKFPSUXQHKIQ-UHFFFAOYSA-N 0 0 357.034 5.873 40 0 FKABRN Cc1cc2nc(-c3ccc(Cl)cc3Cl)oc2c(Br)c1 ZINC000040542325 210186532 /nfs/dbraw/zinc/18/65/32/210186532.db2.gz KOUFIGZPNHPORA-UHFFFAOYSA-N 0 0 357.034 5.873 40 0 FKABRN COc1ccc(-c2nc3cc(C)cc(Br)c3o2)cc1Cl ZINC000040542329 210185768 /nfs/dbraw/zinc/18/57/68/210185768.db2.gz RQHOAXXOEZGVJR-UHFFFAOYSA-N 0 0 352.615 5.228 40 0 FKABRN Nc1ccc2oc(-c3cc(Cl)cc(Cl)c3Br)nc2c1 ZINC000040542345 571015933 /nfs/dbraw/zinc/01/59/33/571015933.db2.gz XMVOCRHBWVENOK-UHFFFAOYSA-N 0 0 358.022 5.146 40 0 FKABRN Cc1cc(C)n(-c2nc3ccc(-c4nc5ccccc5s4)cc3s2)n1 ZINC000040542359 210187360 /nfs/dbraw/zinc/18/73/60/210187360.db2.gz KWPVPXSJLRNBCR-UHFFFAOYSA-N 0 0 362.483 5.376 40 0 FKABRN Cc1cc(C)n(-c2nc3ccc(-c4nc5cc(C)ccc5o4)cc3s2)n1 ZINC000040542373 210187230 /nfs/dbraw/zinc/18/72/30/210187230.db2.gz DTPSXDJIWGFGMD-UHFFFAOYSA-N 0 0 360.442 5.215 40 0 FKABRN Cc1cc(C)n(-c2nc3ccc(-c4nc5cc(C)cc(C)c5o4)cc3s2)n1 ZINC000040542375 210186922 /nfs/dbraw/zinc/18/69/22/210186922.db2.gz RVSGVHPZVZKQPA-UHFFFAOYSA-N 0 0 374.469 5.524 40 0 FKABRN Cc1cc(C)n(-c2nc3ccc(-c4nc5cc(C)c(C)cc5o4)cc3s2)n1 ZINC000040542389 206765042 /nfs/dbraw/zinc/76/50/42/206765042.db2.gz DPUMVWMOIZJVLC-UHFFFAOYSA-N 0 0 374.469 5.524 40 0 FKABRN CCc1ccc2oc(-c3ccc4nc(-n5nc(C)cc5C)sc4c3)nc2c1 ZINC000040542391 210185734 /nfs/dbraw/zinc/18/57/34/210185734.db2.gz WOIOOUZAGDHGHD-UHFFFAOYSA-N 0 0 374.469 5.469 40 0 FKABRN Cc1nn(-c2ccccc2)c2c1[C@@]1(C=C(C)O2)Nc2cc(C(C)C)ccc2O1 ZINC000040544791 220908726 /nfs/dbraw/zinc/90/87/26/220908726.db2.gz GOHVJAVOBNEUFS-QHCPKHFHSA-N 0 0 373.456 5.258 40 0 FKABRN Cc1nn(-c2ccccc2)c2c1[C@]1(C=C(C)O2)Nc2cc(C(C)C)ccc2O1 ZINC000040544793 220908626 /nfs/dbraw/zinc/90/86/26/220908626.db2.gz GOHVJAVOBNEUFS-HSZRJFAPSA-N 0 0 373.456 5.258 40 0 FKABRN Cc1nc(NC(=O)C(C)(C)C)sc1-c1csc(Nc2ccccc2)n1 ZINC000040556473 208254490 /nfs/dbraw/zinc/25/44/90/208254490.db2.gz HOJGZYDCJOUZNI-UHFFFAOYSA-N 0 0 372.519 5.303 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)c1cccnc1Nc1cccc(C)c1 ZINC000040556529 571091690 /nfs/dbraw/zinc/09/16/90/571091690.db2.gz MQEXBMVCWDKTJU-UHFFFAOYSA-N 0 0 367.836 5.048 40 0 FKABRN CCCCOc1ccc(/C=C2\SC(=O)N(Cc3ccccc3)C2=O)cc1 ZINC000040867484 570499077 /nfs/dbraw/zinc/49/90/77/570499077.db2.gz NGPAPTLNDKPZOZ-RGEXLXHISA-N 0 0 367.470 5.102 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc(C)c1Cl ZINC000040913184 570502307 /nfs/dbraw/zinc/50/23/07/570502307.db2.gz BHOZSOWSEJZKPZ-MRXNPFEDSA-N 0 0 359.897 5.795 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc(C)c1Cl ZINC000040913185 570502206 /nfs/dbraw/zinc/50/22/06/570502206.db2.gz BHOZSOWSEJZKPZ-INIZCTEOSA-N 0 0 359.897 5.795 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000040913186 570502255 /nfs/dbraw/zinc/50/22/55/570502255.db2.gz KCUSIXNFDFHWGJ-OAHLLOKOSA-N 0 0 359.897 5.488 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000040913187 570502281 /nfs/dbraw/zinc/50/22/81/570502281.db2.gz KCUSIXNFDFHWGJ-HNNXBMFYSA-N 0 0 359.897 5.488 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(OC(C)C)cc2)cc(C)c1Cl ZINC000040913200 570502260 /nfs/dbraw/zinc/50/22/60/570502260.db2.gz CNBBYVKSKSLAPD-HNNXBMFYSA-N 0 0 361.869 5.150 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(OC(C)C)cc2)cc(C)c1Cl ZINC000040913201 570502249 /nfs/dbraw/zinc/50/22/49/570502249.db2.gz CNBBYVKSKSLAPD-OAHLLOKOSA-N 0 0 361.869 5.150 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2cc(Cl)cc(Cl)c2)cc(C)c1Cl ZINC000040913230 570502302 /nfs/dbraw/zinc/50/23/02/570502302.db2.gz FPAZMKVTQCGUQH-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2cc(Cl)cc(Cl)c2)cc(C)c1Cl ZINC000040913231 570502215 /nfs/dbraw/zinc/50/22/15/570502215.db2.gz FPAZMKVTQCGUQH-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2cccc(Cl)c2C)cc(C)c1Cl ZINC000040913264 570502241 /nfs/dbraw/zinc/50/22/41/570502241.db2.gz PRNXMECILOYMTA-ZDUSSCGKSA-N 0 0 352.261 5.325 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2cccc(Cl)c2C)cc(C)c1Cl ZINC000040913265 570502264 /nfs/dbraw/zinc/50/22/64/570502264.db2.gz PRNXMECILOYMTA-CYBMUJFWSA-N 0 0 352.261 5.325 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)cc(C)c1Cl ZINC000040913286 570502315 /nfs/dbraw/zinc/50/23/15/570502315.db2.gz KYQCRGKMRCEAAN-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccccc2C(F)(F)F)cc(C)c1Cl ZINC000040913287 570502294 /nfs/dbraw/zinc/50/22/94/570502294.db2.gz KYQCRGKMRCEAAN-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cc(C)c1Cl ZINC000040913288 570502329 /nfs/dbraw/zinc/50/23/29/570502329.db2.gz KSYTWRMABDFJCC-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2cccc(C(F)(F)F)c2)cc(C)c1Cl ZINC000040913289 570502312 /nfs/dbraw/zinc/50/23/12/570502312.db2.gz KSYTWRMABDFJCC-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000040913300 570502285 /nfs/dbraw/zinc/50/22/85/570502285.db2.gz MSBFMBLMAQHHFB-CYBMUJFWSA-N 0 0 352.261 5.325 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)[C@H](C)Oc1cc(C)c(Cl)c(C)c1 ZINC000040913301 570502310 /nfs/dbraw/zinc/50/23/10/570502310.db2.gz MSBFMBLMAQHHFB-ZDUSSCGKSA-N 0 0 352.261 5.325 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000040945049 570502526 /nfs/dbraw/zinc/50/25/26/570502526.db2.gz MZJYPKLWJQZGOL-QGZVFWFLSA-N 0 0 353.506 5.733 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000040945051 570502505 /nfs/dbraw/zinc/50/25/05/570502505.db2.gz MZJYPKLWJQZGOL-KRWDZBQOSA-N 0 0 353.506 5.733 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1C(F)(F)F ZINC000040945158 570502538 /nfs/dbraw/zinc/50/25/38/570502538.db2.gz JVUFMAMDYYDLHK-ZDUSSCGKSA-N 0 0 365.395 5.409 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1C(F)(F)F ZINC000040945160 570502467 /nfs/dbraw/zinc/50/24/67/570502467.db2.gz JVUFMAMDYYDLHK-CYBMUJFWSA-N 0 0 365.395 5.409 40 0 FKABRN COc1ccc(Br)cc1/C=C/C(=O)Nc1ccccc1C(C)C ZINC000040948721 220926029 /nfs/dbraw/zinc/92/60/29/220926029.db2.gz PLSRGNIPKHVLJH-DHZHZOJOSA-N 0 0 374.278 5.233 40 0 FKABRN COc1ccc(Br)cc1/C=C/C(=O)Nc1ccc(C(C)C)cc1 ZINC000040948722 570502563 /nfs/dbraw/zinc/50/25/63/570502563.db2.gz CIUOVKSQNQODQE-IZZDOVSWSA-N 0 0 374.278 5.233 40 0 FKABRN Cc1sc(NC(=O)c2ccc(C(C)(C)C)cc2)nc1-c1ccc(F)cc1 ZINC000040968353 570503298 /nfs/dbraw/zinc/50/32/98/570503298.db2.gz BTXGOVDJJWRZIE-UHFFFAOYSA-N 0 0 368.477 5.807 40 0 FKABRN Cc1sc(NC(=O)c2cccc3ccccc32)nc1-c1ccc(F)cc1 ZINC000040994217 209212359 /nfs/dbraw/zinc/21/23/59/209212359.db2.gz GFKTVFSZWWAFRC-UHFFFAOYSA-N 0 0 362.429 5.663 40 0 FKABRN O=C(CCc1ccc(Cl)cc1)Nc1ccc(OCc2ccccc2)cc1 ZINC000040995066 220926982 /nfs/dbraw/zinc/92/69/82/220926982.db2.gz NAELKFYLSYMHAJ-UHFFFAOYSA-N 0 0 365.860 5.490 40 0 FKABRN O=C(CCc1ccc(Cl)cc1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000040995178 208278102 /nfs/dbraw/zinc/27/81/02/208278102.db2.gz UNUXGBUMQKHYOK-UHFFFAOYSA-N 0 0 362.178 5.584 40 0 FKABRN O=C(CCc1ccc(Cl)cc1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000040995215 571096463 /nfs/dbraw/zinc/09/64/63/571096463.db2.gz GDXSWDPTAUBRIS-UHFFFAOYSA-N 0 0 362.178 5.584 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)Nc2ccc(N3CCCCC3)cc2)cc1 ZINC000040995691 535114510 /nfs/dbraw/zinc/11/45/10/535114510.db2.gz WOUINORVHWQRKW-UHFFFAOYSA-N 0 0 364.533 5.546 40 0 FKABRN Clc1cccc(Cl)c1COc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000041005169 205088008 /nfs/dbraw/zinc/08/80/08/205088008.db2.gz CQAZSJCGXNLWSW-UHFFFAOYSA-N 0 0 369.251 6.116 40 0 FKABRN Fc1cccc(Cl)c1COc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000041005179 205087649 /nfs/dbraw/zinc/08/76/49/205087649.db2.gz DOINCULNUUXGKT-UHFFFAOYSA-N 0 0 352.796 5.601 40 0 FKABRN CC(C)c1ccc(NC(=O)c2cc3cc(Br)ccc3o2)cc1 ZINC000041007104 209213167 /nfs/dbraw/zinc/21/31/67/209213167.db2.gz KIEYVFMDWVICOL-UHFFFAOYSA-N 0 0 358.235 5.571 40 0 FKABRN CCCCc1ccc(NC(=O)c2cc3cc(Br)ccc3o2)cc1 ZINC000041007107 570503127 /nfs/dbraw/zinc/50/31/27/570503127.db2.gz VBNMVJCOWNTSEN-UHFFFAOYSA-N 0 0 372.262 5.790 40 0 FKABRN Cc1ccc(NC(=O)c2cc3cc(Br)ccc3o2)cc1Cl ZINC000041007276 209213316 /nfs/dbraw/zinc/21/33/16/209213316.db2.gz PMQMVYIBZSIHRI-UHFFFAOYSA-N 0 0 364.626 5.409 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)c1cc2cc(Br)ccc2o1 ZINC000041007278 570503056 /nfs/dbraw/zinc/50/30/56/570503056.db2.gz XUBCWKLSGZWDCG-UHFFFAOYSA-N 0 0 364.626 5.409 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)cc1 ZINC000041008177 209213667 /nfs/dbraw/zinc/21/36/67/209213667.db2.gz NRHOWUFLMREDTJ-UHFFFAOYSA-N 0 0 372.493 6.086 40 0 FKABRN Cc1cccc(C)c1NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000041019122 571096920 /nfs/dbraw/zinc/09/69/20/571096920.db2.gz XHMFTWDPRRZWFR-UHFFFAOYSA-N 0 0 354.837 5.183 40 0 FKABRN CCCCc1ccc(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)cc1 ZINC000041019344 208279900 /nfs/dbraw/zinc/27/99/00/208279900.db2.gz KJFZFEGBMRYYFQ-UHFFFAOYSA-N 0 0 366.436 5.395 40 0 FKABRN Clc1ccc(C2=NC3N=C(c4ccc(Cl)cc4)SC3S2)cc1 ZINC000041097577 571083185 /nfs/dbraw/zinc/08/31/85/571083185.db2.gz ASDGXTNDFHPRLI-UHFFFAOYSA-N 0 0 365.310 5.333 40 0 FKABRN Cc1ccc2c(c1C)O[C@H](C)C=C2COc1ccc(-c2ccccc2)cc1 ZINC000041105104 571107552 /nfs/dbraw/zinc/10/75/52/571107552.db2.gz UDJODLSTOKCENF-GOSISDBHSA-N 0 0 356.465 6.214 40 0 FKABRN Cc1ccc2c(c1C)O[C@@H](C)C=C2COc1ccc(-c2ccccc2)cc1 ZINC000041105105 220929160 /nfs/dbraw/zinc/92/91/60/220929160.db2.gz UDJODLSTOKCENF-SFHVURJKSA-N 0 0 356.465 6.214 40 0 FKABRN C[C@H]1CCCCN1C(=O)Cc1ccc(-c2nc3cc(Cl)ccc3o2)cc1 ZINC000041127143 210186175 /nfs/dbraw/zinc/18/61/75/210186175.db2.gz VGVTZDFTRYBQKM-AWEZNQCLSA-N 0 0 368.864 5.092 40 0 FKABRN O=C(Cc1ccc(-c2nc3cc(Cl)ccc3o2)cc1)NC1CCCCC1 ZINC000041127151 206765382 /nfs/dbraw/zinc/76/53/82/206765382.db2.gz CMVKUBOTVQXPDA-UHFFFAOYSA-N 0 0 368.864 5.140 40 0 FKABRN COC(=O)c1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1Cl ZINC000041127221 203887529 /nfs/dbraw/zinc/88/75/29/203887529.db2.gz JBFLUKOBRRGFJC-UHFFFAOYSA-N 0 0 356.592 5.242 40 0 FKABRN COC(=O)Cc1ccc(-c2nc3cc(Cl)cc(Cl)c3o2)cc1Cl ZINC000041127261 206765279 /nfs/dbraw/zinc/76/52/79/206765279.db2.gz ZSRCVFZQBNJENC-UHFFFAOYSA-N 0 0 370.619 5.171 40 0 FKABRN O=C(NC1CCCCC1)c1cccc(-c2nc3cc(Cl)ccc3o2)c1 ZINC000041127535 571111741 /nfs/dbraw/zinc/11/17/41/571111741.db2.gz ZTINRCFACUUFIR-UHFFFAOYSA-N 0 0 354.837 5.211 40 0 FKABRN C[C@@H]1CCCCN1C(=O)c1cccc(-c2nc3cc(Cl)ccc3o2)c1 ZINC000041127540 571111665 /nfs/dbraw/zinc/11/16/65/571111665.db2.gz GGSNJHLGUQGCCC-CYBMUJFWSA-N 0 0 354.837 5.163 40 0 FKABRN C[C@H]1CCCCN1C(=O)c1cccc(-c2nc3cc(Cl)ccc3o2)c1 ZINC000041127542 210186778 /nfs/dbraw/zinc/18/67/78/210186778.db2.gz GGSNJHLGUQGCCC-ZDUSSCGKSA-N 0 0 354.837 5.163 40 0 FKABRN CC1CCN(C(=O)c2cccc(-c3nc4cc(Cl)ccc4o3)c2)CC1 ZINC000041127544 571111687 /nfs/dbraw/zinc/11/16/87/571111687.db2.gz XQVLWEFUFFGPIC-UHFFFAOYSA-N 0 0 354.837 5.020 40 0 FKABRN CCN(CC)C(=O)c1cccc(-c2nc3cc(Cl)cc(Cl)c3o2)c1 ZINC000041127552 571111704 /nfs/dbraw/zinc/11/17/04/571111704.db2.gz UYFIFXUSYLTRFQ-UHFFFAOYSA-N 0 0 363.244 5.284 40 0 FKABRN O=C(c1cccc(-c2nc3cc(Cl)cc(Cl)c3o2)c1)N1CCCC1 ZINC000041127555 203887350 /nfs/dbraw/zinc/88/73/50/203887350.db2.gz MNEOQRFMWPYMCM-UHFFFAOYSA-N 0 0 361.228 5.038 40 0 FKABRN O=C(Cc1cccc(-c2nc3cc(Cl)ccc3o2)c1)NC1CCCCC1 ZINC000041127648 571111742 /nfs/dbraw/zinc/11/17/42/571111742.db2.gz FOTUWLKFFSWDIZ-UHFFFAOYSA-N 0 0 368.864 5.140 40 0 FKABRN C[C@@H]1CCCCN1C(=O)Cc1cccc(-c2nc3cc(Cl)ccc3o2)c1 ZINC000041127654 571111719 /nfs/dbraw/zinc/11/17/19/571111719.db2.gz PSCCKLIQZPSRPP-CQSZACIVSA-N 0 0 368.864 5.092 40 0 FKABRN C[C@H]1CCCCN1C(=O)Cc1cccc(-c2nc3cc(Cl)ccc3o2)c1 ZINC000041127655 210186874 /nfs/dbraw/zinc/18/68/74/210186874.db2.gz PSCCKLIQZPSRPP-AWEZNQCLSA-N 0 0 368.864 5.092 40 0 FKABRN Cc1cccc2cc(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)oc21 ZINC000041306717 571097334 /nfs/dbraw/zinc/09/73/34/571097334.db2.gz ACBKBAGIGYNDOY-UHFFFAOYSA-N 0 0 353.727 5.666 40 0 FKABRN O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1cc2cc(Cl)ccc2o1 ZINC000041311004 570516472 /nfs/dbraw/zinc/51/64/72/570516472.db2.gz NRQBKUJKKDVFDT-UHFFFAOYSA-N 0 0 374.145 6.011 40 0 FKABRN O=C(Nc1cccc(Br)c1)c1cc2cc(Cl)ccc2o1 ZINC000041311355 570516501 /nfs/dbraw/zinc/51/65/01/570516501.db2.gz FRQIINSONLANQH-UHFFFAOYSA-N 0 0 350.599 5.101 40 0 FKABRN Cc1cccc2cc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)oc21 ZINC000041313721 205090020 /nfs/dbraw/zinc/09/00/20/205090020.db2.gz CLUHXIWFMRWZFE-UHFFFAOYSA-N 0 0 353.727 5.666 40 0 FKABRN CCOP(=O)(OCC)C(F)(F)c1ccc(C)cc1Br ZINC000042750794 205098175 /nfs/dbraw/zinc/09/81/75/205098175.db2.gz XQJQKMOAICSMME-UHFFFAOYSA-N 0 0 357.131 5.073 40 0 FKABRN CCCCCn1cc(C(=O)c2cccc3ccc(CC)cc32)c2ccccc21 ZINC000042966603 211785325 /nfs/dbraw/zinc/78/53/25/211785325.db2.gz NLUGKAUYCBHVKU-UHFFFAOYSA-N 0 0 369.508 6.778 40 0 in-vitro FKABRN CCCc1ccc(C(=O)c2cn(CCC)c3ccccc23)c2ccccc12 ZINC000042967152 208297836 /nfs/dbraw/zinc/29/78/36/208297836.db2.gz BMOMWXXAVVSIRU-UHFFFAOYSA-N 0 0 355.481 6.388 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2ccc(CC)c3ccccc23)c2ccccc21 ZINC000043013095 205099649 /nfs/dbraw/zinc/09/96/49/205099649.db2.gz LACIUQLUNACUKC-UHFFFAOYSA-N 0 0 369.508 6.778 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2c(OC)ccc3ccccc32)c2ccccc21 ZINC000043015331 208300465 /nfs/dbraw/zinc/30/04/65/208300465.db2.gz BWBLGFVKOJDYSU-UHFFFAOYSA-N 0 0 371.480 6.224 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3ccc(OC)cc32)c2ccccc21 ZINC000043021179 571099306 /nfs/dbraw/zinc/09/93/06/571099306.db2.gz IJNSZBAEVYRFCH-UHFFFAOYSA-N 0 0 371.480 6.224 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3cc(OC)ccc32)c2ccccc21 ZINC000043021515 205099730 /nfs/dbraw/zinc/09/97/30/205099730.db2.gz JCOOBICVPDFZNX-UHFFFAOYSA-N 0 0 371.480 6.224 40 0 in-vitro FKABRN CC(=O)O[C@@H]1CC[C@@H]2[C@H]3CCC4=C(Cl)C(=O)CC[C@@]4(C)[C@@H]3CC[C@@]12C ZINC000043735754 571306292 /nfs/dbraw/zinc/30/62/92/571306292.db2.gz XYGMEFJSKQEBTO-XMJHPVPBSA-N 0 0 364.913 5.017 40 0 FKABRN CCCC1CCC(C2CCC(c3ccc(OCC)c(F)c3F)CC2)CC1 ZINC000044137054 205107577 /nfs/dbraw/zinc/10/75/77/205107577.db2.gz CFJCNWQXOICKIF-UHFFFAOYSA-N 0 0 364.520 7.244 40 0 FKABRN c1ccc(Cn2c(-c3ccccc3)nc3c2ncnc3-c2ccccc2)cc1 ZINC000044137701 205106883 /nfs/dbraw/zinc/10/68/83/205106883.db2.gz ZLYKOEJCSKSVEH-UHFFFAOYSA-N 0 0 362.436 5.209 40 0 FKABRN CCOC(=O)Cc1cc2ccccc2c(-c2ccccc2)c1-c1ccccc1 ZINC000044138389 210046439 /nfs/dbraw/zinc/04/64/39/210046439.db2.gz BINXZPSJDCETNL-UHFFFAOYSA-N 0 0 366.460 6.279 40 0 FKABRN COc1ccc(N2C=Cc3ccccc3[C@@H]2C(Cl)(Cl)Cl)cc1 ZINC000044138558 536666856 /nfs/dbraw/zinc/66/68/56/536666856.db2.gz HRWCGXRDXPTJCU-MRXNPFEDSA-N 0 0 354.664 5.597 40 0 FKABRN COc1ccc(N2C=Cc3ccccc3[C@H]2C(Cl)(Cl)Cl)cc1 ZINC000044138560 536665744 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351.471 5.358 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1SC ZINC000044839025 571102129 /nfs/dbraw/zinc/10/21/29/571102129.db2.gz PCJQAPVZNSVZCO-LJQANCHMSA-N 0 0 351.471 5.358 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000044839352 211801456 /nfs/dbraw/zinc/80/14/56/211801456.db2.gz YIZCWYKVEKUZJJ-LBPRGKRZSA-N 0 0 352.261 5.523 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl ZINC000044839357 220961157 /nfs/dbraw/zinc/96/11/57/220961157.db2.gz YIZCWYKVEKUZJJ-GFCCVEGCSA-N 0 0 352.261 5.523 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000044839782 571102148 /nfs/dbraw/zinc/10/21/48/571102148.db2.gz OEBBSABROPONCO-NSHDSACASA-N 0 0 371.786 5.327 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000044839788 205111214 /nfs/dbraw/zinc/11/12/14/205111214.db2.gz OEBBSABROPONCO-LLVKDONJSA-N 0 0 371.786 5.327 40 0 FKABRN CCOc1ccc(CCC(=O)Nc2ccccc2C(C)C)cc1OCC ZINC000044840147 571102593 /nfs/dbraw/zinc/10/25/93/571102593.db2.gz 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205115348 /nfs/dbraw/zinc/11/53/48/205115348.db2.gz WFSXGMDCCAIFTK-LBPRGKRZSA-N 0 0 354.302 5.133 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N(C)Cc1ccc(Cl)cc1 ZINC000044904552 571104567 /nfs/dbraw/zinc/10/45/67/571104567.db2.gz WFSXGMDCCAIFTK-GFCCVEGCSA-N 0 0 354.302 5.133 40 0 FKABRN O=C(NCc1ccc(F)cc1)c1ccc(CSc2ccccc2)cc1 ZINC000044904736 571104439 /nfs/dbraw/zinc/10/44/39/571104439.db2.gz GCCZUHPLCIKVOF-UHFFFAOYSA-N 0 0 351.446 5.048 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000044904784 220963610 /nfs/dbraw/zinc/96/36/10/220963610.db2.gz WXHQWNHGKZPTFG-SFHVURJKSA-N 0 0 373.374 5.655 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000044904786 220963052 /nfs/dbraw/zinc/96/30/52/220963052.db2.gz WXHQWNHGKZPTFG-GOSISDBHSA-N 0 0 373.374 5.655 40 0 FKABRN Cc1nccn1Cc1ccc(C(=O)Nc2ccccc2-c2ccccc2)cc1 ZINC000044914945 571104782 /nfs/dbraw/zinc/10/47/82/571104782.db2.gz NUDOMGHODUGNDE-UHFFFAOYSA-N 0 0 367.452 5.159 40 0 FKABRN CCc1ccc(NC(=O)c2ccc(CN3CCCc4ccccc43)cc2)cc1 ZINC000044945646 136121833 /nfs/dbraw/zinc/12/18/33/136121833.db2.gz GNSADFBPBMATAR-UHFFFAOYSA-N 0 0 370.496 5.454 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N(C)Cc2ccc(Cl)cc2)cc(C)c1Cl ZINC000044946246 205116091 /nfs/dbraw/zinc/11/60/91/205116091.db2.gz MWVQYTGWVZJVPU-AWEZNQCLSA-N 0 0 366.288 5.036 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N(C)Cc2ccc(Cl)cc2)cc(C)c1Cl ZINC000044946251 208324219 /nfs/dbraw/zinc/32/42/19/208324219.db2.gz MWVQYTGWVZJVPU-CQSZACIVSA-N 0 0 366.288 5.036 40 0 FKABRN CC[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(OC)cc1 ZINC000044946475 211807271 /nfs/dbraw/zinc/80/72/71/211807271.db2.gz OHDKAZFODUBKKH-CIPTZOQDSA-N 0 0 361.441 5.096 40 0 FKABRN CC[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc(OC)cc1 ZINC000044946479 208324000 /nfs/dbraw/zinc/32/40/00/208324000.db2.gz OHDKAZFODUBKKH-QEQIRTOISA-N 0 0 361.441 5.096 40 0 FKABRN CCSc1ccccc1NC(=O)CC(c1ccccc1)c1ccccc1 ZINC000044946733 208324804 /nfs/dbraw/zinc/32/48/04/208324804.db2.gz ZLRXPXYZMUCYEL-UHFFFAOYSA-N 0 0 361.510 5.959 40 0 FKABRN CC[C@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(OC)cc1 ZINC000044946999 571105613 /nfs/dbraw/zinc/10/56/13/571105613.db2.gz ZWEMNKVYNXUQJT-FQEVSTJZSA-N 0 0 359.425 5.476 40 0 FKABRN CC[C@@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc(OC)cc1 ZINC000044947003 205115644 /nfs/dbraw/zinc/11/56/44/205115644.db2.gz ZWEMNKVYNXUQJT-HXUWFJFHSA-N 0 0 359.425 5.476 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)[C@@H](C)Sc2ccccc2)cc1 ZINC000044947369 220964268 /nfs/dbraw/zinc/96/42/68/220964268.db2.gz ZFTXWYIBOHAURX-UZLBHIALSA-N 0 0 357.519 5.079 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)[C@@H](C)Sc2ccccc2)cc1 ZINC000044947374 208325662 /nfs/dbraw/zinc/32/56/62/208325662.db2.gz ZFTXWYIBOHAURX-OXQOHEQNSA-N 0 0 357.519 5.079 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)[C@H](C)Sc2ccccc2)cc1 ZINC000044947379 211807796 /nfs/dbraw/zinc/80/77/96/211807796.db2.gz ZFTXWYIBOHAURX-JXFKEZNVSA-N 0 0 357.519 5.079 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)[C@H](C)Sc2ccccc2)cc1 ZINC000044947383 205115785 /nfs/dbraw/zinc/11/57/85/205115785.db2.gz ZFTXWYIBOHAURX-OXJNMPFZSA-N 0 0 357.519 5.079 40 0 FKABRN O=C(CSCc1ccc(Cl)c(Cl)c1)Nc1ccc(F)c(F)c1 ZINC000044947441 205116477 /nfs/dbraw/zinc/11/64/77/205116477.db2.gz PPBFPJDTWAAZHI-UHFFFAOYSA-N 0 0 362.228 5.144 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](C)Sc2ccc(OC)c(OC)c2)cc1 ZINC000044947518 571105675 /nfs/dbraw/zinc/10/56/75/571105675.db2.gz QFGABLMNRQOLLT-OAHLLOKOSA-N 0 0 373.518 5.166 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](C)Sc2ccc(OC)c(OC)c2)cc1 ZINC000044947522 571105563 /nfs/dbraw/zinc/10/55/63/571105563.db2.gz QFGABLMNRQOLLT-HNNXBMFYSA-N 0 0 373.518 5.166 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)c2ccc(CN3CCc4ccccc43)cc2)cc1 ZINC000044947531 571105690 /nfs/dbraw/zinc/10/56/90/571105690.db2.gz ACPQIFIGWFXGED-LJQANCHMSA-N 0 0 370.496 5.049 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)c2ccc(CN3CCc4ccccc43)cc2)cc1 ZINC000044947536 571105606 /nfs/dbraw/zinc/10/56/06/571105606.db2.gz ACPQIFIGWFXGED-IBGZPJMESA-N 0 0 370.496 5.049 40 0 FKABRN CC(C)C(NC(=O)c1ccc(OCCSc2ccccc2)cc1)C(C)C ZINC000044947853 208325989 /nfs/dbraw/zinc/32/59/89/208325989.db2.gz WVWNPNHTSGXFPL-UHFFFAOYSA-N 0 0 371.546 5.268 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@@H](CC)Oc1cccc2ccccc21 ZINC000044947951 571105587 /nfs/dbraw/zinc/10/55/87/571105587.db2.gz CGNQLASVRGXLCL-OAQYLSRUSA-N 0 0 361.485 5.761 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@H](CC)Oc1cccc2ccccc21 ZINC000044947955 571105685 /nfs/dbraw/zinc/10/56/85/571105685.db2.gz CGNQLASVRGXLCL-NRFANRHFSA-N 0 0 361.485 5.761 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)c1ccc(OC(C)C)cc1)c1ccccc1 ZINC000044948091 571105598 /nfs/dbraw/zinc/10/55/98/571105598.db2.gz NWQVBZYANIWYEJ-HSZRJFAPSA-N 0 0 359.469 5.302 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)c1ccc(OC(C)C)cc1)c1ccccc1 ZINC000044948095 220965082 /nfs/dbraw/zinc/96/50/82/220965082.db2.gz NWQVBZYANIWYEJ-QHCPKHFHSA-N 0 0 359.469 5.302 40 0 FKABRN COc1ccc(/C=C(/C(=O)N(C)Cc2ccc(C)cc2)c2ccccc2)cc1 ZINC000044949271 571105621 /nfs/dbraw/zinc/10/56/21/571105621.db2.gz XBZJYDFBPFEEHD-JJIBRWJFSA-N 0 0 371.480 5.203 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000044949556 205116492 /nfs/dbraw/zinc/11/64/92/205116492.db2.gz PUUWKKOOCIOIPR-AWEZNQCLSA-N 0 0 374.720 6.156 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000044949559 208325364 /nfs/dbraw/zinc/32/53/64/208325364.db2.gz PUUWKKOOCIOIPR-CQSZACIVSA-N 0 0 374.720 6.156 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(SC)c1 ZINC000044949879 571106011 /nfs/dbraw/zinc/10/60/11/571106011.db2.gz BBCRGHPYLVQFRZ-IBGZPJMESA-N 0 0 351.471 5.358 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc(SC)c1 ZINC000044949883 571105984 /nfs/dbraw/zinc/10/59/84/571105984.db2.gz BBCRGHPYLVQFRZ-LJQANCHMSA-N 0 0 351.471 5.358 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl ZINC000044949960 571105945 /nfs/dbraw/zinc/10/59/45/571105945.db2.gz SYVZTEGZDKWDHX-SFHVURJKSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl ZINC000044949964 220965034 /nfs/dbraw/zinc/96/50/34/220965034.db2.gz SYVZTEGZDKWDHX-GOSISDBHSA-N 0 0 374.267 5.943 40 0 FKABRN CC1=C(C)[C@@]2(C)[C@]1(C)[C@@H](C)[C@]2(C)OC(=O)c1ccc(Br)cc1 ZINC000045028148 206076073 /nfs/dbraw/zinc/07/60/73/206076073.db2.gz XCKBIRVNXHZZSU-RPTUDFQQSA-N 0 0 363.295 5.377 40 0 FKABRN CC1=C(C)[C@@]2(C)[C@]1(C)[C@H](C)[C@]2(C)OC(=O)c1ccc(Br)cc1 ZINC000045028149 209322512 /nfs/dbraw/zinc/32/25/12/209322512.db2.gz XCKBIRVNXHZZSU-VKOGCVSHSA-N 0 0 363.295 5.377 40 0 FKABRN CC1=C(C)[C@H](C)[C@@]2(C)N(c3ccc(Br)cc3)N=N[C@]2(C)[C@@H]1C ZINC000045070101 570539003 /nfs/dbraw/zinc/53/90/03/570539003.db2.gz AEIGMGYOVQMLSX-LTCOOKNTSA-N 0 0 362.315 5.776 40 0 FKABRN CC1=C(C)[C@H](C)[C@@]2(C)N(c3ccc(Br)cc3)N=N[C@]2(C)[C@H]1C ZINC000045070104 570539059 /nfs/dbraw/zinc/53/90/59/570539059.db2.gz AEIGMGYOVQMLSX-LBTBCDHLSA-N 0 0 362.315 5.776 40 0 FKABRN CC1=C(C)[C@@H](C)[C@@]2(C)N(c3ccc(Br)cc3)N=N[C@]2(C)[C@@H]1C ZINC000045070107 263405475 /nfs/dbraw/zinc/40/54/75/263405475.db2.gz AEIGMGYOVQMLSX-DTTOXWODSA-N 0 0 362.315 5.776 40 0 FKABRN CC1=C(C)[C@H](C)[C@@]2(C)N=NN(c3ccc(Br)cc3)[C@]2(C)[C@@H]1C ZINC000045070111 263405466 /nfs/dbraw/zinc/40/54/66/263405466.db2.gz AEIGMGYOVQMLSX-MJSCVDMRSA-N 0 0 362.315 5.776 40 0 FKABRN COc1ccc(OC)c2c1[C@@H]1c3c(c(F)c(F)c(F)c3F)[C@H]2C1=C(C)C ZINC000045071358 220966478 /nfs/dbraw/zinc/96/64/78/220966478.db2.gz HAZODKJEOGUBOS-OKILXGFUSA-N 0 0 364.338 5.187 40 0 FKABRN CCCCCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000045789210 208337778 /nfs/dbraw/zinc/33/77/78/208337778.db2.gz PALJPGHWDUHUPO-UHFFFAOYSA-N 0 0 355.481 6.606 40 0 in-vitro FKABRN Cc1cc2nc(N)sc2c(C)c1NC(=O)c1ccc(C(C)(C)C)cc1 ZINC000045888581 571205400 /nfs/dbraw/zinc/20/54/00/571205400.db2.gz LKMILMFWVSUFQE-UHFFFAOYSA-N 0 0 353.491 5.045 40 0 FKABRN Cc1cc2nc(N)sc2c(C)c1NC(=O)c1ccc(Cl)cc1Cl ZINC000045889046 571205386 /nfs/dbraw/zinc/20/53/86/571205386.db2.gz ZHBSVXLIKBMHRD-UHFFFAOYSA-N 0 0 366.273 5.054 40 0 FKABRN Cc1cc2nc(N)sc2c(C)c1NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000045889059 210188419 /nfs/dbraw/zinc/18/84/19/210188419.db2.gz LFTKOIABFRUDLB-UHFFFAOYSA-N 0 0 366.273 5.054 40 0 FKABRN Cc1cc2nc(N)sc2c(C)c1NC(=O)c1cc(Cl)ccc1Cl ZINC000045889064 210188814 /nfs/dbraw/zinc/18/88/14/210188814.db2.gz ZQWWCBHBWOVAFQ-UHFFFAOYSA-N 0 0 366.273 5.054 40 0 FKABRN Cc1cc2nc(N)sc2c(C)c1NC(=O)c1ccc(-c2ccccc2)cc1 ZINC000045889082 210189683 /nfs/dbraw/zinc/18/96/83/210189683.db2.gz RBLDURRNOIHWGR-UHFFFAOYSA-N 0 0 373.481 5.415 40 0 FKABRN CCOC(=O)/C=C/c1ccc(-c2cc(C)c(Br)c(CC)c2)o1 ZINC000045889514 571205353 /nfs/dbraw/zinc/20/53/53/571205353.db2.gz MWJREORLDDTWFC-VQHVLOKHSA-N 0 0 363.251 5.156 40 0 FKABRN Nc1nc2c(s1)c(Cl)c(NC(=O)c1ccc(Cl)cc1)cc2Cl ZINC000045891563 206767974 /nfs/dbraw/zinc/76/79/74/206767974.db2.gz FNFDTPZRWKRDDT-UHFFFAOYSA-N 0 0 372.664 5.091 40 0 FKABRN Nc1nc2c(s1)c(Cl)c(NC(=O)c1ccccc1Cl)cc2Cl ZINC000045891572 571205569 /nfs/dbraw/zinc/20/55/69/571205569.db2.gz HLGVBNVJPRKKPV-UHFFFAOYSA-N 0 0 372.664 5.091 40 0 FKABRN Nc1cc(Cl)c(NC(=O)c2ccc(Cl)c(Cl)c2)cc1Cl ZINC000045891621 210189526 /nfs/dbraw/zinc/18/95/26/210189526.db2.gz MKQCEADFUARPQV-UHFFFAOYSA-N 0 0 350.032 5.135 40 0 FKABRN Nc1ccc2nc(-c3cc(Cl)c(Br)c(Cl)c3)oc2c1 ZINC000045919877 571205646 /nfs/dbraw/zinc/20/56/46/571205646.db2.gz ZOECPBOXCFUHFT-UHFFFAOYSA-N 0 0 358.022 5.146 40 0 FKABRN Nc1ccc2nc(-c3cc(Cl)cc(Cl)c3Br)oc2c1 ZINC000045919879 210189723 /nfs/dbraw/zinc/18/97/23/210189723.db2.gz LJAUGIZBGXIMBS-UHFFFAOYSA-N 0 0 358.022 5.146 40 0 FKABRN Cc1ccc2oc(-c3cc(Cl)c(Br)c(Cl)c3)nc2c1 ZINC000045919895 210188927 /nfs/dbraw/zinc/18/89/27/210188927.db2.gz KQZXLDJJNJMOTR-UHFFFAOYSA-N 0 0 357.034 5.873 40 0 FKABRN Cc1ccc2oc(-c3cc(Cl)cc(Cl)c3Br)nc2c1 ZINC000045919901 210188895 /nfs/dbraw/zinc/18/88/95/210188895.db2.gz CRXPXFQFYQZVIQ-UHFFFAOYSA-N 0 0 357.034 5.873 40 0 FKABRN COC(=O)c1ccc2oc(-c3cc(Cl)cc(Cl)c3Cl)nc2c1 ZINC000045919919 220976417 /nfs/dbraw/zinc/97/64/17/220976417.db2.gz KSHVJUIWLPLSMH-UHFFFAOYSA-N 0 0 356.592 5.242 40 0 FKABRN CCOC(=O)c1ccc2oc(-c3cc(Cl)cc(Cl)c3Cl)nc2c1 ZINC000045919921 571205620 /nfs/dbraw/zinc/20/56/20/571205620.db2.gz CQGNZCPLZFGCCI-UHFFFAOYSA-N 0 0 370.619 5.632 40 0 FKABRN COC(=O)c1ccc2oc(-c3cc(Cl)c(Cl)c(Cl)c3)nc2c1 ZINC000045919925 571205625 /nfs/dbraw/zinc/20/56/25/571205625.db2.gz DGFZFEVXXLURQI-UHFFFAOYSA-N 0 0 356.592 5.242 40 0 FKABRN CCOC(=O)c1ccc2oc(-c3cc(Cl)c(Cl)c(Cl)c3)nc2c1 ZINC000045919927 571205591 /nfs/dbraw/zinc/20/55/91/571205591.db2.gz NZVBKASNESAOFX-UHFFFAOYSA-N 0 0 370.619 5.632 40 0 FKABRN Clc1cc(-c2nc3ccccc3s2)cc(Cl)c1Br ZINC000045919943 203888300 /nfs/dbraw/zinc/88/83/00/203888300.db2.gz GHDNZAHDTDIPMZ-UHFFFAOYSA-N 0 0 359.075 6.033 40 0 FKABRN Clc1cc(Cl)c(Br)c(-c2nc3ccccc3s2)c1 ZINC000045919949 571205644 /nfs/dbraw/zinc/20/56/44/571205644.db2.gz GQOBADRRMKJDRX-UHFFFAOYSA-N 0 0 359.075 6.033 40 0 FKABRN Fc1ccc2nc(-c3cccc4c(Br)cccc34)sc2c1 ZINC000045919995 210188697 /nfs/dbraw/zinc/18/86/97/210188697.db2.gz IEHDMBGCZZQFCO-UHFFFAOYSA-N 0 0 358.235 6.018 40 0 FKABRN COc1cc2nc(-c3ccc(C(C)(C)C)cc3)oc2c(Br)c1 ZINC000045920238 203888198 /nfs/dbraw/zinc/88/81/98/203888198.db2.gz SEGHTVNOCQLFQP-UHFFFAOYSA-N 0 0 360.251 5.563 40 0 FKABRN COc1cc2nc(-c3ccc(C)c(Cl)c3)oc2c(Br)c1 ZINC000045920284 571205740 /nfs/dbraw/zinc/20/57/40/571205740.db2.gz IBEINCLKPKFTOT-UHFFFAOYSA-N 0 0 352.615 5.228 40 0 FKABRN COc1cc2nc(-c3ccc(Cl)c(Cl)c3)oc2c(Br)c1 ZINC000045920292 210189086 /nfs/dbraw/zinc/18/90/86/210189086.db2.gz WNTZFXSAWQYSGB-UHFFFAOYSA-N 0 0 373.033 5.573 40 0 FKABRN COc1cc2nc(-c3ccc(Cl)cc3Cl)oc2c(Br)c1 ZINC000045920294 571205720 /nfs/dbraw/zinc/20/57/20/571205720.db2.gz MHUAORXZEMZTEM-UHFFFAOYSA-N 0 0 373.033 5.573 40 0 FKABRN COc1cc2nc(-c3cc(Cl)ccc3Cl)oc2c(Br)c1 ZINC000045920296 571205747 /nfs/dbraw/zinc/20/57/47/571205747.db2.gz PNYLFXVVOAYPCQ-UHFFFAOYSA-N 0 0 373.033 5.573 40 0 FKABRN COc1cc2nc(-c3cccc4ccccc43)oc2c(Br)c1 ZINC000045920300 571205616 /nfs/dbraw/zinc/20/56/16/571205616.db2.gz WYYMQTRLYGMZID-UHFFFAOYSA-N 0 0 354.203 5.419 40 0 FKABRN Cc1ccc(-c2nc3cc(-c4ccccc4)ccc3o2)cc1-n1cnnc1 ZINC000045920559 571205678 /nfs/dbraw/zinc/20/56/78/571205678.db2.gz ULTHOZGOVKXOSF-UHFFFAOYSA-N 0 0 352.397 5.051 40 0 FKABRN Cc1c(-c2nc3cc(-c4ccccc4)ccc3o2)cccc1-n1cnnc1 ZINC000045920673 571205610 /nfs/dbraw/zinc/20/56/10/571205610.db2.gz XBTMEPRGPGAIRM-UHFFFAOYSA-N 0 0 352.397 5.051 40 0 FKABRN COc1ccc(-c2nc3c(cccc3Cl)s2)cc1Br ZINC000045920887 210188103 /nfs/dbraw/zinc/18/81/03/210188103.db2.gz IDKBEEMUJPMKIO-UHFFFAOYSA-N 0 0 354.656 5.388 40 0 FKABRN Clc1cccc2sc(-c3cccc4c(Br)cccc34)nc21 ZINC000045920899 571205635 /nfs/dbraw/zinc/20/56/35/571205635.db2.gz GDJXBJZZFGCRJQ-UHFFFAOYSA-N 0 0 374.690 6.532 40 0 FKABRN Clc1cccc2sc(-c3cccc(I)c3)nc21 ZINC000045920928 210189819 /nfs/dbraw/zinc/18/98/19/210189819.db2.gz NIMJPHPBBUTKQI-UHFFFAOYSA-N 0 0 371.630 5.221 40 0 FKABRN Clc1cccc2sc(-c3cc(Br)ccc3Cl)nc21 ZINC000045920951 571205601 /nfs/dbraw/zinc/20/56/01/571205601.db2.gz FWZSEHBRFSQZLZ-UHFFFAOYSA-N 0 0 359.075 6.033 40 0 FKABRN Cc1ccc2nc(-c3cc(Cl)c(N)c(Br)c3)sc2c1 ZINC000045923352 210188751 /nfs/dbraw/zinc/18/87/51/210188751.db2.gz PQHLORBKERHMMH-UHFFFAOYSA-N 0 0 353.672 5.270 40 0 FKABRN Cc1ccc2nc(-c3cccc4c(Br)cccc34)sc2c1 ZINC000045923517 571205731 /nfs/dbraw/zinc/20/57/31/571205731.db2.gz ULRDDSKCTQBXEX-UHFFFAOYSA-N 0 0 354.272 6.187 40 0 FKABRN Cc1cccc2sc(-c3cccc4c(Br)cccc34)nc21 ZINC000045946809 571205708 /nfs/dbraw/zinc/20/57/08/571205708.db2.gz JBBKBCTWWXOUSX-UHFFFAOYSA-N 0 0 354.272 6.187 40 0 FKABRN CC(C)c1ccc(CNc2cccc(-c3nc4ccccc4s3)c2)cc1 ZINC000045954103 571205661 /nfs/dbraw/zinc/20/56/61/571205661.db2.gz FZPNQJXBJGCPTG-UHFFFAOYSA-N 0 0 358.510 6.699 40 0 FKABRN Clc1ccc(CNc2cccc(-c3nc4ccccc4s3)c2)cc1 ZINC000045954109 206767532 /nfs/dbraw/zinc/76/75/32/206767532.db2.gz QKEAGNOJYZJVEO-UHFFFAOYSA-N 0 0 350.874 6.229 40 0 FKABRN CCc1cc2nc(-c3ccc(N)c(Cl)c3)oc2c(Br)c1 ZINC000045954143 571205723 /nfs/dbraw/zinc/20/57/23/571205723.db2.gz RMLCSEZKVOTFCV-UHFFFAOYSA-N 0 0 351.631 5.055 40 0 FKABRN CC(C)c1cc2nc(-c3ccc(N)c(Cl)c3)oc2c(Br)c1 ZINC000045954146 203888748 /nfs/dbraw/zinc/88/87/48/203888748.db2.gz VQPCHJGESRJHDX-UHFFFAOYSA-N 0 0 365.658 5.616 40 0 FKABRN O=C(CCc1ccc(Cl)cc1Cl)Nc1ccccc1Br ZINC000046569604 571107096 /nfs/dbraw/zinc/10/70/96/571107096.db2.gz VDLGBIIQRYQFLV-UHFFFAOYSA-N 0 0 373.077 5.327 40 0 FKABRN CCOc1ccc([C@@H](C)NC(=S)Nc2cc(C)ccc2C)cc1OCC ZINC000048228543 571107928 /nfs/dbraw/zinc/10/79/28/571107928.db2.gz DWDBLDMYHROLGB-MRXNPFEDSA-N 0 0 372.534 5.148 40 0 FKABRN CCOc1ccc([C@H](C)NC(=S)Nc2cc(C)ccc2C)cc1OCC ZINC000048228546 205152626 /nfs/dbraw/zinc/15/26/26/205152626.db2.gz DWDBLDMYHROLGB-INIZCTEOSA-N 0 0 372.534 5.148 40 0 FKABRN CCCCCC1CCC(c2ccc(I)cc2)CC1 ZINC000049588470 205174321 /nfs/dbraw/zinc/17/43/21/205174321.db2.gz ZVJXAYCOQJDVMP-UHFFFAOYSA-N 0 0 356.291 6.145 40 0 FKABRN CC(C)=CCc1c(O)cc(CCc2ccccc2)c(CC=C(C)C)c1O ZINC000049601304 221026378 /nfs/dbraw/zinc/02/63/78/221026378.db2.gz PHPXAJCVSGIDFH-UHFFFAOYSA-N 0 0 350.502 5.900 40 0 biogenic,in-vitro FKABRN CC(C=C(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1 ZINC000049959296 221029312 /nfs/dbraw/zinc/02/93/12/221029312.db2.gz SVKCVOLGOYLFJW-UHFFFAOYSA-N 0 0 360.500 7.125 40 0 FKABRN c1ccc(C[C@@H](c2ccccc2)[C@@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000051139510 205180739 /nfs/dbraw/zinc/18/07/39/205180739.db2.gz AOEDHVIDHZGXAP-NSOVKSMOSA-N 0 0 362.516 7.039 40 0 FKABRN c1ccc(C[C@@H](c2ccccc2)[C@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000051139511 571110615 /nfs/dbraw/zinc/11/06/15/571110615.db2.gz AOEDHVIDHZGXAP-HNRBIFIRSA-N 0 0 362.516 7.039 40 0 FKABRN c1ccc(C[C@H](c2ccccc2)[C@H](Cc2ccccc2)c2ccccc2)cc1 ZINC000051139512 221033917 /nfs/dbraw/zinc/03/39/17/221033917.db2.gz AOEDHVIDHZGXAP-VSGBNLITSA-N 0 0 362.516 7.039 40 0 FKABRN CCC(=O)Nc1ccc(Cl)c(NC(=O)c2cc(Cl)ccc2Cl)c1 ZINC000052410559 570689953 /nfs/dbraw/zinc/68/99/53/570689953.db2.gz KVYYGJSWVOZDIG-UHFFFAOYSA-N 0 0 371.651 5.248 40 0 FKABRN CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000052410561 571306389 /nfs/dbraw/zinc/30/63/89/571306389.db2.gz GQPONZYEPMHHAU-UHFFFAOYSA-N 0 0 371.651 5.248 40 0 FKABRN CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Cl)cc2Cl)c1 ZINC000052410792 221038045 /nfs/dbraw/zinc/03/80/45/221038045.db2.gz FTRQETADPPDTJD-UHFFFAOYSA-N 0 0 371.651 5.248 40 0 FKABRN CCOC(=O)/C=C(C)\C=C/C=C(C)\C=C/c1c(C)cc(OC)c(C)c1C ZINC000053682975 570954793 /nfs/dbraw/zinc/95/47/93/570954793.db2.gz HQMNCQVAMBCHCO-NEWHPHRFSA-N 0 0 354.490 5.646 40 0 FKABRN Cc1ccc(-n2cc(-c3ccccc3)c3c2nc[nH]c3=S)cc1Cl ZINC000053944076 205196577 /nfs/dbraw/zinc/19/65/77/205196577.db2.gz IJMKTOUHQVAGAX-UHFFFAOYSA-N 0 0 351.862 5.338 40 0 FKABRN CC(C)(C)CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(Cl)c1Cl ZINC000054363225 221052569 /nfs/dbraw/zinc/05/25/69/221052569.db2.gz RMPMVPUIQKAJAN-UHFFFAOYSA-N 0 0 372.745 5.140 40 0 FKABRN CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)NC(C)(C)CC(C)(C)C ZINC000054363241 571114154 /nfs/dbraw/zinc/11/41/54/571114154.db2.gz SZHFLOJBQGIHJQ-UHFFFAOYSA-N 0 0 369.571 5.010 40 0 FKABRN CC(C)Sc1ccccc1C(=O)Nc1ccc(Cc2ccncc2)cc1 ZINC000054769338 571114826 /nfs/dbraw/zinc/11/48/26/571114826.db2.gz PHOYXLXHCMFRKA-UHFFFAOYSA-N 0 0 362.498 5.425 40 0 FKABRN Cc1ccc2c(cccc2NC(=O)/C=C/c2ccc(-c3ccccc3)o2)n1 ZINC000057312933 568292410 /nfs/dbraw/zinc/29/24/10/568292410.db2.gz YVGLYFXQDSKDNJ-NTCAYCPXSA-N 0 0 354.409 5.455 40 0 FKABRN Cc1ccc2cccc(NC(=O)COc3ccc(C4CCCCC4)cc3)c2n1 ZINC000057313200 568272179 /nfs/dbraw/zinc/27/21/79/568272179.db2.gz PSDUQFCLRRNOQX-UHFFFAOYSA-N 0 0 374.484 5.608 40 0 FKABRN Cc1ccc2nsnc2c1NC(=O)c1cccc2c(Cl)cccc12 ZINC000057313505 568272398 /nfs/dbraw/zinc/27/23/98/568272398.db2.gz BMUUDLDORJHPKZ-UHFFFAOYSA-N 0 0 353.834 5.059 40 0 FKABRN O=C(Nc1c2nsnc2ccc1Cl)c1ccc(-c2ccccc2)cc1 ZINC000057314005 568272798 /nfs/dbraw/zinc/27/27/98/568272798.db2.gz KOJIGUMJOUWVQK-UHFFFAOYSA-N 0 0 365.845 5.264 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2c3nsnc3ccc2Cl)cc1 ZINC000057314129 568272758 /nfs/dbraw/zinc/27/27/58/568272758.db2.gz ISVJNFONKCRCSR-BJMVGYQFSA-N 0 0 357.866 5.120 40 0 FKABRN Cc1cc2sc(NC(=O)/C=C/c3ccc(-c4ccccc4)o3)nc2c(C)c1 ZINC000057315613 568273095 /nfs/dbraw/zinc/27/30/95/568273095.db2.gz GHTMQJGXTAYTBV-PKNBQFBNSA-N 0 0 374.465 5.825 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1ccccc1OC(F)F ZINC000057315733 568273203 /nfs/dbraw/zinc/27/32/03/568273203.db2.gz YIDSBVYMCGKTGL-ACCUITESSA-N 0 0 355.340 5.200 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1cccc(Br)c1 ZINC000057315770 568273198 /nfs/dbraw/zinc/27/31/98/568273198.db2.gz MAJGBHMAGCNDGR-ZRDIBKRKSA-N 0 0 368.230 5.361 40 0 FKABRN CC(C)(C)c1ccc(OC(C)(C)C(=O)NC2C3CC4CC(C3)CC2C4)cc1 ZINC000057315859 568273424 /nfs/dbraw/zinc/27/34/24/568273424.db2.gz OAFUHNHXWUJWRG-UHFFFAOYSA-N 0 0 369.549 5.082 40 0 FKABRN Cc1ccc(NC(=O)C(C)(C)Oc2ccc(C(C)(C)C)cc2)cc1Cl ZINC000057315955 568273661 /nfs/dbraw/zinc/27/36/61/568273661.db2.gz VXOIIOUKPNSIAB-UHFFFAOYSA-N 0 0 359.897 5.742 40 0 FKABRN CCCCc1ccc(NC(=O)C(C)(C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000057316030 568273631 /nfs/dbraw/zinc/27/36/31/568273631.db2.gz OIPODZCVSWJTKG-UHFFFAOYSA-N 0 0 367.533 6.123 40 0 FKABRN CCN(CC)c1ccc(NC(=O)/C=C/c2ccc(-c3ccccc3)o2)c(C)c1 ZINC000057316090 568273706 /nfs/dbraw/zinc/27/37/06/568273706.db2.gz IMXRRTGKCPRZIB-DTQAZKPQSA-N 0 0 374.484 5.753 40 0 FKABRN CCOc1ccccc1NC(=O)C(C)(C)Oc1ccc(C(C)(C)C)cc1 ZINC000057316157 568273802 /nfs/dbraw/zinc/27/38/02/568273802.db2.gz YLUOKJOQGHQUNH-UHFFFAOYSA-N 0 0 355.478 5.179 40 0 FKABRN O=C(Nc1ccc(Cl)c(-c2nc3ccccc3s2)c1)C(F)(F)F ZINC000057316738 568296288 /nfs/dbraw/zinc/29/62/88/568296288.db2.gz AUJTUJXKRWIMOE-UHFFFAOYSA-N 0 0 356.756 5.118 40 0 FKABRN CC[C@@H](C)c1ccc2oc(-c3ccc(NC(=O)C(F)(F)F)cc3)nc2c1 ZINC000057316751 568296270 /nfs/dbraw/zinc/29/62/70/568296270.db2.gz UTYKQWJFHWSLFP-LLVKDONJSA-N 0 0 362.351 5.509 40 0 FKABRN CC[C@H](C)c1ccc2oc(-c3ccc(NC(=O)C(F)(F)F)cc3)nc2c1 ZINC000057316752 568296214 /nfs/dbraw/zinc/29/62/14/568296214.db2.gz UTYKQWJFHWSLFP-NSHDSACASA-N 0 0 362.351 5.509 40 0 FKABRN Cc1ccc(-c2nc3cc(C(C)C)ccc3o2)cc1NC(=O)C(F)(F)F ZINC000057316760 568296216 /nfs/dbraw/zinc/29/62/16/568296216.db2.gz HYGDJHVYIRNMDE-UHFFFAOYSA-N 0 0 362.351 5.427 40 0 FKABRN O=C(Nc1ccc2oc(-c3cccc4ccccc43)nc2c1)C(F)(F)F ZINC000057316768 571122255 /nfs/dbraw/zinc/12/22/55/571122255.db2.gz COTGZKNZZGQXQZ-UHFFFAOYSA-N 0 0 356.303 5.149 40 0 FKABRN O=C(Nc1ccc2oc(-c3ccc4ccccc4c3)nc2c1)C(F)(F)F ZINC000057316771 221086621 /nfs/dbraw/zinc/08/66/21/221086621.db2.gz RXVVLFJBJBJBHR-UHFFFAOYSA-N 0 0 356.303 5.149 40 0 FKABRN COc1c(Br)c2ccccc2cc1-c1nc2cc(N)ccc2o1 ZINC000057326842 221086736 /nfs/dbraw/zinc/08/67/36/221086736.db2.gz DZKVOFHSCFFWBH-UHFFFAOYSA-N 0 0 369.218 5.001 40 0 FKABRN Cc1c(Br)cc(-c2nc3ccccc3o2)cc1Br ZINC000057331871 571207515 /nfs/dbraw/zinc/20/75/15/571207515.db2.gz VMMMGYNZQDRCEP-UHFFFAOYSA-N 0 0 367.040 5.328 40 0 FKABRN Cc1c(Br)cc(-c2nc3ccccc3[nH]2)cc1Br ZINC000057331910 221086732 /nfs/dbraw/zinc/08/67/32/221086732.db2.gz WXGQICZELFDGLH-UHFFFAOYSA-N 0 0 366.056 5.063 40 0 FKABRN COc1ccc(N)cc1NC(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000057340170 571207403 /nfs/dbraw/zinc/20/74/03/571207403.db2.gz JNWIZUOQFQBLBY-UHFFFAOYSA-N 0 0 367.257 5.051 40 0 FKABRN Cc1ccc(N)cc1NC(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000057340178 210208166 /nfs/dbraw/zinc/20/81/66/210208166.db2.gz CUEUEHMIPDLPDC-UHFFFAOYSA-N 0 0 351.258 5.351 40 0 FKABRN Cc1ccc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1N ZINC000057340675 206784215 /nfs/dbraw/zinc/78/42/15/206784215.db2.gz JZVWIPXXPBZRHH-UHFFFAOYSA-N 0 0 351.258 5.351 40 0 FKABRN COc1ccc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1N ZINC000057340677 571207701 /nfs/dbraw/zinc/20/77/01/571207701.db2.gz SMNGZNNVGGXRFH-UHFFFAOYSA-N 0 0 367.257 5.051 40 0 FKABRN CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000057344070 571306538 /nfs/dbraw/zinc/30/65/38/571306538.db2.gz UHQMLFOGLDOTQN-UHFFFAOYSA-N 0 0 365.860 5.388 40 0 FKABRN CC(C)c1ccc2oc(-c3ccc(Br)c(Cl)c3)nc2c1 ZINC000057351580 206783672 /nfs/dbraw/zinc/78/36/72/206783672.db2.gz COIXJHGAOKACTF-UHFFFAOYSA-N 0 0 350.643 6.034 40 0 FKABRN CCc1cc2nc(-c3ccc(F)c(Cl)c3)oc2c(Br)c1 ZINC000057351609 203903239 /nfs/dbraw/zinc/90/32/39/203903239.db2.gz KMWTWQHXNXPRSC-UHFFFAOYSA-N 0 0 354.606 5.612 40 0 FKABRN Clc1cc(-c2nc3c(ccc4ccccc34)o2)ccc1Br ZINC000057351635 571207661 /nfs/dbraw/zinc/20/76/61/571207661.db2.gz VQWXJYDBNBEZCO-UHFFFAOYSA-N 0 0 358.622 6.064 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)Nc1ccc(N2CCCCC2)cc1 ZINC000057351986 136128573 /nfs/dbraw/zinc/12/85/73/136128573.db2.gz UCYRRXDNQXDDNY-UHFFFAOYSA-N 0 0 374.937 5.202 40 0 FKABRN Brc1ccccc1-c1nc2cccc(Cc3ccccc3)c2o1 ZINC000057352424 210208907 /nfs/dbraw/zinc/20/89/07/210208907.db2.gz AXSMNRKZVCGHHG-UHFFFAOYSA-N 0 0 364.242 5.848 40 0 FKABRN Brc1cccc(-c2nc3cccc(Cc4ccccc4)c3o2)c1 ZINC000057352429 571207633 /nfs/dbraw/zinc/20/76/33/571207633.db2.gz XVZQLAGLRBWSMM-UHFFFAOYSA-N 0 0 364.242 5.848 40 0 FKABRN Brc1ccc(-c2nc3cccc(Cc4ccccc4)c3o2)cc1 ZINC000057352430 571207756 /nfs/dbraw/zinc/20/77/56/571207756.db2.gz RDFUQHGEGRJSDZ-UHFFFAOYSA-N 0 0 364.242 5.848 40 0 FKABRN Clc1ccc(-c2nc3cccc(Cc4ccccc4)c3o2)cc1Cl ZINC000057352434 571207728 /nfs/dbraw/zinc/20/77/28/571207728.db2.gz JIOLEIIWCWNSLL-UHFFFAOYSA-N 0 0 354.236 6.392 40 0 FKABRN Clc1ccc(-c2nc3cccc(Cc4ccccc4)c3o2)c(Cl)c1 ZINC000057352435 571207785 /nfs/dbraw/zinc/20/77/85/571207785.db2.gz PQASLPIUVSJAOI-UHFFFAOYSA-N 0 0 354.236 6.392 40 0 FKABRN Clc1ccc(Cl)c(-c2nc3cccc(Cc4ccccc4)c3o2)c1 ZINC000057352437 571207635 /nfs/dbraw/zinc/20/76/35/571207635.db2.gz DVLVPWAJQQCILM-UHFFFAOYSA-N 0 0 354.236 6.392 40 0 FKABRN Nc1c(Cl)cc(-c2nc3cccc(Cc4ccccc4)c3o2)cc1Cl ZINC000057352775 210209679 /nfs/dbraw/zinc/20/96/79/210209679.db2.gz NJZBEVQGIQLRFJ-UHFFFAOYSA-N 0 0 369.251 5.975 40 0 FKABRN Nc1cc(-c2nc3cccc(Cc4ccccc4)c3o2)c(Cl)cc1Cl ZINC000057352787 571207650 /nfs/dbraw/zinc/20/76/50/571207650.db2.gz RNZHWQGDECCBJK-UHFFFAOYSA-N 0 0 369.251 5.975 40 0 FKABRN c1ccc(Cc2cccc3nc(-c4ccc(-c5ccccc5)cc4)oc32)cc1 ZINC000057352801 571207719 /nfs/dbraw/zinc/20/77/19/571207719.db2.gz XEHXNWNEWHVBIN-UHFFFAOYSA-N 0 0 361.444 6.753 40 0 FKABRN Clc1cccc2c(-c3nc4cccc(Cc5ccccc5)c4o3)cccc12 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O=C(Nc1sc2c(c1C(=O)c1ccccc1)CCCC2)C1CCCCC1 ZINC000057576100 206385376 /nfs/dbraw/zinc/38/53/76/206385376.db2.gz QNWAIMWBOKAZQY-UHFFFAOYSA-N 0 0 367.514 5.377 40 0 FKABRN CCc1cccc(CC)c1NC(=O)CSCc1c(F)cccc1Cl ZINC000057684085 568285658 /nfs/dbraw/zinc/28/56/58/568285658.db2.gz QLRJBNPREJYINJ-UHFFFAOYSA-N 0 0 365.901 5.476 40 0 FKABRN COc1c(C(C)C)cc(NCc2cc3ccccc3[nH]c2=O)cc1C(C)C ZINC000057709890 221093342 /nfs/dbraw/zinc/09/33/42/221093342.db2.gz FJPWUXBKZXCUKM-UHFFFAOYSA-N 0 0 364.489 5.396 40 0 FKABRN Cc1ccc2[nH]c(=O)c(CNc3ccc(Oc4ccccc4)cc3)cc2c1 ZINC000057709979 221093167 /nfs/dbraw/zinc/09/31/67/221093167.db2.gz HWHHXXDTCLDDRI-UHFFFAOYSA-N 0 0 356.425 5.241 40 0 FKABRN Cc1ccc2cc(CNc3ccc(Oc4ccccc4)cc3)c(=O)[nH]c2c1 ZINC000057709987 221092974 /nfs/dbraw/zinc/09/29/74/221092974.db2.gz MCXWHAMQTPOSGT-UHFFFAOYSA-N 0 0 356.425 5.241 40 0 FKABRN Cc1ccc2cc(CNc3ccc(Oc4ccccc4)cc3)c(=O)[nH]c2c1C ZINC000057709997 209687852 /nfs/dbraw/zinc/68/78/52/209687852.db2.gz KEUPZGSQSLNNTL-UHFFFAOYSA-N 0 0 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ZINC000059211014 205280674 /nfs/dbraw/zinc/28/06/74/205280674.db2.gz DHIARLXHXKREMF-ZDUSSCGKSA-N 0 0 370.246 5.008 40 0 FKABRN C[C@@H](Oc1ccc(Br)cc1)C(=O)Nc1cccc2ccccc21 ZINC000059211015 571134324 /nfs/dbraw/zinc/13/43/24/571134324.db2.gz DHIARLXHXKREMF-CYBMUJFWSA-N 0 0 370.246 5.008 40 0 FKABRN O=C(COc1ccc(Cl)cc1)Nc1ccccc1Sc1ccccc1 ZINC000059241711 263417793 /nfs/dbraw/zinc/41/77/93/263417793.db2.gz ZGCRJRHMGYFTAV-UHFFFAOYSA-N 0 0 369.873 5.509 40 0 FKABRN CC[C@H](Oc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000059244490 571088484 /nfs/dbraw/zinc/08/84/84/571088484.db2.gz OMSFJXMNQOFWSI-FQEVSTJZSA-N 0 0 363.482 5.634 40 0 FKABRN CC[C@@H](Oc1ccccc1)C(=O)Nc1ccccc1Sc1ccccc1 ZINC000059244491 571088473 /nfs/dbraw/zinc/08/84/73/571088473.db2.gz OMSFJXMNQOFWSI-HXUWFJFHSA-N 0 0 363.482 5.634 40 0 FKABRN Cc1ccc(SCC(=O)Nc2ccccc2Sc2ccccc2)cc1 ZINC000059244521 571088566 /nfs/dbraw/zinc/08/85/66/571088566.db2.gz VUZHEPWXNOXVCR-UHFFFAOYSA-N 0 0 365.523 5.877 40 0 FKABRN CCSc1ccccc1C(=O)Nc1ccccc1Sc1ccccc1 ZINC000059244537 263417934 /nfs/dbraw/zinc/41/79/34/263417934.db2.gz JCTARQIRLZWNPY-UHFFFAOYSA-N 0 0 365.523 6.202 40 0 FKABRN O=C(CCSc1ccccc1)Nc1ccccc1Sc1ccccc1 ZINC000059244560 571088560 /nfs/dbraw/zinc/08/85/60/571088560.db2.gz NWUWGEFHEJMBDY-UHFFFAOYSA-N 0 0 365.523 5.959 40 0 FKABRN O=C(CCSc1ccccc1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000059244589 571088564 /nfs/dbraw/zinc/08/85/64/571088564.db2.gz VZAODAMVXGKCKQ-UHFFFAOYSA-N 0 0 359.800 5.480 40 0 FKABRN CCCC[C@@H](CC)CNC(=O)N1c2ccccc2Sc2ccccc21 ZINC000059244665 136132131 /nfs/dbraw/zinc/13/21/31/136132131.db2.gz WUOGRXLJYPHJPG-MRXNPFEDSA-N 0 0 354.519 6.215 40 0 FKABRN CCCC[C@H](CC)CNC(=O)N1c2ccccc2Sc2ccccc21 ZINC000059244666 535005870 /nfs/dbraw/zinc/00/58/70/535005870.db2.gz WUOGRXLJYPHJPG-INIZCTEOSA-N 0 0 354.519 6.215 40 0 FKABRN O=C(NCCc1ccc(F)cc1)N1c2ccccc2Sc2ccccc21 ZINC000059244670 136132073 /nfs/dbraw/zinc/13/20/73/136132073.db2.gz HROBXMAIRRPKHJ-UHFFFAOYSA-N 0 0 364.445 5.381 40 0 FKABRN CC(C)(C)CC(C)(C)NC(=O)N1c2ccccc2Sc2ccccc21 ZINC000059244680 136132056 /nfs/dbraw/zinc/13/20/56/136132056.db2.gz OBPRKKSOGDGDAK-UHFFFAOYSA-N 0 0 354.519 6.214 40 0 FKABRN COc1ccc(-c2nc(Nc3cccc(Cl)c3Cl)sc2C)cc1 ZINC000059255942 571088917 /nfs/dbraw/zinc/08/89/17/571088917.db2.gz XTWWMPZOEYEEIR-UHFFFAOYSA-N 0 0 365.285 6.178 40 0 FKABRN Cc1ccccc1O[C@@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000059267345 212015188 /nfs/dbraw/zinc/01/51/88/212015188.db2.gz XHGUPOBQTWASQC-NSHDSACASA-N 0 0 357.759 5.073 40 0 FKABRN Cc1ccccc1O[C@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000059267346 212015983 /nfs/dbraw/zinc/01/59/83/212015983.db2.gz XHGUPOBQTWASQC-LLVKDONJSA-N 0 0 357.759 5.073 40 0 FKABRN Cc1ccccc1O[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000059267347 205280307 /nfs/dbraw/zinc/28/03/07/205280307.db2.gz HRXHZHIFKHNLHA-NSHDSACASA-N 0 0 357.759 5.073 40 0 FKABRN Cc1ccccc1O[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000059267348 221125276 /nfs/dbraw/zinc/12/52/76/221125276.db2.gz HRXHZHIFKHNLHA-LLVKDONJSA-N 0 0 357.759 5.073 40 0 FKABRN O=C(Nc1ccc(Cl)cc1Cl)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000059271309 212015458 /nfs/dbraw/zinc/01/54/58/212015458.db2.gz HKAVVOKQHWQWSL-UHFFFAOYSA-N 0 0 366.635 5.085 40 0 FKABRN O=C(/C=C/c1ccccc1Cl)Nc1ccc(Br)c(Cl)c1 ZINC000059289534 263418613 /nfs/dbraw/zinc/41/86/13/263418613.db2.gz VUFFDSHKRXONPP-VMPITWQZSA-N 0 0 371.061 5.408 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(Br)c(Cl)c1 ZINC000059289976 263418141 /nfs/dbraw/zinc/41/81/41/263418141.db2.gz GRBQNGWIERLPKU-FPYGCLRLSA-N 0 0 371.061 5.408 40 0 FKABRN CCSc1ccccc1C(=O)Nc1ccc(Br)c(Cl)c1 ZINC000059290169 571088914 /nfs/dbraw/zinc/08/89/14/571088914.db2.gz OZRKOQQWVHMMLJ-UHFFFAOYSA-N 0 0 370.699 5.467 40 0 FKABRN O=C(CCSc1ccc(Cl)cc1)Nc1ccc(Cl)c(Cl)c1 ZINC000059291550 263418938 /nfs/dbraw/zinc/41/89/38/263418938.db2.gz ZXLBIVMUOAHVCI-UHFFFAOYSA-N 0 0 360.693 5.768 40 0 FKABRN CCc1cccc(C)c1NC(=O)C(C)(C)Oc1ccc(C(C)(C)C)cc1 ZINC000059294054 571088956 /nfs/dbraw/zinc/08/89/56/571088956.db2.gz NRESGGNMMBAABH-UHFFFAOYSA-N 0 0 353.506 5.651 40 0 FKABRN CC[C@@H](C)c1ccccc1NC(=O)C(C)(C)Oc1ccc(C(C)(C)C)cc1 ZINC000059294220 263419014 /nfs/dbraw/zinc/41/90/14/263419014.db2.gz ASTRWKDLKYGELY-QGZVFWFLSA-N 0 0 367.533 6.294 40 0 FKABRN CC[C@H](C)c1ccccc1NC(=O)C(C)(C)Oc1ccc(C(C)(C)C)cc1 ZINC000059294221 571088909 /nfs/dbraw/zinc/08/89/09/571088909.db2.gz ASTRWKDLKYGELY-KRWDZBQOSA-N 0 0 367.533 6.294 40 0 FKABRN Cc1cc(C)c(NC(=O)C(C)(C)Oc2ccc(C(C)(C)C)cc2)c(C)c1 ZINC000059294270 571088945 /nfs/dbraw/zinc/08/89/45/571088945.db2.gz JHDMHNQQDYOADW-UHFFFAOYSA-N 0 0 353.506 5.705 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1nc2ccc(F)cc2s1 ZINC000059294335 571088941 /nfs/dbraw/zinc/08/89/41/571088941.db2.gz ULAQDALXDXYRIA-DHZHZOJOSA-N 0 0 364.401 5.347 40 0 FKABRN Cc1ccc2c(cccc2NC(=O)/C=C/c2ccc(Cl)cc2Cl)n1 ZINC000059294361 263418254 /nfs/dbraw/zinc/41/82/54/263418254.db2.gz KNCBEQMVPUAFID-JXMROGBWSA-N 0 0 357.240 5.502 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1ccc2c3c(cccc31)CC2 ZINC000059294401 571088908 /nfs/dbraw/zinc/08/89/08/571088908.db2.gz QCDDVPPHMKCWHZ-DTQAZKPQSA-N 0 0 365.432 5.850 40 0 FKABRN C[C@H](NC(=O)CSCc1c(Cl)cccc1Cl)c1ccccc1 ZINC000059314850 571089950 /nfs/dbraw/zinc/08/99/50/571089950.db2.gz KXTVBZZEPWFEKS-LBPRGKRZSA-N 0 0 354.302 5.104 40 0 FKABRN C[C@@H]1Cc2ccccc2N1C(=O)CSCc1ccc(Cl)c(Cl)c1 ZINC000059345944 205280156 /nfs/dbraw/zinc/28/01/56/205280156.db2.gz APMNPJIURREJKD-GFCCVEGCSA-N 0 0 366.313 5.204 40 0 FKABRN C[C@H]1Cc2ccccc2N1C(=O)CSCc1ccc(Cl)c(Cl)c1 ZINC000059345946 212016840 /nfs/dbraw/zinc/01/68/40/212016840.db2.gz APMNPJIURREJKD-LBPRGKRZSA-N 0 0 366.313 5.204 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1C ZINC000059351140 221125654 /nfs/dbraw/zinc/12/56/54/221125654.db2.gz ZUWLWAJEQHCQHB-HXUWFJFHSA-N 0 0 357.497 5.703 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1C ZINC000059351142 571134588 /nfs/dbraw/zinc/13/45/88/571134588.db2.gz ZUWLWAJEQHCQHB-FQEVSTJZSA-N 0 0 357.497 5.703 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000059351242 571134651 /nfs/dbraw/zinc/13/46/51/571134651.db2.gz QVIRYJRYICUUSU-QZTJIDSGSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000059351243 221124888 /nfs/dbraw/zinc/12/48/88/221124888.db2.gz QVIRYJRYICUUSU-ZWKOTPCHSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000059351244 205280292 /nfs/dbraw/zinc/28/02/92/205280292.db2.gz QVIRYJRYICUUSU-MSOLQXFVSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000059351245 212017077 /nfs/dbraw/zinc/01/70/77/212017077.db2.gz QVIRYJRYICUUSU-ROUUACIJSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000059351282 571134646 /nfs/dbraw/zinc/13/46/46/571134646.db2.gz YPZWYICJMZEEDJ-IAGOWNOFSA-N 0 0 359.897 5.218 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000059351283 221125646 /nfs/dbraw/zinc/12/56/46/221125646.db2.gz YPZWYICJMZEEDJ-DLBZAZTESA-N 0 0 359.897 5.218 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000059351285 221125074 /nfs/dbraw/zinc/12/50/74/221125074.db2.gz YPZWYICJMZEEDJ-SJORKVTESA-N 0 0 359.897 5.218 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000059351286 571134560 /nfs/dbraw/zinc/13/45/60/571134560.db2.gz YPZWYICJMZEEDJ-IRXDYDNUSA-N 0 0 359.897 5.218 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351349 205280853 /nfs/dbraw/zinc/28/08/53/205280853.db2.gz IXPUWZMXXGSPNT-AVRDEDQJSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351351 205280449 /nfs/dbraw/zinc/28/04/49/205280449.db2.gz IXPUWZMXXGSPNT-PGRDOPGGSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351352 205279578 /nfs/dbraw/zinc/27/95/78/205279578.db2.gz IXPUWZMXXGSPNT-GCJKJVERSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351356 205279731 /nfs/dbraw/zinc/27/97/31/205279731.db2.gz IXPUWZMXXGSPNT-XMSQKQJNSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351358 221125203 /nfs/dbraw/zinc/12/52/03/221125203.db2.gz OQYFCALUGPQVAK-AVRDEDQJSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351359 212017160 /nfs/dbraw/zinc/01/71/60/212017160.db2.gz OQYFCALUGPQVAK-PGRDOPGGSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351361 571134609 /nfs/dbraw/zinc/13/46/09/571134609.db2.gz OQYFCALUGPQVAK-GCJKJVERSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351363 212016747 /nfs/dbraw/zinc/01/67/47/212016747.db2.gz OQYFCALUGPQVAK-XMSQKQJNSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351365 221125755 /nfs/dbraw/zinc/12/57/55/221125755.db2.gz FOKPYENGINXGBC-MBSDFSHPSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351366 212017606 /nfs/dbraw/zinc/01/76/06/212017606.db2.gz FOKPYENGINXGBC-FDDCHVKYSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351368 212017283 /nfs/dbraw/zinc/01/72/83/212017283.db2.gz FOKPYENGINXGBC-JPYJTQIMSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351370 571134529 /nfs/dbraw/zinc/13/45/29/571134529.db2.gz FOKPYENGINXGBC-WZONZLPQSA-N 0 0 361.485 5.491 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351384 205281521 /nfs/dbraw/zinc/28/15/21/205281521.db2.gz UPMZEOIXPUKIMU-JXFKEZNVSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](C)c1ccc(C)c(C)c1 ZINC000059351386 221124970 /nfs/dbraw/zinc/12/49/70/221124970.db2.gz UPMZEOIXPUKIMU-OXJNMPFZSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351387 205282302 /nfs/dbraw/zinc/28/23/02/205282302.db2.gz UPMZEOIXPUKIMU-UZLBHIALSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@H](C)c1ccc(C)c(C)c1 ZINC000059351389 208591273 /nfs/dbraw/zinc/59/12/73/208591273.db2.gz UPMZEOIXPUKIMU-OXQOHEQNSA-N 0 0 359.897 5.300 40 0 FKABRN Cc1ccc(C)c([C@@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)c1 ZINC000059351415 221125799 /nfs/dbraw/zinc/12/57/99/221125799.db2.gz WZQVNTSPIRDBOA-HXUWFJFHSA-N 0 0 357.497 5.703 40 0 FKABRN Cc1ccc(C)c([C@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)c1 ZINC000059351416 212017651 /nfs/dbraw/zinc/01/76/51/212017651.db2.gz WZQVNTSPIRDBOA-FQEVSTJZSA-N 0 0 357.497 5.703 40 0 FKABRN Cc1ccc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000059351482 221124831 /nfs/dbraw/zinc/12/48/31/221124831.db2.gz YQSKYLFQURIEJW-QZTJIDSGSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000059351484 212017052 /nfs/dbraw/zinc/01/70/52/212017052.db2.gz YQSKYLFQURIEJW-ZWKOTPCHSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000059351486 205281348 /nfs/dbraw/zinc/28/13/48/205281348.db2.gz YQSKYLFQURIEJW-MSOLQXFVSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc(C)c([C@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000059351488 205281638 /nfs/dbraw/zinc/28/16/38/205281638.db2.gz YQSKYLFQURIEJW-ROUUACIJSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1ccc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)c1 ZINC000059351510 212016222 /nfs/dbraw/zinc/01/62/22/212016222.db2.gz LSGWCECASXSEAU-IAGOWNOFSA-N 0 0 359.897 5.218 40 0 FKABRN Cc1ccc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)c1 ZINC000059351514 208591146 /nfs/dbraw/zinc/59/11/46/208591146.db2.gz LSGWCECASXSEAU-DLBZAZTESA-N 0 0 359.897 5.218 40 0 FKABRN Cc1ccc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)c1 ZINC000059351515 212017559 /nfs/dbraw/zinc/01/75/59/212017559.db2.gz LSGWCECASXSEAU-SJORKVTESA-N 0 0 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CC(C)(C)c1ccc(NC(=O)Nc2ccc(CCc3ccccn3)cc2)cc1 ZINC000059484695 571091188 /nfs/dbraw/zinc/09/11/88/571091188.db2.gz FEWMFMNPOMFRPZ-UHFFFAOYSA-N 0 0 373.500 5.808 40 0 FKABRN Cc1ccc(C2=NN[C@H](c3ccc(N(C)c4ccccc4)cc3)S2)cc1 ZINC000059488131 571090998 /nfs/dbraw/zinc/09/09/98/571090998.db2.gz HUBRGMWDDMBFCH-QFIPXVFZSA-N 0 0 359.498 5.460 40 0 FKABRN Cc1ccc(C2=NN[C@@H](c3ccc(N(C)c4ccccc4)cc3)S2)cc1 ZINC000059488132 571091135 /nfs/dbraw/zinc/09/11/35/571091135.db2.gz HUBRGMWDDMBFCH-JOCHJYFZSA-N 0 0 359.498 5.460 40 0 FKABRN S=c1oc(-c2ccccc2)nn1CNc1ccc(Cl)c(Cl)c1 ZINC000059488424 571091151 /nfs/dbraw/zinc/09/11/51/571091151.db2.gz ZAZVYLMNJGIDDM-UHFFFAOYSA-N 0 0 352.246 5.249 40 0 FKABRN S=C1SCN(c2ccc(Cl)cc2)CN1c1ccc(Cl)cc1 ZINC000059488428 571091191 /nfs/dbraw/zinc/09/11/91/571091191.db2.gz JGWNCOHFDIQGOT-UHFFFAOYSA-N 0 0 355.315 5.253 40 0 FKABRN Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)c(Cl)c2)cc1 ZINC000059488504 571091558 /nfs/dbraw/zinc/09/15/58/571091558.db2.gz ASDUVHATTUBLGK-HXUWFJFHSA-N 0 0 366.823 5.559 40 0 FKABRN Cc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)c(Cl)c2)cc1 ZINC000059488505 571091486 /nfs/dbraw/zinc/09/14/86/571091486.db2.gz ASDUVHATTUBLGK-FQEVSTJZSA-N 0 0 366.823 5.559 40 0 FKABRN COc1ccc(C2=N[C@H](c3ccccc3)N=C(c3ccccc3)S2)cc1 ZINC000059488710 571091364 /nfs/dbraw/zinc/09/13/64/571091364.db2.gz LDAFIGLPLZMHOG-HXUWFJFHSA-N 0 0 358.466 5.334 40 0 FKABRN COc1ccc(C2=N[C@@H](c3ccccc3)N=C(c3ccccc3)S2)cc1 ZINC000059488711 263421077 /nfs/dbraw/zinc/42/10/77/263421077.db2.gz LDAFIGLPLZMHOG-FQEVSTJZSA-N 0 0 358.466 5.334 40 0 FKABRN COc1ccc(C2=N[C@H](c3cccs3)N=C(c3ccccc3)S2)cc1 ZINC000059488728 571091369 /nfs/dbraw/zinc/09/13/69/571091369.db2.gz KJUSIEFLEAKROQ-GOSISDBHSA-N 0 0 364.495 5.396 40 0 FKABRN COc1ccc(C2=N[C@@H](c3cccs3)N=C(c3ccccc3)S2)cc1 ZINC000059488729 263421283 /nfs/dbraw/zinc/42/12/83/263421283.db2.gz KJUSIEFLEAKROQ-SFHVURJKSA-N 0 0 364.495 5.396 40 0 FKABRN CCOc1ccc2nc(SCc3cc(Cl)ccc3Cl)sc2c1 ZINC000059497606 571091447 /nfs/dbraw/zinc/09/14/47/571091447.db2.gz WKTJWPOYZDMBGA-UHFFFAOYSA-N 0 0 370.326 6.294 40 0 FKABRN O=C(Nc1ccc(Cc2ccncc2)cc1)c1c(Cl)cccc1Cl ZINC000059497651 263421119 /nfs/dbraw/zinc/42/11/19/263421119.db2.gz RUIVEUNRJZRVQT-UHFFFAOYSA-N 0 0 357.240 5.232 40 0 FKABRN Cc1ccc(-c2nn(CNc3ccc(Cl)cc3Cl)c(=S)o2)cc1 ZINC000059497986 263421076 /nfs/dbraw/zinc/42/10/76/263421076.db2.gz CBIBKFYHSJEQOT-UHFFFAOYSA-N 0 0 366.273 5.557 40 0 FKABRN Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccc(Cl)cc2)cc1 ZINC000059498089 571091427 /nfs/dbraw/zinc/09/14/27/571091427.db2.gz IZMBHGWKQHJGCS-OAQYLSRUSA-N 0 0 362.860 5.415 40 0 FKABRN Cc1ccc([C@H]2Nc3ccccc3C(=O)N2Cc2ccc(Cl)cc2)cc1 ZINC000059498090 263421229 /nfs/dbraw/zinc/42/12/29/263421229.db2.gz IZMBHGWKQHJGCS-NRFANRHFSA-N 0 0 362.860 5.415 40 0 FKABRN CC(C)(C)c1ccc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)cc1 ZINC000059498108 571091381 /nfs/dbraw/zinc/09/13/81/571091381.db2.gz NCWLEAZHVHUGOX-HSZRJFAPSA-N 0 0 370.496 5.751 40 0 FKABRN CC(C)(C)c1ccc([C@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)cc1 ZINC000059498112 571091588 /nfs/dbraw/zinc/09/15/88/571091588.db2.gz NCWLEAZHVHUGOX-QHCPKHFHSA-N 0 0 370.496 5.751 40 0 FKABRN CCc1ccc(/N=c2\ssc3c2-c2ccccc2NC3(C)C)cc1 ZINC000059501082 571091390 /nfs/dbraw/zinc/09/13/90/571091390.db2.gz GMUGSTUAWJOENF-VZCXRCSSSA-N 0 0 352.528 5.932 40 0 FKABRN Cc1cccc2c1NC(C)(C)c1ss/c(=N\c3ccc(Cl)cc3)c1-2 ZINC000059501083 263421507 /nfs/dbraw/zinc/42/15/07/263421507.db2.gz VMENYCSNBKPMER-UZYVYHOESA-N 0 0 372.946 6.331 40 0 FKABRN COc1ccc2ccccc2c1/C=C1\COC(c2ccc(C(C)(C)C)cc2)=N1 ZINC000059503062 571091384 /nfs/dbraw/zinc/09/13/84/571091384.db2.gz DHRCTDXBDIBQHM-HMMYKYKNSA-N 0 0 371.480 5.964 40 0 FKABRN CCCCCOc1ccccc1/C=C1\N=C(c2ccc(Cl)cc2)OC1=O ZINC000059507289 571091750 /nfs/dbraw/zinc/09/17/50/571091750.db2.gz NIFJEEZSUJXIJA-JXAWBTAJSA-N 0 0 369.848 5.254 40 0 FKABRN Clc1ccc(SCc2ccc(I)cc2)cc1 ZINC000059517446 571091961 /nfs/dbraw/zinc/09/19/61/571091961.db2.gz HHDLNNQTGRYNKC-UHFFFAOYSA-N 0 0 360.647 5.237 40 0 FKABRN Clc1ccccc1CSc1nc2cc(Br)ccc2[nH]1 ZINC000059535461 571135304 /nfs/dbraw/zinc/13/53/04/571135304.db2.gz PDRZKEXDIWGROA-UHFFFAOYSA-N 0 0 353.672 5.271 40 0 FKABRN Clc1ccc(CNc2ccc(Br)c(Cl)c2)c(Cl)c1 ZINC000059720553 571092696 /nfs/dbraw/zinc/09/26/96/571092696.db2.gz AAGYOGCCLHKIOI-UHFFFAOYSA-N 0 0 365.485 6.021 40 0 FKABRN CN(C)C(=O)c1ccc2oc(-c3cc(Cl)c(Cl)c(Cl)c3)nc2c1 ZINC000059842991 221127914 /nfs/dbraw/zinc/12/79/14/221127914.db2.gz QWEAUEMKULDMGY-UHFFFAOYSA-N 0 0 369.635 5.157 40 0 FKABRN CN(C)C(=O)c1ccc2oc(-c3cc(Cl)cc(Cl)c3Cl)nc2c1 ZINC000059843022 221128039 /nfs/dbraw/zinc/12/80/39/221128039.db2.gz SIZFEQZHFMRHCK-UHFFFAOYSA-N 0 0 369.635 5.157 40 0 FKABRN C[C@@H]1CCCCN1C(=O)c1cccc(-c2nc3ccc(F)cc3s2)c1 ZINC000059843064 221127887 /nfs/dbraw/zinc/12/78/87/221127887.db2.gz KKCYCLNHFOPOMF-CYBMUJFWSA-N 0 0 354.450 5.117 40 0 FKABRN C[C@H]1CCCCN1C(=O)c1cccc(-c2nc3ccc(F)cc3s2)c1 ZINC000059843066 221127211 /nfs/dbraw/zinc/12/72/11/221127211.db2.gz KKCYCLNHFOPOMF-ZDUSSCGKSA-N 0 0 354.450 5.117 40 0 FKABRN O=C(NC1CCCCC1)c1cccc(-c2nc3ccc(F)cc3s2)c1 ZINC000059843073 571091890 /nfs/dbraw/zinc/09/18/90/571091890.db2.gz LONQYBYMGAOHLD-UHFFFAOYSA-N 0 0 354.450 5.165 40 0 FKABRN C[C@@H]1CCCCN1C(=O)c1ccc(-c2nc3ccc(F)cc3s2)cc1 ZINC000059843078 221127224 /nfs/dbraw/zinc/12/72/24/221127224.db2.gz ZVFXIHIXTCRSTI-CYBMUJFWSA-N 0 0 354.450 5.117 40 0 FKABRN C[C@H]1CCCCN1C(=O)c1ccc(-c2nc3ccc(F)cc3s2)cc1 ZINC000059843080 571091773 /nfs/dbraw/zinc/09/17/73/571091773.db2.gz ZVFXIHIXTCRSTI-ZDUSSCGKSA-N 0 0 354.450 5.117 40 0 FKABRN O=C(NC1CCCCC1)c1ccc(-c2nc3ccc(F)cc3s2)cc1 ZINC000059843090 571091919 /nfs/dbraw/zinc/09/19/19/571091919.db2.gz ASQKZWUTQNKVMN-UHFFFAOYSA-N 0 0 354.450 5.165 40 0 FKABRN CCCCSc1nc2ccc(NC(=O)c3ccccc3C)cc2s1 ZINC000059855558 571091838 /nfs/dbraw/zinc/09/18/38/571091838.db2.gz PZBMGXSGDJQIHM-UHFFFAOYSA-N 0 0 356.516 5.749 40 0 FKABRN CCCCCCOc1ccc(/C=C2\N=C(c3ccc(F)cc3)OC2=O)cc1 ZINC000059959025 571091754 /nfs/dbraw/zinc/09/17/54/571091754.db2.gz QBTBGZISFHINNM-HKWRFOASSA-N 0 0 367.420 5.129 40 0 FKABRN O=C(COc1ccccc1)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1 ZINC000059960921 571092170 /nfs/dbraw/zinc/09/21/70/571092170.db2.gz GDDRQLNBELLGKF-UHFFFAOYSA-N 0 0 361.485 5.172 40 0 FKABRN O=C(/C=C/c1ccccc1)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1 ZINC000059960977 571092448 /nfs/dbraw/zinc/09/24/48/571092448.db2.gz VIDRLSLNEVCSRY-IZZDOVSWSA-N 0 0 357.497 5.806 40 0 FKABRN Cc1ccc(-c2nnc([C@@H]3CCCN3Cc3ccc(Cl)cc3)o2)s1 ZINC000060016722 571135963 /nfs/dbraw/zinc/13/59/63/571135963.db2.gz MIBSYUDGLPSXMQ-HNNXBMFYSA-N 0 0 359.882 5.097 40 0 FKABRN Cc1ccc(-c2nnc([C@H]3CCCN3Cc3ccc(Cl)cc3)o2)s1 ZINC000060016725 205283203 /nfs/dbraw/zinc/28/32/03/205283203.db2.gz MIBSYUDGLPSXMQ-OAHLLOKOSA-N 0 0 359.882 5.097 40 0 FKABRN CCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)cc2)CC1 ZINC000060073201 205284072 /nfs/dbraw/zinc/28/40/72/205284072.db2.gz IBFAIOMGVHPWRQ-UHFFFAOYSA-N 0 0 358.472 7.104 40 0 FKABRN COc1cccc(Oc2ccc(NC(=S)NC3CCCCC3)cc2)c1 ZINC000060512653 570870069 /nfs/dbraw/zinc/87/00/69/570870069.db2.gz BHYMSFSDFBZECC-UHFFFAOYSA-N 0 0 356.491 5.107 40 0 FKABRN O=C(Nc1ccc2c(c1)oc1ccccc12)c1ccc(Cn2ccnc2)cc1 ZINC000060642482 221131805 /nfs/dbraw/zinc/13/18/05/221131805.db2.gz DVGCWNPZFNBZKS-UHFFFAOYSA-N 0 0 367.408 5.083 40 0 FKABRN Cc1cc(C)n(Cc2ccc(C(=O)Nc3ccc(Cl)c(Cl)c3)cc2)n1 ZINC000061108676 205285348 /nfs/dbraw/zinc/28/53/48/205285348.db2.gz RNFZIYUZWQXXMB-UHFFFAOYSA-N 0 0 374.271 5.107 40 0 FKABRN O=C(Nc1ccccc1Cl)c1ccccc1-c1ncc(-c2ccccc2)o1 ZINC000061429378 205287218 /nfs/dbraw/zinc/28/72/18/205287218.db2.gz AHOMZCMXFIKYAQ-UHFFFAOYSA-N 0 0 374.827 5.914 40 0 FKABRN COc1ccccc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 ZINC000061429669 221133204 /nfs/dbraw/zinc/13/32/04/221133204.db2.gz TVEWAWWABXIMOB-UHFFFAOYSA-N 0 0 370.408 5.270 40 0 FKABRN CC(C)(C)c1ccc(NC(=O)CC(=O)Nc2ccc(C(C)(C)C)cc2)cc1 ZINC000062701852 571319751 /nfs/dbraw/zinc/31/97/51/571319751.db2.gz YJURZQGANZNREU-UHFFFAOYSA-N 0 0 366.505 5.249 40 0 FKABRN CCCCCCOc1ccc(/C=C/C(=O)Nc2ccc(O)cc2)cc1OC ZINC000062714598 571319810 /nfs/dbraw/zinc/31/98/10/571319810.db2.gz UMKNWZXOXBEIRA-RIYZIHGNSA-N 0 0 369.461 5.012 40 0 FKABRN CCOC(=O)/C=C/c1ccc(OCc2ccc(C(C)(C)C)cc2)c(OC)c1 ZINC000062715778 571319887 /nfs/dbraw/zinc/31/98/87/571319887.db2.gz VRBCCQVZOAUDSQ-GXDHUFHOSA-N 0 0 368.473 5.148 40 0 FKABRN CCc1cccc(C)c1NC(=O)c1ccc(CN2CCc3ccccc32)cc1 ZINC000063450781 212032116 /nfs/dbraw/zinc/03/21/16/212032116.db2.gz ORXPODOJOITKRB-UHFFFAOYSA-N 0 0 370.496 5.372 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1ccc(CN2CCc3ccccc32)cc1 ZINC000063451554 221141910 /nfs/dbraw/zinc/14/19/10/221141910.db2.gz DAJKQEUVPWOOHJ-UHFFFAOYSA-N 0 0 356.469 5.118 40 0 FKABRN COc1ccc(-c2cnc(CCC(=O)Nc3cccc4ccccc43)o2)cc1 ZINC000063887875 212035951 /nfs/dbraw/zinc/03/59/51/212035951.db2.gz MAOUTCNLWZOXHF-UHFFFAOYSA-N 0 0 372.424 5.075 40 0 FKABRN COC(=O)CCCCCCCCCCCCCCCCCCCCO ZINC000064220139 212036468 /nfs/dbraw/zinc/03/64/68/212036468.db2.gz YCYYZXLJQNQRSH-UHFFFAOYSA-N 0 0 356.591 6.564 40 0 FKABRN CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000064624074 571141005 /nfs/dbraw/zinc/14/10/05/571141005.db2.gz XIIAYQZJNBULGD-CJPSHIORSA-N 0 0 372.681 8.498 40 0 in-vitro FKABRN CCCCCN1c2ccccc2C(C(=O)c2cccc3ccccc32)C1=O ZINC000064858553 221155027 /nfs/dbraw/zinc/15/50/27/221155027.db2.gz LSYJCVSGIQLLKF-UHFFFAOYSA-N 0 0 357.453 5.921 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3ccccc32)c2c1cccc2O ZINC000064858557 212047275 /nfs/dbraw/zinc/04/72/75/212047275.db2.gz DFIOKCGWOUDFRF-UHFFFAOYSA-N 0 0 357.453 5.921 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3ccccc32)c2cc(O)ccc21 ZINC000064858562 212047024 /nfs/dbraw/zinc/04/70/24/212047024.db2.gz GMOJICNPAPPCSR-UHFFFAOYSA-N 0 0 357.453 5.921 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3ccccc32)c2ccc(O)cc21 ZINC000064858565 221154346 /nfs/dbraw/zinc/15/43/46/221154346.db2.gz OTRCAWIVHSQWPC-UHFFFAOYSA-N 0 0 357.453 5.921 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3ccccc32)c2cccc(O)c21 ZINC000064858568 571320867 /nfs/dbraw/zinc/32/08/67/571320867.db2.gz OHAPOWHHSCCXIL-UHFFFAOYSA-N 0 0 357.453 5.921 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3ccccc32)c2ccc(OC)cc21 ZINC000064859460 571320873 /nfs/dbraw/zinc/32/08/73/571320873.db2.gz LQWPINYSBSBWIN-UHFFFAOYSA-N 0 0 371.480 6.224 40 0 in-vitro FKABRN C[C@H](O)CCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000064859591 221154926 /nfs/dbraw/zinc/15/49/26/221154926.db2.gz LLFBQQHYZJTRAS-KRWDZBQOSA-N 0 0 357.453 5.187 40 0 in-vitro FKABRN C[C@@H](O)CCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000064859594 205307837 /nfs/dbraw/zinc/30/78/37/205307837.db2.gz LLFBQQHYZJTRAS-QGZVFWFLSA-N 0 0 357.453 5.187 40 0 in-vitro FKABRN Cc1ccc(C(=O)c2cn(CCCCCO)c3ccccc23)c2ccccc12 ZINC000064859701 205307257 /nfs/dbraw/zinc/30/72/57/205307257.db2.gz JRALTDRFXRCGRH-UHFFFAOYSA-N 0 0 371.480 5.497 40 0 in-vitro FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(N3CCCCC3)cc2)ccc1Cl ZINC000064982317 136134253 /nfs/dbraw/zinc/13/42/53/136134253.db2.gz PVNPYYPOYBJVID-INIZCTEOSA-N 0 0 372.896 5.045 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(N3CCCCC3)cc2)ccc1Cl ZINC000064982318 136134239 /nfs/dbraw/zinc/13/42/39/136134239.db2.gz PVNPYYPOYBJVID-MRXNPFEDSA-N 0 0 372.896 5.045 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1C ZINC000064983063 571141249 /nfs/dbraw/zinc/14/12/49/571141249.db2.gz HVSKREZVFKJFFN-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1C ZINC000064983064 221161273 /nfs/dbraw/zinc/16/12/73/221161273.db2.gz HVSKREZVFKJFFN-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN CCOP(=O)(OCC)[C@H](NC1CCCCC1)c1ccc(Cl)cc1 ZINC000065090430 205317336 /nfs/dbraw/zinc/31/73/36/205317336.db2.gz HXEANZFZHCQFHA-KRWDZBQOSA-N 0 0 359.834 5.527 40 0 FKABRN CCOP(=O)(OCC)[C@@H](NC1CCCCC1)c1ccc(Cl)cc1 ZINC000065090431 571141513 /nfs/dbraw/zinc/14/15/13/571141513.db2.gz HXEANZFZHCQFHA-QGZVFWFLSA-N 0 0 359.834 5.527 40 0 FKABRN O=C1CC[C@@H](Sc2ccccc2)[C@@H](c2ccccc2)N1c1ccccc1 ZINC000065090574 136134685 /nfs/dbraw/zinc/13/46/85/136134685.db2.gz AVBBTMMRNYBDIZ-FYYLOGMGSA-N 0 0 359.494 5.716 40 0 FKABRN O=C1CC[C@@H](Sc2ccccc2)[C@H](c2ccccc2)N1c1ccccc1 ZINC000065090575 136134729 /nfs/dbraw/zinc/13/47/29/136134729.db2.gz AVBBTMMRNYBDIZ-GGAORHGYSA-N 0 0 359.494 5.716 40 0 FKABRN O=C1CC[C@H](Sc2ccccc2)[C@@H](c2ccccc2)N1c1ccccc1 ZINC000065090576 136134655 /nfs/dbraw/zinc/13/46/55/136134655.db2.gz AVBBTMMRNYBDIZ-JTHBVZDNSA-N 0 0 359.494 5.716 40 0 FKABRN O=C1CC[C@H](Sc2ccccc2)[C@H](c2ccccc2)N1c1ccccc1 ZINC000065090578 136134690 /nfs/dbraw/zinc/13/46/90/136134690.db2.gz AVBBTMMRNYBDIZ-GMAHTHKFSA-N 0 0 359.494 5.716 40 0 FKABRN Cc1ccc(S[C@@H]2CCC(=O)N(c3ccccc3)[C@@H]2c2ccccc2)cc1 ZINC000065090579 136134638 /nfs/dbraw/zinc/13/46/38/136134638.db2.gz MNUVCKIYHWDZHX-ISKFKSNPSA-N 0 0 373.521 6.024 40 0 FKABRN Cc1ccc(S[C@H]2CCC(=O)N(c3ccccc3)[C@@H]2c2ccccc2)cc1 ZINC000065090580 136134681 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CCCCN1C(=O)CC[C@H](Sc2ccc(C)cc2)[C@@H]1c1ccccc1 ZINC000065090601 221168871 /nfs/dbraw/zinc/16/88/71/221168871.db2.gz BJNJORPGGUCFBV-UNMCSNQZSA-N 0 0 353.531 5.620 40 0 FKABRN CCOc1ccc(Nc2cc(C)nc3c(F)cc(F)cc23)cc1OCC ZINC000065090608 221168717 /nfs/dbraw/zinc/16/87/17/221168717.db2.gz MXSWOIXXDNCJOX-UHFFFAOYSA-N 0 0 358.388 5.362 40 0 FKABRN CCOc1ccc(Nc2ccnc3c(C)cc(Cl)cc23)cc1OCC ZINC000065090609 221168529 /nfs/dbraw/zinc/16/85/29/221168529.db2.gz FMWDNKJPFRNPKE-UHFFFAOYSA-N 0 0 356.853 5.738 40 0 FKABRN CCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(-c2ccccc2)cc1 ZINC000065879003 571306626 /nfs/dbraw/zinc/30/66/26/571306626.db2.gz YFZBIKYHMQAAMD-UHFFFAOYSA-N 0 0 372.468 5.088 40 0 FKABRN Cc1ccsc1-c1nn2c(nnc2-c2cccc(Cl)c2Cl)s1 ZINC000066087699 221240543 /nfs/dbraw/zinc/24/05/43/221240543.db2.gz RRTDVPZSYABOBK-UHFFFAOYSA-N 0 0 367.286 5.197 40 0 FKABRN COc1ccc(Cc2ccc(F)cc2)cc1C(=O)Nc1cccc(Cl)c1 ZINC000066088459 571145714 /nfs/dbraw/zinc/14/57/14/571145714.db2.gz BAIGFCJDHAXLPD-UHFFFAOYSA-N 0 0 369.823 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ZINC000070462183 210064006 /nfs/dbraw/zinc/06/40/06/210064006.db2.gz KJQDATXSIWRHOG-UHFFFAOYSA-N 0 0 358.022 5.146 40 0 FKABRN Clc1cc(-c2nc3cc(-n4cnnc4)ccc3o2)cc(Cl)c1Cl ZINC000070462185 221332379 /nfs/dbraw/zinc/33/23/79/221332379.db2.gz MBSGBOOZYWMBCO-UHFFFAOYSA-N 0 0 365.607 5.036 40 0 FKABRN Cc1cc2[nH]c(-c3cccc4c(Br)cccc34)nc2c(C)c1 ZINC000070462757 210063422 /nfs/dbraw/zinc/06/34/22/210063422.db2.gz YXIHQRPYSZRALU-UHFFFAOYSA-N 0 0 351.247 5.762 40 0 FKABRN Cc1cc2[nH]c(-c3cc(Cl)c(Br)c(Cl)c3)nc2c(C)c1 ZINC000070462779 571051912 /nfs/dbraw/zinc/05/19/12/571051912.db2.gz LRBOKYWGQUEWCP-UHFFFAOYSA-N 0 0 370.077 5.916 40 0 FKABRN COc1cc(C(=O)Nc2c(C)cccc2C)ccc1OCc1ccccc1 ZINC000070674866 571082364 /nfs/dbraw/zinc/08/23/64/571082364.db2.gz LQYFBRRPSOREFO-UHFFFAOYSA-N 0 0 361.441 5.143 40 0 FKABRN CCCOc1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1OCC ZINC000070735398 571082541 /nfs/dbraw/zinc/08/25/41/571082541.db2.gz LDPGODCEQOIBAI-UHFFFAOYSA-N 0 0 367.367 5.145 40 0 FKABRN O=C(Nc1ccccc1C(F)(F)F)c1ccc(COc2ccccc2)o1 ZINC000070735431 571306656 /nfs/dbraw/zinc/30/66/56/571306656.db2.gz ZQUTUPJXHVSVQV-UHFFFAOYSA-N 0 0 361.319 5.130 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1OC ZINC000070735488 571082445 /nfs/dbraw/zinc/08/24/45/571082445.db2.gz OHDQHYRXRWREJS-UHFFFAOYSA-N 0 0 367.367 5.145 40 0 FKABRN Fc1cccc(CSc2nnc(-c3ccccc3)n2-c2ccccc2)c1 ZINC000071234721 571306679 /nfs/dbraw/zinc/30/66/79/571306679.db2.gz YZLVUGYXIFLRAH-UHFFFAOYSA-N 0 0 361.445 5.366 40 0 FKABRN CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC ZINC000071404821 221346177 /nfs/dbraw/zinc/34/61/77/221346177.db2.gz DRFRUDAVKDRAEF-JEBPEJKESA-N 0 0 372.593 7.642 40 0 FKABRN CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC ZINC000071404823 221346134 /nfs/dbraw/zinc/34/61/34/221346134.db2.gz RCJMCGHUQPLZNR-JDPCYWKWSA-N 0 0 370.577 7.418 40 0 FKABRN CC(C)=CCC/C(C)=C\CC/C(C)=C\CC/C(C)=C/COP(C)(C)=O ZINC000071404872 221346553 /nfs/dbraw/zinc/34/65/53/221346553.db2.gz ITUNKXVAULLNIT-JPLCYUTHSA-N 0 0 366.526 7.686 40 0 FKABRN COc1ccc(-c2cc3c(ccc(C)c3-c3ccc(O)cc3)oc2=O)cc1 ZINC000071405000 571117779 /nfs/dbraw/zinc/11/77/79/571117779.db2.gz ZNRRCKYTERHEOC-UHFFFAOYSA-N 0 0 358.393 5.150 40 0 FKABRN FC(F)(F)c1cc(Cl)nc(Nc2ccc(Oc3ccccc3)cc2)n1 ZINC000071422936 571098596 /nfs/dbraw/zinc/09/85/96/571098596.db2.gz GBRHLMIVIRCVFR-UHFFFAOYSA-N 0 0 365.742 5.685 40 0 FKABRN CCOc1ccc(NC(=O)CSCc2ccc(Cl)cc2Cl)cc1 ZINC000071433348 571083094 /nfs/dbraw/zinc/08/30/94/571083094.db2.gz SVCVWPJHXNKVCO-UHFFFAOYSA-N 0 0 370.301 5.264 40 0 FKABRN CCOc1ccc(NC(=O)CSCc2cccc3ccccc32)cc1 ZINC000071433349 571083187 /nfs/dbraw/zinc/08/31/87/571083187.db2.gz MMEWFCUQFDOXKX-UHFFFAOYSA-N 0 0 351.471 5.110 40 0 FKABRN Cc1nc2ccc(C)cn2c1C(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000071459274 208766428 /nfs/dbraw/zinc/76/64/28/208766428.db2.gz DXBZUXWNGNXBHF-UHFFFAOYSA-N 0 0 368.651 5.164 40 0 FKABRN C[C@H](F)CCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071746278 221357990 /nfs/dbraw/zinc/35/79/90/221357990.db2.gz NFOQHRRYZIBSNW-KRWDZBQOSA-N 0 0 359.444 6.164 40 0 in-vitro FKABRN C[C@@H](F)CCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071746279 221358488 /nfs/dbraw/zinc/35/84/88/221358488.db2.gz NFOQHRRYZIBSNW-QGZVFWFLSA-N 0 0 359.444 6.164 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2c(C)ccc3ccccc32)c2ccccc21 ZINC000071746280 205437562 /nfs/dbraw/zinc/43/75/62/205437562.db2.gz JFJAWRDBCAFLQA-UHFFFAOYSA-N 0 0 355.481 6.524 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3cc(C)ccc32)c2ccccc21 ZINC000071746306 570510666 /nfs/dbraw/zinc/51/06/66/570510666.db2.gz QGZBPEQODUAQNS-UHFFFAOYSA-N 0 0 355.481 6.524 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2c(CC)ccc3ccccc32)c2ccccc21 ZINC000071746307 221358724 /nfs/dbraw/zinc/35/87/24/221358724.db2.gz ODRBKYARHZKAPB-UHFFFAOYSA-N 0 0 369.508 6.778 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3c(OC)cccc23)c2ccccc21 ZINC000071746311 570510638 /nfs/dbraw/zinc/51/06/38/570510638.db2.gz HWBCWKTVWWHQRW-UHFFFAOYSA-N 0 0 371.480 6.224 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3ccc(C)cc32)c2ccccc21 ZINC000071746312 208771057 /nfs/dbraw/zinc/77/10/57/208771057.db2.gz NULKGPOKWWKWBU-UHFFFAOYSA-N 0 0 355.481 6.524 40 0 in-vitro FKABRN O=C(c1cn(CCCCCCO)c2ccccc12)c1cccc2ccccc21 ZINC000071746314 570510625 /nfs/dbraw/zinc/51/06/25/570510625.db2.gz LBVZVDUWOZUDJT-UHFFFAOYSA-N 0 0 371.480 5.578 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3cccc(CC)c32)c2ccccc21 ZINC000071746323 221358068 /nfs/dbraw/zinc/35/80/68/221358068.db2.gz FRVNYZYXZMSTJD-UHFFFAOYSA-N 0 0 369.508 6.778 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cc(C)cc3ccccc32)c2ccccc21 ZINC000071746325 221358078 /nfs/dbraw/zinc/35/80/78/221358078.db2.gz AWAISCZQPNYSRY-UHFFFAOYSA-N 0 0 355.481 6.524 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3c(C)cccc23)c2ccccc21 ZINC000071746330 221358236 /nfs/dbraw/zinc/35/82/36/221358236.db2.gz MZYMFNUISGWLPY-UHFFFAOYSA-N 0 0 355.481 6.524 40 0 in-vitro FKABRN CC[C@H](O)CCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071746332 221357841 /nfs/dbraw/zinc/35/78/41/221357841.db2.gz VSFMJFFDYLVSBU-SFHVURJKSA-N 0 0 357.453 5.187 40 0 in-vitro FKABRN CC[C@@H](O)CCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071746333 221358134 /nfs/dbraw/zinc/35/81/34/221358134.db2.gz VSFMJFFDYLVSBU-GOSISDBHSA-N 0 0 357.453 5.187 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3c(CC)cccc23)c2ccccc21 ZINC000071746334 205438134 /nfs/dbraw/zinc/43/81/34/205438134.db2.gz GZTHGJZKDOBJTK-UHFFFAOYSA-N 0 0 369.508 6.778 40 0 in-vitro FKABRN CC[C@H](F)CCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071746335 570510622 /nfs/dbraw/zinc/51/06/22/570510622.db2.gz HZCSEIOOIWCYMP-SFHVURJKSA-N 0 0 359.444 6.164 40 0 in-vitro FKABRN CC[C@@H](F)CCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071746336 221358222 /nfs/dbraw/zinc/35/82/22/221358222.db2.gz HZCSEIOOIWCYMP-GOSISDBHSA-N 0 0 359.444 6.164 40 0 in-vitro FKABRN CC(C)[C@@H](C)/C=C/[C@@H](C)[C@@H]1CC[C@H]2C3=CC[C@H]4CCC[C@@]4(C)[C@@H]3CC[C@@]21C ZINC000071775097 571083577 /nfs/dbraw/zinc/08/35/77/571083577.db2.gz VOYKELMCSUDIBK-CJOPVKFFSA-N 0 0 368.649 8.050 40 0 FKABRN CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=CC[C@H]4CCC[C@@]4(C)[C@@H]3CC[C@@]21C ZINC000071775098 571083616 /nfs/dbraw/zinc/08/36/16/571083616.db2.gz VOYKELMCSUDIBK-NLPVQUKCSA-N 0 0 368.649 8.050 40 0 FKABRN CC(C)[C@@H](C)/C=C/[C@@H](C)[C@@H]1CC[C@@H]2C3=CC[C@H]4CCC[C@@]4(C)[C@@H]3CC[C@@]21C ZINC000071775099 571083581 /nfs/dbraw/zinc/08/35/81/571083581.db2.gz VOYKELMCSUDIBK-SRIBHTERSA-N 0 0 368.649 8.050 40 0 FKABRN CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]2C3=CC[C@H]4CCC[C@@]4(C)[C@@H]3CC[C@]12C ZINC000071775100 571083470 /nfs/dbraw/zinc/08/34/70/571083470.db2.gz VOYKELMCSUDIBK-PFNGXAAASA-N 0 0 368.649 8.050 40 0 FKABRN CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@H]2c3ccc4c(c3CC[C@@]21C)CCCC4 ZINC000071775187 571083592 /nfs/dbraw/zinc/08/35/92/571083592.db2.gz VLVSPITURLTIAR-LBANBBHTSA-N 0 0 366.633 7.720 40 0 FKABRN CC(C)[C@@H](C)CC[C@@H](C)[C@H]1CC[C@@H]2c3ccc4c(c3CC[C@]12C)CCCC4 ZINC000071775189 571083672 /nfs/dbraw/zinc/08/36/72/571083672.db2.gz VLVSPITURLTIAR-SNIDIPQXSA-N 0 0 366.633 7.720 40 0 FKABRN Cc1c2c(c(C)c(C)c1C)[C@H]1C=C[C@@H]2C1=C(c1ccccc1)c1ccccc1 ZINC000071782704 571166829 /nfs/dbraw/zinc/16/68/29/571166829.db2.gz WYQMNPVJLIUOAZ-PSWAGMNNSA-N 0 0 362.516 7.173 40 0 FKABRN CC1(C)[C@]2(c3ccccc3)[C@H]3CC(Br)=C[C@@H]3[C@]12c1ccccc1 ZINC000071785442 221376025 /nfs/dbraw/zinc/37/60/25/221376025.db2.gz ZCUSLGXRRGHAJZ-MPJJRAAHSA-N 0 0 365.314 5.831 40 0 FKABRN CC1(C)[C@]2(c3ccccc3)[C@H]3C=C(Br)C[C@@H]3[C@]12c1ccccc1 ZINC000071785443 571083605 /nfs/dbraw/zinc/08/36/05/571083605.db2.gz ZCUSLGXRRGHAJZ-BLKABHOGSA-N 0 0 365.314 5.831 40 0 FKABRN CCC[C@H](O)Cn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071789376 221376669 /nfs/dbraw/zinc/37/66/69/221376669.db2.gz ICOUPJBNCNTOKV-SFHVURJKSA-N 0 0 357.453 5.187 40 0 in-vitro FKABRN CCC[C@@H](O)Cn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071789377 221376494 /nfs/dbraw/zinc/37/64/94/221376494.db2.gz ICOUPJBNCNTOKV-GOSISDBHSA-N 0 0 357.453 5.187 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3cccc(C)c32)c2ccccc21 ZINC000071789384 570514378 /nfs/dbraw/zinc/51/43/78/570514378.db2.gz NMSMHEOGZBXQDF-UHFFFAOYSA-N 0 0 355.481 6.524 40 0 in-vitro FKABRN CCC[C@H](F)Cn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071789387 208781403 /nfs/dbraw/zinc/78/14/03/208781403.db2.gz UYTSDBWWEGEPLY-SFHVURJKSA-N 0 0 359.444 6.164 40 0 in-vitro FKABRN CCC[C@@H](F)Cn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000071789388 221376872 /nfs/dbraw/zinc/37/68/72/221376872.db2.gz UYTSDBWWEGEPLY-GOSISDBHSA-N 0 0 359.444 6.164 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cccc3cccc(OC)c32)c2ccccc21 ZINC000071789399 221376094 /nfs/dbraw/zinc/37/60/94/221376094.db2.gz CNQSHGRPSVJODG-UHFFFAOYSA-N 0 0 371.480 6.224 40 0 in-vitro FKABRN Nc1nc(-c2ccc(Cl)cc2)cc(-c2ccc(Cl)c(Cl)c2)n1 ZINC000071977902 205458603 /nfs/dbraw/zinc/45/86/03/205458603.db2.gz OBIXAANINVSMFY-UHFFFAOYSA-N 0 0 350.636 5.353 40 0 FKABRN Nc1nc(-c2ccc(Cl)c(Cl)c2)cc(-c2ccccc2Cl)n1 ZINC000071977911 518197938 /nfs/dbraw/zinc/19/79/38/518197938.db2.gz XIKOLDAOOSBENJ-UHFFFAOYSA-N 0 0 350.636 5.353 40 0 FKABRN CCOc1ccc(-c2cc(-c3ccc(Cl)c(Cl)c3)nc(N)n2)cc1 ZINC000071977913 571167743 /nfs/dbraw/zinc/16/77/43/571167743.db2.gz CYPXNQFNPAXSHK-UHFFFAOYSA-N 0 0 360.244 5.098 40 0 FKABRN CC(C)(C)c1ccc(-c2cc(-c3ccc(Cl)c(Cl)c3)nc(N)n2)cc1 ZINC000071977922 571167849 /nfs/dbraw/zinc/16/78/49/571167849.db2.gz HYBYTFMHNAUGEI-UHFFFAOYSA-N 0 0 372.299 5.997 40 0 FKABRN Nc1nc(-c2cccc(Cl)c2)cc(-c2ccc(Cl)c(Cl)c2)n1 ZINC000071977929 221393432 /nfs/dbraw/zinc/39/34/32/221393432.db2.gz HLWOUCRCMRSQLM-UHFFFAOYSA-N 0 0 350.636 5.353 40 0 FKABRN CCCCCn1cc(C(=O)Nc2ccc3ccccc3c2)c2ccccc21 ZINC000072119789 571277770 /nfs/dbraw/zinc/27/77/70/571277770.db2.gz LKGPFICOQRIBQC-UHFFFAOYSA-N 0 0 356.469 6.237 40 0 in-vitro FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1ccc(OCc2ccccc2)nc1 ZINC000072212047 570528169 /nfs/dbraw/zinc/52/81/69/570528169.db2.gz YXZDAAWWSKBHLK-LJQANCHMSA-N 0 0 368.477 5.123 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1ccc(OCc2ccccc2)nc1 ZINC000072212048 570527995 /nfs/dbraw/zinc/52/79/95/570527995.db2.gz YXZDAAWWSKBHLK-IBGZPJMESA-N 0 0 368.477 5.123 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1ccc(OCc2ccccc2)nc1 ZINC000072212055 570528125 /nfs/dbraw/zinc/52/81/25/570528125.db2.gz SUDALWROIZHPJP-QFIPXVFZSA-N 0 0 372.468 5.028 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1ccc(OCc2ccccc2)nc1 ZINC000072212056 570528200 /nfs/dbraw/zinc/52/82/00/570528200.db2.gz SUDALWROIZHPJP-JOCHJYFZSA-N 0 0 372.468 5.028 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1cccnc1OCc1ccccc1 ZINC000072212107 570528205 /nfs/dbraw/zinc/52/82/05/570528205.db2.gz JRMUXTAIXITUFU-LJQANCHMSA-N 0 0 368.477 5.123 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1cccnc1OCc1ccccc1 ZINC000072212108 570528090 /nfs/dbraw/zinc/52/80/90/570528090.db2.gz JRMUXTAIXITUFU-IBGZPJMESA-N 0 0 368.477 5.123 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1cccnc1OCc1ccccc1 ZINC000072212115 570527921 /nfs/dbraw/zinc/52/79/21/570527921.db2.gz HKEBZMDXYOKLPV-QFIPXVFZSA-N 0 0 372.468 5.028 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1cccnc1OCc1ccccc1 ZINC000072212116 570527943 /nfs/dbraw/zinc/52/79/43/570527943.db2.gz HKEBZMDXYOKLPV-JOCHJYFZSA-N 0 0 372.468 5.028 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@@H]1c1ccc(Oc2ccccc2)nc1 ZINC000072212134 570528138 /nfs/dbraw/zinc/52/81/38/570528138.db2.gz OLOANEDIOIJOHC-OAQYLSRUSA-N 0 0 374.440 5.348 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@H]1c1ccc(Oc2ccccc2)nc1 ZINC000072212135 570528056 /nfs/dbraw/zinc/52/80/56/570528056.db2.gz OLOANEDIOIJOHC-NRFANRHFSA-N 0 0 374.440 5.348 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1ccc(Oc2ccccc2)nc1 ZINC000072212167 570528158 /nfs/dbraw/zinc/52/81/58/570528158.db2.gz HUKVHZBVXSXJLX-GOSISDBHSA-N 0 0 354.450 5.336 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1ccc(Oc2ccccc2)nc1 ZINC000072212168 570528019 /nfs/dbraw/zinc/52/80/19/570528019.db2.gz HUKVHZBVXSXJLX-SFHVURJKSA-N 0 0 354.450 5.336 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1ccc(Oc2ccccc2)nc1 ZINC000072212175 570527936 /nfs/dbraw/zinc/52/79/36/570527936.db2.gz DTJJUUSOODAHBM-OAQYLSRUSA-N 0 0 358.441 5.241 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1ccc(Oc2ccccc2)nc1 ZINC000072212176 570528064 /nfs/dbraw/zinc/52/80/64/570528064.db2.gz DTJJUUSOODAHBM-NRFANRHFSA-N 0 0 358.441 5.241 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@@H]1c1cccnc1Oc1ccccc1 ZINC000072212194 570527967 /nfs/dbraw/zinc/52/79/67/570527967.db2.gz MLLGIEXRLULBJD-OAQYLSRUSA-N 0 0 374.440 5.348 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@H]1c1cccnc1Oc1ccccc1 ZINC000072212195 570528216 /nfs/dbraw/zinc/52/82/16/570528216.db2.gz MLLGIEXRLULBJD-NRFANRHFSA-N 0 0 374.440 5.348 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1cccnc1Oc1ccccc1 ZINC000072212227 570527960 /nfs/dbraw/zinc/52/79/60/570527960.db2.gz HSLYOZHPFPQYJN-GOSISDBHSA-N 0 0 354.450 5.336 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1cccnc1Oc1ccccc1 ZINC000072212228 570528144 /nfs/dbraw/zinc/52/81/44/570528144.db2.gz HSLYOZHPFPQYJN-SFHVURJKSA-N 0 0 354.450 5.336 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1cccnc1Oc1ccccc1 ZINC000072212235 570528195 /nfs/dbraw/zinc/52/81/95/570528195.db2.gz XGZBQSJDRSODLI-OAQYLSRUSA-N 0 0 358.441 5.241 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1cccnc1Oc1ccccc1 ZINC000072212236 570528163 /nfs/dbraw/zinc/52/81/63/570528163.db2.gz XGZBQSJDRSODLI-NRFANRHFSA-N 0 0 358.441 5.241 40 0 FKABRN CC(C)N(c1ccc([C@@H]2CCCCN2C(=O)OC(C)(C)C)cn1)C(C)C ZINC000072212984 570528642 /nfs/dbraw/zinc/52/86/42/570528642.db2.gz AQESWKWTXXYMCW-SFHVURJKSA-N 0 0 361.530 5.167 40 0 FKABRN CC(C)N(c1ccc([C@H]2CCCCN2C(=O)OC(C)(C)C)cn1)C(C)C ZINC000072212985 570528722 /nfs/dbraw/zinc/52/87/22/570528722.db2.gz AQESWKWTXXYMCW-GOSISDBHSA-N 0 0 361.530 5.167 40 0 FKABRN CC(C)N(c1ccc([C@@H]2CCCCN2C(=O)c2ccccc2)cn1)C(C)C ZINC000072212992 570528772 /nfs/dbraw/zinc/52/87/72/570528772.db2.gz IBJCFQWNAPVCKY-NRFANRHFSA-N 0 0 365.521 5.072 40 0 FKABRN CC(C)N(c1ccc([C@H]2CCCCN2C(=O)c2ccccc2)cn1)C(C)C ZINC000072212993 570528432 /nfs/dbraw/zinc/52/84/32/570528432.db2.gz IBJCFQWNAPVCKY-OAQYLSRUSA-N 0 0 365.521 5.072 40 0 FKABRN CC(C)N(c1ncccc1[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(C)C ZINC000072213044 570528746 /nfs/dbraw/zinc/52/87/46/570528746.db2.gz YAKAAFFUJZISGS-SFHVURJKSA-N 0 0 361.530 5.167 40 0 FKABRN CC(C)N(c1ncccc1[C@H]1CCCCN1C(=O)OC(C)(C)C)C(C)C ZINC000072213045 570528514 /nfs/dbraw/zinc/52/85/14/570528514.db2.gz YAKAAFFUJZISGS-GOSISDBHSA-N 0 0 361.530 5.167 40 0 FKABRN CC(C)N(c1ncccc1[C@@H]1CCCCN1C(=O)c1ccccc1)C(C)C ZINC000072213052 570528453 /nfs/dbraw/zinc/52/84/53/570528453.db2.gz URHLFWXANUCVEU-NRFANRHFSA-N 0 0 365.521 5.072 40 0 FKABRN CC(C)N(c1ncccc1[C@H]1CCCCN1C(=O)c1ccccc1)C(C)C ZINC000072213053 570528555 /nfs/dbraw/zinc/52/85/55/570528555.db2.gz URHLFWXANUCVEU-OAQYLSRUSA-N 0 0 365.521 5.072 40 0 FKABRN CC(C)CNc1ncccc1[C@@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213284 570528658 /nfs/dbraw/zinc/52/86/58/570528658.db2.gz DRMLKRMPKXSMME-FQEVSTJZSA-N 0 0 367.493 5.013 40 0 FKABRN CC(C)CNc1ncccc1[C@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213285 570528502 /nfs/dbraw/zinc/52/85/02/570528502.db2.gz DRMLKRMPKXSMME-HXUWFJFHSA-N 0 0 367.493 5.013 40 0 FKABRN CC(C)CNc1ccc([C@@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213344 570529000 /nfs/dbraw/zinc/52/90/00/570529000.db2.gz XKFLCPULKJZBBB-FQEVSTJZSA-N 0 0 367.493 5.013 40 0 FKABRN CC(C)CNc1ccc([C@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213345 570529276 /nfs/dbraw/zinc/52/92/76/570529276.db2.gz XKFLCPULKJZBBB-HXUWFJFHSA-N 0 0 367.493 5.013 40 0 FKABRN CC[C@@H](C)Nc1ncccc1[C@@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213445 570528960 /nfs/dbraw/zinc/52/89/60/570528960.db2.gz HFZPQSYLGOYNSS-XLIONFOSSA-N 0 0 367.493 5.156 40 0 FKABRN CC[C@H](C)Nc1ncccc1[C@@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213446 570528921 /nfs/dbraw/zinc/52/89/21/570528921.db2.gz HFZPQSYLGOYNSS-PXNSSMCTSA-N 0 0 367.493 5.156 40 0 FKABRN CC[C@@H](C)Nc1ncccc1[C@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213447 570528894 /nfs/dbraw/zinc/52/88/94/570528894.db2.gz HFZPQSYLGOYNSS-YLJYHZDGSA-N 0 0 367.493 5.156 40 0 FKABRN CC[C@H](C)Nc1ncccc1[C@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213448 570529239 /nfs/dbraw/zinc/52/92/39/570529239.db2.gz HFZPQSYLGOYNSS-FXAWDEMLSA-N 0 0 367.493 5.156 40 0 FKABRN CC[C@@H](C)Nc1ccc([C@@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213557 570529154 /nfs/dbraw/zinc/52/91/54/570529154.db2.gz VVKJABXTCUZHES-XLIONFOSSA-N 0 0 367.493 5.156 40 0 FKABRN CC[C@H](C)Nc1ccc([C@@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213558 570529102 /nfs/dbraw/zinc/52/91/02/570529102.db2.gz VVKJABXTCUZHES-PXNSSMCTSA-N 0 0 367.493 5.156 40 0 FKABRN CC[C@@H](C)Nc1ccc([C@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213559 570529255 /nfs/dbraw/zinc/52/92/55/570529255.db2.gz VVKJABXTCUZHES-YLJYHZDGSA-N 0 0 367.493 5.156 40 0 FKABRN CC[C@H](C)Nc1ccc([C@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213560 570529143 /nfs/dbraw/zinc/52/91/43/570529143.db2.gz VVKJABXTCUZHES-FXAWDEMLSA-N 0 0 367.493 5.156 40 0 FKABRN CCCCNc1ncccc1[C@@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213628 570528941 /nfs/dbraw/zinc/52/89/41/570528941.db2.gz IJOSSKAETDQBCF-FQEVSTJZSA-N 0 0 367.493 5.157 40 0 FKABRN CCCCNc1ncccc1[C@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072213629 570528880 /nfs/dbraw/zinc/52/88/80/570528880.db2.gz IJOSSKAETDQBCF-HXUWFJFHSA-N 0 0 367.493 5.157 40 0 FKABRN CCCCNc1ccc([C@@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213688 570529131 /nfs/dbraw/zinc/52/91/31/570529131.db2.gz ZACRTILONHFJAP-FQEVSTJZSA-N 0 0 367.493 5.157 40 0 FKABRN CCCCNc1ccc([C@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072213689 570529271 /nfs/dbraw/zinc/52/92/71/570529271.db2.gz ZACRTILONHFJAP-HXUWFJFHSA-N 0 0 367.493 5.157 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1cccnc1NC1CCCCC1 ZINC000072214046 570529667 /nfs/dbraw/zinc/52/96/67/570529667.db2.gz GLOWWJPETAKXFP-GOSISDBHSA-N 0 0 359.514 5.288 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1cccnc1NC1CCCCC1 ZINC000072214047 570529525 /nfs/dbraw/zinc/52/95/25/570529525.db2.gz GLOWWJPETAKXFP-SFHVURJKSA-N 0 0 359.514 5.288 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1cccnc1NC1CCCCC1 ZINC000072214054 570529401 /nfs/dbraw/zinc/52/94/01/570529401.db2.gz NFZFCEVOQOUUJI-OAQYLSRUSA-N 0 0 363.505 5.194 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1cccnc1NC1CCCCC1 ZINC000072214055 570529640 /nfs/dbraw/zinc/52/96/40/570529640.db2.gz NFZFCEVOQOUUJI-NRFANRHFSA-N 0 0 363.505 5.194 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@@H]1c1ccc(Nc2ccccc2)nc1 ZINC000072214073 570529674 /nfs/dbraw/zinc/52/96/74/570529674.db2.gz RHEVABRCOWJVAW-OAQYLSRUSA-N 0 0 373.456 5.299 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@H]1c1ccc(Nc2ccccc2)nc1 ZINC000072214074 570529618 /nfs/dbraw/zinc/52/96/18/570529618.db2.gz RHEVABRCOWJVAW-NRFANRHFSA-N 0 0 373.456 5.299 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1ccc(Nc2ccccc2)nc1 ZINC000072214106 570529545 /nfs/dbraw/zinc/52/95/45/570529545.db2.gz DFGGWDLQJSMGIZ-GOSISDBHSA-N 0 0 353.466 5.287 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1ccc(Nc2ccccc2)nc1 ZINC000072214107 570529555 /nfs/dbraw/zinc/52/95/55/570529555.db2.gz DFGGWDLQJSMGIZ-SFHVURJKSA-N 0 0 353.466 5.287 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1ccc(Nc2ccccc2)nc1 ZINC000072214114 570529703 /nfs/dbraw/zinc/52/97/03/570529703.db2.gz MBJSJNLQSWNKGX-OAQYLSRUSA-N 0 0 357.457 5.193 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1ccc(Nc2ccccc2)nc1 ZINC000072214115 570529505 /nfs/dbraw/zinc/52/95/05/570529505.db2.gz MBJSJNLQSWNKGX-NRFANRHFSA-N 0 0 357.457 5.193 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@@H]1c1cccnc1Nc1ccccc1 ZINC000072214133 570529574 /nfs/dbraw/zinc/52/95/74/570529574.db2.gz PCKWIYMFCFLGHB-OAQYLSRUSA-N 0 0 373.456 5.299 40 0 FKABRN O=C(OCc1ccccc1)N1CCC[C@H]1c1cccnc1Nc1ccccc1 ZINC000072214134 570529531 /nfs/dbraw/zinc/52/95/31/570529531.db2.gz PCKWIYMFCFLGHB-NRFANRHFSA-N 0 0 373.456 5.299 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1cccnc1Nc1ccccc1 ZINC000072214166 570529482 /nfs/dbraw/zinc/52/94/82/570529482.db2.gz AVJHRKUFIDSIME-GOSISDBHSA-N 0 0 353.466 5.287 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1cccnc1Nc1ccccc1 ZINC000072214167 570529586 /nfs/dbraw/zinc/52/95/86/570529586.db2.gz AVJHRKUFIDSIME-SFHVURJKSA-N 0 0 353.466 5.287 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1cccnc1Nc1ccccc1 ZINC000072214174 570529603 /nfs/dbraw/zinc/52/96/03/570529603.db2.gz FDGVEGQQPBTLOJ-OAQYLSRUSA-N 0 0 357.457 5.193 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1cccnc1Nc1ccccc1 ZINC000072214175 570529655 /nfs/dbraw/zinc/52/96/55/570529655.db2.gz FDGVEGQQPBTLOJ-NRFANRHFSA-N 0 0 357.457 5.193 40 0 FKABRN CN(c1ccccc1)c1ccc([C@H]2CCCCN2C(=O)OC(C)(C)C)cn1 ZINC000072214226 570529395 /nfs/dbraw/zinc/52/93/95/570529395.db2.gz ALOGKLOEWUJDOH-LJQANCHMSA-N 0 0 367.493 5.312 40 0 FKABRN CN(c1ccccc1)c1ccc([C@@H]2CCCCN2C(=O)OC(C)(C)C)cn1 ZINC000072214227 570529440 /nfs/dbraw/zinc/52/94/40/570529440.db2.gz ALOGKLOEWUJDOH-IBGZPJMESA-N 0 0 367.493 5.312 40 0 FKABRN CN(c1ccccc1)c1ccc([C@@H]2CCCCN2C(=O)c2ccccc2)cn1 ZINC000072214234 570529466 /nfs/dbraw/zinc/52/94/66/570529466.db2.gz XANCTIXFGMASSP-QFIPXVFZSA-N 0 0 371.484 5.217 40 0 FKABRN CN(c1ccccc1)c1ccc([C@H]2CCCCN2C(=O)c2ccccc2)cn1 ZINC000072214235 570529459 /nfs/dbraw/zinc/52/94/59/570529459.db2.gz XANCTIXFGMASSP-JOCHJYFZSA-N 0 0 371.484 5.217 40 0 FKABRN CN(c1ccccc1)c1ncccc1[C@H]1CCCCN1C(=O)OC(C)(C)C ZINC000072214286 570529976 /nfs/dbraw/zinc/52/99/76/570529976.db2.gz DHDIIMOOCWZTHQ-LJQANCHMSA-N 0 0 367.493 5.312 40 0 FKABRN CN(c1ccccc1)c1ncccc1[C@@H]1CCCCN1C(=O)OC(C)(C)C ZINC000072214287 570530155 /nfs/dbraw/zinc/53/01/55/570530155.db2.gz DHDIIMOOCWZTHQ-IBGZPJMESA-N 0 0 367.493 5.312 40 0 FKABRN CN(c1ccccc1)c1ncccc1[C@@H]1CCCCN1C(=O)c1ccccc1 ZINC000072214294 570529907 /nfs/dbraw/zinc/52/99/07/570529907.db2.gz OIMWUIFMGIYFJZ-QFIPXVFZSA-N 0 0 371.484 5.217 40 0 FKABRN CN(c1ccccc1)c1ncccc1[C@H]1CCCCN1C(=O)c1ccccc1 ZINC000072214295 570529964 /nfs/dbraw/zinc/52/99/64/570529964.db2.gz OIMWUIFMGIYFJZ-JOCHJYFZSA-N 0 0 371.484 5.217 40 0 FKABRN CC(C)(C)OC(=O)N(c1ccc(C2=NCCCC2)cn1)C1CCCCC1 ZINC000072215693 570532943 /nfs/dbraw/zinc/53/29/43/570532943.db2.gz CJJMMOCTWOKVBT-UHFFFAOYSA-N 0 0 357.498 5.129 40 0 FKABRN CC(C)(C)OC(=O)N(c1ncccc1C1=NCCCC1)C1CCCCC1 ZINC000072215753 570533016 /nfs/dbraw/zinc/53/30/16/570533016.db2.gz VMARLEXYIWDYFX-UHFFFAOYSA-N 0 0 357.498 5.129 40 0 FKABRN CC(C)(C)OC(=O)N(c1ccccc1)c1ccc(C2=NCCCC2)cn1 ZINC000072215813 570532925 /nfs/dbraw/zinc/53/29/25/570532925.db2.gz WBBBQNZREJWILE-UHFFFAOYSA-N 0 0 351.450 5.128 40 0 FKABRN CC(C)(C)OC(=O)N(c1ccccc1)c1ncccc1C1=NCCCC1 ZINC000072215873 570533601 /nfs/dbraw/zinc/53/36/01/570533601.db2.gz WQMHIUGQISWOHO-UHFFFAOYSA-N 0 0 351.450 5.128 40 0 FKABRN CN1CCCC[C@H]1c1cccnc1N(C(=O)OC(C)(C)C)c1ccccc1 ZINC000072215876 570533486 /nfs/dbraw/zinc/53/34/86/570533486.db2.gz WXOQAVYVDKCOJX-IBGZPJMESA-N 0 0 367.493 5.312 40 0 FKABRN CN1CCCC[C@@H]1c1cccnc1N(C(=O)OC(C)(C)C)c1ccccc1 ZINC000072215877 570533371 /nfs/dbraw/zinc/53/33/71/570533371.db2.gz WXOQAVYVDKCOJX-LJQANCHMSA-N 0 0 367.493 5.312 40 0 FKABRN CCSc1ccc([C@@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217151 570533859 /nfs/dbraw/zinc/53/38/59/570533859.db2.gz GTPMROLSDLQABI-SFHVURJKSA-N 0 0 356.491 5.057 40 0 FKABRN CCSc1ccc([C@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217152 570534034 /nfs/dbraw/zinc/53/40/34/570534034.db2.gz GTPMROLSDLQABI-GOSISDBHSA-N 0 0 356.491 5.057 40 0 FKABRN CCSc1ncccc1[C@@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072217211 570534046 /nfs/dbraw/zinc/53/40/46/570534046.db2.gz YMHSHJLDRQWZFR-SFHVURJKSA-N 0 0 356.491 5.057 40 0 FKABRN CCSc1ncccc1[C@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072217212 570534044 /nfs/dbraw/zinc/53/40/44/570534044.db2.gz YMHSHJLDRQWZFR-GOSISDBHSA-N 0 0 356.491 5.057 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@@H]1c1ccc(SC2CCCCC2)nc1 ZINC000072217238 570532206 /nfs/dbraw/zinc/53/22/06/570532206.db2.gz SWMUURYOBLOHMM-QGZVFWFLSA-N 0 0 362.539 5.578 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@H]1c1ccc(SC2CCCCC2)nc1 ZINC000072217239 570532050 /nfs/dbraw/zinc/53/20/50/570532050.db2.gz SWMUURYOBLOHMM-KRWDZBQOSA-N 0 0 362.539 5.578 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@@H]1c1ccc(SC2CCCCC2)nc1 ZINC000072217248 570531988 /nfs/dbraw/zinc/53/19/88/570531988.db2.gz JWCGDYDVLVZYAZ-HXUWFJFHSA-N 0 0 366.530 5.484 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@H]1c1ccc(SC2CCCCC2)nc1 ZINC000072217249 570532232 /nfs/dbraw/zinc/53/22/32/570532232.db2.gz JWCGDYDVLVZYAZ-FQEVSTJZSA-N 0 0 366.530 5.484 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@@H]1c1cccnc1SC1CCCCC1 ZINC000072217298 570531979 /nfs/dbraw/zinc/53/19/79/570531979.db2.gz WAYTVOZJDMGQJA-QGZVFWFLSA-N 0 0 362.539 5.578 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@H]1c1cccnc1SC1CCCCC1 ZINC000072217299 570531998 /nfs/dbraw/zinc/53/19/98/570531998.db2.gz WAYTVOZJDMGQJA-KRWDZBQOSA-N 0 0 362.539 5.578 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@@H]1c1cccnc1SC1CCCCC1 ZINC000072217308 570531947 /nfs/dbraw/zinc/53/19/47/570531947.db2.gz HHEQVPVULBFKRD-HXUWFJFHSA-N 0 0 366.530 5.484 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@H]1c1cccnc1SC1CCCCC1 ZINC000072217309 570531977 /nfs/dbraw/zinc/53/19/77/570531977.db2.gz HHEQVPVULBFKRD-FQEVSTJZSA-N 0 0 366.530 5.484 40 0 FKABRN CC(C)(C)Sc1ccc([C@@H]2CCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217356 570532046 /nfs/dbraw/zinc/53/20/46/570532046.db2.gz CKMGOHAJLXCRDH-SFHVURJKSA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)(C)Sc1ccc([C@H]2CCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217357 570532067 /nfs/dbraw/zinc/53/20/67/570532067.db2.gz CKMGOHAJLXCRDH-GOSISDBHSA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1ccc(SC(C)(C)C)nc1 ZINC000072217389 570532127 /nfs/dbraw/zinc/53/21/27/570532127.db2.gz YJKXIAXMXWGXKD-OAHLLOKOSA-N 0 0 350.528 5.434 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1ccc(SC(C)(C)C)nc1 ZINC000072217390 570532438 /nfs/dbraw/zinc/53/24/38/570532438.db2.gz YJKXIAXMXWGXKD-HNNXBMFYSA-N 0 0 350.528 5.434 40 0 FKABRN CC(C)(C)Sc1ccc([C@@H]2CCCCN2C(=O)c2ccccc2)cn1 ZINC000072217397 570532520 /nfs/dbraw/zinc/53/25/20/570532520.db2.gz WEWSHRYJABKLHX-SFHVURJKSA-N 0 0 354.519 5.340 40 0 FKABRN CC(C)(C)Sc1ccc([C@H]2CCCCN2C(=O)c2ccccc2)cn1 ZINC000072217398 570532546 /nfs/dbraw/zinc/53/25/46/570532546.db2.gz WEWSHRYJABKLHX-GOSISDBHSA-N 0 0 354.519 5.340 40 0 FKABRN CC(C)(C)Sc1ncccc1[C@@H]1CCCN1C(=O)OCc1ccccc1 ZINC000072217416 570532516 /nfs/dbraw/zinc/53/25/16/570532516.db2.gz HZEWTWFXPMUDHK-SFHVURJKSA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)(C)Sc1ncccc1[C@H]1CCCN1C(=O)OCc1ccccc1 ZINC000072217417 570532609 /nfs/dbraw/zinc/53/26/09/570532609.db2.gz HZEWTWFXPMUDHK-GOSISDBHSA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1cccnc1SC(C)(C)C ZINC000072217449 570532434 /nfs/dbraw/zinc/53/24/34/570532434.db2.gz IYYSJPJTUJKIOI-OAHLLOKOSA-N 0 0 350.528 5.434 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1cccnc1SC(C)(C)C ZINC000072217450 570532536 /nfs/dbraw/zinc/53/25/36/570532536.db2.gz IYYSJPJTUJKIOI-HNNXBMFYSA-N 0 0 350.528 5.434 40 0 FKABRN CC(C)(C)Sc1ncccc1[C@@H]1CCCCN1C(=O)c1ccccc1 ZINC000072217457 570532575 /nfs/dbraw/zinc/53/25/75/570532575.db2.gz MPVIFQVTFGSWHA-SFHVURJKSA-N 0 0 354.519 5.340 40 0 FKABRN CC(C)(C)Sc1ncccc1[C@H]1CCCCN1C(=O)c1ccccc1 ZINC000072217458 570532512 /nfs/dbraw/zinc/53/25/12/570532512.db2.gz MPVIFQVTFGSWHA-GOSISDBHSA-N 0 0 354.519 5.340 40 0 FKABRN CC(C)Sc1ccc([C@@H]2CCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217476 570532508 /nfs/dbraw/zinc/53/25/08/570532508.db2.gz MRNYDOMJDIHFQM-SFHVURJKSA-N 0 0 356.491 5.056 40 0 FKABRN CC(C)Sc1ccc([C@H]2CCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217477 570532557 /nfs/dbraw/zinc/53/25/57/570532557.db2.gz MRNYDOMJDIHFQM-GOSISDBHSA-N 0 0 356.491 5.056 40 0 FKABRN CC(C)Sc1ccc([C@@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217511 570532441 /nfs/dbraw/zinc/53/24/41/570532441.db2.gz UTRAEIOZTKUYRZ-IBGZPJMESA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)Sc1ccc([C@H]2CCCCN2C(=O)OCc2ccccc2)cn1 ZINC000072217512 570532477 /nfs/dbraw/zinc/53/24/77/570532477.db2.gz UTRAEIOZTKUYRZ-LJQANCHMSA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)Sc1ncccc1[C@@H]1CCCN1C(=O)OCc1ccccc1 ZINC000072217536 570532471 /nfs/dbraw/zinc/53/24/71/570532471.db2.gz WAONWYRQUCEBRK-SFHVURJKSA-N 0 0 356.491 5.056 40 0 FKABRN CC(C)Sc1ncccc1[C@H]1CCCN1C(=O)OCc1ccccc1 ZINC000072217537 570532591 /nfs/dbraw/zinc/53/25/91/570532591.db2.gz WAONWYRQUCEBRK-GOSISDBHSA-N 0 0 356.491 5.056 40 0 FKABRN CC(C)Sc1ncccc1[C@@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072217571 570532479 /nfs/dbraw/zinc/53/24/79/570532479.db2.gz CLNOXWARQBZKFG-IBGZPJMESA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)Sc1ncccc1[C@H]1CCCCN1C(=O)OCc1ccccc1 ZINC000072217572 570532422 /nfs/dbraw/zinc/53/24/22/570532422.db2.gz CLNOXWARQBZKFG-LJQANCHMSA-N 0 0 370.518 5.446 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217598 570532505 /nfs/dbraw/zinc/53/25/05/570532505.db2.gz BYCRWMUFTSEONN-QGZVFWFLSA-N 0 0 356.491 5.305 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217599 570532444 /nfs/dbraw/zinc/53/24/44/570532444.db2.gz BYCRWMUFTSEONN-KRWDZBQOSA-N 0 0 356.491 5.305 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217608 570532510 /nfs/dbraw/zinc/53/25/10/570532510.db2.gz FUCNIXMECDAXCJ-HXUWFJFHSA-N 0 0 360.482 5.210 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217609 570532487 /nfs/dbraw/zinc/53/24/87/570532487.db2.gz FUCNIXMECDAXCJ-FQEVSTJZSA-N 0 0 360.482 5.210 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217629 570532451 /nfs/dbraw/zinc/53/24/51/570532451.db2.gz VBYRJUFDWPBWGF-GOSISDBHSA-N 0 0 370.518 5.695 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217630 570532533 /nfs/dbraw/zinc/53/25/33/570532533.db2.gz VBYRJUFDWPBWGF-SFHVURJKSA-N 0 0 370.518 5.695 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217637 570532506 /nfs/dbraw/zinc/53/25/06/570532506.db2.gz IWMBIOAQDQRXJL-OAQYLSRUSA-N 0 0 374.509 5.600 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1ccc(Sc2ccccc2)nc1 ZINC000072217638 570532430 /nfs/dbraw/zinc/53/24/30/570532430.db2.gz IWMBIOAQDQRXJL-NRFANRHFSA-N 0 0 374.509 5.600 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@@H]1c1cccnc1Sc1ccccc1 ZINC000072217658 570532454 /nfs/dbraw/zinc/53/24/54/570532454.db2.gz HUURPRZRAVZLKY-QGZVFWFLSA-N 0 0 356.491 5.305 40 0 FKABRN CC(C)(C)OC(=O)N1CCC[C@H]1c1cccnc1Sc1ccccc1 ZINC000072217659 570532448 /nfs/dbraw/zinc/53/24/48/570532448.db2.gz HUURPRZRAVZLKY-KRWDZBQOSA-N 0 0 356.491 5.305 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@@H]1c1cccnc1Sc1ccccc1 ZINC000072217668 570532540 /nfs/dbraw/zinc/53/25/40/570532540.db2.gz QJZFBTLSWLZXFG-HXUWFJFHSA-N 0 0 360.482 5.210 40 0 FKABRN O=C(c1ccccc1)N1CCC[C@H]1c1cccnc1Sc1ccccc1 ZINC000072217669 570532542 /nfs/dbraw/zinc/53/25/42/570532542.db2.gz QJZFBTLSWLZXFG-FQEVSTJZSA-N 0 0 360.482 5.210 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@@H]1c1cccnc1Sc1ccccc1 ZINC000072217689 570532492 /nfs/dbraw/zinc/53/24/92/570532492.db2.gz NGCFOKAVIZMKCH-GOSISDBHSA-N 0 0 370.518 5.695 40 0 FKABRN CC(C)(C)OC(=O)N1CCCC[C@H]1c1cccnc1Sc1ccccc1 ZINC000072217690 570532599 /nfs/dbraw/zinc/53/25/99/570532599.db2.gz NGCFOKAVIZMKCH-SFHVURJKSA-N 0 0 370.518 5.695 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@@H]1c1cccnc1Sc1ccccc1 ZINC000072217697 570532418 /nfs/dbraw/zinc/53/24/18/570532418.db2.gz YJNKVJPXDOOYSS-OAQYLSRUSA-N 0 0 374.509 5.600 40 0 FKABRN O=C(c1ccccc1)N1CCCC[C@H]1c1cccnc1Sc1ccccc1 ZINC000072217698 570532594 /nfs/dbraw/zinc/53/25/94/570532594.db2.gz YJNKVJPXDOOYSS-NRFANRHFSA-N 0 0 374.509 5.600 40 0 FKABRN Cc1ccccc1C(=O)Nc1cc(NC2CCCCC2)c(N)cc1Cl ZINC000072229040 571178179 /nfs/dbraw/zinc/17/81/79/571178179.db2.gz NZSDVLAKAWOFST-UHFFFAOYSA-N 0 0 357.885 5.228 40 0 FKABRN Cc1cccc(C(=O)Nc2cc(NC3CCCCC3)c(N)cc2Cl)c1 ZINC000072229041 571178229 /nfs/dbraw/zinc/17/82/29/571178229.db2.gz QBHQKCSFGCMOGJ-UHFFFAOYSA-N 0 0 357.885 5.228 40 0 FKABRN Cc1ccc(C(=O)Nc2cc(NC3CCCCC3)c(N)cc2Cl)cc1 ZINC000072229042 571178245 /nfs/dbraw/zinc/17/82/45/571178245.db2.gz GDUKOAUEDROOPN-UHFFFAOYSA-N 0 0 357.885 5.228 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2cc(N3CCCCC3)c(N)cc2Cl)cc1 ZINC000072229166 136143871 /nfs/dbraw/zinc/14/38/71/136143871.db2.gz CDMJPJZJXYLCQY-UHFFFAOYSA-N 0 0 371.912 5.288 40 0 FKABRN CCc1ccc(C(=O)Nc2cc(N3CCCC[C@@H]3C)c(N)cc2Cl)cc1 ZINC000072229171 136143884 /nfs/dbraw/zinc/14/38/84/136143884.db2.gz XTCZXSQIPVFENK-AWEZNQCLSA-N 0 0 371.912 5.116 40 0 FKABRN CCc1ccc(C(=O)Nc2cc(N3CCCC[C@H]3C)c(N)cc2Cl)cc1 ZINC000072229172 136143827 /nfs/dbraw/zinc/14/38/27/136143827.db2.gz XTCZXSQIPVFENK-CQSZACIVSA-N 0 0 371.912 5.116 40 0 FKABRN CCN(CC)c1cc(NC(=O)c2ccc(C(C)C)cc2)c(Cl)cc1N ZINC000072229181 571178160 /nfs/dbraw/zinc/17/81/60/571178160.db2.gz RLZDUPRRSVUATH-UHFFFAOYSA-N 0 0 359.901 5.144 40 0 FKABRN CCN(CC)c1cc(NC(=O)c2ccc(C(C)(C)C)cc2)c(Cl)cc1N ZINC000072229182 571178180 /nfs/dbraw/zinc/17/81/80/571178180.db2.gz PJIUUPOVVMGNOL-UHFFFAOYSA-N 0 0 373.928 5.318 40 0 FKABRN CC(C)(C)c1ccc(C(=O)Nc2cc(N3CCCC3)c(N)cc2Cl)cc1 ZINC000072229188 571178241 /nfs/dbraw/zinc/17/82/41/571178241.db2.gz CJLIVZHNQNADRB-UHFFFAOYSA-N 0 0 371.912 5.072 40 0 FKABRN CCc1ccc(C(=O)Nc2cc(NC3CCCCC3)c(N)cc2Cl)cc1 ZINC000072229191 221452259 /nfs/dbraw/zinc/45/22/59/221452259.db2.gz OLTLFWNJGATZMH-UHFFFAOYSA-N 0 0 371.912 5.482 40 0 FKABRN Nc1cc(Cl)c(NC(=O)c2ccccc2F)cc1NC1CCCCC1 ZINC000072229198 571178165 /nfs/dbraw/zinc/17/81/65/571178165.db2.gz UHMHHRPWTUYALZ-UHFFFAOYSA-N 0 0 361.848 5.058 40 0 FKABRN Nc1cc(Cl)c(NC(=O)c2ccc(F)cc2)cc1NC1CCCCC1 ZINC000072229332 571178215 /nfs/dbraw/zinc/17/82/15/571178215.db2.gz XAWVTOVXAUSXQQ-UHFFFAOYSA-N 0 0 361.848 5.058 40 0 FKABRN Nc1cc(Cl)c(NC(=O)c2cc(Cl)ccc2Cl)cc1Cl ZINC000072229434 571178210 /nfs/dbraw/zinc/17/82/10/571178210.db2.gz RCBMLWOMHAJAJR-UHFFFAOYSA-N 0 0 350.032 5.135 40 0 FKABRN Nc1cc(Cl)c(NC(=O)c2ccc(Cl)cc2Cl)cc1Cl ZINC000072229435 571178152 /nfs/dbraw/zinc/17/81/52/571178152.db2.gz ORHZEQRUOUKWNT-UHFFFAOYSA-N 0 0 350.032 5.135 40 0 FKABRN Nc1cc(Cl)c(NC(=O)c2ccc(-c3ccccc3)cc2)cc1Cl ZINC000072229439 221452158 /nfs/dbraw/zinc/45/21/58/221452158.db2.gz LEYHNZFRHFNEFD-UHFFFAOYSA-N 0 0 357.240 5.495 40 0 FKABRN CCCCOc1cccc(C(=O)Nc2cc(Cl)c(N)cc2Cl)c1 ZINC000072229460 221452649 /nfs/dbraw/zinc/45/26/49/221452649.db2.gz BGAJQDYYAJPIKO-UHFFFAOYSA-N 0 0 353.249 5.007 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2cc(Cl)c(N)cc2Cl)cc1 ZINC000072229471 221451663 /nfs/dbraw/zinc/45/16/63/221451663.db2.gz PGHFCMZZKHUMMH-UHFFFAOYSA-N 0 0 353.249 5.007 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)Nc2cc(Cl)c(N)cc2Cl)c1 ZINC000072229509 571178232 /nfs/dbraw/zinc/17/82/32/571178232.db2.gz YFEYEHIOJDBNQP-UHFFFAOYSA-N 0 0 367.276 5.025 40 0 FKABRN CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1cc(Cl)c(N)cc1Cl ZINC000072229527 571178218 /nfs/dbraw/zinc/17/82/18/571178218.db2.gz IRTCDKZZAPLMQW-UHFFFAOYSA-N 0 0 373.667 5.025 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(Cl)cc2[C@H](O)c2ccccc2)cc1 ZINC000072229845 210064725 /nfs/dbraw/zinc/06/47/25/210064725.db2.gz DZPCONRZEQYWNS-OAQYLSRUSA-N 0 0 365.860 5.236 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(Cl)cc2[C@@H](O)c2ccccc2)cc1 ZINC000072229846 203797584 /nfs/dbraw/zinc/79/75/84/203797584.db2.gz DZPCONRZEQYWNS-NRFANRHFSA-N 0 0 365.860 5.236 40 0 FKABRN O=C(Nc1ccc(Cl)cc1[C@@H](O)c1ccccc1)c1ccccc1Cl ZINC000072229855 571053439 /nfs/dbraw/zinc/05/34/39/571053439.db2.gz OBTKHMPSEZFDNR-IBGZPJMESA-N 0 0 372.251 5.327 40 0 FKABRN O=C(Nc1ccc(Cl)cc1[C@H](O)c1ccccc1)c1ccccc1Cl ZINC000072229856 571053284 /nfs/dbraw/zinc/05/32/84/571053284.db2.gz OBTKHMPSEZFDNR-LJQANCHMSA-N 0 0 372.251 5.327 40 0 FKABRN O=C(Nc1ccc(Cl)cc1[C@@H](O)c1ccccc1)c1cccc(Cl)c1 ZINC000072229859 571053176 /nfs/dbraw/zinc/05/31/76/571053176.db2.gz NTFRYKMCOKWCJY-IBGZPJMESA-N 0 0 372.251 5.327 40 0 FKABRN O=C(Nc1ccc(Cl)cc1[C@H](O)c1ccccc1)c1cccc(Cl)c1 ZINC000072229860 206677616 /nfs/dbraw/zinc/67/76/16/206677616.db2.gz NTFRYKMCOKWCJY-LJQANCHMSA-N 0 0 372.251 5.327 40 0 FKABRN O=C(Nc1ccc(Cl)cc1[C@@H](O)c1ccccc1)c1ccc(Cl)cc1 ZINC000072229867 571053228 /nfs/dbraw/zinc/05/32/28/571053228.db2.gz ORBFYLAFALXNMW-IBGZPJMESA-N 0 0 372.251 5.327 40 0 FKABRN O=C(Nc1ccc(Cl)cc1[C@H](O)c1ccccc1)c1ccc(Cl)cc1 ZINC000072229868 210064914 /nfs/dbraw/zinc/06/49/14/210064914.db2.gz ORBFYLAFALXNMW-LJQANCHMSA-N 0 0 372.251 5.327 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(Cl)cc2[C@H](O)c2ccccc2)cc1C ZINC000072229879 571053273 /nfs/dbraw/zinc/05/32/73/571053273.db2.gz VNXAWVCPNIOEPF-OAQYLSRUSA-N 0 0 365.860 5.291 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(Cl)cc2[C@@H](O)c2ccccc2)cc1C ZINC000072229880 571053570 /nfs/dbraw/zinc/05/35/70/571053570.db2.gz VNXAWVCPNIOEPF-NRFANRHFSA-N 0 0 365.860 5.291 40 0 FKABRN O=C(/C=C/c1ccccc1)Nc1ccc(Cl)cc1[C@H](O)c1ccccc1 ZINC000072230091 206678747 /nfs/dbraw/zinc/67/87/47/206678747.db2.gz RMPVDRYTSSKNJM-YDYPUGOESA-N 0 0 363.844 5.074 40 0 FKABRN O=C(/C=C/c1ccccc1)Nc1ccc(Cl)cc1[C@@H](O)c1ccccc1 ZINC000072230092 571053576 /nfs/dbraw/zinc/05/35/76/571053576.db2.gz RMPVDRYTSSKNJM-FZNBYNMYSA-N 0 0 363.844 5.074 40 0 FKABRN Cc1cccc(-c2cccc([C@@H]3CCCN(C(=O)c4ccccc4)C3)n2)c1 ZINC000072348601 518190187 /nfs/dbraw/zinc/19/01/87/518190187.db2.gz MATHOWLCAFMVTE-OAQYLSRUSA-N 0 0 356.469 5.077 40 0 FKABRN Cc1cccc(-c2cccc([C@H]3CCCN(C(=O)c4ccccc4)C3)n2)c1 ZINC000072348602 571180024 /nfs/dbraw/zinc/18/00/24/571180024.db2.gz MATHOWLCAFMVTE-NRFANRHFSA-N 0 0 356.469 5.077 40 0 FKABRN Cc1ccccc1Cc1cccc(C2CCN(C(=O)c3ccccc3)CC2)n1 ZINC000072348624 571179966 /nfs/dbraw/zinc/17/99/66/571179966.db2.gz XWZIMJSHDZMBIF-UHFFFAOYSA-N 0 0 370.496 5.001 40 0 FKABRN Cc1cccc(Cc2cccc([C@@H]3CCCN(C(=O)c4ccccc4)C3)n2)c1 ZINC000072348625 571179977 /nfs/dbraw/zinc/17/99/77/571179977.db2.gz VJCKSZJXHPUYGP-JOCHJYFZSA-N 0 0 370.496 5.001 40 0 FKABRN Cc1cccc(Cc2cccc([C@H]3CCCN(C(=O)c4ccccc4)C3)n2)c1 ZINC000072348626 571180234 /nfs/dbraw/zinc/18/02/34/571180234.db2.gz VJCKSZJXHPUYGP-QFIPXVFZSA-N 0 0 370.496 5.001 40 0 FKABRN Cc1ccc(Cc2cccc([C@@H]3CCCN3C(=O)c3ccc(F)cc3)n2)cc1 ZINC000072357605 571182778 /nfs/dbraw/zinc/18/27/78/571182778.db2.gz ZPWFDRJXXRIHPP-QHCPKHFHSA-N 0 0 374.459 5.097 40 0 FKABRN Cc1ccc(Cc2cccc([C@H]3CCCN3C(=O)c3ccc(F)cc3)n2)cc1 ZINC000072357606 571182797 /nfs/dbraw/zinc/18/27/97/571182797.db2.gz ZPWFDRJXXRIHPP-HSZRJFAPSA-N 0 0 374.459 5.097 40 0 FKABRN O=C(C1CCCC1)N1CCC[C@H]1c1cccc(Cc2ccccc2Cl)n1 ZINC000072358010 571183286 /nfs/dbraw/zinc/18/32/86/571183286.db2.gz WITWUHGIJGDHTD-NRFANRHFSA-N 0 0 368.908 5.180 40 0 FKABRN O=C(C1CCCC1)N1CCC[C@@H]1c1cccc(Cc2ccccc2Cl)n1 ZINC000072358011 571183142 /nfs/dbraw/zinc/18/31/42/571183142.db2.gz WITWUHGIJGDHTD-OAQYLSRUSA-N 0 0 368.908 5.180 40 0 FKABRN O=C(C1CCCC1)N1CCC[C@H]1c1cccc(Cc2ccc(Cl)cc2)n1 ZINC000072358012 571183324 /nfs/dbraw/zinc/18/33/24/571183324.db2.gz HAEMCIURKMOPQJ-NRFANRHFSA-N 0 0 368.908 5.180 40 0 FKABRN O=C(C1CCCC1)N1CCC[C@@H]1c1cccc(Cc2ccc(Cl)cc2)n1 ZINC000072358013 571183234 /nfs/dbraw/zinc/18/32/34/571183234.db2.gz HAEMCIURKMOPQJ-OAQYLSRUSA-N 0 0 368.908 5.180 40 0 FKABRN Cc1cnc(Nc2cccc([C@@H]3CCCN3Cc3ccccc3F)n2)s1 ZINC000072375109 571185429 /nfs/dbraw/zinc/18/54/29/571185429.db2.gz SGRWESBHLAUCLO-SFHVURJKSA-N 0 0 368.481 5.066 40 0 FKABRN Cc1cnc(Nc2cccc([C@H]3CCCN3Cc3ccccc3F)n2)s1 ZINC000072375110 571185296 /nfs/dbraw/zinc/18/52/96/571185296.db2.gz SGRWESBHLAUCLO-GOSISDBHSA-N 0 0 368.481 5.066 40 0 FKABRN O=C(C1CCCCC1)N1CCC[C@@H](c2n[nH]cc2-c2ccc(Cl)cc2)C1 ZINC000072380277 571187548 /nfs/dbraw/zinc/18/75/48/571187548.db2.gz SKRFBTPSHMCPRH-QGZVFWFLSA-N 0 0 371.912 5.016 40 0 FKABRN O=C(C1CCCCC1)N1CCC[C@H](c2n[nH]cc2-c2ccc(Cl)cc2)C1 ZINC000072380278 571187574 /nfs/dbraw/zinc/18/75/74/571187574.db2.gz SKRFBTPSHMCPRH-KRWDZBQOSA-N 0 0 371.912 5.016 40 0 FKABRN O=C(CC1CCCC1)N1CCC[C@@H](c2n[nH]cc2-c2ccc(Cl)cc2)C1 ZINC000072380339 571188149 /nfs/dbraw/zinc/18/81/49/571188149.db2.gz PVOUAYAXWUAJCX-QGZVFWFLSA-N 0 0 371.912 5.016 40 0 FKABRN O=C(CC1CCCC1)N1CCC[C@H](c2n[nH]cc2-c2ccc(Cl)cc2)C1 ZINC000072380340 571188059 /nfs/dbraw/zinc/18/80/59/571188059.db2.gz PVOUAYAXWUAJCX-KRWDZBQOSA-N 0 0 371.912 5.016 40 0 FKABRN CC(C)c1ccc(CN2CCCC[C@@H]2c2nnc(-c3ccsc3)o2)cc1 ZINC000072390151 571189652 /nfs/dbraw/zinc/18/96/52/571189652.db2.gz DBMWDEYUQLZKFJ-LJQANCHMSA-N 0 0 367.518 5.649 40 0 FKABRN CC(C)c1ccc(CN2CCCC[C@H]2c2nnc(-c3ccsc3)o2)cc1 ZINC000072390152 571189674 /nfs/dbraw/zinc/18/96/74/571189674.db2.gz DBMWDEYUQLZKFJ-IBGZPJMESA-N 0 0 367.518 5.649 40 0 FKABRN Cc1ccc(-c2nnc([C@@H]3CCCN3Cc3ccc(C(C)C)cc3)o2)s1 ZINC000072390173 571189681 /nfs/dbraw/zinc/18/96/81/571189681.db2.gz GWPAYTVODSNCEY-SFHVURJKSA-N 0 0 367.518 5.567 40 0 FKABRN Cc1ccc(-c2nnc([C@H]3CCCN3Cc3ccc(C(C)C)cc3)o2)s1 ZINC000072390174 571189670 /nfs/dbraw/zinc/18/96/70/571189670.db2.gz GWPAYTVODSNCEY-GOSISDBHSA-N 0 0 367.518 5.567 40 0 FKABRN O=C(CCNc1ccc(-c2nc3ccccc3s2)cc1)c1ccccc1 ZINC000072408080 570555243 /nfs/dbraw/zinc/55/52/43/570555243.db2.gz XZZMZTMNQNQNLR-UHFFFAOYSA-N 0 0 358.466 5.648 40 0 FKABRN Cc1ccc2c(c1)c(-c1ccccc1)nc1sc(-c3ccccc3)c([O-])[n+]12 ZINC000072414060 570558240 /nfs/dbraw/zinc/55/82/40/570558240.db2.gz FKBVHUCUANASOL-UHFFFAOYSA-O 0 0 369.469 5.383 40 0 FKABRN O=C1NC(=S)SC1=Cc1ccc(-c2ccccc2C(F)(F)F)o1 ZINC000073159552 571084011 /nfs/dbraw/zinc/08/40/11/571084011.db2.gz HIZCSPFDIBZVHG-GHXNOFRVSA-N 0 0 355.362 5.295 40 0 FKABRN O=CN(c1sc2ccccc2c1Cl)c1cccc(Br)c1 ZINC000073632037 571201078 /nfs/dbraw/zinc/20/10/78/571201078.db2.gz NJKAGXVHYLUMOP-UHFFFAOYSA-N 0 0 366.667 5.612 40 0 FKABRN Clc1cccc(-c2nnc(-c3cccc(Cl)c3Cl)o2)c1Cl ZINC000073634422 205031641 /nfs/dbraw/zinc/03/16/41/205031641.db2.gz BSCOODXKRYJKJZ-UHFFFAOYSA-N 0 0 360.027 6.017 40 0 FKABRN Clc1ccc(Cl)c(-c2nnc(-c3cc(Cl)ccc3Cl)o2)c1 ZINC000073634424 571083800 /nfs/dbraw/zinc/08/38/00/571083800.db2.gz WTBBJMVTMNNUEH-UHFFFAOYSA-N 0 0 360.027 6.017 40 0 FKABRN COc1ccc(-c2nc3c([nH]2)c(Cl)ccc3Cl)cc1Br ZINC000073634714 571083969 /nfs/dbraw/zinc/08/39/69/571083969.db2.gz MFQWKOPWNLSQMB-UHFFFAOYSA-N 0 0 372.049 5.308 40 0 FKABRN Cc1cc(-c2nc3c([nH]2)c(Cl)ccc3Cl)cc(Br)c1N ZINC000073634780 211686702 /nfs/dbraw/zinc/68/67/02/211686702.db2.gz NSHOAGCAUDKXIV-UHFFFAOYSA-N 0 0 371.065 5.190 40 0 FKABRN CCN(CC)c1ccc(-n2c3ccccc3nc2-c2cccc(N)c2)cc1 ZINC000073739980 571084084 /nfs/dbraw/zinc/08/40/84/571084084.db2.gz AIQKHNCCCNZONX-UHFFFAOYSA-N 0 0 356.473 5.121 40 0 FKABRN CCN(CC)c1ccc(-n2c3ccccc3nc2-c2ccc(C)cc2)cc1 ZINC000073739983 211687220 /nfs/dbraw/zinc/68/72/20/211687220.db2.gz ZGSKATIELMXJAM-UHFFFAOYSA-N 0 0 355.485 5.847 40 0 FKABRN CCN(CC)c1ccc(-n2c3ccccc3nc2-c2ccc(N)cc2)cc1 ZINC000073739986 571083977 /nfs/dbraw/zinc/08/39/77/571083977.db2.gz OHCIUENXHQQWOW-UHFFFAOYSA-N 0 0 356.473 5.121 40 0 FKABRN Nc1cccc(-c2nc3ccccc3n2-c2ccc(Br)cc2)c1 ZINC000073740005 221567728 /nfs/dbraw/zinc/56/77/28/221567728.db2.gz KMWGNSDQRWEUMD-UHFFFAOYSA-N 0 0 364.246 5.037 40 0 FKABRN Cc1ccc(-c2nc3ccccc3n2-c2ccc(Br)cc2)cc1 ZINC000073740006 205032044 /nfs/dbraw/zinc/03/20/44/205032044.db2.gz AQSZMLBQIGJGCL-UHFFFAOYSA-N 0 0 363.258 5.763 40 0 FKABRN Nc1ccc(-c2nc3ccccc3n2-c2ccc(Br)cc2)cc1 ZINC000073740011 205032356 /nfs/dbraw/zinc/03/23/56/205032356.db2.gz PPLQSMJTUVWATN-UHFFFAOYSA-N 0 0 364.246 5.037 40 0 FKABRN Cc1ccc(-n2c3ccccc3nc2-c2ccc(Cl)cc2)cc1Cl ZINC000073740042 205032319 /nfs/dbraw/zinc/03/23/19/205032319.db2.gz NQXPEXZJWDKRBD-UHFFFAOYSA-N 0 0 353.252 6.308 40 0 FKABRN Cc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1C ZINC000075282954 221578313 /nfs/dbraw/zinc/57/83/13/221578313.db2.gz PUXGCAQLLAAMST-UHFFFAOYSA-N 0 0 351.833 6.001 40 0 FKABRN O=C(CC(c1ccccc1)c1ccccc1)Nc1ccc(N2CCCC2)cc1 ZINC000075283093 221577507 /nfs/dbraw/zinc/57/75/07/221577507.db2.gz UNMQCJVRFXVBSF-UHFFFAOYSA-N 0 0 370.496 5.448 40 0 FKABRN O=C(Cc1ccc(F)cc1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000075283158 571202965 /nfs/dbraw/zinc/20/29/65/571202965.db2.gz GLNLIMPGZXQKAS-UHFFFAOYSA-N 0 0 355.796 5.453 40 0 FKABRN O=C(COc1ccccc1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000075283313 571084321 /nfs/dbraw/zinc/08/43/21/571084321.db2.gz GLNNCOFWXIJBTQ-UHFFFAOYSA-N 0 0 353.805 5.150 40 0 FKABRN O=C(Nc1cc(Cl)ccc1Oc1ccccc1)c1ccccc1Cl ZINC000075283522 571084430 /nfs/dbraw/zinc/08/44/30/571084430.db2.gz IGBCJVJPHHMTDW-UHFFFAOYSA-N 0 0 358.224 6.038 40 0 FKABRN Cc1ccc(OCC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1 ZINC000075283684 221577690 /nfs/dbraw/zinc/57/76/90/221577690.db2.gz GCUVMKUEXAXFTL-UHFFFAOYSA-N 0 0 367.832 5.458 40 0 FKABRN Cc1ccc(/C=C/C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1 ZINC000075285030 263425227 /nfs/dbraw/zinc/42/52/27/263425227.db2.gz XJCCLYGGNKSAET-SDNWHVSQSA-N 0 0 363.844 6.093 40 0 FKABRN O=C(CCC(=O)c1ccc(Cl)cc1)Nc1ccc(Cl)c(Cl)c1 ZINC000075288775 571084371 /nfs/dbraw/zinc/08/43/71/571084371.db2.gz SJESZJBIAGHPJE-UHFFFAOYSA-N 0 0 356.636 5.248 40 0 FKABRN O=C(CCC(=O)c1ccc(Cl)cc1)Nc1cc(Cl)cc(Cl)c1 ZINC000075288781 263425234 /nfs/dbraw/zinc/42/52/34/263425234.db2.gz WZVDTSAZJGQCSE-UHFFFAOYSA-N 0 0 356.636 5.248 40 0 FKABRN CC(C)Oc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1 ZINC000075289806 571084377 /nfs/dbraw/zinc/08/43/77/571084377.db2.gz DKBPRRFLVHGYNP-UHFFFAOYSA-N 0 0 357.759 5.398 40 0 FKABRN Clc1ccc(CSc2nnc(Cc3ccc(Cl)cc3)o2)cc1 ZINC000075342215 570870393 /nfs/dbraw/zinc/87/03/93/570870393.db2.gz ITMCKABATFPTBG-UHFFFAOYSA-N 0 0 351.258 5.260 40 0 FKABRN Clc1ccc(Cc2nnc(SCc3ccccc3Cl)o2)cc1 ZINC000075342216 570870512 /nfs/dbraw/zinc/87/05/12/570870512.db2.gz AJDODHDGRLBKGW-UHFFFAOYSA-N 0 0 351.258 5.260 40 0 FKABRN CCn1c(SCCCc2ccccc2)nnc1-c1ccc(Cl)cc1 ZINC000075344413 570870587 /nfs/dbraw/zinc/87/05/87/570870587.db2.gz WMSXRHPXOWQQHW-UHFFFAOYSA-N 0 0 357.910 5.343 40 0 FKABRN CCCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(C)cc1 ZINC000075344415 570870525 /nfs/dbraw/zinc/87/05/25/570870525.db2.gz HURQXEFWZXGBGH-UHFFFAOYSA-N 0 0 357.910 5.788 40 0 FKABRN Brc1ccc(-c2cc3ccc(Br)cc3[nH]2)cc1 ZINC000077284773 571205872 /nfs/dbraw/zinc/20/58/72/571205872.db2.gz JCJZRKBSYWJRTE-UHFFFAOYSA-N 0 0 351.041 5.360 40 0 in-vitro FKABRN C[C@H](c1cccc2ccccc21)N(O)CCCc1cccc(C(F)(F)F)c1 ZINC000077285917 571205938 /nfs/dbraw/zinc/20/59/38/571205938.db2.gz NNDFTKSSGCGZLY-MRXNPFEDSA-N 0 0 373.418 6.244 40 0 in-vitro FKABRN COc1ccc(-c2cc(Cl)nc(-c3ccc(Cl)cc3)n2)cc1OC ZINC000078401187 571216171 /nfs/dbraw/zinc/21/61/71/571216171.db2.gz SDIUBOYVHKHXGH-UHFFFAOYSA-N 0 0 361.228 5.135 40 0 FKABRN Fc1ccc(-c2nc(Cl)cc(-c3ccc(Br)cc3)n2)cc1 ZINC000078401199 221658336 /nfs/dbraw/zinc/65/83/36/221658336.db2.gz ITMNFGVPKCZBMH-UHFFFAOYSA-N 0 0 363.617 5.366 40 0 FKABRN COc1ccc(-c2cc(Cl)nc(-c3cccc(Cl)c3)n2)cc1OC ZINC000078401254 571216190 /nfs/dbraw/zinc/21/61/90/571216190.db2.gz GHNCHURYOXIUIU-UHFFFAOYSA-N 0 0 361.228 5.135 40 0 FKABRN COc1ccc(-c2nc(Cl)cc(-c3ccc(Cl)cc3)n2)cc1OC ZINC000078401302 221658075 /nfs/dbraw/zinc/65/80/75/221658075.db2.gz OVWDCXBANQJUEY-UHFFFAOYSA-N 0 0 361.228 5.135 40 0 FKABRN Clc1cc(-c2ccc(Br)cc2)nc(Cc2ccccc2)n1 ZINC000078401350 571216234 /nfs/dbraw/zinc/21/62/34/571216234.db2.gz YZBASVAIEHYPBV-UHFFFAOYSA-N 0 0 359.654 5.150 40 0 FKABRN Cc1cc(Nc2ccc(C(=O)[O-])cc2)c2cc(Oc3ccccc3)ccc2[nH+]1 ZINC000078401719 571216260 /nfs/dbraw/zinc/21/62/60/571216260.db2.gz FGVJEJVLAASBNU-UHFFFAOYSA-N 0 0 370.408 5.777 40 0 FKABRN Cc1cc(Nc2cccc(C(=O)[O-])c2)c2cc(Oc3ccccc3)ccc2[nH+]1 ZINC000078401722 571216187 /nfs/dbraw/zinc/21/61/87/571216187.db2.gz LHPDOGXAMCWBCE-UHFFFAOYSA-N 0 0 370.408 5.777 40 0 FKABRN Cc1cc(Nc2ccccc2C(=O)[O-])c2cc(Oc3ccccc3)ccc2[nH+]1 ZINC000078401725 571216173 /nfs/dbraw/zinc/21/61/73/571216173.db2.gz DHSPPHAKZVTEJG-UHFFFAOYSA-N 0 0 370.408 5.777 40 0 FKABRN Clc1cnc2oc(-c3cccc4c(Br)cccc34)nc2c1 ZINC000078406972 210212395 /nfs/dbraw/zinc/21/23/95/210212395.db2.gz MZLVLYUXNPDZSA-UHFFFAOYSA-N 0 0 359.610 5.459 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)c1 ZINC000078457533 526248755 /nfs/dbraw/zinc/24/87/55/526248755.db2.gz WKRAPRGIYQLWTN-OALUTQOASA-N 0 0 353.506 5.380 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)c2ccc(C)c(C)c2)c1 ZINC000078457541 526249804 /nfs/dbraw/zinc/24/98/04/526249804.db2.gz WKRAPRGIYQLWTN-RBUKOAKNSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](C)c2ccc(C)c(C)c2)c1 ZINC000078457549 526249025 /nfs/dbraw/zinc/24/90/25/526249025.db2.gz WKRAPRGIYQLWTN-MOPGFXCFSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)c2ccc(C)c(C)c2)c1 ZINC000078457556 526249729 /nfs/dbraw/zinc/24/97/29/526249729.db2.gz WKRAPRGIYQLWTN-RTBURBONSA-N 0 0 353.506 5.380 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000078457700 524022428 /nfs/dbraw/zinc/02/24/28/524022428.db2.gz VZHZHLGQPMQDLV-LJQANCHMSA-N 0 0 357.497 5.648 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1 ZINC000078457704 524043919 /nfs/dbraw/zinc/04/39/19/524043919.db2.gz VZHZHLGQPMQDLV-IBGZPJMESA-N 0 0 357.497 5.648 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000078458069 524023102 /nfs/dbraw/zinc/02/31/02/524023102.db2.gz RLVZGAWXKJFESH-IAGOWNOFSA-N 0 0 353.506 5.191 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000078458078 524044638 /nfs/dbraw/zinc/04/46/38/524044638.db2.gz RLVZGAWXKJFESH-DLBZAZTESA-N 0 0 353.506 5.191 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000078458084 524022922 /nfs/dbraw/zinc/02/29/22/524022922.db2.gz RLVZGAWXKJFESH-SJORKVTESA-N 0 0 353.506 5.191 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000078458093 524045189 /nfs/dbraw/zinc/04/51/89/524045189.db2.gz RLVZGAWXKJFESH-IRXDYDNUSA-N 0 0 353.506 5.191 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2cc(C)ccc2C(C)C)cc1 ZINC000078458235 524022794 /nfs/dbraw/zinc/02/27/94/524022794.db2.gz FOBSYSFGAZUKGG-QZTJIDSGSA-N 0 0 353.506 5.326 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2cc(C)ccc2C(C)C)cc1 ZINC000078458237 524044471 /nfs/dbraw/zinc/04/44/71/524044471.db2.gz FOBSYSFGAZUKGG-ZWKOTPCHSA-N 0 0 353.506 5.326 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)[C@H](C)Oc2cc(C)ccc2C(C)C)cc1 ZINC000078458246 524023030 /nfs/dbraw/zinc/02/30/30/524023030.db2.gz FOBSYSFGAZUKGG-MSOLQXFVSA-N 0 0 353.506 5.326 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@H](C)Oc2cc(C)ccc2C(C)C)cc1 ZINC000078458249 524044998 /nfs/dbraw/zinc/04/49/98/524044998.db2.gz FOBSYSFGAZUKGG-ROUUACIJSA-N 0 0 353.506 5.326 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1 ZINC000078458280 524023441 /nfs/dbraw/zinc/02/34/41/524023441.db2.gz ZTGBFLNPVLITNI-HZPDHXFCSA-N 0 0 359.897 5.164 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1 ZINC000078458288 524044430 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CCc1ccc([C@@H](C)NC(=O)[C@H](CC)Oc2ccc(Cl)c(C)c2)cc1 ZINC000078458628 524024227 /nfs/dbraw/zinc/02/42/27/524024227.db2.gz LVTHAMOQEJCXPZ-QRWLVFNGSA-N 0 0 359.897 5.246 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@H](CC)Oc2ccc(Cl)c(C)c2)cc1 ZINC000078458633 524045194 /nfs/dbraw/zinc/04/51/94/524045194.db2.gz LVTHAMOQEJCXPZ-YWZLYKJASA-N 0 0 359.897 5.246 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)c2cc(C)ccc2C)c1 ZINC000078458789 526249563 /nfs/dbraw/zinc/24/95/63/526249563.db2.gz ZXUAOENQBVMISB-RTBURBONSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)c2cc(C)ccc2C)c1 ZINC000078458797 526249494 /nfs/dbraw/zinc/24/94/94/526249494.db2.gz ZXUAOENQBVMISB-RBUKOAKNSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](C)c2cc(C)ccc2C)c1 ZINC000078458803 526249039 /nfs/dbraw/zinc/24/90/39/526249039.db2.gz ZXUAOENQBVMISB-MOPGFXCFSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](C)c2cc(C)ccc2C)c1 ZINC000078458807 526249059 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SCGINETYOHUIFI-SDNWHVSQSA-N 0 0 364.828 5.538 40 0 FKABRN CCOc1ccc(-c2nc(-c3cccc(N)c3)sc2C)cc1OCC ZINC000085397359 570537215 /nfs/dbraw/zinc/53/72/15/570537215.db2.gz XTRMLKBEQWERJV-UHFFFAOYSA-N 0 0 354.475 5.165 40 0 FKABRN COC(=O)c1cc(-c2csc(C)n2)ccc1OCc1ccccc1Cl ZINC000085397508 570537246 /nfs/dbraw/zinc/53/72/46/570537246.db2.gz NQTWXXCLIPYDIK-UHFFFAOYSA-N 0 0 373.861 5.138 40 0 FKABRN COC(=O)c1cc(-c2csc(C)n2)ccc1OCc1cccc(Cl)c1 ZINC000085397512 570537194 /nfs/dbraw/zinc/53/71/94/570537194.db2.gz OSCPLDCCIRLVQX-UHFFFAOYSA-N 0 0 373.861 5.138 40 0 FKABRN COC(=O)c1cc(-c2csc(C)n2)ccc1OCc1ccc(Cl)cc1 ZINC000085397516 570537242 /nfs/dbraw/zinc/53/72/42/570537242.db2.gz RMPXQELBUFHPDV-UHFFFAOYSA-N 0 0 373.861 5.138 40 0 FKABRN CCOC(=O)c1cc(-c2csc(C)n2)ccc1OCc1ccccc1F ZINC000085397549 570537237 /nfs/dbraw/zinc/53/72/37/570537237.db2.gz MSTNYLSKOJKKHL-UHFFFAOYSA-N 0 0 371.433 5.013 40 0 FKABRN CCOC(=O)c1cc(-c2csc(C)n2)ccc1OCc1cccc(F)c1 ZINC000085397552 570537641 /nfs/dbraw/zinc/53/76/41/570537641.db2.gz RUUOIWLNXQMZKZ-UHFFFAOYSA-N 0 0 371.433 5.013 40 0 FKABRN CCOC(=O)c1cc(-c2csc(C)n2)ccc1OCc1ccc(F)cc1 ZINC000085397556 570537682 /nfs/dbraw/zinc/53/76/82/570537682.db2.gz HRZHMNAOSBGPDS-UHFFFAOYSA-N 0 0 371.433 5.013 40 0 FKABRN COc1ccc(C)cc1[C@H]1CC(=O)[C@]2(C=C1C)C(C)=N[C@@]1(C)CCCC[C@H]12 ZINC000085408692 571233611 /nfs/dbraw/zinc/23/36/11/571233611.db2.gz ZGEKFEQZCLSBIE-IZSMGAQTSA-N 0 0 365.517 5.416 40 0 FKABRN COc1ccc(C)cc1[C@@H]1CC(=O)[C@@]2(C=C1C)C(C)=N[C@@]1(C)CCCC[C@@H]21 ZINC000085408697 571233700 /nfs/dbraw/zinc/23/37/00/571233700.db2.gz ZGEKFEQZCLSBIE-JIYUALFRSA-N 0 0 365.517 5.416 40 0 FKABRN COc1ccc(C)cc1[C@H]1CC(=O)[C@@]2(C=C1C)C(C)=N[C@@]1(C)CCCC[C@@H]21 ZINC000085408700 571233601 /nfs/dbraw/zinc/23/36/01/571233601.db2.gz ZGEKFEQZCLSBIE-ZKZIVCHGSA-N 0 0 365.517 5.416 40 0 FKABRN C[C@H](O)CCCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000086032894 525708657 /nfs/dbraw/zinc/70/86/57/525708657.db2.gz OMWLYFDUQMJPOS-SFHVURJKSA-N 0 0 371.480 5.577 40 0 in-vitro FKABRN C[C@@H](O)CCCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000086032898 525752075 /nfs/dbraw/zinc/75/20/75/525752075.db2.gz OMWLYFDUQMJPOS-GOSISDBHSA-N 0 0 371.480 5.577 40 0 in-vitro FKABRN CC(C)=C[C@H](O)C/C(C)=C/CCc1c2ccoc2cc2oc(=O)ccc21 ZINC000087493307 519443948 /nfs/dbraw/zinc/44/39/48/519443948.db2.gz FBBLYIUMOWEBEF-UZPPOTPCSA-N 0 0 352.430 5.135 40 0 FKABRN CC(C)=C[C@@H](O)C/C(C)=C/CCc1c2ccoc2cc2oc(=O)ccc21 ZINC000087493308 519444656 /nfs/dbraw/zinc/44/46/56/519444656.db2.gz FBBLYIUMOWEBEF-HSUWOCHWSA-N 0 0 352.430 5.135 40 0 FKABRN Cc1ccc(Br)cc1Nc1nc2ccc(Cl)cc2s1 ZINC000089065165 525987486 /nfs/dbraw/zinc/98/74/86/525987486.db2.gz KLPKZABWAKVDMI-UHFFFAOYSA-N 0 0 353.672 5.764 40 0 FKABRN CC(C)(C)OP(=O)(Cc1ccc(Br)cc1)OC(C)(C)C ZINC000090372321 571217025 /nfs/dbraw/zinc/21/70/25/571217025.db2.gz HSZRXHSJWXZFFC-UHFFFAOYSA-N 0 0 363.232 5.772 40 0 FKABRN N#COc1ccc([C@@H]2C[C@@H]3C[C@H]2[C@H]2C[C@@H](c4ccc(OC#N)cc4)C[C@H]32)cc1 ZINC000090398611 571237499 /nfs/dbraw/zinc/23/74/99/571237499.db2.gz ZYDCNZOJNSJLMS-BAQUWZKJSA-N 0 0 370.452 5.340 40 0 FKABRN N#COc1ccc([C@H]2C[C@@H]3[C@@H]4C[C@H](c5ccc(OC#N)cc5)[C@@H](C4)[C@H]3C2)cc1 ZINC000090398612 571237476 /nfs/dbraw/zinc/23/74/76/571237476.db2.gz ZYDCNZOJNSJLMS-GCRRLYLHSA-N 0 0 370.452 5.340 40 0 FKABRN N#COc1ccc([C@@H]2C[C@@H]3C[C@H]2[C@@H]2C[C@@H](c4ccc(OC#N)cc4)C[C@@H]23)cc1 ZINC000090398613 221746004 /nfs/dbraw/zinc/74/60/04/221746004.db2.gz ZYDCNZOJNSJLMS-UTQUWRQESA-N 0 0 370.452 5.340 40 0 FKABRN N#COc1ccc([C@H]2C[C@H]3[C@@H](C2)[C@@H]2C[C@H]3C[C@@H]2c2ccc(OC#N)cc2)cc1 ZINC000090398621 526490501 /nfs/dbraw/zinc/49/05/01/526490501.db2.gz ZYDCNZOJNSJLMS-YIFQJNAVSA-N 0 0 370.452 5.340 40 0 FKABRN CC(C)(C)OC(=O)N(Cc1ccccc1)c1ccc(Br)cc1 ZINC000090413403 571237494 /nfs/dbraw/zinc/23/74/94/571237494.db2.gz MKEUJYLWUDYPAQ-UHFFFAOYSA-N 0 0 362.267 5.391 40 0 FKABRN BrC1(c2cccc3ccccc32)c2ccccc2-c2ccccc21 ZINC000090470015 571237582 /nfs/dbraw/zinc/23/75/82/571237582.db2.gz XAUSBDSEEKGDSE-UHFFFAOYSA-N 0 0 371.277 6.507 40 0 FKABRN Clc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1 ZINC000090487178 208750574 /nfs/dbraw/zinc/75/05/74/208750574.db2.gz DUWBYNUKPGQYPJ-UHFFFAOYSA-N 0 0 355.868 7.477 40 0 FKABRN Clc1ccccc1/C=C1/c2ccccc2-c2ccc(Br)cc21 ZINC000090549802 205667601 /nfs/dbraw/zinc/66/76/01/205667601.db2.gz QRRHSQWZGDECJM-WQRHYEAKSA-N 0 0 367.673 6.672 40 0 FKABRN Clc1ccccc1/C=C1\c2ccccc2-c2ccc(Br)cc21 ZINC000090549804 221745533 /nfs/dbraw/zinc/74/55/33/221745533.db2.gz QRRHSQWZGDECJM-WOJGMQOQSA-N 0 0 367.673 6.672 40 0 FKABRN CC(C)CCC[C@@H](C)[C@@H]1CC[C@H]2[C@H]3C=C4C=CCC[C@]4(C)[C@@H]3CC[C@]12C ZINC000090768785 571237721 /nfs/dbraw/zinc/23/77/21/571237721.db2.gz KMOZZJKTWNSBHG-XJKWNJIDSA-N 0 0 354.622 7.804 40 0 FKABRN CC(C)CCC[C@H](C)[C@@H]1CC[C@H]2[C@H]3C=C4C=CCC[C@]4(C)[C@@H]3CC[C@]12C ZINC000090768786 571237796 /nfs/dbraw/zinc/23/77/96/571237796.db2.gz KMOZZJKTWNSBHG-CSAFWQBTSA-N 0 0 354.622 7.804 40 0 FKABRN CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H]3C=C4C=CCC[C@]4(C)[C@@H]3CC[C@]12C ZINC000090768787 571237742 /nfs/dbraw/zinc/23/77/42/571237742.db2.gz KMOZZJKTWNSBHG-IYRXRQTASA-N 0 0 354.622 7.804 40 0 FKABRN CC(C)CCC[C@H](C)[C@H]1CC[C@H]2[C@H]3C=C4C=CCC[C@]4(C)[C@@H]3CC[C@]12C ZINC000090768788 571237802 /nfs/dbraw/zinc/23/78/02/571237802.db2.gz KMOZZJKTWNSBHG-LTRSYTFFSA-N 0 0 354.622 7.804 40 0 FKABRN COc1c(Br)cc(NC(=O)OC(C)(C)C)cc1C(C)(C)C ZINC000091297084 208972397 /nfs/dbraw/zinc/97/23/97/208972397.db2.gz XCZKCIQLJARGGI-UHFFFAOYSA-N 0 0 358.276 5.102 40 0 FKABRN CCn1cc(C(=O)Nc2ccsc2[C@@H](C)CC(C)C)c(C(F)(F)F)n1 ZINC000091301184 571158820 /nfs/dbraw/zinc/15/88/20/571158820.db2.gz LSHDQQKTEZPMAM-NSHDSACASA-N 0 0 373.444 5.385 40 0 FKABRN CCn1cc(C(=O)Nc2ccsc2[C@H](C)CC(C)C)c(C(F)(F)F)n1 ZINC000091301185 221749710 /nfs/dbraw/zinc/74/97/10/221749710.db2.gz LSHDQQKTEZPMAM-LLVKDONJSA-N 0 0 373.444 5.385 40 0 FKABRN CC(=O)c1cc(C(C)C)c(OCc2ccccc2)cc1OCc1ccccc1 ZINC000091302056 518276634 /nfs/dbraw/zinc/27/66/34/518276634.db2.gz RLXQJELUJMDJFL-UHFFFAOYSA-N 0 0 374.480 6.171 40 0 FKABRN c1ccc2oc(COc3ccc(C45CC6CC(CC(C6)C4)C5)cc3)nc2c1 ZINC000095093017 570451244 /nfs/dbraw/zinc/45/12/44/570451244.db2.gz ULEYMPSNUZSNOS-UHFFFAOYSA-N 0 0 359.469 5.875 40 0 FKABRN CCOc1cc(C=O)c(Cl)cc1OCc1ccc(Cl)cc1Cl ZINC000095094976 205724382 /nfs/dbraw/zinc/72/43/82/205724382.db2.gz PYGNYJVHFUSUPK-UHFFFAOYSA-N 0 0 359.636 5.437 40 0 FKABRN CCOc1cc(C=O)c(Cl)cc1OCc1c(Cl)cccc1Cl ZINC000095094983 570813886 /nfs/dbraw/zinc/81/38/86/570813886.db2.gz VPCZBVCFOBOGAV-UHFFFAOYSA-N 0 0 359.636 5.437 40 0 FKABRN CCOc1cc(C=O)c(Cl)cc1OCc1ccc(Cl)c(Cl)c1 ZINC000095094986 570813802 /nfs/dbraw/zinc/81/38/02/570813802.db2.gz MEISPMMBHYUWHJ-UHFFFAOYSA-N 0 0 359.636 5.437 40 0 FKABRN CCOc1cc(CO)cc(Cl)c1OCc1c(Cl)cccc1Cl ZINC000095095029 209021649 /nfs/dbraw/zinc/02/16/49/209021649.db2.gz ZXGNESUJUPJYHF-UHFFFAOYSA-N 0 0 361.652 5.117 40 0 FKABRN CCOc1cc(CO)c(Cl)cc1OCc1ccc(Cl)cc1Cl ZINC000095095054 570814740 /nfs/dbraw/zinc/81/47/40/570814740.db2.gz KKTNGIYVMLPDBE-UHFFFAOYSA-N 0 0 361.652 5.117 40 0 FKABRN CCOc1cc(CO)c(Cl)cc1OCc1c(Cl)cccc1Cl ZINC000095095061 570814676 /nfs/dbraw/zinc/81/46/76/570814676.db2.gz HUIVNNRCUORDIG-UHFFFAOYSA-N 0 0 361.652 5.117 40 0 FKABRN CCOc1cc(CO)c(Cl)cc1OCc1ccc(Cl)c(Cl)c1 ZINC000095095064 209021565 /nfs/dbraw/zinc/02/15/65/209021565.db2.gz JVWNIOYWHCMZPY-UHFFFAOYSA-N 0 0 361.652 5.117 40 0 FKABRN Clc1nc2ccc(Br)cc2c(Cl)c1Br ZINC000095098200 209020783 /nfs/dbraw/zinc/02/07/83/209020783.db2.gz XBFYQQSUISYCNO-UHFFFAOYSA-N 0 0 355.844 5.067 40 0 FKABRN O=C(Nc1nc2ccc3scnc3c2s1)c1ccc2ccccc2c1 ZINC000095147726 571275982 /nfs/dbraw/zinc/27/59/82/571275982.db2.gz YAISOECYKYATLL-UHFFFAOYSA-N 0 0 361.451 5.312 40 0 FKABRN COc1ccc(C2=Nc3ccc(C(C)C)cc3C(c3ccccc3)=NN2)cc1 ZINC000095215338 221849139 /nfs/dbraw/zinc/84/91/39/221849139.db2.gz SMCBOZMTYBLGCG-UHFFFAOYSA-N 0 0 369.468 5.253 40 0 FKABRN CCCCCn1cc(C(=O)c2cccc3cc(CC)ccc32)c2ccccc21 ZINC000095215368 571328753 /nfs/dbraw/zinc/32/87/53/571328753.db2.gz GNPOOHZSCSYKPJ-UHFFFAOYSA-N 0 0 369.508 6.778 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2cc(OC)cc3ccccc32)c2ccccc21 ZINC000095215375 209021514 /nfs/dbraw/zinc/02/15/14/209021514.db2.gz MGSSAESHPAJYSC-UHFFFAOYSA-N 0 0 371.480 6.224 40 0 in-vitro FKABRN ClC(Cl)(Cl)c1nc(-c2cccc(Oc3ccccc3)c2)no1 ZINC000095471945 570643065 /nfs/dbraw/zinc/64/30/65/570643065.db2.gz JBLDOQJBNYQBOM-UHFFFAOYSA-N 0 0 355.608 5.356 40 0 FKABRN O=P[C@@]1(Cl)C2C[C@H]3C[C@@H](C2)CC1(C12CC4CC(CC(C4)C1)C2)C3 ZINC000095496253 568395058 /nfs/dbraw/zinc/39/50/58/568395058.db2.gz JIGXGTAKPFISBE-GJDZJLSASA-N 0 0 350.870 6.256 40 0 FKABRN CCCCCn1cc(C(=O)c2ccc(F)c3ccccc23)c2ccccc21 ZINC000095561015 571331554 /nfs/dbraw/zinc/33/15/54/571331554.db2.gz HDWMKVHXWFNFQW-UHFFFAOYSA-N 0 0 359.444 6.355 40 0 in-vitro FKABRN CCCCCc1cc(OC)c2cc(Cc3ccccc3OC)c(=O)oc2c1 ZINC000095578651 571331579 /nfs/dbraw/zinc/33/15/79/571331579.db2.gz VZYCAUIYIZSPQY-UHFFFAOYSA-N 0 0 366.457 5.134 40 0 in-vitro FKABRN O=C(Cc1ccc(-c2ccccc2)cc1)Nc1ccc(Br)cc1 ZINC000095582293 209082497 /nfs/dbraw/zinc/08/24/97/209082497.db2.gz BEYVMNMZCCVPFW-UHFFFAOYSA-N 0 0 366.258 5.297 40 0 FKABRN CCCCCn1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)c2ccccc21 ZINC000095704999 571331748 /nfs/dbraw/zinc/33/17/48/571331748.db2.gz MDJYHWLDDJBTMX-UHFFFAOYSA-N 0 0 364.533 5.530 40 0 in-vitro FKABRN CCC[C@H](F)Cn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21 ZINC000095705040 571331704 /nfs/dbraw/zinc/33/17/04/571331704.db2.gz GKGOOBXNSBWSAR-SFHVURJKSA-N 0 0 373.471 6.472 40 0 in-vitro FKABRN CCC[C@@H](F)Cn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21 ZINC000095705041 571331727 /nfs/dbraw/zinc/33/17/27/571331727.db2.gz GKGOOBXNSBWSAR-GOSISDBHSA-N 0 0 373.471 6.472 40 0 in-vitro FKABRN CCCCCCn1cc(C(=O)c2cccc3ccccc32)c2cc(O)ccc21 ZINC000095705064 571331710 /nfs/dbraw/zinc/33/17/10/571331710.db2.gz VEOUPNIXKBJMFF-UHFFFAOYSA-N 0 0 371.480 6.311 40 0 in-vitro FKABRN CCCCn1cc(C(=O)c2cccc3ccccc32)c2ccc(OC)cc21 ZINC000095705075 571331735 /nfs/dbraw/zinc/33/17/35/571331735.db2.gz YFQNBXNHANIAJR-UHFFFAOYSA-N 0 0 357.453 5.834 40 0 in-vitro FKABRN O=C(Nc1cccc2ccccc21)c1cn(CCCCCF)c2ccccc12 ZINC000095705085 571331702 /nfs/dbraw/zinc/33/17/02/571331702.db2.gz DJKVOBZLMBHFKX-UHFFFAOYSA-N 0 0 374.459 6.187 40 0 in-vitro FKABRN O=C(Nc1ccc2ccccc2c1)c1cn(CCCCCF)c2ccccc12 ZINC000095705086 571331716 /nfs/dbraw/zinc/33/17/16/571331716.db2.gz NQVUCORTOJUJIB-UHFFFAOYSA-N 0 0 374.459 6.187 40 0 in-vitro FKABRN O=C(c1cn(CCCCCF)c2ccccc12)C12CC3CC(CC(C3)C1)C2 ZINC000095705110 571331699 /nfs/dbraw/zinc/33/16/99/571331699.db2.gz WBLLMFXPGHZFFP-UHFFFAOYSA-N 0 0 367.508 6.180 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2cnc3ccccc3c2)c2ccccc21 ZINC000095726721 571331784 /nfs/dbraw/zinc/33/17/84/571331784.db2.gz HEHZKKPXIYMZJA-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2ccnc3ccccc32)c2ccccc21 ZINC000095726724 571331768 /nfs/dbraw/zinc/33/17/68/571331768.db2.gz SPDKRXJQAMKXNU-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2cccc3ncccc32)c2ccccc21 ZINC000095726727 571331795 /nfs/dbraw/zinc/33/17/95/571331795.db2.gz OSRRQNMXXGSCGK-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2ccc3ncccc3c2)c2ccccc21 ZINC000095726730 571331773 /nfs/dbraw/zinc/33/17/73/571331773.db2.gz KDWWTTHVTXGQLC-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2ccc3cccnc3c2)c2ccccc21 ZINC000095726732 571331816 /nfs/dbraw/zinc/33/18/16/571331816.db2.gz SUNZNQGBYFPRIB-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2cncc3ccccc32)c2ccccc21 ZINC000095726741 571331825 /nfs/dbraw/zinc/33/18/25/571331825.db2.gz JGSBWZAKRSPZEM-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2ccc3cnccc3c2)c2ccccc21 ZINC000095726744 571114464 /nfs/dbraw/zinc/11/44/64/571114464.db2.gz NFRXBKALAWDUSI-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2ccc3ccncc3c2)c2ccccc21 ZINC000095726746 571331787 /nfs/dbraw/zinc/33/17/87/571331787.db2.gz SKNIUESFTXIXQK-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)c2ccc(O)c3ccccc23)c2ccccc21 ZINC000095803970 571306723 /nfs/dbraw/zinc/30/67/23/571306723.db2.gz SVZBBFXTYNKESE-UHFFFAOYSA-N 0 0 357.453 5.921 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2cccc3cnccc32)c2ccccc21 ZINC000095803980 571331979 /nfs/dbraw/zinc/33/19/79/571331979.db2.gz GFCQZKDLFJNMPV-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Oc2cccc3ccncc32)c2ccccc21 ZINC000095803981 571331974 /nfs/dbraw/zinc/33/19/74/571331974.db2.gz FCEZWMICUGXUDA-UHFFFAOYSA-N 0 0 358.441 5.599 40 0 in-vitro FKABRN CC(C)c1cc(C=O)c(OCc2ccccc2)cc1OCc1ccccc1 ZINC000095830571 570471413 /nfs/dbraw/zinc/47/14/13/570471413.db2.gz SPNCDKLGLPWEGP-UHFFFAOYSA-N 0 0 360.453 5.781 40 0 FKABRN Brc1ccc2c(c1)c1ccccc1n2-c1cccc2ccccc21 ZINC000095830620 568478529 /nfs/dbraw/zinc/47/85/29/568478529.db2.gz QTWVKYHIDBPQIL-UHFFFAOYSA-N 0 0 372.265 6.699 40 0 FKABRN CCC[C@H](C)CCC[C@H](C)CCC[C@@H](C)CCC[C@@H](C)CCCC(C)C ZINC000095868120 570471441 /nfs/dbraw/zinc/47/14/41/570471441.db2.gz KRYOQEAJTHSPKQ-CQJMVLFOSA-N 0 0 366.718 9.668 40 0 FKABRN CCCCC[C@H](CC)OC(=O)c1ccccc1C(=O)OCc1ccccc1 ZINC000095868134 570471212 /nfs/dbraw/zinc/47/12/12/570471212.db2.gz AMJMHZXMMFYORT-IBGZPJMESA-N 0 0 368.473 5.559 40 0 FKABRN CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000095868148 570471342 /nfs/dbraw/zinc/47/13/42/570471342.db2.gz YWHWYTRNKBGSRE-HKQCOZBKSA-N 0 0 370.665 8.418 40 0 FKABRN CC(C)CCC[C@@H](C)[C@@H]1CC[C@@H]2[C@@H]3CC[C@H]4CCCC[C@]4(C)[C@H]3CC[C@@]21C ZINC000095868156 571306627 /nfs/dbraw/zinc/30/66/27/571306627.db2.gz XIIAYQZJNBULGD-BOKDSARMSA-N 0 0 372.681 8.498 40 0 FKABRN CC1(C)[C@@H]2CC[C@@]1(C)[C@H]1O[C@@H](O[C@H]3C[C@H]4[C@@H](O3)[C@@]3(C)CC[C@@H]4C3(C)C)C[C@@H]21 ZINC000095871133 570471410 /nfs/dbraw/zinc/47/14/10/570471410.db2.gz VUDXCBLBKXFCNA-HTFXFZDQSA-N 0 0 374.565 5.378 40 0 FKABRN CC1(C)[C@@H]2CC[C@@]1(C)[C@@H]1O[C@@H](O[C@H]3C[C@H]4[C@@H](O3)[C@@]3(C)CC[C@@H]4C3(C)C)C[C@@H]21 ZINC000095871135 570471436 /nfs/dbraw/zinc/47/14/36/570471436.db2.gz VUDXCBLBKXFCNA-DSGZZYCSSA-N 0 0 374.565 5.378 40 0 FKABRN Cc1ccc(C(=O)c2cn(CCC[C@@H](C)O)c3ccccc23)c2ccccc12 ZINC000095910942 571332245 /nfs/dbraw/zinc/33/22/45/571332245.db2.gz CLPJTHSXFZPIBP-GOSISDBHSA-N 0 0 371.480 5.495 40 0 in-vitro FKABRN Cc1ccc(C(=O)c2cn(CCC[C@H](C)O)c3ccccc23)c2ccccc12 ZINC000095910943 571332229 /nfs/dbraw/zinc/33/22/29/571332229.db2.gz CLPJTHSXFZPIBP-SFHVURJKSA-N 0 0 371.480 5.495 40 0 in-vitro FKABRN COc1ccccc1C(=O)c1c(CC(C)C)cc(C=O)cc1CC(C)C ZINC000095931958 221972084 /nfs/dbraw/zinc/97/20/84/221972084.db2.gz QPXMCGIYMMUZJG-UHFFFAOYSA-N 0 0 352.474 5.136 40 0 FKABRN CCn1c2ccc(C(C)=O)cc2c2cc(C(=O)c3ccc(F)cc3)ccc21 ZINC000095933575 570471660 /nfs/dbraw/zinc/47/16/60/570471660.db2.gz PIIZBUAGGCPPSE-UHFFFAOYSA-N 0 0 359.400 5.387 40 0 FKABRN C[C@@H](/C=C\c1ccc(Br)cc1)c1ccc(Br)cc1 ZINC000095934710 570471918 /nfs/dbraw/zinc/47/19/18/570471918.db2.gz ZIBMZYVKNSKPBU-DLGQBQFBSA-N 0 0 366.096 6.029 40 0 FKABRN C[C@H](/C=C\c1ccc(Br)cc1)c1ccc(Br)cc1 ZINC000095934711 221973722 /nfs/dbraw/zinc/97/37/22/221973722.db2.gz ZIBMZYVKNSKPBU-ZZKXABKFSA-N 0 0 366.096 6.029 40 0 FKABRN FC(F)(F)c1cc(Cl)c(Cc2cccnc2)cc1Br ZINC000095942417 570471884 /nfs/dbraw/zinc/47/18/84/570471884.db2.gz BORAOIRQARZEOL-UHFFFAOYSA-N 0 0 350.565 5.107 40 0 FKABRN CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCO ZINC000096024565 571334032 /nfs/dbraw/zinc/33/40/32/571334032.db2.gz IZUGLNJRCDBYKA-WMPRHZDHSA-N 0 0 373.581 5.797 40 0 in-vitro FKABRN CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)NCCO ZINC000096024566 571334041 /nfs/dbraw/zinc/33/40/41/571334041.db2.gz XZURZCGSKALDLA-JLNKQSITSA-N 0 0 373.581 5.797 40 0 in-vitro FKABRN CCCCCn1nc(C(=O)Nc2cccc3cccnc32)c2ccccc21 ZINC000096024570 571334017 /nfs/dbraw/zinc/33/40/17/571334017.db2.gz YAYIQXMTUCPLHG-UHFFFAOYSA-N 0 0 358.445 5.027 40 0 in-vitro FKABRN CCCCCn1cc(C(=O)Nc2cccc3cccnc32)c2ccccc21 ZINC000096024572 571334051 /nfs/dbraw/zinc/33/40/51/571334051.db2.gz LSDZETPTKCENTH-UHFFFAOYSA-N 0 0 357.457 5.632 40 0 in-vitro FKABRN CCCCCn1nc(C(=O)Nc2cccc3ccccc32)c2ccccc21 ZINC000096024618 571334007 /nfs/dbraw/zinc/33/40/07/571334007.db2.gz UJKHLVOEXULDRU-UHFFFAOYSA-N 0 0 357.457 5.632 40 0 in-vitro FKABRN O=C(c1nc2ccccc2n1CCCCCF)c1cccc2ccccc21 ZINC000096024656 571334043 /nfs/dbraw/zinc/33/40/43/571334043.db2.gz KUESSZMROAFKQJ-UHFFFAOYSA-N 0 0 360.432 5.560 40 0 in-vitro FKABRN O=C(c1nn(CCCCCF)c2ccccc21)c1cccc2ccccc21 ZINC000096024682 571334016 /nfs/dbraw/zinc/33/40/16/571334016.db2.gz DULWRYKFTVFPTL-UHFFFAOYSA-N 0 0 360.432 5.560 40 0 in-vitro FKABRN C[C@H](F)CCCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000096032887 571334152 /nfs/dbraw/zinc/33/41/52/571334152.db2.gz RUNACDQZPZNQMN-SFHVURJKSA-N 0 0 373.471 6.554 40 0 in-vitro FKABRN C[C@@H](F)CCCCn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000096032888 571334190 /nfs/dbraw/zinc/33/41/90/571334190.db2.gz RUNACDQZPZNQMN-GOSISDBHSA-N 0 0 373.471 6.554 40 0 in-vitro FKABRN CCN(Cc1ccccc1)C(=O)c1cc2c(c3ccccc3n2C)n1C(C)C ZINC000096037260 570472214 /nfs/dbraw/zinc/47/22/14/570472214.db2.gz DLMKAABRIUMURL-UHFFFAOYSA-N 0 0 373.500 5.376 40 0 FKABRN CCc1ccc(NC(=O)c2cc3c(c4ccccc4n3C)n2C(C)C)cc1 ZINC000096037264 209097421 /nfs/dbraw/zinc/09/74/21/209097421.db2.gz ZICLTDMYLLELMC-UHFFFAOYSA-N 0 0 359.473 5.529 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2cc3c(c4ccccc4n3C)n2C(C)C)c1 ZINC000096037266 209098573 /nfs/dbraw/zinc/09/85/73/209098573.db2.gz JEUUUXFOPVDZKL-UHFFFAOYSA-N 0 0 359.473 5.583 40 0 FKABRN Cc1cccc(NC(=O)c2cc3c(c4ccccc4n3C)n2C(C)C)c1C ZINC000096037267 209098835 /nfs/dbraw/zinc/09/88/35/209098835.db2.gz FEWSWQADMKPZNN-UHFFFAOYSA-N 0 0 359.473 5.583 40 0 FKABRN Cc1ccc(NC(=O)c2cc3c(c4ccccc4n3C)n2C(C)C)cc1C ZINC000096037268 570472161 /nfs/dbraw/zinc/47/21/61/570472161.db2.gz RWXMAZPWAJAARB-UHFFFAOYSA-N 0 0 359.473 5.583 40 0 FKABRN CC(C)n1c(C(=O)NC2CCCCCC2)cc2c1c1ccccc1n2C ZINC000096037279 570472327 /nfs/dbraw/zinc/47/23/27/570472327.db2.gz BKOCVNUIZMQWNN-UHFFFAOYSA-N 0 0 351.494 5.167 40 0 FKABRN CCN(Cc1ccccc1)C(=O)c1cc2c(c3ccccc3n2C(C)C)n1C ZINC000096037338 570472560 /nfs/dbraw/zinc/47/25/60/570472560.db2.gz ZGKITCHQGVZRGB-UHFFFAOYSA-N 0 0 373.500 5.376 40 0 FKABRN CCc1ccc(NC(=O)c2cc3c(c4ccccc4n3C(C)C)n2C)cc1 ZINC000096037345 570472565 /nfs/dbraw/zinc/47/25/65/570472565.db2.gz FXWCIVMQXXHJJP-UHFFFAOYSA-N 0 0 359.473 5.529 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2cc3c(c4ccccc4n3C(C)C)n2C)c1 ZINC000096037346 570472620 /nfs/dbraw/zinc/47/26/20/570472620.db2.gz GOPUJLNXBSYNDQ-UHFFFAOYSA-N 0 0 359.473 5.583 40 0 FKABRN Cc1cccc(NC(=O)c2cc3c(c4ccccc4n3C(C)C)n2C)c1C ZINC000096037347 205804107 /nfs/dbraw/zinc/80/41/07/205804107.db2.gz YSPAGCNJYFWSHR-UHFFFAOYSA-N 0 0 359.473 5.583 40 0 FKABRN Cc1ccc(NC(=O)c2cc3c(c4ccccc4n3C(C)C)n2C)cc1C ZINC000096037348 570472568 /nfs/dbraw/zinc/47/25/68/570472568.db2.gz HHTPIQZTKPDBCW-UHFFFAOYSA-N 0 0 359.473 5.583 40 0 FKABRN Cc1ccc(NC(=O)c2cc3c(c4ccccc4n3C(C)C)n2C)c(F)c1 ZINC000096037350 570472483 /nfs/dbraw/zinc/47/24/83/570472483.db2.gz KZHAPKJCRXUYJX-UHFFFAOYSA-N 0 0 363.436 5.414 40 0 FKABRN CC(C)n1c2cc(C(=O)NC3CCCCCC3)n(C)c2c2ccccc21 ZINC000096037359 209097624 /nfs/dbraw/zinc/09/76/24/209097624.db2.gz CFNCCGKDGGBDSI-UHFFFAOYSA-N 0 0 351.494 5.167 40 0 FKABRN Cc1cccc(NC(=O)c2cc3c(c4ccccc4n3CC3CC3)n2C)c1 ZINC000096037406 570472495 /nfs/dbraw/zinc/47/24/95/570472495.db2.gz LEVWZEANZFTLQP-UHFFFAOYSA-N 0 0 357.457 5.104 40 0 FKABRN Cc1ccccc1NC(=O)c1cc2c(c3ccccc3n2CC2CC2)n1C ZINC000096037410 221994953 /nfs/dbraw/zinc/99/49/53/221994953.db2.gz UFHILLAQAJADSV-UHFFFAOYSA-N 0 0 357.457 5.104 40 0 FKABRN CCc1ccc(NC(=O)c2cc3c(c4ccccc4n3CC3CC3)n2C)cc1 ZINC000096037411 570472741 /nfs/dbraw/zinc/47/27/41/570472741.db2.gz DVAHKYBKKBOWDM-UHFFFAOYSA-N 0 0 371.484 5.358 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2cc3c(c4ccccc4n3CC3CC3)n2C)c1 ZINC000096037412 570472617 /nfs/dbraw/zinc/47/26/17/570472617.db2.gz ISWDGDVZXACJOT-UHFFFAOYSA-N 0 0 371.484 5.412 40 0 FKABRN Cc1cccc(NC(=O)c2cc3c(c4ccccc4n3CC3CC3)n2C)c1C ZINC000096037413 570472478 /nfs/dbraw/zinc/47/24/78/570472478.db2.gz UKNHYMCYZMHUPN-UHFFFAOYSA-N 0 0 371.484 5.412 40 0 FKABRN Cc1ccc(NC(=O)c2cc3c(c4ccccc4n3CC3CC3)n2C)cc1C ZINC000096037414 209097495 /nfs/dbraw/zinc/09/74/95/209097495.db2.gz ZLRVFXMZJKIHQG-UHFFFAOYSA-N 0 0 371.484 5.412 40 0 FKABRN Cc1nc(-c2noc3ccc(C(=O)Nc4cccc(Cl)c4)cc32)cs1 ZINC000096037852 570472726 /nfs/dbraw/zinc/47/27/26/570472726.db2.gz PUUWZDNFCQQBHH-UHFFFAOYSA-N 0 0 369.833 5.165 40 0 FKABRN CCc1ccc(NC(=O)c2ccc3onc(-c4csc(C)n4)c3c2)cc1 ZINC000096037854 209098896 /nfs/dbraw/zinc/09/88/96/209098896.db2.gz GPDMVCRRPDISCO-UHFFFAOYSA-N 0 0 363.442 5.074 40 0 FKABRN CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCc1ccccc1 ZINC000096282634 222110924 /nfs/dbraw/zinc/11/09/24/222110924.db2.gz VCMMYRWIEZCYDK-PDBXOOCHSA-N 0 0 367.577 6.892 40 0 biogenic,in-vitro FKABRN CCCCC/C=C\C/C=C\CCCCCCCC(=O)NCc1ccccc1 ZINC000096282638 222110678 /nfs/dbraw/zinc/11/06/78/222110678.db2.gz YJWLCIANOBCQGW-HZJYTTRNSA-N 0 0 369.593 7.116 40 0 biogenic,in-vitro FKABRN CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC[C@H](C)O ZINC000096300366 571335160 /nfs/dbraw/zinc/33/51/60/571335160.db2.gz SHJQWWJDUAHTLY-ZVBGTZBRSA-N 0 0 359.554 5.405 40 0 in-vitro FKABRN CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NC[C@@H](C)O ZINC000096300367 571335188 /nfs/dbraw/zinc/33/51/88/571335188.db2.gz SHJQWWJDUAHTLY-DZUHFYEBSA-N 0 0 359.554 5.405 40 0 in-vitro FKABRN Cc1cc(C)cc(Oc2nnc(-c3ccc(C)c(C)c3)c3ccccc32)c1 ZINC000096305873 222113234 /nfs/dbraw/zinc/11/32/34/222113234.db2.gz ZHLXFDZHBVSVCB-UHFFFAOYSA-N 0 0 354.453 6.323 40 0 FKABRN Clc1ccc(COc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1Cl ZINC000096308063 571335214 /nfs/dbraw/zinc/33/52/14/571335214.db2.gz YLCHPGILMPKMEF-UHFFFAOYSA-N 0 0 369.251 6.116 40 0 FKABRN O=Cc1cc(-c2ccc3cc(OCc4ccccc4)ccc3c2)ccc1O ZINC000096312817 571214617 /nfs/dbraw/zinc/21/46/17/571214617.db2.gz MKVRKAYXHGYPIQ-UHFFFAOYSA-N 0 0 354.405 5.604 40 0 FKABRN CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C=CC4=CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000096328835 222115408 /nfs/dbraw/zinc/11/54/08/222115408.db2.gz SSOCUFRKNVQUCP-HKQCOZBKSA-N 0 0 368.649 8.194 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000096504005 571098784 /nfs/dbraw/zinc/09/87/84/571098784.db2.gz RSYXEDBUPHTOPH-UHFFFAOYSA-N 0 0 373.239 6.430 40 0 FKABRN O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(OCc2ccccc2)cc1 ZINC000096506438 571098713 /nfs/dbraw/zinc/09/87/13/571098713.db2.gz PVJAGXSXYBFDDS-UHFFFAOYSA-N 0 0 371.358 5.537 40 0 FKABRN O=C(Nc1ccc(Cl)cc1Cl)c1ccc(OCc2ccccc2)cc1 ZINC000096506450 571098683 /nfs/dbraw/zinc/09/86/83/571098683.db2.gz VNDCXWCPZJKABF-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN CC(C)C(=O)c1c(Br)c2ccccc2n1C(=O)OC(C)(C)C ZINC000096509781 222122946 /nfs/dbraw/zinc/12/29/46/222122946.db2.gz IAALNBGRLGMNDP-UHFFFAOYSA-N 0 0 366.255 5.026 40 0 FKABRN CC(C)C(=O)c1cccc2c1c(Br)cn2C(=O)OC(C)(C)C ZINC000096509796 222122967 /nfs/dbraw/zinc/12/29/67/222122967.db2.gz ILNLOGIKIZNWTQ-UHFFFAOYSA-N 0 0 366.255 5.026 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)CSCc1ccc(Cl)cc1Cl ZINC000096538355 222123396 /nfs/dbraw/zinc/12/33/96/222123396.db2.gz JWRYUMQUGROUFW-UHFFFAOYSA-N 0 0 374.720 5.827 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)CSCc1c(F)cccc1Cl ZINC000096538357 571098822 /nfs/dbraw/zinc/09/88/22/571098822.db2.gz AXFKVJMUBPXUFM-UHFFFAOYSA-N 0 0 358.265 5.313 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)CSCc1ccc(Cl)cc1F ZINC000096538479 222123722 /nfs/dbraw/zinc/12/37/22/222123722.db2.gz HNVXZWNQZUQYRB-UHFFFAOYSA-N 0 0 358.265 5.313 40 0 FKABRN O=C(COc1ccc2c(c1)CCCC2)Nc1ccc(Oc2ccccc2)cc1 ZINC000096586356 209156588 /nfs/dbraw/zinc/15/65/88/209156588.db2.gz MOHQBBHNLOERKO-UHFFFAOYSA-N 0 0 373.452 5.375 40 0 FKABRN C[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cc(Cl)ccc1Cl ZINC000096586409 222126208 /nfs/dbraw/zinc/12/62/08/222126208.db2.gz GLIDSOHWKURPLQ-LBPRGKRZSA-N 0 0 364.272 5.278 40 0 FKABRN C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cc(Cl)ccc1Cl ZINC000096586410 222126363 /nfs/dbraw/zinc/12/63/63/222126363.db2.gz GLIDSOHWKURPLQ-GFCCVEGCSA-N 0 0 364.272 5.278 40 0 FKABRN C[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000096586413 209155383 /nfs/dbraw/zinc/15/53/83/209155383.db2.gz AFSOFTDKCPFMEX-LBPRGKRZSA-N 0 0 364.272 5.278 40 0 FKABRN C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000096586414 570481260 /nfs/dbraw/zinc/48/12/60/570481260.db2.gz AFSOFTDKCPFMEX-GFCCVEGCSA-N 0 0 364.272 5.278 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@@H](C)Oc1ccc2c(c1)CCCC2 ZINC000096586417 570481640 /nfs/dbraw/zinc/48/16/40/570481640.db2.gz YBAPYBHPBWXZIG-MRXNPFEDSA-N 0 0 351.490 5.096 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@H](C)Oc1ccc2c(c1)CCCC2 ZINC000096586418 222126317 /nfs/dbraw/zinc/12/63/17/222126317.db2.gz YBAPYBHPBWXZIG-INIZCTEOSA-N 0 0 351.490 5.096 40 0 FKABRN Cc1ccc(CCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1C ZINC000096621735 222126177 /nfs/dbraw/zinc/12/61/77/222126177.db2.gz IAJMEDYEEYXWBX-UHFFFAOYSA-N 0 0 359.469 5.454 40 0 FKABRN CC(C)COc1ccc(C(=O)Nc2ccc(N3CCC(C)CC3)cc2)cc1 ZINC000096636112 571098769 /nfs/dbraw/zinc/09/87/69/571098769.db2.gz ZMLZIKAJBRRLML-UHFFFAOYSA-N 0 0 366.505 5.210 40 0 FKABRN CC(C)(Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 ZINC000096761798 222128949 /nfs/dbraw/zinc/12/89/49/222128949.db2.gz OGEMCGZYMFAAOD-UHFFFAOYSA-N 0 0 357.497 5.346 40 0 FKABRN O=C(c1cn(CCCCCCF)c2ccccc12)c1cccc2ccccc21 ZINC000097758814 570702145 /nfs/dbraw/zinc/70/21/45/570702145.db2.gz TVYGCQWIIHUDGL-UHFFFAOYSA-N 0 0 373.471 6.555 40 0 in-vitro FKABRN CCCC[C@H](F)Cn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000097758831 570702234 /nfs/dbraw/zinc/70/22/34/570702234.db2.gz RUJXGVGAOVOROW-IBGZPJMESA-N 0 0 373.471 6.554 40 0 in-vitro FKABRN CCCC[C@@H](F)Cn1cc(C(=O)c2cccc3ccccc32)c2ccccc21 ZINC000097758832 570702331 /nfs/dbraw/zinc/70/23/31/570702331.db2.gz RUJXGVGAOVOROW-LJQANCHMSA-N 0 0 373.471 6.554 40 0 in-vitro FKABRN CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC=CC[C@]4(C)[C@H]3CC[C@]12C ZINC000098043902 571104557 /nfs/dbraw/zinc/10/45/57/571104557.db2.gz BDJOURVDARTIRJ-HKQCOZBKSA-N 0 0 368.649 8.194 40 0 FKABRN CCCCN(CC)c1ncnc2c1c(C)cn2-c1c(C)cc(C)cc1C ZINC000098175545 209206573 /nfs/dbraw/zinc/20/65/73/209206573.db2.gz WUZMKYMGGUQSBC-UHFFFAOYSA-N 0 0 350.510 5.281 40 0 FKABRN Clc1nc(Cl)c2c(Cl)c(Cl)c(Cl)c(Cl)c2c1Cl ZINC000100028483 222232909 /nfs/dbraw/zinc/23/29/09/222232909.db2.gz BYFJWFNAVPMYST-UHFFFAOYSA-N 0 0 370.277 6.809 40 0 FKABRN Clc1nc2c(Cl)c(Cl)c(Cl)c(Cl)c2c(Cl)c1Cl ZINC000100028489 222233170 /nfs/dbraw/zinc/23/31/70/222233170.db2.gz CMWSJLNFOVKWGA-UHFFFAOYSA-N 0 0 370.277 6.809 40 0 FKABRN CCC[C@H]1CC[C@H](CC[C@H]2CC[C@H](c3cc(F)c(F)c(F)c3)CC2)CC1 ZINC000100035615 222233307 /nfs/dbraw/zinc/23/33/07/222233307.db2.gz PGBOJQDLNPQVCK-QGFMHUBQSA-N 0 0 366.511 7.764 40 0 FKABRN Cc1ccc(-c2cs/c(=N\Cc3ccccc3)n2-c2ccccc2)cc1 ZINC000100053049 222234129 /nfs/dbraw/zinc/23/41/29/222234129.db2.gz QOORWMGUXMBVCC-VHXPQNKSSA-N 0 0 356.494 5.615 40 0 FKABRN CCn1c(-c2ccc(Br)cc2)cs/c1=N/c1ccc(C)cc1 ZINC000100053128 209209134 /nfs/dbraw/zinc/20/91/34/209209134.db2.gz IOPBXWVGCLFARM-CZIZESTLSA-N 0 0 373.319 5.540 40 0 FKABRN O=C(Nc1c(Cl)cccc1Cl)C1[C@@H]2CC/C=C/CC/C=C\CC[C@H]12 ZINC000100066808 570498829 /nfs/dbraw/zinc/49/88/29/570498829.db2.gz IBBHEQXRACLNGJ-VBSDCSAUSA-N 0 0 364.316 6.261 40 0 FKABRN CCCCC[C@H]1CC[C@H]([C@H]2CO[C@H](c3ccc(F)c(F)c3)OC2)CC1 ZINC000100074553 222234424 /nfs/dbraw/zinc/23/44/24/222234424.db2.gz PXQGJCAMNTXNSQ-HHTAETPLSA-N 0 0 352.465 6.013 40 0 FKABRN Cc1c(-c2ccccc2)s/c(=N\C(=O)c2ccccc2)n1-c1ccccc1 ZINC000100109195 222235858 /nfs/dbraw/zinc/23/58/58/222235858.db2.gz WCXNUUDVDSNLSW-VHXPQNKSSA-N 0 0 370.477 5.255 40 0 FKABRN CC[C@H]1CC[C@H]([C@H]2CC[C@H](c3ccc(OC(F)(F)F)cc3)CC2)CC1 ZINC000100156658 570500386 /nfs/dbraw/zinc/50/03/86/570500386.db2.gz PBIFTROFCZATFC-USTZCAOPSA-N 0 0 354.456 7.075 40 0 FKABRN CCOc1ccc2c(c1)C(c1ccc(C)cc1)=NNC(c1ccc(C)cc1)=N2 ZINC000100251164 570759902 /nfs/dbraw/zinc/75/99/02/570759902.db2.gz DSIJIWPKYALVPW-UHFFFAOYSA-N 0 0 369.468 5.136 40 0 FKABRN COc1ccc(/N=c2/cc(-c3ccc(OC)cc3)oc3ccccc32)cc1 ZINC000100346814 222241499 /nfs/dbraw/zinc/24/14/99/222241499.db2.gz WPOZDTNLQLMWQF-FLFQWRMESA-N 0 0 357.409 5.349 40 0 FKABRN CC[C@H](Oc1cccc(C)c1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000100432206 570504288 /nfs/dbraw/zinc/50/42/88/570504288.db2.gz FRVBOPHMSZREMI-INIZCTEOSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000100432209 222244307 /nfs/dbraw/zinc/24/43/07/222244307.db2.gz FRVBOPHMSZREMI-MRXNPFEDSA-N 0 0 371.786 5.463 40 0 FKABRN O=C1O[C@H]2CCCC[C@H]2C2(CCCCC2)[C@H]1CCCCNc1ccccc1 ZINC000100743096 222250103 /nfs/dbraw/zinc/25/01/03/222250103.db2.gz OZRXHOCLDHJQJT-FSSWDIPSSA-N 0 0 369.549 5.951 40 0 FKABRN Cc1ccc(-n2c(-c3ccc(Cl)cc3)cs/c2=N\C(=O)C(C)C)cc1 ZINC000100840862 222255812 /nfs/dbraw/zinc/25/58/12/222255812.db2.gz CXIUOUWMCHQPTR-XDOYNYLZSA-N 0 0 370.905 5.251 40 0 FKABRN Cc1ccccc1/N=c1/scc(-c2ccccc2)n1-c1ccccc1C ZINC000100841002 222255413 /nfs/dbraw/zinc/25/54/13/222255413.db2.gz ULZCLLHIHQIUDB-WCWDXBQESA-N 0 0 356.494 6.055 40 0 FKABRN COc1ccc(-c2c(C)s/c(=N/c3ccccc3)n2-c2ccccc2)cc1 ZINC000100929321 222257511 /nfs/dbraw/zinc/25/75/11/222257511.db2.gz ICZZHKFEFMIYBN-WCWDXBQESA-N 0 0 372.493 5.755 40 0 FKABRN COc1ccc(-c2cs/c(=N/Cc3ccccc3)n2-c2ccccc2)cc1 ZINC000100929528 205951154 /nfs/dbraw/zinc/95/11/54/205951154.db2.gz XDLLMOGXQABNNR-WCWDXBQESA-N 0 0 372.493 5.315 40 0 FKABRN CC1=C(C)[C@H](C)[C@]2(C)N(c3ccc(Br)cc3)N=N[C@@]2(C)[C@H]1C ZINC000101043401 570871939 /nfs/dbraw/zinc/87/19/39/570871939.db2.gz AEIGMGYOVQMLSX-USJZOSNVSA-N 0 0 362.315 5.776 40 0 FKABRN CC1=C(C)[C@H](C)[C@]2(C)N(c3ccc(Br)cc3)N=N[C@]2(C)[C@H]1C ZINC000101043405 570871817 /nfs/dbraw/zinc/87/18/17/570871817.db2.gz AEIGMGYOVQMLSX-ZZCKCESHSA-N 0 0 362.315 5.776 40 0 FKABRN Cc1ccc(-n2c(C(C)(C)C)cs/c2=N\c2ccc(C)cc2C)cc1 ZINC000101143377 570547315 /nfs/dbraw/zinc/54/73/15/570547315.db2.gz DTSQLNCADLBTAF-LNVKXUELSA-N 0 0 350.531 5.994 40 0 FKABRN NC(=O)c1ccccc1/N=c1\cc(-c2ccccc2)oc2ccc(Cl)cc21 ZINC000101168606 222265408 /nfs/dbraw/zinc/26/54/08/222265408.db2.gz KKYOUUOVONQGSL-NCELDCMTSA-N 0 0 374.827 5.085 40 0 FKABRN O=C(CNc1ccccc1Oc1ccccc1)c1cc2ccccc2oc1=O ZINC000101174675 209222280 /nfs/dbraw/zinc/22/22/80/209222280.db2.gz CYUMYVPBUBNYIZ-HKWRFOASSA-N 0 0 371.392 5.554 40 0 FKABRN CCCCCCOc1ccc(/C=C2\N=C(c3cccc(F)c3)OC2=O)cc1 ZINC000101415210 206228310 /nfs/dbraw/zinc/22/83/10/206228310.db2.gz HUSVJMJTRILLKY-ZHZULCJRSA-N 0 0 367.420 5.129 40 0 FKABRN CCc1ccc(CC2=CN3C[C@H](c4ccc(Cl)cc4)N=C3S2)cc1 ZINC000101460318 209226232 /nfs/dbraw/zinc/22/62/32/209226232.db2.gz DSYHVWPBNMEZOM-LJQANCHMSA-N 0 0 354.906 5.446 40 0 FKABRN CCc1ccc(CC2=CN3C[C@@H](c4ccc(Cl)cc4)N=C3S2)cc1 ZINC000101460321 570820481 /nfs/dbraw/zinc/82/04/81/570820481.db2.gz DSYHVWPBNMEZOM-IBGZPJMESA-N 0 0 354.906 5.446 40 0 FKABRN O=C1[C@H]2CC[C@@H](c3ccccc3)C[C@@H]2C(=O)N1c1ccc(Cl)c(Cl)c1 ZINC000101464078 570764935 /nfs/dbraw/zinc/76/49/35/570764935.db2.gz COXAAIGTNDLOER-KBMXLJTQSA-N 0 0 374.267 5.067 40 0 FKABRN CCOC(=O)n1c(-c2ccc3ccccc3c2)cs/c1=N\c1ccccc1 ZINC000101544507 571070562 /nfs/dbraw/zinc/07/05/62/571070562.db2.gz OWFOUVAKMCVQET-LNVKXUELSA-N 0 0 374.465 5.607 40 0 FKABRN N#COc1ccc([C@H]2C[C@H]3[C@@H]4C[C@@H](C[C@H]4c4ccc(OC#N)cc4)[C@@H]3C2)cc1 ZINC000101789101 570513228 /nfs/dbraw/zinc/51/32/28/570513228.db2.gz ZYDCNZOJNSJLMS-OHUINNRQSA-N 0 0 370.452 5.340 40 0 FKABRN N#COc1ccc([C@@H]2C[C@H]3[C@@H]4C[C@@H](c5ccc(OC#N)cc5)[C@@H](C4)[C@H]3C2)cc1 ZINC000101789107 571306822 /nfs/dbraw/zinc/30/68/22/571306822.db2.gz ZYDCNZOJNSJLMS-MZICDQERSA-N 0 0 370.452 5.340 40 0 FKABRN CCCCC/C=C/C/C=C\CCCCCCCC(=O)NC1CCCCC1 ZINC000101988380 570871792 /nfs/dbraw/zinc/87/17/92/570871792.db2.gz OFSPDNIHQQKLPZ-KQHSAVHASA-N 0 0 361.614 7.249 40 0 FKABRN O=P[C@]1(Cl)C2C[C@H]3C[C@@H](C2)CC1(C12CC4CC(CC(C4)C1)C2)C3 ZINC000102139085 209382855 /nfs/dbraw/zinc/38/28/55/209382855.db2.gz JIGXGTAKPFISBE-AIEUBGRPSA-N 0 0 350.870 6.256 40 0 FKABRN COc1ccc(/N=c2\nc(-c3ccc(C)cc3)n(-c3ccccc3)s2)cc1 ZINC000102627251 222302867 /nfs/dbraw/zinc/30/28/67/222302867.db2.gz JYXZQYHEHNCACA-GHVJWSGMSA-N 0 0 373.481 5.150 40 0 FKABRN C[C@H]1C(O)[C@@H](C)[C@H](c2ccc(Cl)cc2)[NH2+][C@@H]1c1ccc(Cl)cc1 ZINC000102695827 222305566 /nfs/dbraw/zinc/30/55/66/222305566.db2.gz YOCSCRSTBWZYLM-PXMUBCGSSA-N 0 0 350.289 5.012 40 0 FKABRN COc1ccc(-c2cs/c(=N/C3CCCCC3)n2C2CCCCC2)cc1 ZINC000102945793 222315250 /nfs/dbraw/zinc/31/52/50/222315250.db2.gz VNCSUDYWKAPZJV-GHVJWSGMSA-N 0 0 370.562 5.964 40 0 FKABRN CCc1ccc(-c2cs/c(=N/c3ccc(C)cc3)n2CC(C)C)cc1 ZINC000102962644 222315676 /nfs/dbraw/zinc/31/56/76/222315676.db2.gz VVFOALDTCQNMNM-GHVJWSGMSA-N 0 0 350.531 5.976 40 0 FKABRN Clc1ccc(/N=c2/scc(-c3ccccc3)n2C[C@@H]2CCCO2)cc1 ZINC000102962656 222315696 /nfs/dbraw/zinc/31/56/96/222315696.db2.gz WYJOTHJYNDROQN-LQTLECTNSA-N 0 0 370.905 5.281 40 0 FKABRN Clc1ccc(/N=c2/scc(-c3ccccc3)n2C[C@H]2CCCO2)cc1 ZINC000102962658 209493472 /nfs/dbraw/zinc/49/34/72/209493472.db2.gz WYJOTHJYNDROQN-HYHOCUEZSA-N 0 0 370.905 5.281 40 0 FKABRN Fc1ccc(-c2cs/c(=N/c3ccccc3F)n2C2CCCCC2)cc1 ZINC000102962792 222317261 /nfs/dbraw/zinc/31/72/61/222317261.db2.gz KGFDZXQXFRIXNM-DARPEHSRSA-N 0 0 370.468 6.232 40 0 FKABRN Cc1ccc(NC2=C[C@H](c3ccccc3Cl)N(c3ccc(C)cc3)C2)cc1 ZINC000103753751 570771850 /nfs/dbraw/zinc/77/18/50/570771850.db2.gz NNRSYRWWAQXDLG-XMMPIXPASA-N 0 0 374.915 6.514 40 0 FKABRN Cc1ccc(NC2=C[C@@H](c3ccccc3Cl)N(c3ccc(C)cc3)C2)cc1 ZINC000103753753 570771893 /nfs/dbraw/zinc/77/18/93/570771893.db2.gz NNRSYRWWAQXDLG-DEOSSOPVSA-N 0 0 374.915 6.514 40 0 FKABRN Cc1ccc(NC2=C[C@@H](c3ccc(C)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000103764416 570772389 /nfs/dbraw/zinc/77/23/89/570772389.db2.gz HRUKIALOGDQWGF-DEOSSOPVSA-N 0 0 368.480 5.696 40 0 FKABRN Cc1ccc(NC2=C[C@H](c3ccc(C)cc3)N(c3ccc(C)cc3)C2=O)cc1 ZINC000103764419 570772212 /nfs/dbraw/zinc/77/22/12/570772212.db2.gz HRUKIALOGDQWGF-XMMPIXPASA-N 0 0 368.480 5.696 40 0 FKABRN CC(=CC(=O)Nc1ccc2ccccc2c1)Nc1ccc2ccccc2c1 ZINC000104074555 222350186 /nfs/dbraw/zinc/35/01/86/222350186.db2.gz LZWKVWAJBKAEKD-VKAVYKQESA-N 0 0 352.437 5.947 40 0 FKABRN CC1(C)c2ccccc2[C@](C)(C(Cl)(Cl)Cl)c2ccc(Cl)cc21 ZINC000104074654 209257908 /nfs/dbraw/zinc/25/79/08/209257908.db2.gz KLOARVIYAREIJR-KRWDZBQOSA-N 0 0 374.138 6.656 40 0 FKABRN CC1(C)CCC(C)(C)[C@@H]2CC3C[C@H]4[C@H](CC3C[C@H]21)C(C)(C)CCC4(C)C ZINC000104084127 209257915 /nfs/dbraw/zinc/25/79/15/209257915.db2.gz CCCFMUYCLQXOGW-CLGXJXAXSA-N 0 0 358.654 7.964 40 0 FKABRN CC1(C)CCC(C)(C)[C@@H]2CC3C[C@H]4[C@@H](CC3C[C@H]21)C(C)(C)CCC4(C)C ZINC000104084131 222351006 /nfs/dbraw/zinc/35/10/06/222351006.db2.gz CCCFMUYCLQXOGW-LXIAHWLOSA-N 0 0 358.654 7.964 40 0 FKABRN CC1(C)CCC(C)(C)[C@@H]2CC3C[C@@H]4[C@@H](CC3C[C@H]21)C(C)(C)CCC4(C)C ZINC000104084134 222350812 /nfs/dbraw/zinc/35/08/12/222350812.db2.gz CCCFMUYCLQXOGW-JZHHSBMOSA-N 0 0 358.654 7.964 40 0 FKABRN Br/C(Cc1ccccc1)=C(\Br)Cc1ccccc1 ZINC000104094766 570520209 /nfs/dbraw/zinc/52/02/09/570520209.db2.gz LGDCZULANHVHFY-NXVVXOECSA-N 0 0 366.096 5.473 40 0 FKABRN c1ccc(C(c2ccccc2)=C2CCCCCCCCCCCCC2)cc1 ZINC000104097502 209258305 /nfs/dbraw/zinc/25/83/05/209258305.db2.gz JYDJAMGOWYLPRZ-UHFFFAOYSA-N 0 0 360.585 8.573 40 0 FKABRN Clc1ccc(/C(=C(\Br)c2ccccc2)c2ccccc2)cc1 ZINC000104138376 209258320 /nfs/dbraw/zinc/25/83/20/209258320.db2.gz RKOAUGLLPKMQQD-VXPUYCOJSA-N 0 0 369.689 6.652 40 0 FKABRN Cc1ccc([C@@H]2[C@H]3C(c4ccccc4)=NC=C[C@@H](c4ccccc4)N23)cc1 ZINC000104145803 209258649 /nfs/dbraw/zinc/25/86/49/209258649.db2.gz QGYCSPJHNUOMPZ-WDGKENEZSA-N 0 0 350.465 5.478 40 0 FKABRN Cc1ccc([C@H]2[C@H]3C(c4ccccc4)=NC=C[C@@H](c4ccccc4)N23)cc1 ZINC000104145807 222351409 /nfs/dbraw/zinc/35/14/09/222351409.db2.gz QGYCSPJHNUOMPZ-UWLCSTEFSA-N 0 0 350.465 5.478 40 0 FKABRN Cc1ccc([C@@H]2[C@@H]3C(c4ccccc4)=NC=C[C@@H](c4ccccc4)N23)cc1 ZINC000104145810 209258311 /nfs/dbraw/zinc/25/83/11/209258311.db2.gz QGYCSPJHNUOMPZ-FOHCBJOKSA-N 0 0 350.465 5.478 40 0 FKABRN Cc1ccc([C@H]2[C@@H]3C(c4ccccc4)=NC=C[C@@H](c4ccccc4)N32)cc1 ZINC000104145814 209258734 /nfs/dbraw/zinc/25/87/34/209258734.db2.gz QGYCSPJHNUOMPZ-NDTJKBBYSA-N 0 0 350.465 5.478 40 0 FKABRN O=C1C[C@@H](c2ccccc2)[P@](=O)(Cc2ccccc2)C1c1ccccc1 ZINC000104183308 209259119 /nfs/dbraw/zinc/25/91/19/209259119.db2.gz MJSUUSHGYQJORK-BKMJKUGQSA-N 0 0 360.393 6.622 40 0 FKABRN O=C1C[C@@H](c2ccccc2)[P@@](=O)(Cc2ccccc2)C1c1ccccc1 ZINC000104183312 222352512 /nfs/dbraw/zinc/35/25/12/222352512.db2.gz MJSUUSHGYQJORK-NVQXNPDNSA-N 0 0 360.393 6.622 40 0 FKABRN O=C1C[C@H](c2ccccc2)[P@](=O)(Cc2ccccc2)C1c1ccccc1 ZINC000104183314 222352910 /nfs/dbraw/zinc/35/29/10/222352910.db2.gz MJSUUSHGYQJORK-ATIYNZHBSA-N 0 0 360.393 6.622 40 0 FKABRN O=C1C[C@H](c2ccccc2)[P@@](=O)(Cc2ccccc2)C1c1ccccc1 ZINC000104183317 209259844 /nfs/dbraw/zinc/25/98/44/209259844.db2.gz MJSUUSHGYQJORK-GJZUVCINSA-N 0 0 360.393 6.622 40 0 FKABRN S=c1nc(-c2ccccc2)o/c(=N\C2CCCCC2)n1C1CCCCC1 ZINC000104215312 222351966 /nfs/dbraw/zinc/35/19/66/222351966.db2.gz QRHQIOYWEQJXOH-XDOYNYLZSA-N 0 0 369.534 5.611 40 0 FKABRN ClC1(c2ccc(-c3ccccc3)cc2)c2ccccc2-c2ccccc21 ZINC000104343545 222356402 /nfs/dbraw/zinc/35/64/02/222356402.db2.gz QLMDRLRCHKICRO-UHFFFAOYSA-N 0 0 352.864 6.865 40 0 FKABRN ClC(c1ccccc1)(c1ccccc1)c1ccc(-c2ccccc2)cc1 ZINC000104343555 209260546 /nfs/dbraw/zinc/26/05/46/209260546.db2.gz MCSJNCWYTVAOCR-UHFFFAOYSA-N 0 0 354.880 6.884 40 0 FKABRN C(/C=C\c1ccc(-c2ccccc2)cc1)=C/c1ccc(-c2ccccc2)cc1 ZINC000104356252 209260615 /nfs/dbraw/zinc/26/06/15/209260615.db2.gz FNGCNIQEQUNTCR-XOHWUJONSA-N 0 0 358.484 7.747 40 0 FKABRN C(=C/c1ccc(-c2ccccc2)cc1)\C=C/c1ccc(-c2ccccc2)cc1 ZINC000104356257 222355379 /nfs/dbraw/zinc/35/53/79/222355379.db2.gz FNGCNIQEQUNTCR-FKJILZIQSA-N 0 0 358.484 7.747 40 0 FKABRN Cc1ccc(NC(C(Cl)=C(Cl)Cl)=C(Cl)[N+](=O)[O-])c(C)c1 ZINC000104817313 209262795 /nfs/dbraw/zinc/26/27/95/209262795.db2.gz 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367.470 5.100 40 0 FKABRN CC[C@H](C)Oc1ccc(/C=C2\SC(=O)N(Cc3ccccc3)C2=O)cc1 ZINC000106681943 570784754 /nfs/dbraw/zinc/78/47/54/570784754.db2.gz PYKADICYTZKAFX-CCNLRRDASA-N 0 0 367.470 5.100 40 0 FKABRN CCc1ccc(/C=C2\SC(=O)N(Cc3ccccc3Cl)C2=O)cc1 ZINC000106683550 570784722 /nfs/dbraw/zinc/78/47/22/570784722.db2.gz LJIHGGUYEDOHEW-BOPFTXTBSA-N 0 0 357.862 5.139 40 0 FKABRN O=C1S/C(=C\c2c[nH]c3ccccc23)C(=O)N1Cc1ccc(Cl)cc1 ZINC000106685313 263448937 /nfs/dbraw/zinc/44/89/37/263448937.db2.gz LIJLVMQGYBAZFB-MFOYZWKCSA-N 0 0 368.845 5.058 40 0 FKABRN O=C1S/C(=C\c2ccc(Cl)cc2)C(=O)N1Cc1ccc(Cl)cc1 ZINC000106686393 570784667 /nfs/dbraw/zinc/78/46/67/570784667.db2.gz RHQFQUYVFBJOEK-DHDCSXOGSA-N 0 0 364.253 5.230 40 0 FKABRN CC(C)c1ccc(/C=C2\SC(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1 ZINC000106686642 570784715 /nfs/dbraw/zinc/78/47/15/570784715.db2.gz ZRGYNZVITNVKGI-WQRHYEAKSA-N 0 0 371.889 5.700 40 0 FKABRN CCn1c(C)cc(/C=C2\SC(=O)N(Cc3ccccc3Cl)C2=O)c1C ZINC000106700586 570784277 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40 0 FKABRN CCOc1c(Br)cc(CNc2ccc(C)c(C)c2)cc1OC ZINC000106956470 570785144 /nfs/dbraw/zinc/78/51/44/570785144.db2.gz IFNSHTNIYVVPLV-UHFFFAOYSA-N 0 0 364.283 5.085 40 0 FKABRN CCOc1cc(CNc2ccc(F)c(Cl)c2)cc(Cl)c1OCC ZINC000106956549 570785085 /nfs/dbraw/zinc/78/50/85/570785085.db2.gz VPUSWGJRPZUDMA-UHFFFAOYSA-N 0 0 358.240 5.542 40 0 FKABRN CCOc1cc(CNc2ccc(C)c(C)c2)cc(Br)c1OC ZINC000106956573 570785142 /nfs/dbraw/zinc/78/51/42/570785142.db2.gz SIHCLKUHRFQIIG-UHFFFAOYSA-N 0 0 364.283 5.085 40 0 FKABRN CCOc1ccc2ccccc2c1CNc1ccc(Br)cc1 ZINC000106956769 263450615 /nfs/dbraw/zinc/45/06/15/263450615.db2.gz KCPUWWZXMFGPTK-UHFFFAOYSA-N 0 0 356.263 5.613 40 0 FKABRN CCOc1c(Cl)cc(CNc2ccc(Cl)c(Cl)c2)cc1OC ZINC000106956972 570785101 /nfs/dbraw/zinc/78/51/01/570785101.db2.gz QGRPJRIGCQACCW-UHFFFAOYSA-N 0 0 360.668 5.666 40 0 FKABRN CCOc1cc(CNc2ccc(Cl)c(Cl)c2)cc(Cl)c1OCC ZINC000106957022 570785063 /nfs/dbraw/zinc/78/50/63/570785063.db2.gz HXEIVFFQOAMHBF-UHFFFAOYSA-N 0 0 374.695 6.056 40 0 FKABRN CCOc1ccc(Br)cc1CNc1ccc(F)c(Cl)c1 ZINC000106957041 570785134 /nfs/dbraw/zinc/78/51/34/570785134.db2.gz BWIAWGPALWBIMG-UHFFFAOYSA-N 0 0 358.638 5.252 40 0 FKABRN COc1cc(CNc2ccc(C)c(C)c2)ccc1OCc1ccc(C)cc1 ZINC000106957964 263450617 /nfs/dbraw/zinc/45/06/17/263450617.db2.gz XOWSLNIIICUWHW-UHFFFAOYSA-N 0 0 361.485 5.812 40 0 FKABRN COc1cc(CNc2ccc(F)cc2)ccc1OCc1ccc(C)cc1 ZINC000106958943 570785553 /nfs/dbraw/zinc/78/55/53/570785553.db2.gz KWQJKPHVZDRJHQ-UHFFFAOYSA-N 0 0 351.421 5.334 40 0 FKABRN CCOc1cc(CNc2ccc(C)cc2)cc(Br)c1OCC ZINC000106959577 263450571 /nfs/dbraw/zinc/45/05/71/263450571.db2.gz NUGMRADQSRRAAR-UHFFFAOYSA-N 0 0 364.283 5.167 40 0 FKABRN COc1cc(CNc2ccccc2)ccc1OCc1cccc(Cl)c1 ZINC000106960447 570785538 /nfs/dbraw/zinc/78/55/38/570785538.db2.gz AYSHMMCDSWPBRD-UHFFFAOYSA-N 0 0 353.849 5.540 40 0 FKABRN COc1cc(CNc2ccc(C)cc2)ccc1OCc1cccc(Cl)c1 ZINC000106960705 263450576 /nfs/dbraw/zinc/45/05/76/263450576.db2.gz GWNXSWPOIVCZJI-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN 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Clc1ccc(COc2ccc3ccccc3c2CNc2ccccc2)cc1 ZINC000106970698 570786210 /nfs/dbraw/zinc/78/62/10/570786210.db2.gz LOCMGRGRMGVGGX-UHFFFAOYSA-N 0 0 373.883 6.684 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccc(Cl)cc3)c2)cc1Cl ZINC000106970816 570786274 /nfs/dbraw/zinc/78/62/74/570786274.db2.gz CQYADBZSTMIIPV-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCOc1cc(CNc2ccc(Cl)cc2Cl)cc(Cl)c1OC ZINC000106970848 263450575 /nfs/dbraw/zinc/45/05/75/263450575.db2.gz IQIJLBCGPQIFGI-UHFFFAOYSA-N 0 0 360.668 5.666 40 0 FKABRN Clc1ccc(NCc2ccc(OCc3ccccc3)cc2)c(Cl)c1 ZINC000106970899 263450609 /nfs/dbraw/zinc/45/06/09/263450609.db2.gz CVUYJCHGVUUVBD-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccc(Cl)cc3)cc2)cc1Cl ZINC000106971037 570786228 /nfs/dbraw/zinc/78/62/28/570786228.db2.gz FOTWOANCZKZFTO-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccccc3F)c2)cc1Cl ZINC000106971080 263450611 /nfs/dbraw/zinc/45/06/11/263450611.db2.gz OJZPPVNDKBEJRY-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCOc1c(Cl)cc(CNc2ccc(Cl)cc2Cl)cc1OC ZINC000106971105 570786199 /nfs/dbraw/zinc/78/61/99/570786199.db2.gz AVPOLQXNTFJIEO-UHFFFAOYSA-N 0 0 360.668 5.666 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3Cl)cc2)cc1Cl ZINC000106971262 570786296 /nfs/dbraw/zinc/78/62/96/570786296.db2.gz AXCQFHALASBJCF-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2)cc1Cl ZINC000106971328 263450583 /nfs/dbraw/zinc/45/05/83/263450583.db2.gz CAKBJTMYFGJTRW-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccccc3Cl)c2)cc1Cl ZINC000106971433 570786233 /nfs/dbraw/zinc/78/62/33/570786233.db2.gz CDIYPIYPVDAQJH-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN COc1cc(CNc2ccc(F)cc2)ccc1OCc1ccc(F)cc1 ZINC000106971697 570786684 /nfs/dbraw/zinc/78/66/84/570786684.db2.gz YMUIWORGMQJFGS-UHFFFAOYSA-N 0 0 355.384 5.165 40 0 FKABRN CCOc1cc(CNc2ccc(C)c(Cl)c2)cc(Cl)c1OCC ZINC000106971833 570786658 /nfs/dbraw/zinc/78/66/58/570786658.db2.gz OKIXNGCLQFTCEZ-UHFFFAOYSA-N 0 0 354.277 5.711 40 0 FKABRN CCOc1cc(CNc2ccc(Cl)cc2Cl)cc(Cl)c1OCC ZINC000106971836 570786694 /nfs/dbraw/zinc/78/66/94/570786694.db2.gz VUNBFIIUVLTVQC-UHFFFAOYSA-N 0 0 374.695 6.056 40 0 FKABRN COc1cc(CNc2ccc(C)c(Cl)c2)ccc1OCc1ccccc1 ZINC000106971882 570786670 /nfs/dbraw/zinc/78/66/70/570786670.db2.gz IMGWTBIIIVFJNY-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN Clc1ccc(NCc2ccccc2OCc2ccccc2)c(Cl)c1 ZINC000106971970 263450580 /nfs/dbraw/zinc/45/05/80/263450580.db2.gz WHAGVGWDTYTJMA-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2ccc(Cl)cc2)cc1Cl ZINC000106972081 570786533 /nfs/dbraw/zinc/78/65/33/570786533.db2.gz GOSSBKGURAIQLW-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2ccc(F)cc2)cc1Cl ZINC000106972107 570786717 /nfs/dbraw/zinc/78/67/17/570786717.db2.gz AUNVAJLZYRLVRU-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Clc1ccc(NCc2cccc(OCc3ccccc3)c2)c(Cl)c1 ZINC000106972114 570786645 /nfs/dbraw/zinc/78/66/45/570786645.db2.gz PNXQLECGEVATQL-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2ccccc2Cl)cc1Cl ZINC000106972268 570786691 /nfs/dbraw/zinc/78/66/91/570786691.db2.gz NYSWIOJDWNCAPP-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2ccccc2F)cc1Cl ZINC000106972286 263450726 /nfs/dbraw/zinc/45/07/26/263450726.db2.gz VFQNRKMIEDQBQZ-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccc(F)cc3)c2)cc1Cl ZINC000106972299 570786639 /nfs/dbraw/zinc/78/66/39/570786639.db2.gz LNCYVLSLRVLAFK-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(COc2ccc(CNc3ccc(F)c(Cl)c3)cc2)cc1 ZINC000106974002 570786673 /nfs/dbraw/zinc/78/66/73/570786673.db2.gz HBCVAJFWNGEEAS-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(COc2ccc3ccccc3c2CNc2ccc(F)cc2)cc1 ZINC000106974034 570786642 /nfs/dbraw/zinc/78/66/42/570786642.db2.gz CRSQICXFNLYYJD-UHFFFAOYSA-N 0 0 371.455 6.478 40 0 FKABRN Cc1ccc(COc2cccc(CNc3ccc(C)c(Cl)c3)c2)cc1 ZINC000106974272 570786606 /nfs/dbraw/zinc/78/66/06/570786606.db2.gz TZWMNYGMMBNZNM-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(COc2c(Cl)cc(Cl)cc2CNc2ccccc2)cc1 ZINC000106974341 570786597 /nfs/dbraw/zinc/78/65/97/570786597.db2.gz HLDSHKGIPYGZOR-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2cccc(CNc3ccc(Cl)cc3Cl)c2)cc1 ZINC000106974366 263450608 /nfs/dbraw/zinc/45/06/08/263450608.db2.gz DKIIQZNWRJYRGC-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2cccc(CNc3ccc(Cl)c(Cl)c3)c2)cc1 ZINC000106974445 570786705 /nfs/dbraw/zinc/78/67/05/570786705.db2.gz DJPVNMUTVNUNRV-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccccc2CNc2ccc(C)c(Cl)c2)cc1 ZINC000106974668 570786539 /nfs/dbraw/zinc/78/65/39/570786539.db2.gz MOYQYMKWPXCBPM-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(COc2ccccc2CNc2ccc(Cl)c(Cl)c2)cc1 ZINC000106974742 570786612 /nfs/dbraw/zinc/78/66/12/570786612.db2.gz XOCAZXFMUJJRTB-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccccc2CNc2ccc(Cl)cc2Cl)cc1 ZINC000106974746 570786701 /nfs/dbraw/zinc/78/67/01/570786701.db2.gz ITEUIHCYTSZBEG-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccc3ccccc3c2CNc2ccccc2)cc1 ZINC000106974863 263450616 /nfs/dbraw/zinc/45/06/16/263450616.db2.gz MDVIODWWYXPOGA-UHFFFAOYSA-N 0 0 353.465 6.339 40 0 FKABRN Cc1ccc(COc2ccc3ccccc3c2CNc2ccc(C)cc2)cc1 ZINC000106974866 570786636 /nfs/dbraw/zinc/78/66/36/570786636.db2.gz DHTCPLDJEUMPMS-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN Cc1ccc(COc2cccc(CNc3ccc(F)c(Cl)c3)c2)cc1 ZINC000106974879 570786603 /nfs/dbraw/zinc/78/66/03/570786603.db2.gz JNGSYAYKCFMKSM-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(COc2ccc(CNc3ccc(C)c(Cl)c3)cc2)cc1 ZINC000106974941 570786625 /nfs/dbraw/zinc/78/66/25/570786625.db2.gz SEVZCPCMBCFTEF-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(COc2ccc(CNc3ccc(Cl)c(Cl)c3)cc2)cc1 ZINC000106975026 263450604 /nfs/dbraw/zinc/45/06/04/263450604.db2.gz QCSWDUKKUAWRJJ-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccc(CNc3ccc(Cl)cc3Cl)cc2)cc1 ZINC000106975032 263450691 /nfs/dbraw/zinc/45/06/91/263450691.db2.gz HPZYBKAFAGRXHZ-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccccc2CNc2ccc(F)c(Cl)c2)cc1 ZINC000106975222 263450721 /nfs/dbraw/zinc/45/07/21/263450721.db2.gz ZIBUGGHDVYUAGP-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCOc1cc(CNc2ccc(C)cc2)ccc1OCc1ccc(C)cc1 ZINC000106975391 570786711 /nfs/dbraw/zinc/78/67/11/570786711.db2.gz CGWRBEWZRXHPRL-UHFFFAOYSA-N 0 0 361.485 5.893 40 0 FKABRN COc1c(Cl)cc(CNc2ccc(Cl)cc2Cl)cc1Cl ZINC000106975629 570786620 /nfs/dbraw/zinc/78/66/20/570786620.db2.gz IRJUDSXHXPJWIO-UHFFFAOYSA-N 0 0 351.060 5.921 40 0 FKABRN CCCOc1ccc(Cl)cc1CNc1ccc(Br)cc1 ZINC000106975771 570786707 /nfs/dbraw/zinc/78/67/07/570786707.db2.gz RUVIDTNPIGCONC-UHFFFAOYSA-N 0 0 354.675 5.503 40 0 FKABRN Clc1ccc(NCc2ccc(OCc3cccc(Cl)c3)cc2)cc1 ZINC000106977040 570786696 /nfs/dbraw/zinc/78/66/96/570786696.db2.gz YAAJGBYCTRATBS-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN COc1ccc(NCc2ccc(OCc3cccc(Cl)c3)cc2)cc1 ZINC000106977147 570786577 /nfs/dbraw/zinc/78/65/77/570786577.db2.gz IOGLQNQYRLZFSI-UHFFFAOYSA-N 0 0 353.849 5.540 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3cccc(Cl)c3)cc2)cc1C ZINC000106977262 570786699 /nfs/dbraw/zinc/78/66/99/570786699.db2.gz TXQKLFIUSTUHQT-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3cccc(Cl)c3)cc2)cc1Cl ZINC000106977929 570786709 /nfs/dbraw/zinc/78/67/09/570786709.db2.gz MHKXLEGKBVFCGN-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Brc1cc(CNc2ccccc2)ccc1OCc1ccccc1 ZINC000106978572 263450735 /nfs/dbraw/zinc/45/07/35/263450735.db2.gz LHPCLBMSTAQETA-UHFFFAOYSA-N 0 0 368.274 5.640 40 0 FKABRN CCOc1ccc(CNc2ccc(F)c(Cl)c2)cc1Br ZINC000106978683 570786653 /nfs/dbraw/zinc/78/66/53/570786653.db2.gz JWLCQXGDBPPHDP-UHFFFAOYSA-N 0 0 358.638 5.252 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3)c(Cl)c2)cc1Cl ZINC000106978934 570786586 /nfs/dbraw/zinc/78/65/86/570786586.db2.gz IBUUSKWMWWPEQR-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCOc1c(Cl)cc(CNc2ccc(Cl)c(Cl)c2)cc1Cl ZINC000106979467 570786615 /nfs/dbraw/zinc/78/66/15/570786615.db2.gz CPUBOKLMAYBPNT-UHFFFAOYSA-N 0 0 365.087 6.311 40 0 FKABRN Clc1ccc(NCc2ccc(OCc3ccccc3)c(Cl)c2)cc1 ZINC000106979863 570786727 /nfs/dbraw/zinc/78/67/27/570786727.db2.gz QOXPBPMZXZXCJG-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN CCOc1c(Cl)cc(CNc2ccc(Cl)cc2Cl)cc1Cl ZINC000106980014 570786718 /nfs/dbraw/zinc/78/67/18/570786718.db2.gz CGSSYBZIUGLUEK-UHFFFAOYSA-N 0 0 365.087 6.311 40 0 FKABRN COc1ccc(NCc2ccc(OCc3ccccc3)c(Cl)c2)cc1 ZINC000106980088 570786630 /nfs/dbraw/zinc/78/66/30/570786630.db2.gz UEGIMQIGBKFGFM-UHFFFAOYSA-N 0 0 353.849 5.540 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3)c(Cl)c2)cc1C ZINC000106980091 570786650 /nfs/dbraw/zinc/78/66/50/570786650.db2.gz VXTPNGUFLZWOSE-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCOc1ccc(CNc2ccc(C)c(Cl)c2)cc1Br ZINC000106980285 570786686 /nfs/dbraw/zinc/78/66/86/570786686.db2.gz NTAGPNUZJXEICB-UHFFFAOYSA-N 0 0 354.675 5.422 40 0 FKABRN COc1cc(CNc2ccccc2)cc(Cl)c1OCc1ccc(C)cc1 ZINC000106982358 570786560 /nfs/dbraw/zinc/78/65/60/570786560.db2.gz TUMIHFPOPMDRAJ-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN Clc1cc(CNc2ccccc2)cc(Cl)c1OCc1ccccc1 ZINC000106982656 570786647 /nfs/dbraw/zinc/78/66/47/570786647.db2.gz LMVQJFIFTPGXBW-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2cc(Cl)c(OCc3ccccc3)c(Cl)c2)cc1 ZINC000106982662 570786720 /nfs/dbraw/zinc/78/67/20/570786720.db2.gz GQDDBBIYPMMMOD-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccc(Cl)cc2CNc2ccc(C)cc2)cc1 ZINC000106982843 263450622 /nfs/dbraw/zinc/45/06/22/263450622.db2.gz RSYZGMXWLNBMGI-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN COc1ccc(NCc2cc(Cl)ccc2OCc2ccc(C)cc2)cc1 ZINC000106983073 570786715 /nfs/dbraw/zinc/78/67/15/570786715.db2.gz MTMAOYWFSMTDAI-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN Cc1ccc(COc2ccc(Cl)cc2CNc2ccc(C)c(C)c2)cc1 ZINC000106983215 263450723 /nfs/dbraw/zinc/45/07/23/263450723.db2.gz RUZSVKGMKQJYIK-UHFFFAOYSA-N 0 0 365.904 6.456 40 0 FKABRN Cc1ccc(COc2ccc(Cl)cc2CNc2ccc(F)cc2)cc1 ZINC000106983536 263450620 /nfs/dbraw/zinc/45/06/20/263450620.db2.gz CLQWBJKQOOHCRA-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CC(C)Oc1ccc2ccccc2c1CNc1ccc(Cl)cc1Cl ZINC000106989986 570786663 /nfs/dbraw/zinc/78/66/63/570786663.db2.gz RIDYARHWOXKDBZ-UHFFFAOYSA-N 0 0 360.284 6.546 40 0 FKABRN CCCOc1c(Br)cc(CNc2ccccc2)cc1OCC ZINC000106992388 570787002 /nfs/dbraw/zinc/78/70/02/570787002.db2.gz QTBKFYHRTBMNCA-UHFFFAOYSA-N 0 0 364.283 5.249 40 0 FKABRN CCCOc1ccc2ccccc2c1CNc1ccc(Cl)cc1Cl ZINC000106992580 570786972 /nfs/dbraw/zinc/78/69/72/570786972.db2.gz ZNPVZYMYGBNKBY-UHFFFAOYSA-N 0 0 360.284 6.548 40 0 FKABRN CCCOc1c(Cl)cc(CNc2ccc(F)c(Cl)c2)cc1OC ZINC000106992981 263450614 /nfs/dbraw/zinc/45/06/14/263450614.db2.gz KTBGJTWKUKXUIH-UHFFFAOYSA-N 0 0 358.240 5.542 40 0 FKABRN CCCOc1c(Cl)cc(CNc2ccc(C)c(Cl)c2)cc1OC ZINC000106992988 570787086 /nfs/dbraw/zinc/78/70/86/570787086.db2.gz YTGROSYUZXPNPN-UHFFFAOYSA-N 0 0 354.277 5.711 40 0 FKABRN CCCOc1c(Cl)cc(CNc2ccc(Cl)cc2Cl)cc1OC ZINC000106993078 570786983 /nfs/dbraw/zinc/78/69/83/570786983.db2.gz ZOXQLQDISXIVNB-UHFFFAOYSA-N 0 0 374.695 6.056 40 0 FKABRN CCCOc1c(Cl)cc(Cl)cc1CNc1ccc(C)c(Cl)c1 ZINC000106993132 570787113 /nfs/dbraw/zinc/78/71/13/570787113.db2.gz AOFRWTGCJHAQNW-UHFFFAOYSA-N 0 0 358.696 6.356 40 0 FKABRN CCCOc1ccc2ccccc2c1CNc1ccc(Br)cc1 ZINC000106993408 570787059 /nfs/dbraw/zinc/78/70/59/570787059.db2.gz CIIICNVSRJCAKE-UHFFFAOYSA-N 0 0 370.290 6.003 40 0 FKABRN CCCOc1c(Br)cc(CNc2ccc(C)cc2)cc1OC ZINC000106993528 570787109 /nfs/dbraw/zinc/78/71/09/570787109.db2.gz SQZOULBBFMTHLY-UHFFFAOYSA-N 0 0 364.283 5.167 40 0 FKABRN CCCOc1c(Cl)cc(CNc2ccc(Cl)c(Cl)c2)cc1OC ZINC000106993818 570787119 /nfs/dbraw/zinc/78/71/19/570787119.db2.gz OWHZZCSRJGYQQK-UHFFFAOYSA-N 0 0 374.695 6.056 40 0 FKABRN CCCOc1c(Cl)cc(CNc2ccc(F)c(Cl)c2)cc1OCC ZINC000106993919 570787029 /nfs/dbraw/zinc/78/70/29/570787029.db2.gz JMXYMZHHYWYPPH-UHFFFAOYSA-N 0 0 372.267 5.932 40 0 FKABRN CCCOc1c(Cl)cc(CNc2ccc(C)c(Cl)c2)cc1OCC ZINC000106993922 570787124 /nfs/dbraw/zinc/78/71/24/570787124.db2.gz JWJAVLNODPTTQG-UHFFFAOYSA-N 0 0 368.304 6.101 40 0 FKABRN CCCOc1ccc(CNc2ccc(Br)cc2)cc1OCC ZINC000106994704 570787008 /nfs/dbraw/zinc/78/70/08/570787008.db2.gz JLSPVAUPNJPSSI-UHFFFAOYSA-N 0 0 364.283 5.249 40 0 FKABRN CCCOc1ccc(CNc2ccc(Cl)c(Cl)c2)cc1OCC ZINC000106994706 570786990 /nfs/dbraw/zinc/78/69/90/570786990.db2.gz UVLXROCPARMDHZ-UHFFFAOYSA-N 0 0 354.277 5.793 40 0 FKABRN S=C(NCCC1=CCCCC1)Nc1ccc(Br)c(Cl)c1 ZINC000106994838 206017902 /nfs/dbraw/zinc/01/79/02/206017902.db2.gz ADFCXEPBHPCLKD-UHFFFAOYSA-N 0 0 373.747 5.279 40 0 FKABRN CCCOc1ccc(CNc2ccc(Cl)cc2Cl)cc1OCC ZINC000106995541 570786967 /nfs/dbraw/zinc/78/69/67/570786967.db2.gz FFOQGGNIPOTKPP-UHFFFAOYSA-N 0 0 354.277 5.793 40 0 FKABRN Clc1ccc(NCc2ccccc2OCc2cccc(Cl)c2)cc1 ZINC000107019318 570787587 /nfs/dbraw/zinc/78/75/87/570787587.db2.gz OPGKMBGASUTMPO-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN COc1ccc(NCc2ccccc2OCc2cccc(Cl)c2)cc1 ZINC000107019448 570787364 /nfs/dbraw/zinc/78/73/64/570787364.db2.gz DXTFYUUGBSZNNJ-UHFFFAOYSA-N 0 0 353.849 5.540 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2cccc(Cl)c2)cc1C ZINC000107019589 570787512 /nfs/dbraw/zinc/78/75/12/570787512.db2.gz FTOYFLGZBXHJIO-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2cccc(Cl)c2)cc1Cl ZINC000107020430 570787524 /nfs/dbraw/zinc/78/75/24/570787524.db2.gz ISPWELFFWNKYQI-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3cccc(Cl)c3)c2)cc1Cl ZINC000107023248 570787397 /nfs/dbraw/zinc/78/73/97/570787397.db2.gz PBHGNCRHTOZLQG-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCOc1cc(CNc2ccccc2)ccc1OCc1cccc(Cl)c1 ZINC000107023525 570787390 /nfs/dbraw/zinc/78/73/90/570787390.db2.gz QMCRBHMPLGXSRA-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN COc1ccc(NCc2cccc(OCc3cccc(Cl)c3)c2)cc1 ZINC000107024389 570787528 /nfs/dbraw/zinc/78/75/28/570787528.db2.gz XOXGUZSMGDXAFH-UHFFFAOYSA-N 0 0 353.849 5.540 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3cccc(Cl)c3)c2)cc1C ZINC000107024519 263450581 /nfs/dbraw/zinc/45/05/81/263450581.db2.gz ZGENKBWOJVUXEY-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Clc1ccc(COc2cccc(CNc3ccccc3)c2)c(Cl)c1 ZINC000107027196 263450737 /nfs/dbraw/zinc/45/07/37/263450737.db2.gz UYYVCHUAZFYROK-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccc(Cl)cc3Cl)c2)cc1 ZINC000107027279 570787337 /nfs/dbraw/zinc/78/73/37/570787337.db2.gz ULDFUGZCVHRXGU-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Brc1ccc(NCc2cccc(OCc3ccccc3)c2)cc1 ZINC000107027531 570787553 /nfs/dbraw/zinc/78/75/53/570787553.db2.gz ZPJICRGBSWXDNS-UHFFFAOYSA-N 0 0 368.274 5.640 40 0 FKABRN Clc1ccc(NCc2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000107027556 263450680 /nfs/dbraw/zinc/45/06/80/263450680.db2.gz SBNKXOCLYJDJAP-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Clc1ccc(NCc2cccc(OCc3ccccc3)c2)cc1Cl ZINC000107027651 570787578 /nfs/dbraw/zinc/78/75/78/570787578.db2.gz IPHXEKIJQAWHAK-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccccc3Cl)c2)cc1C ZINC000107027775 570787505 /nfs/dbraw/zinc/78/75/05/570787505.db2.gz WPWGIZSCGBQPPQ-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Brc1ccc(OCc2ccccc2)c(CNc2ccccc2)c1 ZINC000107028215 570787419 /nfs/dbraw/zinc/78/74/19/570787419.db2.gz XRCYWPXFORQSJJ-UHFFFAOYSA-N 0 0 368.274 5.640 40 0 FKABRN Clc1cccc(COc2ccc3ccccc3c2CNc2ccccc2)c1 ZINC000107029079 570787547 /nfs/dbraw/zinc/78/75/47/570787547.db2.gz OZDPZBQNQJXNKW-UHFFFAOYSA-N 0 0 373.883 6.684 40 0 FKABRN Clc1ccc(NCc2ccc(OCc3ccccc3)cc2)cc1Cl ZINC000107030207 570787541 /nfs/dbraw/zinc/78/75/41/570787541.db2.gz ZDAWOEDZWIJQAQ-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Clc1cccc(COc2ccc(Cl)cc2CNc2ccccc2)c1 ZINC000107030503 570787351 /nfs/dbraw/zinc/78/73/51/570787351.db2.gz DUBLQPFBSMYEEB-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2cccc(Cl)c2)cc1 ZINC000107030506 570787469 /nfs/dbraw/zinc/78/74/69/570787469.db2.gz HRAHIHQIASCPRI-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Clc1ccc(NCc2ccc(OCc3ccccc3Cl)cc2)cc1 ZINC000107030873 570787404 /nfs/dbraw/zinc/78/74/04/570787404.db2.gz TUJGGLBFHRVDAG-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccc(Cl)cc3)cc2)cc1C ZINC000107030980 570787491 /nfs/dbraw/zinc/78/74/91/570787491.db2.gz RLMCDGGZAVTDEZ-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccc(Cl)cc3)c2)cc1C ZINC000107031085 570787462 /nfs/dbraw/zinc/78/74/62/570787462.db2.gz GOAQKJIJJFNVEG-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3Cl)cc2)cc1C ZINC000107031100 570787572 /nfs/dbraw/zinc/78/75/72/570787572.db2.gz KZPMUVATLDRTLT-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2ccc(Cl)cc2)cc1C ZINC000107031201 263450678 /nfs/dbraw/zinc/45/06/78/263450678.db2.gz ICSBCCJCFQJTFO-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN COc1cc(CNc2ccc(F)cc2)ccc1OCc1ccc(Cl)cc1 ZINC000107031206 263450572 /nfs/dbraw/zinc/45/05/72/263450572.db2.gz FSPVBQVYUSSAMH-UHFFFAOYSA-N 0 0 371.839 5.679 40 0 FKABRN Clc1ccc(COc2ccc(CNc3ccccc3)cc2)c(Cl)c1 ZINC000107031313 570787432 /nfs/dbraw/zinc/78/74/32/570787432.db2.gz KSGCCUUFWQBABB-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccc(Cl)cc3Cl)cc2)cc1 ZINC000107031316 263451156 /nfs/dbraw/zinc/45/11/56/263451156.db2.gz DHSCBYMNZIAGSW-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN COc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000107039232 570787369 /nfs/dbraw/zinc/78/73/69/570787369.db2.gz HJCAJWROBVJHAE-UHFFFAOYSA-N 0 0 353.849 5.540 40 0 FKABRN Clc1ccc(COc2ccc(Cl)cc2CNc2ccccc2)cc1 ZINC000107039354 570787424 /nfs/dbraw/zinc/78/74/24/570787424.db2.gz XHBNIPUQFQIGJH-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN Clc1ccc(OCc2ccccc2Cl)c(CNc2ccccc2)c1 ZINC000107039358 570787448 /nfs/dbraw/zinc/78/74/48/570787448.db2.gz BBZKTGGFSCONQL-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN COc1ccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)cc1 ZINC000107039365 570787567 /nfs/dbraw/zinc/78/75/67/570787567.db2.gz IELPQHDLRITOQV-UHFFFAOYSA-N 0 0 371.839 5.679 40 0 FKABRN Fc1ccc(COc2ccc(Cl)cc2CNc2ccc(F)cc2)cc1 ZINC000107039378 570787444 /nfs/dbraw/zinc/78/74/44/570787444.db2.gz XYZJBIHDKHKRAK-UHFFFAOYSA-N 0 0 359.803 5.809 40 0 FKABRN COc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2F)cc1 ZINC000107039437 570787834 /nfs/dbraw/zinc/78/78/34/570787834.db2.gz OKLSMZQGAOIOME-UHFFFAOYSA-N 0 0 371.839 5.679 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2)cc1C ZINC000107039440 263451193 /nfs/dbraw/zinc/45/11/93/263451193.db2.gz GXEGMIKGTUDVOM-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2ccc(Cl)cc2)cc1 ZINC000107039576 570787963 /nfs/dbraw/zinc/78/79/63/570787963.db2.gz XYTDOJLXCPXBQH-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2Cl)cc1 ZINC000107039580 570787778 /nfs/dbraw/zinc/78/77/78/570787778.db2.gz BLWKXIIXNDVJRO-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)cc1C ZINC000107039586 263451172 /nfs/dbraw/zinc/45/11/72/263451172.db2.gz LZTDQABERXRTLL-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)cc1 ZINC000107039653 263451233 /nfs/dbraw/zinc/45/12/33/263451233.db2.gz GOHLXSZFQQTOOV-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN 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COc1ccc(NCc2c(OCc3ccccc3)ccc3ccccc32)cc1 ZINC000107040571 570787999 /nfs/dbraw/zinc/78/79/99/570787999.db2.gz QGVBFUBBBZFDMS-UHFFFAOYSA-N 0 0 369.464 6.040 40 0 FKABRN COc1cc(CNc2ccc(C)c(C)c2)ccc1OCc1ccc(F)cc1 ZINC000107040627 570787812 /nfs/dbraw/zinc/78/78/12/570787812.db2.gz RJWFBJJZPUBAAK-UHFFFAOYSA-N 0 0 365.448 5.642 40 0 FKABRN Cc1ccc(NCc2c(OCc3ccccc3)ccc3ccccc32)cc1C ZINC000107040649 263451079 /nfs/dbraw/zinc/45/10/79/263451079.db2.gz CFQNGBWRUQTDRT-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN COc1cc(CNc2ccc(C)cc2)ccc1OCc1ccccc1F ZINC000107040782 263451122 /nfs/dbraw/zinc/45/11/22/263451122.db2.gz VAIKLYDRBHRAFJ-UHFFFAOYSA-N 0 0 351.421 5.334 40 0 FKABRN Fc1ccc(NCc2c(OCc3ccccc3)ccc3ccccc32)cc1 ZINC000107040802 570787906 /nfs/dbraw/zinc/78/79/06/570787906.db2.gz XDNVTKYUVCRGAX-UHFFFAOYSA-N 0 0 357.428 6.170 40 0 FKABRN COc1cc(CNc2ccc(F)cc2)ccc1OCc1ccccc1Cl ZINC000107040828 570788021 /nfs/dbraw/zinc/78/80/21/570788021.db2.gz CJOIKJZSOALXGX-UHFFFAOYSA-N 0 0 371.839 5.679 40 0 FKABRN 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ZINC000111454118 570805312 /nfs/dbraw/zinc/80/53/12/570805312.db2.gz BGSGLEHAUASFLQ-RGEXLXHISA-N 0 0 369.848 5.254 40 0 FKABRN Cc1ccc(C)c(NC(=O)C(=O)c2c(-c3ccccc3)cc3ccccn32)c1 ZINC000111871367 571307157 /nfs/dbraw/zinc/30/71/57/571307157.db2.gz VCXVVXMJTJQUNP-UHFFFAOYSA-N 0 0 368.436 5.045 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(F)c(Cl)c2)cc(C)c1Cl ZINC000111894581 571307112 /nfs/dbraw/zinc/30/71/12/571307112.db2.gz ICHRRNVRWXQBBC-NSHDSACASA-N 0 0 356.224 5.155 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(F)c(Cl)c2)cc(C)c1Cl ZINC000111894582 571307094 /nfs/dbraw/zinc/30/70/94/571307094.db2.gz ICHRRNVRWXQBBC-LLVKDONJSA-N 0 0 356.224 5.155 40 0 FKABRN O=C(Nc1ccc(F)c(Cl)c1)c1cc2cc(Br)ccc2o1 ZINC000111895298 571307150 /nfs/dbraw/zinc/30/71/50/571307150.db2.gz RHSOXRCFPYLOJR-UHFFFAOYSA-N 0 0 368.589 5.240 40 0 FKABRN O=C1S/C(=C/c2ccc(-c3ccccc3)cc2)C(=O)N1c1ccccc1 ZINC000113835940 263451900 /nfs/dbraw/zinc/45/19/00/263451900.db2.gz SSXVJCSAJUMABR-HMMYKYKNSA-N 0 0 357.434 5.595 40 0 FKABRN 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O=C(CSCc1c(Cl)cccc1Cl)NCc1ccc(Cl)cc1 ZINC000113933140 570826049 /nfs/dbraw/zinc/82/60/49/570826049.db2.gz DKMGVKKFKSBZHZ-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN CC(C)Oc1cccc(CNC(=O)c2cc3c(ccc4ccccc34)o2)c1 ZINC000113941175 570545392 /nfs/dbraw/zinc/54/53/92/570545392.db2.gz DTHZWDLSLGYXSD-UHFFFAOYSA-N 0 0 359.425 5.303 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H]1CCCc2ccccc21 ZINC000113950557 222502049 /nfs/dbraw/zinc/50/20/49/222502049.db2.gz CVTOBJOLLVPBBK-PKTZIBPZSA-N 0 0 359.469 5.191 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H]1CCCc2ccccc21 ZINC000113950560 209340222 /nfs/dbraw/zinc/34/02/22/209340222.db2.gz CVTOBJOLLVPBBK-DHIUTWEWSA-N 0 0 359.469 5.191 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)N[C@H]1CCCc2ccccc21 ZINC000113950563 570545687 /nfs/dbraw/zinc/54/56/87/570545687.db2.gz CVTOBJOLLVPBBK-GOTSBHOMSA-N 0 0 359.469 5.191 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@H]1CCCc2ccccc21 ZINC000113950565 209340468 /nfs/dbraw/zinc/34/04/68/209340468.db2.gz CVTOBJOLLVPBBK-XZOQPEGZSA-N 0 0 359.469 5.191 40 0 FKABRN CCCCC/C=C/C/C=C/C/C=C\C/C=C\CCCCOC(CO)CO ZINC000113962765 571307161 /nfs/dbraw/zinc/30/71/61/571307161.db2.gz CUJUUWXZAQHCNC-BJCBFJDFSA-N 0 0 364.570 5.502 40 0 FKABRN Clc1cccc(Cl)c1-c1nc2ccnc(Br)c2s1 ZINC000114602636 570839539 /nfs/dbraw/zinc/83/95/39/570839539.db2.gz HTCYWAFCOTZBLQ-UHFFFAOYSA-N 0 0 360.063 5.428 40 0 FKABRN CC(C)Sc1ccccc1C(=O)NCCOc1ccc2ccccc2c1 ZINC000115287845 570547708 /nfs/dbraw/zinc/54/77/08/570547708.db2.gz GOUSLHSWLWAVPA-UHFFFAOYSA-N 0 0 365.498 5.149 40 0 FKABRN Cc1ccc(Nc2ccc(C)cc2Br)c(Br)c1 ZINC000116251482 571307118 /nfs/dbraw/zinc/30/71/18/571307118.db2.gz ZHBZSWCIGANZSB-UHFFFAOYSA-N 0 0 355.073 5.572 40 0 FKABRN Fc1cc(Br)ccc1Nc1nc2ccc(Cl)cc2s1 ZINC000116937376 203874887 /nfs/dbraw/zinc/87/48/87/203874887.db2.gz XNUBHRGDFHGHDT-UHFFFAOYSA-N 0 0 357.635 5.595 40 0 FKABRN CC(=O)Oc1ccc(Cl)cc1/C=C\c1ccccc1Br ZINC000117756006 570874010 /nfs/dbraw/zinc/87/40/10/570874010.db2.gz RZELIUUDCHQPEY-SREVYHEPSA-N 0 0 351.627 5.198 40 0 FKABRN Ic1cc(-c2ccccc2)cc(-c2ccccc2)c1 ZINC000118269591 570509279 /nfs/dbraw/zinc/50/92/79/570509279.db2.gz LICOFADCKUKHJI-UHFFFAOYSA-N 0 0 356.206 5.625 40 0 FKABRN COC(=O)CC[C@H](C)[C@H]1CC[C@H]2[C@@H]3C=C[C@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000118914675 206102940 /nfs/dbraw/zinc/10/29/40/206102940.db2.gz PDFYDMTVIFSSKW-VYPZBVOESA-N 0 0 372.593 6.401 40 0 FKABRN COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C=C[C@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000118914677 209348292 /nfs/dbraw/zinc/34/82/92/209348292.db2.gz PDFYDMTVIFSSKW-HXNVYPELSA-N 0 0 372.593 6.401 40 0 FKABRN COC(=O)CC[C@H](C)[C@H]1CC[C@H]2[C@@H]3C=C[C@@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000118914678 570559730 /nfs/dbraw/zinc/55/97/30/570559730.db2.gz PDFYDMTVIFSSKW-CVSNRTSLSA-N 0 0 372.593 6.401 40 0 FKABRN COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3C=C[C@@H]4CCCC[C@]4(C)[C@H]3CC[C@]12C ZINC000118914680 570559611 /nfs/dbraw/zinc/55/96/11/570559611.db2.gz PDFYDMTVIFSSKW-ZXKBGTPZSA-N 0 0 372.593 6.401 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@H]4CCCC[C@@]43C)[C@@H]1CC[C@]2(O)c1ccccc1 ZINC000118914812 209349042 /nfs/dbraw/zinc/34/90/42/209349042.db2.gz GUFISKMWHBUYOH-IEHCJHDVSA-N 0 0 352.562 6.307 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@@H]4CCCC[C@@]43C)[C@@H]1CC[C@]2(O)c1ccccc1 ZINC000118914813 570559628 /nfs/dbraw/zinc/55/96/28/570559628.db2.gz GUFISKMWHBUYOH-DMOOCHNQSA-N 0 0 352.562 6.307 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@H]4CCCC[C@@]43C)[C@@H]1CC[C@@]2(O)c1ccccc1 ZINC000118914814 570559624 /nfs/dbraw/zinc/55/96/24/570559624.db2.gz GUFISKMWHBUYOH-CDAVIMALSA-N 0 0 352.562 6.307 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@@H]4CCCC[C@@]43C)[C@@H]1CC[C@@]2(O)c1ccccc1 ZINC000118914815 570559632 /nfs/dbraw/zinc/55/96/32/570559632.db2.gz GUFISKMWHBUYOH-FRSFAZTNSA-N 0 0 352.562 6.307 40 0 FKABRN CC/C=C1\CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000118914816 570559740 /nfs/dbraw/zinc/55/97/40/570559740.db2.gz PCFLWNUQAQQXOU-RVSUXUMISA-N 0 0 358.566 6.297 40 0 FKABRN 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FKABRN CC[C@]1(O)CC[C@H]2[C@@H]3CC[C@H]4C[C@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@@]21C ZINC000118914875 209348466 /nfs/dbraw/zinc/34/84/66/209348466.db2.gz XFQZMLHHLMNCGB-BCUDGRBNSA-N 0 0 362.554 5.102 40 0 FKABRN CC[C@]1(O)CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@@]21C ZINC000118914876 570559574 /nfs/dbraw/zinc/55/95/74/570559574.db2.gz XFQZMLHHLMNCGB-NZXYYOKSSA-N 0 0 362.554 5.102 40 0 FKABRN CCCO[C@@H]1CC[C@H]2[C@@H]3CC=C4CC5(CC[C@]4(C)[C@H]3CC[C@]12C)OCCO5 ZINC000118914929 570559988 /nfs/dbraw/zinc/55/99/88/570559988.db2.gz XXOMRYJCPZNLCW-FHEJEKGWSA-N 0 0 374.565 5.488 40 0 FKABRN CCCO[C@H]1CC[C@H]2[C@@H]3CC=C4CC5(CC[C@]4(C)[C@H]3CC[C@]12C)OCCO5 ZINC000118914930 570560091 /nfs/dbraw/zinc/56/00/91/570560091.db2.gz XXOMRYJCPZNLCW-LLINQDLYSA-N 0 0 374.565 5.488 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC=CC[C@@]43C)[C@@H]1CC=C2CCc1ccccc1 ZINC000118915040 570560101 /nfs/dbraw/zinc/56/01/01/570560101.db2.gz VBTNPIPMZUSOJR-ZFWJRURNSA-N 0 0 360.585 7.364 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@@H]4CC=CC[C@@]43C)[C@@H]1CC=C2CCc1ccccc1 ZINC000118915041 570560073 /nfs/dbraw/zinc/56/00/73/570560073.db2.gz VBTNPIPMZUSOJR-XMIRPNQRSA-N 0 0 360.585 7.364 40 0 FKABRN CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](C(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000118915042 209348257 /nfs/dbraw/zinc/34/82/57/209348257.db2.gz CLPGKLFDFQUHLE-RHCGTSLQSA-N 0 0 360.538 5.166 40 0 FKABRN CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@@H](C(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000118915043 222512049 /nfs/dbraw/zinc/51/20/49/222512049.db2.gz CLPGKLFDFQUHLE-QGZPSTLZSA-N 0 0 360.538 5.166 40 0 FKABRN CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](C(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000118915044 209348281 /nfs/dbraw/zinc/34/82/81/209348281.db2.gz CLPGKLFDFQUHLE-AYNVCCPXSA-N 0 0 360.538 5.166 40 0 FKABRN CC(=O)O[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](C(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C ZINC000118915045 222512215 /nfs/dbraw/zinc/51/22/15/222512215.db2.gz CLPGKLFDFQUHLE-FTQGCKHGSA-N 0 0 360.538 5.166 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CC[C@H](Oc1cc(C)ccc1C)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000216334429 222664329 /nfs/dbraw/zinc/66/43/29/222664329.db2.gz BTECYTYGTJHLLR-INIZCTEOSA-N 0 0 351.368 5.118 40 0 FKABRN O=C(NCc1ccc(F)cc1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000216337718 568118558 /nfs/dbraw/zinc/11/85/58/568118558.db2.gz KIPBHDPYSHQMMW-XSFVSMFZSA-N 0 0 365.835 5.336 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000216354681 523055365 /nfs/dbraw/zinc/05/53/65/523055365.db2.gz DMTXSHRWWFQWKQ-MGPUTAFESA-N 0 0 351.421 5.014 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000216354731 522890105 /nfs/dbraw/zinc/89/01/05/522890105.db2.gz DMTXSHRWWFQWKQ-YWZLYKJASA-N 0 0 351.421 5.014 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000216354772 523054053 /nfs/dbraw/zinc/05/40/53/523054053.db2.gz DMTXSHRWWFQWKQ-FOIQADDNSA-N 0 0 351.421 5.014 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000216354814 522888964 /nfs/dbraw/zinc/88/89/64/522888964.db2.gz DMTXSHRWWFQWKQ-QRWLVFNGSA-N 0 0 351.421 5.014 40 0 FKABRN CCc1ccc(NC(=O)c2ccc(CN3CCc4ccccc43)cc2)cc1 ZINC000216357058 568119555 /nfs/dbraw/zinc/11/95/55/568119555.db2.gz DXMPPUJLOGDQAU-UHFFFAOYSA-N 0 0 356.469 5.064 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000216361177 523050749 /nfs/dbraw/zinc/05/07/49/523050749.db2.gz UFOUUXJMNQVQGK-VQTJNVASSA-N 0 0 359.897 5.401 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000216361220 522885040 /nfs/dbraw/zinc/88/50/40/522885040.db2.gz UFOUUXJMNQVQGK-PMACEKPBSA-N 0 0 359.897 5.401 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000216361270 523050691 /nfs/dbraw/zinc/05/06/91/523050691.db2.gz UFOUUXJMNQVQGK-WOJBJXKFSA-N 0 0 359.897 5.401 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000216361316 522884199 /nfs/dbraw/zinc/88/41/99/522884199.db2.gz UFOUUXJMNQVQGK-UXHICEINSA-N 0 0 359.897 5.401 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000216366744 206357944 /nfs/dbraw/zinc/35/79/44/206357944.db2.gz YSVBPBIUCQDPQD-LBPRGKRZSA-N 0 0 352.261 5.523 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000216366787 206357390 /nfs/dbraw/zinc/35/73/90/206357390.db2.gz YSVBPBIUCQDPQD-GFCCVEGCSA-N 0 0 352.261 5.523 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)cc1Cl ZINC000216368400 568120172 /nfs/dbraw/zinc/12/01/72/568120172.db2.gz VLDXGLDCALYIKT-GOSISDBHSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)Nc1ccc(Cl)cc1Cl ZINC000216368444 568120154 /nfs/dbraw/zinc/12/01/54/568120154.db2.gz VLDXGLDCALYIKT-SFHVURJKSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000216371155 523040624 /nfs/dbraw/zinc/04/06/24/523040624.db2.gz TVJVYULGGDBIFG-PGRDOPGGSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000216371202 522871067 /nfs/dbraw/zinc/87/10/67/522871067.db2.gz TVJVYULGGDBIFG-AVRDEDQJSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000216371249 523040715 /nfs/dbraw/zinc/04/07/15/523040715.db2.gz TVJVYULGGDBIFG-XMSQKQJNSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000216371293 522872927 /nfs/dbraw/zinc/87/29/27/522872927.db2.gz TVJVYULGGDBIFG-GCJKJVERSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc(Cl)cc1 ZINC000216373941 523080981 /nfs/dbraw/zinc/08/09/81/523080981.db2.gz SOTYUYKPNPMVCA-MRXNPFEDSA-N 0 0 354.302 5.181 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc(Cl)cc1 ZINC000216373996 522919994 /nfs/dbraw/zinc/91/99/94/522919994.db2.gz SOTYUYKPNPMVCA-INIZCTEOSA-N 0 0 354.302 5.181 40 0 FKABRN CC(C)C(NC(=O)c1ccc(CN2CCCc3ccccc32)cc1)C(C)C ZINC000216375148 519548350 /nfs/dbraw/zinc/54/83/50/519548350.db2.gz XQRQJWIYVBHYOT-UHFFFAOYSA-N 0 0 364.533 5.050 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000216377312 519847809 /nfs/dbraw/zinc/84/78/09/519847809.db2.gz IZPKJDNSFAHLBT-IBGZPJMESA-N 0 0 373.496 5.483 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000216377355 519847981 /nfs/dbraw/zinc/84/79/81/519847981.db2.gz IZPKJDNSFAHLBT-LJQANCHMSA-N 0 0 373.496 5.483 40 0 FKABRN Cc1cc(C)c(C)c(O[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)c1 ZINC000216382410 568120984 /nfs/dbraw/zinc/12/09/84/568120984.db2.gz HKTYBQHMGPKJOX-AWEZNQCLSA-N 0 0 351.368 5.037 40 0 FKABRN Cc1cc(C)c(C)c(O[C@H](C)C(=O)Nc2ccccc2C(F)(F)F)c1 ZINC000216382454 222665551 /nfs/dbraw/zinc/66/55/51/222665551.db2.gz HKTYBQHMGPKJOX-CQSZACIVSA-N 0 0 351.368 5.037 40 0 FKABRN Cc1cc(Cl)ccc1NS(=O)(=O)c1ccc(Oc2ccccc2)cc1 ZINC000216383830 568121043 /nfs/dbraw/zinc/12/10/43/568121043.db2.gz OJVZPSRJTFHDGL-UHFFFAOYSA-N 0 0 373.861 5.242 40 0 FKABRN Cc1ccc(NC(=O)c2ccc(CN3CCCc4ccccc43)cc2)c(C)c1 ZINC000216412974 132271068 /nfs/dbraw/zinc/27/10/68/132271068.db2.gz VVTLFHCQIHASHF-UHFFFAOYSA-N 0 0 370.496 5.509 40 0 FKABRN CN(C(=O)c1ccc(OCCSc2ccccc2)cc1)C1CCCCC1 ZINC000216426312 568122930 /nfs/dbraw/zinc/12/29/30/568122930.db2.gz RHZDTHZYZUZJNZ-UHFFFAOYSA-N 0 0 369.530 5.262 40 0 FKABRN CC(C)(C)c1ccc(C(=O)c2cccc(NC(=O)c3cccs3)c2)cc1 ZINC000216438391 222664706 /nfs/dbraw/zinc/66/47/06/222664706.db2.gz IUDMEGXTVZWDSX-UHFFFAOYSA-N 0 0 363.482 5.529 40 0 FKABRN CCCCc1ccc(NC(=O)CCc2ccc(OCC)c(OCC)c2)cc1 ZINC000216440607 206359651 /nfs/dbraw/zinc/35/96/51/206359651.db2.gz APQZLPPQPGANMR-UHFFFAOYSA-N 0 0 369.505 5.398 40 0 FKABRN C[C@@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(F)cc1 ZINC000216454401 525325543 /nfs/dbraw/zinc/32/55/43/525325543.db2.gz JFAHNXHDJOUUNJ-MRXNPFEDSA-N 0 0 365.473 5.609 40 0 FKABRN C[C@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(F)cc1 ZINC000216454450 525211258 /nfs/dbraw/zinc/21/12/58/525211258.db2.gz JFAHNXHDJOUUNJ-INIZCTEOSA-N 0 0 365.473 5.609 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000216455538 222666516 /nfs/dbraw/zinc/66/65/16/222666516.db2.gz VHUCWTSJKCHSRD-LJQANCHMSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000216455590 568124043 /nfs/dbraw/zinc/12/40/43/568124043.db2.gz VHUCWTSJKCHSRD-IBGZPJMESA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000216458361 523045877 /nfs/dbraw/zinc/04/58/77/523045877.db2.gz DFHYFFALYRIXIH-LJQANCHMSA-N 0 0 374.267 5.943 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000216458412 209655140 /nfs/dbraw/zinc/65/51/40/209655140.db2.gz DFHYFFALYRIXIH-IBGZPJMESA-N 0 0 374.267 5.943 40 0 FKABRN CC(C)Oc1ccc(CNC(=O)c2ccccc2CCc2ccccc2)cc1 ZINC000216465891 568124465 /nfs/dbraw/zinc/12/44/65/568124465.db2.gz UMNPGXOXLSCLKJ-UHFFFAOYSA-N 0 0 373.496 5.189 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000216468536 222667282 /nfs/dbraw/zinc/66/72/82/222667282.db2.gz UHSQTTDCKVPIML-NSHDSACASA-N 0 0 371.786 5.327 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000216468584 568124482 /nfs/dbraw/zinc/12/44/82/568124482.db2.gz UHSQTTDCKVPIML-LLVKDONJSA-N 0 0 371.786 5.327 40 0 FKABRN O=C(CSCc1ccc(F)cc1)Nc1ccccc1Oc1ccccc1 ZINC000216477871 527024915 /nfs/dbraw/zinc/02/49/15/527024915.db2.gz VAHMTZAKGSMZTL-UHFFFAOYSA-N 0 0 367.445 5.490 40 0 FKABRN Cc1ccc([C@@H](NC(=O)/C=C/c2ccccc2Cl)c2ccccc2)cc1 ZINC000216481343 206359848 /nfs/dbraw/zinc/35/98/48/206359848.db2.gz POCGXPZZLYUJAU-TVXVBNPNSA-N 0 0 361.872 5.567 40 0 FKABRN Cc1ccc([C@H](NC(=O)/C=C/c2ccccc2Cl)c2ccccc2)cc1 ZINC000216481387 568125126 /nfs/dbraw/zinc/12/51/26/568125126.db2.gz POCGXPZZLYUJAU-POICXBNUSA-N 0 0 361.872 5.567 40 0 FKABRN CC[C@@H](Oc1ccccc1C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000216482474 523058257 /nfs/dbraw/zinc/05/82/57/523058257.db2.gz QGEYIUGMMQYWNS-OAQYLSRUSA-N 0 0 359.469 5.058 40 0 FKABRN CC[C@H](Oc1ccccc1C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000216482522 522892613 /nfs/dbraw/zinc/89/26/13/522892613.db2.gz QGEYIUGMMQYWNS-NRFANRHFSA-N 0 0 359.469 5.058 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1C ZINC000216489076 568125546 /nfs/dbraw/zinc/12/55/46/568125546.db2.gz DMKAVYBEGITTHA-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1C ZINC000216489116 568125573 /nfs/dbraw/zinc/12/55/73/568125573.db2.gz DMKAVYBEGITTHA-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000216495276 206359977 /nfs/dbraw/zinc/35/99/77/206359977.db2.gz HSPBRRKQABNJOF-IBGZPJMESA-N 0 0 365.517 5.059 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)N1CCC(Cc2ccccc2)CC1 ZINC000216495322 568125815 /nfs/dbraw/zinc/12/58/15/568125815.db2.gz HSPBRRKQABNJOF-LJQANCHMSA-N 0 0 365.517 5.059 40 0 FKABRN Cc1ccccc1NC(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000216571233 568129042 /nfs/dbraw/zinc/12/90/42/568129042.db2.gz CLWUJASPDFEASB-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN Cc1cccc(NC(=O)c2cccc(OCc3ccccc3Cl)c2)c1 ZINC000216571371 568129066 /nfs/dbraw/zinc/12/90/66/568129066.db2.gz WCLAJKQEWYQUPJ-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN Cc1ccc(NC(=O)c2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000216571435 568129152 /nfs/dbraw/zinc/12/91/52/568129152.db2.gz ZUQZTKQDYSQTTM-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN O=C(Nc1ccccc1Cl)c1cccc(OCc2ccccc2Cl)c1 ZINC000216571622 222666921 /nfs/dbraw/zinc/66/69/21/222666921.db2.gz QAZWLIKITDDJOP-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN C[C@@H]1CCC[C@@H](C)N1C(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000216572605 222666631 /nfs/dbraw/zinc/66/66/31/222666631.db2.gz SVXVKRYWQBSVQN-HZPDHXFCSA-N 0 0 357.881 5.322 40 0 FKABRN C[C@@H]1CCC[C@H](C)N1C(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000216572652 568129198 /nfs/dbraw/zinc/12/91/98/568129198.db2.gz SVXVKRYWQBSVQN-IYBDPMFKSA-N 0 0 357.881 5.322 40 0 FKABRN C[C@H]1CCC[C@H](C)N1C(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000216572700 206359382 /nfs/dbraw/zinc/35/93/82/206359382.db2.gz SVXVKRYWQBSVQN-HOTGVXAUSA-N 0 0 357.881 5.322 40 0 FKABRN CN(Cc1ccccc1)C(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000216572788 523339799 /nfs/dbraw/zinc/33/97/99/523339799.db2.gz PFENRDDAZGKEGO-UHFFFAOYSA-N 0 0 365.860 5.191 40 0 FKABRN Cc1ccc(NC(=O)c2cccc(OCc3ccccc3Cl)c2)cc1C ZINC000216572854 206359801 /nfs/dbraw/zinc/35/98/01/206359801.db2.gz XLYCJYUXHVILMW-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN Cc1cccc(C)c1NC(=O)c1cccc(OCc2ccccc2Cl)c1 ZINC000216572923 568129202 /nfs/dbraw/zinc/12/92/02/568129202.db2.gz AXNNFJFMSTUDKX-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN c1ccn(-c2ccc3nc(C(c4ccccc4)c4ccccc4)oc3c2)c1 ZINC000216742801 210157092 /nfs/dbraw/zinc/15/70/92/210157092.db2.gz XJOFTBIXKILPOA-UHFFFAOYSA-N 0 0 350.421 5.799 40 0 FKABRN Cc1c(Br)cccc1-c1nc2ccc(-n3cccc3)cc2o1 ZINC000216742992 210156087 /nfs/dbraw/zinc/15/60/87/210156087.db2.gz JDMKJOKQYGCGJP-UHFFFAOYSA-N 0 0 353.219 5.356 40 0 FKABRN Cc1c(Br)cccc1-c1nc2cc(-n3cccc3)ccc2o1 ZINC000216743239 571141314 /nfs/dbraw/zinc/14/13/14/571141314.db2.gz JVMDVDBDNQBMMW-UHFFFAOYSA-N 0 0 353.219 5.356 40 0 FKABRN Cc1ccc(-c2nc3ccc(-n4cccc4)cc3o2)cc1Br ZINC000216743501 203864849 /nfs/dbraw/zinc/86/48/49/203864849.db2.gz NPIRXSGXNNTHJF-UHFFFAOYSA-N 0 0 353.219 5.356 40 0 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FKABRN Cc1cc(C)cc(O[C@@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000219541394 568285799 /nfs/dbraw/zinc/28/57/99/568285799.db2.gz WBIYTVIIQASBKH-MSOLQXFVSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1cc(C)cc(O[C@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000219541476 206386578 /nfs/dbraw/zinc/38/65/78/206386578.db2.gz WBIYTVIIQASBKH-QZTJIDSGSA-N 0 0 353.506 5.246 40 0 FKABRN Cc1cc(C)cc(O[C@@H](C)C(=O)Nc2ccc(OC3CCCC3)cc2)c1 ZINC000219545778 206386871 /nfs/dbraw/zinc/38/68/71/206386871.db2.gz NRKLOCVYOMLDGJ-KRWDZBQOSA-N 0 0 353.462 5.031 40 0 FKABRN Cc1cc(C)cc(O[C@H](C)C(=O)Nc2ccc(OC3CCCC3)cc2)c1 ZINC000219545848 206386495 /nfs/dbraw/zinc/38/64/95/206386495.db2.gz NRKLOCVYOMLDGJ-QGZVFWFLSA-N 0 0 353.462 5.031 40 0 FKABRN CC[C@@H](Oc1ccccc1OC)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219556843 568287479 /nfs/dbraw/zinc/28/74/79/568287479.db2.gz FWBBXDUQNZHUHV-QFBILLFUSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](Oc1ccccc1OC)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219556903 568287557 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FKABRN CC[C@H](Oc1ccccc1F)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219572895 206387056 /nfs/dbraw/zinc/38/70/56/206387056.db2.gz ABKFUEXSYOMXPO-BEFAXECRSA-N 0 0 357.469 5.158 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219587398 222705077 /nfs/dbraw/zinc/70/50/77/222705077.db2.gz IPWZSKPFONJARL-LAUBAEHRSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219587478 568290892 /nfs/dbraw/zinc/29/08/92/568290892.db2.gz IPWZSKPFONJARL-UWJYYQICSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219587555 568290861 /nfs/dbraw/zinc/29/08/61/568290861.db2.gz IPWZSKPFONJARL-DYESRHJHSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219587617 568290816 /nfs/dbraw/zinc/29/08/16/568290816.db2.gz IPWZSKPFONJARL-UTKZUKDTSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccccc1C(=O)c1ccccc1 ZINC000219591278 209687778 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CC[C@@H](Oc1ccc(C)cc1)C(=O)N[C@H](CC(C)C)c1ccc(OC)cc1 ZINC000219593166 568291494 /nfs/dbraw/zinc/29/14/94/568291494.db2.gz JBHGNZGCEFMAMK-FGZHOGPDSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)N[C@H](CC(C)C)c1ccc(OC)cc1 ZINC000219593229 222705294 /nfs/dbraw/zinc/70/52/94/222705294.db2.gz JBHGNZGCEFMAMK-YADHBBJMSA-N 0 0 369.505 5.065 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000219601357 206387586 /nfs/dbraw/zinc/38/75/86/206387586.db2.gz NLKMADSCQTZDEO-JOCHJYFZSA-N 0 0 353.506 5.025 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000219601431 568292343 /nfs/dbraw/zinc/29/23/43/568292343.db2.gz NLKMADSCQTZDEO-QFIPXVFZSA-N 0 0 353.506 5.025 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219603244 206386988 /nfs/dbraw/zinc/38/69/88/206386988.db2.gz MWVFATPEYAVACY-MGPUTAFESA-N 0 0 373.924 5.672 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000219603329 222705209 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MJVJKUZEQFWVQQ-UHFFFAOYSA-N 0 0 363.482 5.630 40 0 FKABRN O=C(CCc1ccccc1Cl)N(Cc1ccccc1)Cc1ccccc1 ZINC000220010808 222712580 /nfs/dbraw/zinc/71/25/80/222712580.db2.gz MIXSNWOVGDFGNO-UHFFFAOYSA-N 0 0 363.888 5.502 40 0 FKABRN O=C(CCc1ccccc1Cl)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000220011852 568316410 /nfs/dbraw/zinc/31/64/10/568316410.db2.gz QBXPFXNVPSFTJL-UHFFFAOYSA-N 0 0 362.178 5.584 40 0 FKABRN O=C(CCc1ccccc1Cl)Nc1ccccc1Oc1ccccc1 ZINC000220013373 568316465 /nfs/dbraw/zinc/31/64/65/568316465.db2.gz ONVWGXCWDQIKGK-UHFFFAOYSA-N 0 0 351.833 5.704 40 0 FKABRN O=C(CCc1ccccc1Cl)Nc1ccccc1C(=O)c1ccccc1 ZINC000220016285 568316605 /nfs/dbraw/zinc/31/66/05/568316605.db2.gz DGSUIPQKJJPQTK-UHFFFAOYSA-N 0 0 363.844 5.142 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)CCc2ccccc2Cl)cc1 ZINC000220017701 568316793 /nfs/dbraw/zinc/31/67/93/568316793.db2.gz ZTLHEDKLCOQVOB-HXUWFJFHSA-N 0 0 359.897 5.185 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)CCc2ccccc2Cl)cc1 ZINC000220017772 568316784 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JNDFDPUSLNLTAI-UHFFFAOYSA-N 0 0 358.228 5.011 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000222558932 568539300 /nfs/dbraw/zinc/53/93/00/568539300.db2.gz ULSLYVFKYYLRNE-FDDCHVKYSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1ccc(C)cc1C ZINC000222558996 568539326 /nfs/dbraw/zinc/53/93/26/568539326.db2.gz ULSLYVFKYYLRNE-MBSDFSHPSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000222559056 568539305 /nfs/dbraw/zinc/53/93/05/568539305.db2.gz ULSLYVFKYYLRNE-WZONZLPQSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@H](C)c1ccc(C)cc1C ZINC000222559123 206418612 /nfs/dbraw/zinc/41/86/12/206418612.db2.gz ULSLYVFKYYLRNE-JPYJTQIMSA-N 0 0 365.517 5.217 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)CCCSc2ccc(Cl)cc2)cc1 ZINC000222563260 568539873 /nfs/dbraw/zinc/53/98/73/568539873.db2.gz NYVQGMFMRSIECM-OAHLLOKOSA-N 0 0 361.938 5.652 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)CCCSc2ccc(Cl)cc2)cc1 ZINC000222563326 568539834 /nfs/dbraw/zinc/53/98/34/568539834.db2.gz NYVQGMFMRSIECM-HNNXBMFYSA-N 0 0 361.938 5.652 40 0 FKABRN C[C@@H](Oc1cccc2c1CCCC2)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000222564629 568540001 /nfs/dbraw/zinc/54/00/01/568540001.db2.gz DKKYNXLFCZPRQG-GFCCVEGCSA-N 0 0 364.272 5.278 40 0 FKABRN C[C@H](Oc1cccc2c1CCCC2)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000222564696 568540034 /nfs/dbraw/zinc/54/00/34/568540034.db2.gz DKKYNXLFCZPRQG-LBPRGKRZSA-N 0 0 364.272 5.278 40 0 FKABRN CCn1c(Cl)nc2cc(C(=O)N(Cc3ccccc3)CC(C)C)ccc21 ZINC000222565334 568540147 /nfs/dbraw/zinc/54/01/47/568540147.db2.gz CQDSEYBMGBYXDO-UHFFFAOYSA-N 0 0 369.896 5.008 40 0 FKABRN Cc1nc(C2CC2)ncc1C(=O)Nc1ccccc1Sc1ccccc1 ZINC000222567590 206419806 /nfs/dbraw/zinc/41/98/06/206419806.db2.gz DVPOYQMJAPPNJR-UHFFFAOYSA-N 0 0 361.470 5.066 40 0 FKABRN COC(=O)c1cn(C(=O)/C=C/c2ccc(Cl)cc2Cl)c2ccccc12 ZINC000222568605 568540560 /nfs/dbraw/zinc/54/05/60/568540560.db2.gz ZSNKWRKJGUJLAF-VQHVLOKHSA-N 0 0 374.223 5.088 40 0 FKABRN COC(=O)c1cn(C(=O)/C=C/c2ccc(C(C)(C)C)cc2)c2ccccc12 ZINC000222569191 568540670 /nfs/dbraw/zinc/54/06/70/568540670.db2.gz BWHKCHYOGFGOSR-SDNWHVSQSA-N 0 0 361.441 5.079 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)Nc2ccc(OC3CCCC3)cc2)c1 ZINC000222571319 568540899 /nfs/dbraw/zinc/54/08/99/568540899.db2.gz PRGCZXNJCBNOTC-UHFFFAOYSA-N 0 0 367.489 5.457 40 0 FKABRN Cc1nc(C(C)C)ncc1C(=O)Nc1ccccc1Sc1ccccc1 ZINC000222574169 568541238 /nfs/dbraw/zinc/54/12/38/568541238.db2.gz WXHLCYGDIXMQHV-UHFFFAOYSA-N 0 0 363.486 5.312 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)c(C)c1 ZINC000222575651 206419246 /nfs/dbraw/zinc/41/92/46/206419246.db2.gz JAAIQMKWGYXYJA-UHFFFAOYSA-N 0 0 359.513 6.024 40 0 FKABRN CCCCc1ccc(NC(=O)c2cnc(-c3ccc(F)cc3)nc2C)cc1 ZINC000222584994 568542381 /nfs/dbraw/zinc/54/23/81/568542381.db2.gz JVUXAMNTFKFIRO-UHFFFAOYSA-N 0 0 363.436 5.186 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1cccc2c1CCCC2 ZINC000222594800 222741479 /nfs/dbraw/zinc/74/14/79/222741479.db2.gz ZKIFGHNTELODBJ-QGZVFWFLSA-N 0 0 351.490 5.403 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1cccc2c1CCCC2 ZINC000222594873 568543431 /nfs/dbraw/zinc/54/34/31/568543431.db2.gz ZKIFGHNTELODBJ-KRWDZBQOSA-N 0 0 351.490 5.403 40 0 FKABRN COC(=O)c1cn(C(=O)c2cc3c(ccc4ccccc34)o2)c2ccccc12 ZINC000222598165 222741842 /nfs/dbraw/zinc/74/18/42/222741842.db2.gz LUUNLEPCJSYHCJ-UHFFFAOYSA-N 0 0 369.376 5.016 40 0 FKABRN O=C(Nc1cc(Cl)ccc1Oc1ccccc1)c1cnc(C2CC2)nc1 ZINC000222599503 568543642 /nfs/dbraw/zinc/54/36/42/568543642.db2.gz LQPSORHLQRCUFV-UHFFFAOYSA-N 0 0 365.820 5.052 40 0 FKABRN CC(C)c1ccc(NC(=O)c2cnc(-c3ccc(Cl)cc3)nc2)cc1 ZINC000222602701 568544194 /nfs/dbraw/zinc/54/41/94/568544194.db2.gz FYFPCBUGKLBQEW-UHFFFAOYSA-N 0 0 351.837 5.173 40 0 FKABRN O=C(Nc1cccc2ccccc21)c1cnc(-c2ccc(Cl)cc2)nc1 ZINC000222602789 568544115 /nfs/dbraw/zinc/54/41/15/568544115.db2.gz RNLUANLROXHXSB-UHFFFAOYSA-N 0 0 359.816 5.203 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)c1cnc(-c2ccc(Cl)cc2)nc1 ZINC000222603839 568544294 /nfs/dbraw/zinc/54/42/94/568544294.db2.gz QBEDFDYALBASDO-UHFFFAOYSA-N 0 0 358.228 5.011 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)c1cnc(-c2ccc(Cl)cc2)nc1 ZINC000222603922 222741850 /nfs/dbraw/zinc/74/18/50/222741850.db2.gz PHYMRYDGXBGYIW-UHFFFAOYSA-N 0 0 358.228 5.011 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)c1cnc(-c2ccc(Cl)cc2)nc1 ZINC000222604018 568544256 /nfs/dbraw/zinc/54/42/56/568544256.db2.gz HRLKAJOAEYXDOW-UHFFFAOYSA-N 0 0 358.228 5.011 40 0 FKABRN Cc1ccc(NC(=O)c2cnc(-c3ccc(Cl)cc3)nc2)cc1Cl ZINC000222604107 568544296 /nfs/dbraw/zinc/54/42/96/568544296.db2.gz FIXQPHSFDJTPAH-UHFFFAOYSA-N 0 0 358.228 5.011 40 0 FKABRN CCCCc1ccc(NC(=O)c2cnc(-c3ccc(Cl)cc3)nc2)cc1 ZINC000222608002 222741295 /nfs/dbraw/zinc/74/12/95/222741295.db2.gz GWLNXCYNYWGQLI-UHFFFAOYSA-N 0 0 365.864 5.392 40 0 FKABRN CSc1cccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc32)c1 ZINC000222627233 568547093 /nfs/dbraw/zinc/54/70/93/568547093.db2.gz FBGAXBLUNLUVMN-UHFFFAOYSA-N 0 0 370.477 5.876 40 0 FKABRN CCC[C@@H](C)NC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc21 ZINC000222628926 568547469 /nfs/dbraw/zinc/54/74/69/568547469.db2.gz LQOJJEBYNLZKCR-CQSZACIVSA-N 0 0 352.865 5.474 40 0 FKABRN CCC[C@H](C)NC(=O)c1cc(-c2ccc(Cl)cc2)nc2ccccc21 ZINC000222628996 222742692 /nfs/dbraw/zinc/74/26/92/222742692.db2.gz LQOJJEBYNLZKCR-AWEZNQCLSA-N 0 0 352.865 5.474 40 0 FKABRN O=C(N[C@@H]1CC2(CCCCC2)Oc2ccccc21)c1ccc(Cl)cc1F ZINC000222637351 568548330 /nfs/dbraw/zinc/54/83/30/568548330.db2.gz GSHIXYLQVIMCKQ-GOSISDBHSA-N 0 0 373.855 5.436 40 0 FKABRN O=C(N[C@H]1CC2(CCCCC2)Oc2ccccc21)c1ccc(Cl)cc1F ZINC000222637400 568548323 /nfs/dbraw/zinc/54/83/23/568548323.db2.gz GSHIXYLQVIMCKQ-SFHVURJKSA-N 0 0 373.855 5.436 40 0 FKABRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(C(C)C)cc3)N21 ZINC000222642014 568548708 /nfs/dbraw/zinc/54/87/08/568548708.db2.gz AHMJIWIHTRRBKG-YZGWKJHDSA-N 0 0 351.519 5.184 40 0 FKABRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3ccc(C(C)C)cc3)N21 ZINC000222642078 568548629 /nfs/dbraw/zinc/54/86/29/568548629.db2.gz AHMJIWIHTRRBKG-YSIASYRMSA-N 0 0 351.519 5.184 40 0 FKABRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(C(C)C)cc3)N21 ZINC000222642146 517791046 /nfs/dbraw/zinc/79/10/46/517791046.db2.gz AHMJIWIHTRRBKG-MISYRCLQSA-N 0 0 351.519 5.184 40 0 FKABRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3ccc(C(C)C)cc3)N21 ZINC000222642202 568548736 /nfs/dbraw/zinc/54/87/36/568548736.db2.gz AHMJIWIHTRRBKG-DFQSSKMNSA-N 0 0 351.519 5.184 40 0 FKABRN COc1ccc(CC(=O)Nc2ccccc2Sc2ccccc2)cc1C ZINC000222653297 568550081 /nfs/dbraw/zinc/55/00/81/568550081.db2.gz HQAXZXFDARLMKM-UHFFFAOYSA-N 0 0 363.482 5.336 40 0 FKABRN O=C(CCc1cccc2ccccc21)Nc1cccc(Br)c1 ZINC000222658013 568550560 /nfs/dbraw/zinc/55/05/60/568550560.db2.gz AKWBDVVTJLUJBK-UHFFFAOYSA-N 0 0 354.247 5.174 40 0 FKABRN O=C(CCc1cccc2ccccc21)Nc1ccc(Br)cc1 ZINC000222658114 568550607 /nfs/dbraw/zinc/55/06/07/568550607.db2.gz BXUDVUGVXKSJQS-UHFFFAOYSA-N 0 0 354.247 5.174 40 0 FKABRN O=C(CCc1cccc2ccccc21)Nc1ccc(Oc2ccccc2)cc1 ZINC000222658632 568550753 /nfs/dbraw/zinc/55/07/53/568550753.db2.gz ZTPZNCDWPCCPDZ-UHFFFAOYSA-N 0 0 367.448 6.203 40 0 FKABRN O=C(CCc1cccc2ccccc21)Nc1ccccc1Br ZINC000222659312 568550658 /nfs/dbraw/zinc/55/06/58/568550658.db2.gz BVKXWCHFLLWWHG-UHFFFAOYSA-N 0 0 354.247 5.174 40 0 FKABRN O=C(CCc1cccc2ccccc21)NCCSc1ccc(Cl)cc1 ZINC000222660603 568550822 /nfs/dbraw/zinc/55/08/22/568550822.db2.gz XAXYHBZIWNNEOI-UHFFFAOYSA-N 0 0 369.917 5.334 40 0 FKABRN Cc1ccc(CSCCNC(=O)CCc2cccc3ccccc32)cc1 ZINC000222660780 568550870 /nfs/dbraw/zinc/55/08/70/568550870.db2.gz SSAVVMALLWZGQW-UHFFFAOYSA-N 0 0 363.526 5.130 40 0 FKABRN O=C(CCc1cccc2ccccc21)NCc1ccc(Cl)cc1Cl ZINC000222661238 568551001 /nfs/dbraw/zinc/55/10/01/568551001.db2.gz BFWWYRRPLVDNQN-UHFFFAOYSA-N 0 0 358.268 5.396 40 0 FKABRN O=C(CCc1cccc2ccccc21)N1CCC(Cc2ccccc2)CC1 ZINC000222663196 568551199 /nfs/dbraw/zinc/55/11/99/568551199.db2.gz RVRSJCPLRCRDNV-UHFFFAOYSA-N 0 0 357.497 5.254 40 0 FKABRN Cc1cccc(CSCCNC(=O)CCc2cccc3ccccc32)c1 ZINC000222663699 568551326 /nfs/dbraw/zinc/55/13/26/568551326.db2.gz XRNHKLRNMUDPDZ-UHFFFAOYSA-N 0 0 363.526 5.130 40 0 FKABRN Cc1ccccc1CSCCNC(=O)CCc1cccc2ccccc21 ZINC000222664555 568551336 /nfs/dbraw/zinc/55/13/36/568551336.db2.gz QHSOOHYBIARBJH-UHFFFAOYSA-N 0 0 363.526 5.130 40 0 FKABRN O=C(CCc1cccc2ccccc21)Nc1ccc(Br)cc1F ZINC000222668130 222745115 /nfs/dbraw/zinc/74/51/15/222745115.db2.gz JRSUFHWVGNRIGT-UHFFFAOYSA-N 0 0 372.237 5.313 40 0 FKABRN O=C(CCc1cccc2ccccc21)Nc1ccccc1Oc1ccccc1 ZINC000222669128 518198362 /nfs/dbraw/zinc/19/83/62/518198362.db2.gz UWWJRZKCKXACED-UHFFFAOYSA-N 0 0 367.448 6.203 40 0 FKABRN COc1cc(NC(=O)CCc2cccc3ccccc32)c(OC)cc1Cl ZINC000222669795 222745377 /nfs/dbraw/zinc/74/53/77/222745377.db2.gz XMEOVGPSOYCXCE-UHFFFAOYSA-N 0 0 369.848 5.082 40 0 FKABRN O=C(CCc1cccc2ccccc21)NC(c1ccccc1)c1ccccc1 ZINC000222670258 568551982 /nfs/dbraw/zinc/55/19/82/568551982.db2.gz BINDVKAEDHVAMC-UHFFFAOYSA-N 0 0 365.476 5.678 40 0 FKABRN C[C@@H](NC(=O)CCc1cccc2ccccc21)c1ccc(C(C)(C)C)cc1 ZINC000222671597 222745591 /nfs/dbraw/zinc/74/55/91/222745591.db2.gz RRWMKSQXTKJRDW-GOSISDBHSA-N 0 0 359.513 5.947 40 0 FKABRN C[C@H](NC(=O)CCc1cccc2ccccc21)c1ccc(C(C)(C)C)cc1 ZINC000222671670 568552236 /nfs/dbraw/zinc/55/22/36/568552236.db2.gz RRWMKSQXTKJRDW-SFHVURJKSA-N 0 0 359.513 5.947 40 0 FKABRN O=C(CCc1cccc2ccccc21)NCCCc1ccccc1Cl ZINC000222671757 568552210 /nfs/dbraw/zinc/55/22/10/568552210.db2.gz HEGIPDCJJZFEDV-UHFFFAOYSA-N 0 0 351.877 5.175 40 0 FKABRN O=C(CCc1cccc2ccccc21)NCCCc1ccc(Cl)cc1 ZINC000222671851 568552205 /nfs/dbraw/zinc/55/22/05/568552205.db2.gz GCHKIHGREWEILO-UHFFFAOYSA-N 0 0 351.877 5.175 40 0 FKABRN O=C(CCc1cccc2ccccc21)Nc1ccc(OC2CCCC2)cc1 ZINC000222674301 568552501 /nfs/dbraw/zinc/55/25/01/568552501.db2.gz CEIRRCQHIBHFOK-UHFFFAOYSA-N 0 0 359.469 5.733 40 0 FKABRN CC1(C)C[C@@H](NC(=O)CCc2cccc3ccccc32)c2ccccc2O1 ZINC000222674477 222745468 /nfs/dbraw/zinc/74/54/68/222745468.db2.gz QAHJACHSWCEJKC-OAQYLSRUSA-N 0 0 359.469 5.191 40 0 FKABRN CC1(C)C[C@H](NC(=O)CCc2cccc3ccccc32)c2ccccc2O1 ZINC000222674527 568552468 /nfs/dbraw/zinc/55/24/68/568552468.db2.gz QAHJACHSWCEJKC-NRFANRHFSA-N 0 0 359.469 5.191 40 0 FKABRN Cc1ccc2c(c1)[C@@H](NC(=O)CCc1cccc3ccccc31)CC(C)(C)O2 ZINC000222677604 222745740 /nfs/dbraw/zinc/74/57/40/222745740.db2.gz HDKNJSPMKABDHI-QFIPXVFZSA-N 0 0 373.496 5.499 40 0 FKABRN Cc1ccc2c(c1)[C@H](NC(=O)CCc1cccc3ccccc31)CC(C)(C)O2 ZINC000222677667 568552655 /nfs/dbraw/zinc/55/26/55/568552655.db2.gz HDKNJSPMKABDHI-JOCHJYFZSA-N 0 0 373.496 5.499 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=O)CCc1cccc2ccccc21 ZINC000222677762 568552763 /nfs/dbraw/zinc/55/27/63/568552763.db2.gz ALIHXPIMRDQMOI-QFIPXVFZSA-N 0 0 373.496 5.499 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=O)CCc1cccc2ccccc21 ZINC000222677831 206421718 /nfs/dbraw/zinc/42/17/18/206421718.db2.gz ALIHXPIMRDQMOI-JOCHJYFZSA-N 0 0 373.496 5.499 40 0 FKABRN O=C(NCCSCc1ccc(Cl)cc1)C1(c2ccccc2)CCCC1 ZINC000222679049 568552727 /nfs/dbraw/zinc/55/27/27/568552727.db2.gz OOSXAYZRFBBIIZ-UHFFFAOYSA-N 0 0 373.949 5.201 40 0 FKABRN CC(C)c1ccc(CCCNC(=O)CCc2cccc3ccccc32)cc1 ZINC000222680758 568552948 /nfs/dbraw/zinc/55/29/48/568552948.db2.gz VLRKIHMWLAVPOO-UHFFFAOYSA-N 0 0 359.513 5.645 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)Nc1cccc(C(F)(F)F)c1 ZINC000222682187 568553086 /nfs/dbraw/zinc/55/30/86/568553086.db2.gz VCVQCQGIGAXENN-UHFFFAOYSA-N 0 0 373.827 5.870 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)NCCSc1ccccc1 ZINC000222682970 568553271 /nfs/dbraw/zinc/55/32/71/568553271.db2.gz UYFZFRBLTOPIHL-UHFFFAOYSA-N 0 0 365.951 5.121 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)NCc1ccc(Cl)cc1 ZINC000222683655 568553259 /nfs/dbraw/zinc/55/32/59/568553259.db2.gz DYCHLSRJHDOLOM-UHFFFAOYSA-N 0 0 354.302 5.182 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222684038 222745443 /nfs/dbraw/zinc/74/54/43/222745443.db2.gz WFEIPNFUAXOVLV-UHFFFAOYSA-N 0 0 370.301 5.513 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222684142 568553362 /nfs/dbraw/zinc/55/33/62/568553362.db2.gz XNDOWSKWWNDSHW-UHFFFAOYSA-N 0 0 354.302 5.813 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222684229 568553350 /nfs/dbraw/zinc/55/33/50/568553350.db2.gz GVXWMMUFXSPCBA-UHFFFAOYSA-N 0 0 354.302 5.813 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)Nc1ccccc1C(F)(F)F ZINC000222684322 568553416 /nfs/dbraw/zinc/55/34/16/568553416.db2.gz XVKFHGZMZIMXLI-UHFFFAOYSA-N 0 0 373.827 5.870 40 0 FKABRN CSc1cccc(NC(=O)CCCSc2ccc(Cl)cc2)c1 ZINC000222685430 568553554 /nfs/dbraw/zinc/55/35/54/568553554.db2.gz DJNNPSPGVNJHCV-UHFFFAOYSA-N 0 0 351.924 5.573 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)NCCSC1CCCCC1 ZINC000222685534 568553567 /nfs/dbraw/zinc/55/35/67/568553567.db2.gz FJAUENPOFZLVOP-UHFFFAOYSA-N 0 0 371.999 5.394 40 0 FKABRN CCc1cccc(CC)c1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222686459 568553553 /nfs/dbraw/zinc/55/35/53/568553553.db2.gz IWKISHWPMLUBLQ-UHFFFAOYSA-N 0 0 361.938 5.976 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)NCc1ccccc1Cl ZINC000222686889 568553663 /nfs/dbraw/zinc/55/36/63/568553663.db2.gz BZVQNLXGZJOKMX-UHFFFAOYSA-N 0 0 354.302 5.182 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222687073 568553653 /nfs/dbraw/zinc/55/36/53/568553653.db2.gz TYUWKDUNCVRMKH-UHFFFAOYSA-N 0 0 361.938 6.283 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)Nc1ccc(C(F)(F)F)cc1 ZINC000222687155 568553702 /nfs/dbraw/zinc/55/37/02/568553702.db2.gz BSOMTAQMQWMYKP-UHFFFAOYSA-N 0 0 373.827 5.870 40 0 FKABRN CSc1ccccc1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222687329 568553693 /nfs/dbraw/zinc/55/36/93/568553693.db2.gz ALZUPHZGMBVSBL-UHFFFAOYSA-N 0 0 351.924 5.573 40 0 FKABRN CCCCc1ccc(NC(=O)CCCSc2ccc(Cl)cc2)cc1 ZINC000222687409 568553675 /nfs/dbraw/zinc/55/36/75/568553675.db2.gz WPSNQOGVGMLLLV-UHFFFAOYSA-N 0 0 361.938 6.194 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)Nc1ccc(Cl)c(Cl)c1 ZINC000222687595 568553774 /nfs/dbraw/zinc/55/37/74/568553774.db2.gz CSPWOGCXZTZRAS-UHFFFAOYSA-N 0 0 374.720 6.158 40 0 FKABRN CC(C)Oc1ccc(NC(=O)CCCSc2ccc(Cl)cc2)cc1 ZINC000222688083 568553834 /nfs/dbraw/zinc/55/38/34/568553834.db2.gz NGPMLSMXCUIBME-UHFFFAOYSA-N 0 0 363.910 5.638 40 0 FKABRN CC(C)Oc1cccc(NC(=O)CCCSc2ccc(Cl)cc2)c1 ZINC000222688158 568553778 /nfs/dbraw/zinc/55/37/78/568553778.db2.gz HJENXIAVJLMTAX-UHFFFAOYSA-N 0 0 363.910 5.638 40 0 FKABRN C[C@@H](CCc1ccccc1)NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222688769 568553907 /nfs/dbraw/zinc/55/39/07/568553907.db2.gz ONMWWQNNVCVIEA-INIZCTEOSA-N 0 0 361.938 5.350 40 0 FKABRN C[C@H](CCc1ccccc1)NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222688833 568553965 /nfs/dbraw/zinc/55/39/65/568553965.db2.gz ONMWWQNNVCVIEA-MRXNPFEDSA-N 0 0 361.938 5.350 40 0 FKABRN Cc1ccc(C)c([C@@H](C)NC(=O)CCCSc2ccc(Cl)cc2)c1 ZINC000222689881 222745071 /nfs/dbraw/zinc/74/50/71/222745071.db2.gz XDUIXMQIXRFWDB-MRXNPFEDSA-N 0 0 361.938 5.707 40 0 FKABRN Cc1ccc(C)c([C@H](C)NC(=O)CCCSc2ccc(Cl)cc2)c1 ZINC000222689934 222745479 /nfs/dbraw/zinc/74/54/79/222745479.db2.gz XDUIXMQIXRFWDB-INIZCTEOSA-N 0 0 361.938 5.707 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)NCCCc1ccc(F)cc1 ZINC000222690355 568554078 /nfs/dbraw/zinc/55/40/78/568554078.db2.gz MCHZRLSRWTYLRF-UHFFFAOYSA-N 0 0 365.901 5.100 40 0 FKABRN Cc1ccc(CCCNC(=O)CCCSc2ccc(Cl)cc2)cc1 ZINC000222691101 568554168 /nfs/dbraw/zinc/55/41/68/568554168.db2.gz LBLISKRTQDTJPK-UHFFFAOYSA-N 0 0 361.938 5.270 40 0 FKABRN Cc1cccc(CCCNC(=O)CCCSc2ccc(Cl)cc2)c1 ZINC000222691179 568554190 /nfs/dbraw/zinc/55/41/90/568554190.db2.gz IWOYRWGDLWMJRR-UHFFFAOYSA-N 0 0 361.938 5.270 40 0 FKABRN CC[C@@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(C(C)C)c3C)N21 ZINC000222692864 206421262 /nfs/dbraw/zinc/42/12/62/206421262.db2.gz MARZADRDSJRWAX-LSTHTHJFSA-N 0 0 368.550 5.060 40 0 FKABRN COc1ccc([C@@H](C)NC(=O)CCCSc2ccc(Cl)cc2)cc1 ZINC000222692876 568554553 /nfs/dbraw/zinc/55/45/53/568554553.db2.gz CGMTWVYIIPFPIQ-CQSZACIVSA-N 0 0 363.910 5.098 40 0 FKABRN CC[C@H]1CSC2=N[C@@H](c3ccccn3)[C@@H](c3cc(C)n(C(C)C)c3C)N21 ZINC000222692919 568554487 /nfs/dbraw/zinc/55/44/87/568554487.db2.gz MARZADRDSJRWAX-FFZOFVMBSA-N 0 0 368.550 5.060 40 0 FKABRN COc1ccc([C@H](C)NC(=O)CCCSc2ccc(Cl)cc2)cc1 ZINC000222692936 222745727 /nfs/dbraw/zinc/74/57/27/222745727.db2.gz CGMTWVYIIPFPIQ-AWEZNQCLSA-N 0 0 363.910 5.098 40 0 FKABRN CC[C@@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(C(C)C)c3C)N21 ZINC000222692992 568554489 /nfs/dbraw/zinc/55/44/89/568554489.db2.gz MARZADRDSJRWAX-NSISKUIASA-N 0 0 368.550 5.060 40 0 FKABRN CC[C@H]1CSC2=N[C@H](c3ccccn3)[C@@H](c3cc(C)n(C(C)C)c3C)N21 ZINC000222693052 568554586 /nfs/dbraw/zinc/55/45/86/568554586.db2.gz MARZADRDSJRWAX-PWIZWCRZSA-N 0 0 368.550 5.060 40 0 FKABRN C[C@@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000222693163 568554583 /nfs/dbraw/zinc/55/45/83/568554583.db2.gz AETKMHDHHZNCMN-CYBMUJFWSA-N 0 0 351.874 5.229 40 0 FKABRN C[C@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000222693216 568554538 /nfs/dbraw/zinc/55/45/38/568554538.db2.gz AETKMHDHHZNCMN-ZDUSSCGKSA-N 0 0 351.874 5.229 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)CCCSc2ccc(Cl)cc2)c(C)c1 ZINC000222693312 568554521 /nfs/dbraw/zinc/55/45/21/568554521.db2.gz FXKNRSDTKGYCPH-MRXNPFEDSA-N 0 0 361.938 5.707 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)CCCSc2ccc(Cl)cc2)c(C)c1 ZINC000222693379 568554572 /nfs/dbraw/zinc/55/45/72/568554572.db2.gz FXKNRSDTKGYCPH-INIZCTEOSA-N 0 0 361.938 5.707 40 0 FKABRN CC[C@@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000222693465 568554533 /nfs/dbraw/zinc/55/45/33/568554533.db2.gz UOVFLAFGHOVXBV-LJQANCHMSA-N 0 0 361.938 5.788 40 0 FKABRN CC[C@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000222693531 222745177 /nfs/dbraw/zinc/74/51/77/222745177.db2.gz UOVFLAFGHOVXBV-IBGZPJMESA-N 0 0 361.938 5.788 40 0 FKABRN CCSc1ccccc1NC(=O)CCCSc1ccc(Cl)cc1 ZINC000222694037 568554648 /nfs/dbraw/zinc/55/46/48/568554648.db2.gz GHGZBUKATLZIHO-UHFFFAOYSA-N 0 0 365.951 5.963 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)CCCSc2ccc(Cl)cc2)cc1C ZINC000222695784 568554754 /nfs/dbraw/zinc/55/47/54/568554754.db2.gz HATSDMZBIYOJBA-MRXNPFEDSA-N 0 0 361.938 5.707 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)CCCSc2ccc(Cl)cc2)cc1C ZINC000222695843 222745825 /nfs/dbraw/zinc/74/58/25/222745825.db2.gz HATSDMZBIYOJBA-INIZCTEOSA-N 0 0 361.938 5.707 40 0 FKABRN O=C(CSCc1ccccc1F)Nc1ccc(Oc2ccccc2)cc1 ZINC000222698141 568555052 /nfs/dbraw/zinc/55/50/52/568555052.db2.gz GAQQBVVKFZKZNR-UHFFFAOYSA-N 0 0 367.445 5.490 40 0 FKABRN O=C(CSCc1ccccc1F)Nc1ccccc1Oc1ccccc1 ZINC000222703560 568555457 /nfs/dbraw/zinc/55/54/57/568555457.db2.gz JDSIDRPCUSHIPG-UHFFFAOYSA-N 0 0 367.445 5.490 40 0 FKABRN C[C@@H](NC(=O)CSCc1ccccc1F)c1ccc(C(C)(C)C)cc1 ZINC000222706048 568555779 /nfs/dbraw/zinc/55/57/79/568555779.db2.gz XAENDRYBCWPHHV-OAHLLOKOSA-N 0 0 359.510 5.234 40 0 FKABRN C[C@H](NC(=O)CSCc1ccccc1F)c1ccc(C(C)(C)C)cc1 ZINC000222706108 568555790 /nfs/dbraw/zinc/55/57/90/568555790.db2.gz XAENDRYBCWPHHV-HNNXBMFYSA-N 0 0 359.510 5.234 40 0 FKABRN O=C(CSCc1ccccc1F)Nc1ccc(OC2CCCC2)cc1 ZINC000222708649 568555956 /nfs/dbraw/zinc/55/59/56/568555956.db2.gz BKDKSYWEQIIFIC-UHFFFAOYSA-N 0 0 359.466 5.019 40 0 FKABRN C[C@@H](NC(=O)CSCc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000222714667 222746698 /nfs/dbraw/zinc/74/66/98/222746698.db2.gz OSFQSEDOXRIOLT-GFCCVEGCSA-N 0 0 354.302 5.104 40 0 FKABRN C[C@H](NC(=O)CSCc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000222714731 222747124 /nfs/dbraw/zinc/74/71/24/222747124.db2.gz OSFQSEDOXRIOLT-LBPRGKRZSA-N 0 0 354.302 5.104 40 0 FKABRN Cc1cc(C)cc(NC(=O)CSCc2ccc(Cl)cc2Cl)c1 ZINC000222715084 568556395 /nfs/dbraw/zinc/55/63/95/568556395.db2.gz QUJDJDSBPKWQGG-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN CC(C)c1ccc(NC(=O)CSCc2ccc(Cl)cc2Cl)cc1 ZINC000222715160 568556438 /nfs/dbraw/zinc/55/64/38/568556438.db2.gz RTHIHYXCMKZHBX-UHFFFAOYSA-N 0 0 368.329 5.989 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1Cl)Nc1cccc(Cl)c1 ZINC000222715242 568556455 /nfs/dbraw/zinc/55/64/55/568556455.db2.gz RBPHDFUUSZEYNE-UHFFFAOYSA-N 0 0 360.693 5.519 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1Cl)NCc1ccc(Cl)cc1 ZINC000222716857 568556514 /nfs/dbraw/zinc/55/65/14/568556514.db2.gz PJUPNKJIOWWOHQ-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1Cl)NCCC1=CCCCC1 ZINC000222718306 568556631 /nfs/dbraw/zinc/55/66/31/568556631.db2.gz KRJDVUQQUKWMHE-UHFFFAOYSA-N 0 0 358.334 5.233 40 0 FKABRN CSc1cccc(NC(=O)CSCc2ccc(Cl)cc2Cl)c1 ZINC000222718399 568556689 /nfs/dbraw/zinc/55/66/89/568556689.db2.gz GITPSXYOQRYZHT-UHFFFAOYSA-N 0 0 372.342 5.587 40 0 FKABRN Cc1cc(C)c(NC(=O)CSCc2ccc(Cl)cc2Cl)c(C)c1 ZINC000222719314 568556721 /nfs/dbraw/zinc/55/67/21/568556721.db2.gz FZRFNTKEVZOXAV-UHFFFAOYSA-N 0 0 368.329 5.791 40 0 FKABRN CC(C)c1ccccc1NC(=O)CSCc1ccc(Cl)cc1Cl ZINC000222719573 568556776 /nfs/dbraw/zinc/55/67/76/568556776.db2.gz FSVDDNLRRMCIEE-UHFFFAOYSA-N 0 0 368.329 5.989 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1Cl)NCc1ccccc1Cl ZINC000222719821 568556751 /nfs/dbraw/zinc/55/67/51/568556751.db2.gz BDGVEEORTAMAIT-UHFFFAOYSA-N 0 0 374.720 5.196 40 0 FKABRN CSc1ccccc1NC(=O)CSCc1ccc(Cl)cc1Cl ZINC000222720266 568556737 /nfs/dbraw/zinc/55/67/37/568556737.db2.gz GCXZABJQJSURBJ-UHFFFAOYSA-N 0 0 372.342 5.587 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1Cl)Nc1ccc(F)c(F)c1 ZINC000222720438 568556772 /nfs/dbraw/zinc/55/67/72/568556772.db2.gz LSKPQAGKYYWQNR-UHFFFAOYSA-N 0 0 362.228 5.144 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1Cl)NC1CCCCCCC1 ZINC000222721999 568556898 /nfs/dbraw/zinc/55/68/98/568556898.db2.gz TVHKAVYAUWYHDE-UHFFFAOYSA-N 0 0 360.350 5.456 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1Cl)N1CCCc2ccccc21 ZINC000222722249 132277610 /nfs/dbraw/zinc/27/76/10/132277610.db2.gz SCSILEKSKZBVIZ-UHFFFAOYSA-N 0 0 366.313 5.206 40 0 FKABRN CCOc1cccc(NC(=O)CSCc2ccc(Cl)cc2Cl)c1 ZINC000222724455 568556999 /nfs/dbraw/zinc/55/69/99/568556999.db2.gz KHNPBXXNBYTGTK-UHFFFAOYSA-N 0 0 370.301 5.264 40 0 FKABRN Cc1ccc([C@@H](C)NC(=O)CSCc2ccc(Cl)cc2Cl)cc1 ZINC000222726177 222747646 /nfs/dbraw/zinc/74/76/46/222747646.db2.gz UFHKFCRSTNWAJT-CYBMUJFWSA-N 0 0 368.329 5.412 40 0 FKABRN Cc1ccc([C@H](C)NC(=O)CSCc2ccc(Cl)cc2Cl)cc1 ZINC000222726235 568557112 /nfs/dbraw/zinc/55/71/12/568557112.db2.gz UFHKFCRSTNWAJT-ZDUSSCGKSA-N 0 0 368.329 5.412 40 0 FKABRN C[C@@H](NC(=O)CSCc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000222726309 568557139 /nfs/dbraw/zinc/55/71/39/568557139.db2.gz SXYJQDPFKDVNKY-LLVKDONJSA-N 0 0 372.292 5.243 40 0 FKABRN C[C@H](NC(=O)CSCc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000222726370 568557144 /nfs/dbraw/zinc/55/71/44/568557144.db2.gz SXYJQDPFKDVNKY-NSHDSACASA-N 0 0 372.292 5.243 40 0 FKABRN O=C(Cc1cccc(Cl)c1)Nc1ccc(CSc2ccccc2)cc1 ZINC000222732332 568557740 /nfs/dbraw/zinc/55/77/40/568557740.db2.gz AGDVOQQYJWKBAC-UHFFFAOYSA-N 0 0 367.901 5.814 40 0 FKABRN Cc1cccc(CSCC(=O)Nc2ccccc2Oc2ccccc2)c1 ZINC000222739395 568558393 /nfs/dbraw/zinc/55/83/93/568558393.db2.gz KUZHSAYIJWWWCG-UHFFFAOYSA-N 0 0 363.482 5.659 40 0 FKABRN Cc1cccc(CSCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000222741079 568558633 /nfs/dbraw/zinc/55/86/33/568558633.db2.gz LBMJHEBRORNHHL-KRWDZBQOSA-N 0 0 355.547 5.403 40 0 FKABRN Cc1cccc(CSCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1 ZINC000222741143 568558705 /nfs/dbraw/zinc/55/87/05/568558705.db2.gz LBMJHEBRORNHHL-QGZVFWFLSA-N 0 0 355.547 5.403 40 0 FKABRN Cc1cccc(CSCC(=O)Nc2ccc(OC3CCCC3)cc2)c1 ZINC000222742944 568558830 /nfs/dbraw/zinc/55/88/30/568558830.db2.gz IYDYQCNPQPLZKF-UHFFFAOYSA-N 0 0 355.503 5.188 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)CSCc2cccc(C)c2)cc1 ZINC000222744141 568558949 /nfs/dbraw/zinc/55/89/49/568558949.db2.gz IMGSOANUTMBJSD-OAQYLSRUSA-N 0 0 371.546 5.140 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)CSCc2cccc(C)c2)cc1 ZINC000222744201 568558986 /nfs/dbraw/zinc/55/89/86/568558986.db2.gz IMGSOANUTMBJSD-NRFANRHFSA-N 0 0 371.546 5.140 40 0 FKABRN O=C(NCc1ccc2ccccc2c1)C(c1ccccc1)c1ccccc1 ZINC000222745819 568559276 /nfs/dbraw/zinc/55/92/76/568559276.db2.gz YNGYZUVRSSLOQB-UHFFFAOYSA-N 0 0 351.449 5.288 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1Cl)NCc1ccc2ccccc2c1 ZINC000222747084 568559424 /nfs/dbraw/zinc/55/94/24/568559424.db2.gz SBGMBUSBXPTQLB-CSKARUKUSA-N 0 0 356.252 5.476 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc2ccccc2c1 ZINC000222748013 568559454 /nfs/dbraw/zinc/55/94/54/568559454.db2.gz PWTJKPKHXTZNJT-CQSZACIVSA-N 0 0 355.890 5.290 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc2ccccc2c1 ZINC000222748066 568559445 /nfs/dbraw/zinc/55/94/45/568559445.db2.gz PWTJKPKHXTZNJT-AWEZNQCLSA-N 0 0 355.890 5.290 40 0 FKABRN Cc1cccc(CSCC(=O)NCCCc2ccc(C(C)C)cc2)c1 ZINC000222748187 568559462 /nfs/dbraw/zinc/55/94/62/568559462.db2.gz YEURLYJOKJDSBD-UHFFFAOYSA-N 0 0 355.547 5.101 40 0 FKABRN O=C(CSCc1ccccc1Cl)NCc1ccc2ccccc2c1 ZINC000222748684 568559448 /nfs/dbraw/zinc/55/94/48/568559448.db2.gz NTHIJTGATXJBPR-UHFFFAOYSA-N 0 0 355.890 5.043 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)NCc1ccc2ccccc2c1 ZINC000222748762 568559451 /nfs/dbraw/zinc/55/94/51/568559451.db2.gz BHDJGGROMPUTBF-UHFFFAOYSA-N 0 0 355.890 5.043 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1)NCc1ccc2ccccc2c1 ZINC000222748845 568559474 /nfs/dbraw/zinc/55/94/74/568559474.db2.gz ASXXRACCPBZVFC-UHFFFAOYSA-N 0 0 355.890 5.043 40 0 FKABRN O=C(CCSc1ccc(Cl)cc1)NCc1ccc2ccccc2c1 ZINC000222749489 568559549 /nfs/dbraw/zinc/55/95/49/568559549.db2.gz FIAXPSRRJPZDRR-UHFFFAOYSA-N 0 0 355.890 5.292 40 0 FKABRN O=C(NCc1ccc2ccccc2c1)/C(=C/c1ccco1)c1ccccc1 ZINC000222750001 222748620 /nfs/dbraw/zinc/74/86/20/222748620.db2.gz WYTNKGHYKNATAG-XQNSMLJCSA-N 0 0 353.421 5.290 40 0 FKABRN O=C(NCc1ccc2ccccc2c1)/C(=C/c1ccccc1)c1ccccc1 ZINC000222750710 222748938 /nfs/dbraw/zinc/74/89/38/222748938.db2.gz MRKKELRLHDYLLI-XIEYBQDHSA-N 0 0 363.460 5.697 40 0 FKABRN O=C(CSCc1c(F)cccc1Cl)NCc1ccc2ccccc2c1 ZINC000222751081 222748940 /nfs/dbraw/zinc/74/89/40/222748940.db2.gz SIHRPXMPDWSATH-UHFFFAOYSA-N 0 0 373.880 5.182 40 0 FKABRN Cc1cccc(OCC(=O)Nc2ccc(CSc3ccccc3)cc2)c1 ZINC000222752115 568559726 /nfs/dbraw/zinc/55/97/26/568559726.db2.gz BOUZUBBSGNVJMU-UHFFFAOYSA-N 0 0 363.482 5.305 40 0 FKABRN Cc1ccc(OCC(=O)Nc2ccc(CSc3ccccc3)cc2)cc1 ZINC000222758294 568560245 /nfs/dbraw/zinc/56/02/45/568560245.db2.gz GZEFFXVQSHMBHU-UHFFFAOYSA-N 0 0 363.482 5.305 40 0 FKABRN COc1cccc(Oc2ccc(Cl)cc2NC(=O)Cc2cccs2)c1 ZINC000222760401 568560547 /nfs/dbraw/zinc/56/05/47/568560547.db2.gz CPYFFTGVFGIBSB-UHFFFAOYSA-N 0 0 373.861 5.384 40 0 FKABRN O=C(CC(c1ccccc1)c1ccccc1)NCCSC1CCCC1 ZINC000222763415 568560658 /nfs/dbraw/zinc/56/06/58/568560658.db2.gz QRZLIQBKNNGTPY-UHFFFAOYSA-N 0 0 353.531 5.001 40 0 FKABRN O=C(COc1cccc(Cl)c1)Nc1ccccc1Oc1ccccc1 ZINC000222766755 568560847 /nfs/dbraw/zinc/56/08/47/568560847.db2.gz HJCGBQGTQSDHAI-UHFFFAOYSA-N 0 0 353.805 5.150 40 0 FKABRN O=C(COc1ccccc1F)Nc1ccc(CSc2ccccc2)cc1 ZINC000222773942 568561431 /nfs/dbraw/zinc/56/14/31/568561431.db2.gz WHOLWSUVEDXBPO-UHFFFAOYSA-N 0 0 367.445 5.136 40 0 FKABRN O=C(NCc1ccc2ccccc2c1)c1cc2c(ccc3ccccc23)o1 ZINC000222774525 568561624 /nfs/dbraw/zinc/56/16/24/568561624.db2.gz NODHVGOYRLHZDA-UHFFFAOYSA-N 0 0 351.405 5.669 40 0 FKABRN O=C(COc1ccc(F)cc1)Nc1ccc(CSc2ccccc2)cc1 ZINC000222780315 568562300 /nfs/dbraw/zinc/56/23/00/568562300.db2.gz VZPCAZXUYHGQAX-UHFFFAOYSA-N 0 0 367.445 5.136 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc2ccccc2c1 ZINC000222780642 568562276 /nfs/dbraw/zinc/56/22/76/568562276.db2.gz YMZUKEGLQNHMDE-QGZVFWFLSA-N 0 0 361.485 5.221 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc2ccccc2c1 ZINC000222780711 568562306 /nfs/dbraw/zinc/56/23/06/568562306.db2.gz YMZUKEGLQNHMDE-KRWDZBQOSA-N 0 0 361.485 5.221 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)NCc2ccc3ccccc3c2)cc(C)c1Cl ZINC000222781319 568562361 /nfs/dbraw/zinc/56/23/61/568562361.db2.gz AAGHAEMPFHFCOR-INIZCTEOSA-N 0 0 367.876 5.194 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)NCc2ccc3ccccc3c2)cc(C)c1Cl ZINC000222781373 568562405 /nfs/dbraw/zinc/56/24/05/568562405.db2.gz AAGHAEMPFHFCOR-MRXNPFEDSA-N 0 0 367.876 5.194 40 0 FKABRN O=C(NCc1ccc2ccccc2c1)c1cccc(OCc2ccccc2)c1 ZINC000222787793 206424434 /nfs/dbraw/zinc/42/44/34/206424434.db2.gz BMZHBLFCPRIARI-UHFFFAOYSA-N 0 0 367.448 5.349 40 0 FKABRN O=C(NCc1ccc2ccccc2c1)c1ccccc1OCc1ccccc1 ZINC000222788053 568563065 /nfs/dbraw/zinc/56/30/65/568563065.db2.gz HFVHAELRIRJNKG-UHFFFAOYSA-N 0 0 367.448 5.349 40 0 FKABRN O=C(NCc1ccc2ccccc2c1)c1ccccc1CCc1ccccc1 ZINC000222788330 568563157 /nfs/dbraw/zinc/56/31/57/568563157.db2.gz QIEQAXHUOUDABT-UHFFFAOYSA-N 0 0 365.476 5.555 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc2ccccc2c1 ZINC000222788564 568563223 /nfs/dbraw/zinc/56/32/23/568563223.db2.gz KGZQGTJDOVGWBB-QGZVFWFLSA-N 0 0 355.437 5.077 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc2ccccc2c1 ZINC000222788624 568563202 /nfs/dbraw/zinc/56/32/02/568563202.db2.gz KGZQGTJDOVGWBB-KRWDZBQOSA-N 0 0 355.437 5.077 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)NCc1ccc2ccccc2c1 ZINC000222788708 222749217 /nfs/dbraw/zinc/74/92/17/222749217.db2.gz MBWKSLSMFQNXQP-QGZVFWFLSA-N 0 0 355.437 5.077 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)NCc1ccc2ccccc2c1 ZINC000222788777 568563194 /nfs/dbraw/zinc/56/31/94/568563194.db2.gz MBWKSLSMFQNXQP-KRWDZBQOSA-N 0 0 355.437 5.077 40 0 FKABRN O=C(CC(c1ccccc1)c1ccccc1)NCc1ccc2ccccc2c1 ZINC000222790039 568563232 /nfs/dbraw/zinc/56/32/32/568563232.db2.gz CXMIGDOIAAUZJZ-UHFFFAOYSA-N 0 0 365.476 5.678 40 0 FKABRN Cc1ccc(CCC(=O)Nc2nnc(-c3ccc(Cl)cc3)s2)cc1C ZINC000222793446 568563408 /nfs/dbraw/zinc/56/34/08/568563408.db2.gz BWMJOGPUJVXRBN-UHFFFAOYSA-N 0 0 371.893 5.047 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(Br)c(Cl)c2)cc1C ZINC000222795278 568563731 /nfs/dbraw/zinc/56/37/31/568563731.db2.gz BDSUDTNAPIDKFD-UHFFFAOYSA-N 0 0 368.658 5.062 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)NCc1ccc2ccccc2c1 ZINC000222796359 568563907 /nfs/dbraw/zinc/56/39/07/568563907.db2.gz IDLRUDVEECWBOI-HSZRJFAPSA-N 0 0 369.464 5.467 40 0 FKABRN C[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(C(C)(C)C)cc1 ZINC000222796371 568563905 /nfs/dbraw/zinc/56/39/05/568563905.db2.gz OSAIWNKAVQEXEL-QGZVFWFLSA-N 0 0 367.533 5.538 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)NCc1ccc2ccccc2c1 ZINC000222796422 222750908 /nfs/dbraw/zinc/75/09/08/222750908.db2.gz IDLRUDVEECWBOI-QHCPKHFHSA-N 0 0 369.464 5.467 40 0 FKABRN C[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(C(C)(C)C)cc1 ZINC000222796434 568563923 /nfs/dbraw/zinc/56/39/23/568563923.db2.gz OSAIWNKAVQEXEL-KRWDZBQOSA-N 0 0 367.533 5.538 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc2ccccc2c1 ZINC000222796518 568563933 /nfs/dbraw/zinc/56/39/33/568563933.db2.gz PTGTUNOKOHQWKJ-XMMPIXPASA-N 0 0 369.464 5.467 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1ccc2ccccc2c1 ZINC000222796970 568563970 /nfs/dbraw/zinc/56/39/70/568563970.db2.gz PTGTUNOKOHQWKJ-DEOSSOPVSA-N 0 0 369.464 5.467 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc2ccccc2c1 ZINC000222797509 568564115 /nfs/dbraw/zinc/56/41/15/568564115.db2.gz SAOUBGUXZJHGMU-HXUWFJFHSA-N 0 0 369.917 5.680 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1ccc2ccccc2c1 ZINC000222797556 222751165 /nfs/dbraw/zinc/75/11/65/222751165.db2.gz SAOUBGUXZJHGMU-FQEVSTJZSA-N 0 0 369.917 5.680 40 0 FKABRN CC(C)(C)c1ccccc1OCC(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000222798611 568564357 /nfs/dbraw/zinc/56/43/57/568564357.db2.gz RZXDLCTVPAYXKN-UHFFFAOYSA-N 0 0 367.489 5.323 40 0 FKABRN CC(C)C[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccccc1 ZINC000222799743 568564528 /nfs/dbraw/zinc/56/45/28/568564528.db2.gz HQMZLEDDABQGKG-HXUWFJFHSA-N 0 0 353.506 5.267 40 0 FKABRN CC(C)C[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccccc1 ZINC000222799818 568564501 /nfs/dbraw/zinc/56/45/01/568564501.db2.gz HQMZLEDDABQGKG-FQEVSTJZSA-N 0 0 353.506 5.267 40 0 FKABRN CC[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(C)c(C)c1 ZINC000222801792 568564586 /nfs/dbraw/zinc/56/45/86/568564586.db2.gz FNZBZHYFFZTZHQ-HXUWFJFHSA-N 0 0 353.506 5.247 40 0 FKABRN CC[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(C)c(C)c1 ZINC000222801861 568564676 /nfs/dbraw/zinc/56/46/76/568564676.db2.gz FNZBZHYFFZTZHQ-FQEVSTJZSA-N 0 0 353.506 5.247 40 0 FKABRN CC[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(C)cc1C ZINC000222801954 206424517 /nfs/dbraw/zinc/42/45/17/206424517.db2.gz XICPSKIYHAGPMH-HXUWFJFHSA-N 0 0 353.506 5.247 40 0 FKABRN CC[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc(C)cc1C ZINC000222802000 568564665 /nfs/dbraw/zinc/56/46/65/568564665.db2.gz XICPSKIYHAGPMH-FQEVSTJZSA-N 0 0 353.506 5.247 40 0 FKABRN CC(C)c1ccc(CCCNC(=O)COc2ccccc2C(C)(C)C)cc1 ZINC000222803734 568565204 /nfs/dbraw/zinc/56/52/04/568565204.db2.gz KRRJRYZAVNVUEY-UHFFFAOYSA-N 0 0 367.533 5.235 40 0 FKABRN CC(C)c1ccccc1OCC(=O)N(Cc1ccccc1)Cc1ccccc1 ZINC000222804280 568565208 /nfs/dbraw/zinc/56/52/08/568565208.db2.gz QSRBHIJUMGYMMV-UHFFFAOYSA-N 0 0 373.496 5.418 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccccc2C)cc1C ZINC000222804644 568565320 /nfs/dbraw/zinc/56/53/20/568565320.db2.gz BRBILLDSFPASSU-QHCPKHFHSA-N 0 0 359.469 5.222 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](c2ccccc2)c2ccccc2C)cc1C ZINC000222804714 568565357 /nfs/dbraw/zinc/56/53/57/568565357.db2.gz BRBILLDSFPASSU-HSZRJFAPSA-N 0 0 359.469 5.222 40 0 FKABRN CC(C)c1ccccc1OCC(=O)Nc1ccccc1Oc1ccccc1 ZINC000222807226 568565607 /nfs/dbraw/zinc/56/56/07/568565607.db2.gz FNDMNBAQIYJDJR-UHFFFAOYSA-N 0 0 361.441 5.620 40 0 FKABRN CC(C)c1ccccc1OCC(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222808409 206424527 /nfs/dbraw/zinc/42/45/27/206424527.db2.gz ZRZSIFSOQKBPJZ-KRWDZBQOSA-N 0 0 353.506 5.364 40 0 FKABRN CC(C)c1ccccc1OCC(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222808473 568565713 /nfs/dbraw/zinc/56/57/13/568565713.db2.gz ZRZSIFSOQKBPJZ-QGZVFWFLSA-N 0 0 353.506 5.364 40 0 FKABRN CC(C)c1ccccc1OCC(=O)Nc1ccccc1C(=O)c1ccccc1 ZINC000222810159 568566108 /nfs/dbraw/zinc/56/61/08/568566108.db2.gz STWSLBUNKWAHGT-UHFFFAOYSA-N 0 0 373.452 5.059 40 0 FKABRN CC(C)c1ccccc1OCC(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000222810533 568566064 /nfs/dbraw/zinc/56/60/64/568566064.db2.gz ZFAROOPXUAJLIA-UHFFFAOYSA-N 0 0 353.462 5.149 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)COc2ccccc2C(C)C)cc1 ZINC000222811227 222751685 /nfs/dbraw/zinc/75/16/85/222751685.db2.gz NYVPOQPCIMAIRH-OAQYLSRUSA-N 0 0 369.505 5.101 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)COc2ccccc2C(C)C)cc1 ZINC000222811290 568566062 /nfs/dbraw/zinc/56/60/62/568566062.db2.gz NYVPOQPCIMAIRH-NRFANRHFSA-N 0 0 369.505 5.101 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)NCc1ccc2ccccc2c1 ZINC000222814424 568566565 /nfs/dbraw/zinc/56/65/65/568566565.db2.gz RDUFMCAKKMOSGZ-UHFFFAOYSA-N 0 0 369.917 5.682 40 0 FKABRN CC(C)c1ccc(CCCNC(=O)COc2ccccc2C(C)C)cc1 ZINC000222815147 568566724 /nfs/dbraw/zinc/56/67/24/568566724.db2.gz XQQXFPKQUXTRPX-UHFFFAOYSA-N 0 0 353.506 5.061 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)NCc1ccc2ccccc2c1 ZINC000222816250 222750854 /nfs/dbraw/zinc/75/08/54/222750854.db2.gz DSGDMJOTSGZYJH-OAQYLSRUSA-N 0 0 367.876 5.275 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)NCc1ccc2ccccc2c1 ZINC000222816322 568566802 /nfs/dbraw/zinc/56/68/02/568566802.db2.gz DSGDMJOTSGZYJH-NRFANRHFSA-N 0 0 367.876 5.275 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCc2ccc3ccccc3c2)c1 ZINC000222817261 568566952 /nfs/dbraw/zinc/56/69/52/568566952.db2.gz IUNBWPPSPYPGFH-SFHVURJKSA-N 0 0 361.485 5.355 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCc2ccc3ccccc3c2)c1 ZINC000222817325 568566927 /nfs/dbraw/zinc/56/69/27/568566927.db2.gz IUNBWPPSPYPGFH-GOSISDBHSA-N 0 0 361.485 5.355 40 0 FKABRN CC(C)(C)c1ccc(CCC(=O)NCc2cccc(C(F)(F)F)c2)cc1 ZINC000222817329 222752214 /nfs/dbraw/zinc/75/22/14/222752214.db2.gz MQNHVMOTSNPVIW-UHFFFAOYSA-N 0 0 363.423 5.252 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1F)NCc1ccc2ccccc2c1 ZINC000222819143 206425364 /nfs/dbraw/zinc/42/53/64/206425364.db2.gz PMIJAPBHCZMFGD-UHFFFAOYSA-N 0 0 373.880 5.182 40 0 FKABRN O=C(CCc1ccccc1F)N[C@@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000222820941 568567513 /nfs/dbraw/zinc/56/75/13/568567513.db2.gz CPYOVDYCFGBBND-HXUWFJFHSA-N 0 0 367.464 5.101 40 0 FKABRN O=C(CCc1ccccc1F)N[C@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000222820999 568567522 /nfs/dbraw/zinc/56/75/22/568567522.db2.gz CPYOVDYCFGBBND-FQEVSTJZSA-N 0 0 367.464 5.101 40 0 FKABRN O=C(CCc1ccc(Cl)c(Cl)c1)NCc1ccc2ccccc2c1 ZINC000222822020 568567656 /nfs/dbraw/zinc/56/76/56/568567656.db2.gz VMPAHWTYXWRSTP-UHFFFAOYSA-N 0 0 358.268 5.396 40 0 FKABRN O=C(CCc1c(Cl)cccc1Cl)NCc1ccc2ccccc2c1 ZINC000222822098 568567652 /nfs/dbraw/zinc/56/76/52/568567652.db2.gz OKADNHKTNMFCAB-UHFFFAOYSA-N 0 0 358.268 5.396 40 0 FKABRN O=C(CCc1ccc(Cl)cc1Cl)NCc1ccc2ccccc2c1 ZINC000222822180 568567640 /nfs/dbraw/zinc/56/76/40/568567640.db2.gz ULYUXPOGUAHPOA-UHFFFAOYSA-N 0 0 358.268 5.396 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1Cl)NCc1cccc2ccccc21 ZINC000222825790 568568094 /nfs/dbraw/zinc/56/80/94/568568094.db2.gz SAEMYNAZGBHMDJ-PKNBQFBNSA-N 0 0 356.252 5.476 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1cccc2ccccc21 ZINC000222826900 568568168 /nfs/dbraw/zinc/56/81/68/568568168.db2.gz RAISJRDHPQTZRA-CQSZACIVSA-N 0 0 355.890 5.290 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1cccc2ccccc21 ZINC000222826952 568568220 /nfs/dbraw/zinc/56/82/20/568568220.db2.gz RAISJRDHPQTZRA-AWEZNQCLSA-N 0 0 355.890 5.290 40 0 FKABRN O=C(CSCc1ccccc1Cl)NCc1cccc2ccccc21 ZINC000222827448 568568353 /nfs/dbraw/zinc/56/83/53/568568353.db2.gz GQBKHGRZBCTAME-UHFFFAOYSA-N 0 0 355.890 5.043 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)NCc1cccc2ccccc21 ZINC000222827538 222752181 /nfs/dbraw/zinc/75/21/81/222752181.db2.gz ICRZMPLSMKCKCB-UHFFFAOYSA-N 0 0 355.890 5.043 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1)NCc1cccc2ccccc21 ZINC000222827634 568568275 /nfs/dbraw/zinc/56/82/75/568568275.db2.gz HUBPJDIYTQPRBI-UHFFFAOYSA-N 0 0 355.890 5.043 40 0 FKABRN O=C(CCSc1ccc(Cl)cc1)NCc1cccc2ccccc21 ZINC000222828257 568568462 /nfs/dbraw/zinc/56/84/62/568568462.db2.gz IQZKLXQHXBLIJK-UHFFFAOYSA-N 0 0 355.890 5.292 40 0 FKABRN O=C(NCc1cccc2ccccc21)/C(=C/c1ccco1)c1ccccc1 ZINC000222828758 568568528 /nfs/dbraw/zinc/56/85/28/568568528.db2.gz NLRMRXDKIXVCLC-XQNSMLJCSA-N 0 0 353.421 5.290 40 0 FKABRN O=C(NCc1cccc2ccccc21)/C(=C/c1ccccc1)c1ccccc1 ZINC000222829772 568568652 /nfs/dbraw/zinc/56/86/52/568568652.db2.gz IYSVVOGIMPENOO-XIEYBQDHSA-N 0 0 363.460 5.697 40 0 FKABRN O=C(CSCc1c(F)cccc1Cl)NCc1cccc2ccccc21 ZINC000222830129 568568762 /nfs/dbraw/zinc/56/87/62/568568762.db2.gz FCLWTHAKPNDVED-UHFFFAOYSA-N 0 0 373.880 5.182 40 0 FKABRN C[C@@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(C(C)(C)C)cc1 ZINC000222833736 568569340 /nfs/dbraw/zinc/56/93/40/568569340.db2.gz KKZVJDHHOGEECU-QGZVFWFLSA-N 0 0 361.485 5.394 40 0 FKABRN C[C@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(C(C)(C)C)cc1 ZINC000222833801 568569407 /nfs/dbraw/zinc/56/94/07/568569407.db2.gz KKZVJDHHOGEECU-KRWDZBQOSA-N 0 0 361.485 5.394 40 0 FKABRN O=C(COc1ccc2ccccc2c1)Nc1ccc(OC2CCCC2)cc1 ZINC000222835709 568569848 /nfs/dbraw/zinc/56/98/48/568569848.db2.gz JPFXILYFUIZZKJ-UHFFFAOYSA-N 0 0 361.441 5.179 40 0 FKABRN CC(C)c1ccc(CCCNC(=O)COc2ccc3ccccc3c2)cc1 ZINC000222839124 568570277 /nfs/dbraw/zinc/57/02/77/568570277.db2.gz OWKDLRUNTQHIHR-UHFFFAOYSA-N 0 0 361.485 5.091 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)NCc2ccc(Cl)cc2Cl)ccc1Cl ZINC000222841049 568570692 /nfs/dbraw/zinc/57/06/92/568570692.db2.gz VCBYRYVMQPLFSA-NSHDSACASA-N 0 0 372.679 5.039 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)NCc2ccc(Cl)cc2Cl)ccc1Cl ZINC000222841110 568570684 /nfs/dbraw/zinc/57/06/84/568570684.db2.gz VCBYRYVMQPLFSA-LLVKDONJSA-N 0 0 372.679 5.039 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc1C ZINC000222846649 206425452 /nfs/dbraw/zinc/42/54/52/206425452.db2.gz AEMXOGDEMLEVOP-UHFFFAOYSA-N 0 0 359.513 6.024 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCCCc2ccc(Cl)cc2)c1 ZINC000222847799 568571730 /nfs/dbraw/zinc/57/17/30/568571730.db2.gz SHFGVUATNJZCHZ-KRWDZBQOSA-N 0 0 373.924 5.288 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCCCc2ccc(Cl)cc2)c1 ZINC000222847878 568571694 /nfs/dbraw/zinc/57/16/94/568571694.db2.gz SHFGVUATNJZCHZ-QGZVFWFLSA-N 0 0 373.924 5.288 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)ccc1Cl ZINC000222848809 568571778 /nfs/dbraw/zinc/57/17/78/568571778.db2.gz XKTVNHAPWJWTFS-HOTGVXAUSA-N 0 0 373.924 5.591 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)ccc1Cl ZINC000222848877 222753720 /nfs/dbraw/zinc/75/37/20/222753720.db2.gz XKTVNHAPWJWTFS-JKSUJKDBSA-N 0 0 373.924 5.591 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)ccc1Cl ZINC000222848939 222753293 /nfs/dbraw/zinc/75/32/93/222753293.db2.gz XKTVNHAPWJWTFS-CVEARBPZSA-N 0 0 373.924 5.591 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)ccc1Cl ZINC000222848997 568571821 /nfs/dbraw/zinc/57/18/21/568571821.db2.gz XKTVNHAPWJWTFS-HZPDHXFCSA-N 0 0 373.924 5.591 40 0 FKABRN O=C(NCc1cccc2ccccc21)c1cc2c(ccc3ccccc23)o1 ZINC000222852157 568572334 /nfs/dbraw/zinc/57/23/34/568572334.db2.gz ZTGFVHMEUWHXLR-UHFFFAOYSA-N 0 0 351.405 5.669 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc(OC3CCCC3)cc2)ccc1Cl ZINC000222852504 568572299 /nfs/dbraw/zinc/57/22/99/568572299.db2.gz SXGZIOJMOSAFCZ-HNNXBMFYSA-N 0 0 373.880 5.376 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc(OC3CCCC3)cc2)ccc1Cl ZINC000222852556 568572274 /nfs/dbraw/zinc/57/22/74/568572274.db2.gz SXGZIOJMOSAFCZ-OAHLLOKOSA-N 0 0 373.880 5.376 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)ccc1Cl ZINC000222852980 568572445 /nfs/dbraw/zinc/57/24/45/568572445.db2.gz CAHOLDBBTQXPRQ-JXFKEZNVSA-N 0 0 359.897 5.319 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)ccc1Cl ZINC000222853045 568572348 /nfs/dbraw/zinc/57/23/48/568572348.db2.gz CAHOLDBBTQXPRQ-UZLBHIALSA-N 0 0 359.897 5.319 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)ccc1Cl ZINC000222853113 568572407 /nfs/dbraw/zinc/57/24/07/568572407.db2.gz CAHOLDBBTQXPRQ-OXJNMPFZSA-N 0 0 359.897 5.319 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)ccc1Cl ZINC000222853169 568572416 /nfs/dbraw/zinc/57/24/16/568572416.db2.gz CAHOLDBBTQXPRQ-OXQOHEQNSA-N 0 0 359.897 5.319 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)c(C)c1 ZINC000222856448 568572964 /nfs/dbraw/zinc/57/29/64/568572964.db2.gz GAOJTIATAXJMGH-OXQOHEQNSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)c(C)c1 ZINC000222856511 206425183 /nfs/dbraw/zinc/42/51/83/206425183.db2.gz GAOJTIATAXJMGH-UZLBHIALSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)c(C)c1 ZINC000222856567 568572978 /nfs/dbraw/zinc/57/29/78/568572978.db2.gz GAOJTIATAXJMGH-OXJNMPFZSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)c(C)c1 ZINC000222856653 568572901 /nfs/dbraw/zinc/57/29/01/568572901.db2.gz GAOJTIATAXJMGH-JXFKEZNVSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)cc1C ZINC000222856733 568572920 /nfs/dbraw/zinc/57/29/20/568572920.db2.gz MGPSRNCBDIYOQX-OXQOHEQNSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)cc1C ZINC000222856784 568572937 /nfs/dbraw/zinc/57/29/37/568572937.db2.gz MGPSRNCBDIYOQX-UZLBHIALSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)cc1C ZINC000222856862 568572918 /nfs/dbraw/zinc/57/29/18/568572918.db2.gz MGPSRNCBDIYOQX-OXJNMPFZSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1ccc(Cl)c(C)c1)c1ccc(C)cc1C ZINC000222856939 206425760 /nfs/dbraw/zinc/42/57/60/206425760.db2.gz MGPSRNCBDIYOQX-JXFKEZNVSA-N 0 0 359.897 5.300 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1cccc2ccccc21 ZINC000222857711 568573051 /nfs/dbraw/zinc/57/30/51/568573051.db2.gz BTLBISVLEWOSMM-QGZVFWFLSA-N 0 0 361.485 5.221 40 0 FKABRN C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1cccc2ccccc21 ZINC000222857766 206425831 /nfs/dbraw/zinc/42/58/31/206425831.db2.gz BTLBISVLEWOSMM-KRWDZBQOSA-N 0 0 361.485 5.221 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)NCc2cccc3ccccc32)cc(C)c1Cl ZINC000222858363 568573119 /nfs/dbraw/zinc/57/31/19/568573119.db2.gz VPERZPUQTSUWGG-INIZCTEOSA-N 0 0 367.876 5.194 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)NCc2cccc3ccccc32)cc(C)c1Cl ZINC000222858419 568573099 /nfs/dbraw/zinc/57/30/99/568573099.db2.gz VPERZPUQTSUWGG-MRXNPFEDSA-N 0 0 367.876 5.194 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)NCCCc2ccc(C(C)C)cc2)ccc1Cl ZINC000222858637 222754357 /nfs/dbraw/zinc/75/43/57/222754357.db2.gz ILQAAACJEPIJNB-KRWDZBQOSA-N 0 0 373.924 5.288 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)NCCCc2ccc(C(C)C)cc2)ccc1Cl ZINC000222858693 568573301 /nfs/dbraw/zinc/57/33/01/568573301.db2.gz ILQAAACJEPIJNB-QGZVFWFLSA-N 0 0 373.924 5.288 40 0 FKABRN O=C(NCc1cccc2ccccc21)c1cccc(OCc2ccccc2)c1 ZINC000222864541 568573663 /nfs/dbraw/zinc/57/36/63/568573663.db2.gz NCHZDPVJDCRBDT-UHFFFAOYSA-N 0 0 367.448 5.349 40 0 FKABRN O=C(NCc1cccc2ccccc21)c1ccccc1OCc1ccccc1 ZINC000222864809 568573784 /nfs/dbraw/zinc/57/37/84/568573784.db2.gz HXNSRHIWBJKENX-UHFFFAOYSA-N 0 0 367.448 5.349 40 0 FKABRN O=C(NCc1cccc2ccccc21)c1ccccc1CCc1ccccc1 ZINC000222865048 568573766 /nfs/dbraw/zinc/57/37/66/568573766.db2.gz WKKJIDYANANDDP-UHFFFAOYSA-N 0 0 365.476 5.555 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1cccc2ccccc21 ZINC000222865237 568573802 /nfs/dbraw/zinc/57/38/02/568573802.db2.gz AKMIJCQGDQKUCM-QGZVFWFLSA-N 0 0 355.437 5.077 40 0 FKABRN C[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1cccc2ccccc21 ZINC000222865300 209740309 /nfs/dbraw/zinc/74/03/09/209740309.db2.gz AKMIJCQGDQKUCM-KRWDZBQOSA-N 0 0 355.437 5.077 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)NCc1cccc2ccccc21 ZINC000222865397 568573781 /nfs/dbraw/zinc/57/37/81/568573781.db2.gz IJHZREDPMYJUJK-QGZVFWFLSA-N 0 0 355.437 5.077 40 0 FKABRN C[C@H](Oc1cccc2ccccc21)C(=O)NCc1cccc2ccccc21 ZINC000222865470 568573911 /nfs/dbraw/zinc/57/39/11/568573911.db2.gz IJHZREDPMYJUJK-KRWDZBQOSA-N 0 0 355.437 5.077 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)Nc2cccc(C(F)(F)F)c2)cc1 ZINC000222872961 568574563 /nfs/dbraw/zinc/57/45/63/568574563.db2.gz UKYNDNQWOPONKV-KRWDZBQOSA-N 0 0 351.368 5.064 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)NCc1cccc2ccccc21 ZINC000222872998 568574645 /nfs/dbraw/zinc/57/46/45/568574645.db2.gz NRBZNMLKBCCBFX-HSZRJFAPSA-N 0 0 369.464 5.467 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)Nc2cccc(C(F)(F)F)c2)cc1 ZINC000222873028 568574605 /nfs/dbraw/zinc/57/46/05/568574605.db2.gz UKYNDNQWOPONKV-QGZVFWFLSA-N 0 0 351.368 5.064 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)NCc1cccc2ccccc21 ZINC000222873042 568574561 /nfs/dbraw/zinc/57/45/61/568574561.db2.gz NRBZNMLKBCCBFX-QHCPKHFHSA-N 0 0 369.464 5.467 40 0 FKABRN CC[C@@H](Oc1ccc2ccccc2c1)C(=O)NCc1cccc2ccccc21 ZINC000222873132 568574557 /nfs/dbraw/zinc/57/45/57/568574557.db2.gz ILXWMZMNQXFLFF-XMMPIXPASA-N 0 0 369.464 5.467 40 0 FKABRN CC[C@H](Oc1ccc2ccccc2c1)C(=O)NCc1cccc2ccccc21 ZINC000222873188 568574562 /nfs/dbraw/zinc/57/45/62/568574562.db2.gz ILXWMZMNQXFLFF-DEOSSOPVSA-N 0 0 369.464 5.467 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 ZINC000222873604 206427532 /nfs/dbraw/zinc/42/75/32/206427532.db2.gz NBCLMVVHQXVXKW-KRWDZBQOSA-N 0 0 352.261 5.352 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 ZINC000222873660 568574728 /nfs/dbraw/zinc/57/47/28/568574728.db2.gz NBCLMVVHQXVXKW-QGZVFWFLSA-N 0 0 352.261 5.352 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NCc1cccc2ccccc21 ZINC000222873708 222755547 /nfs/dbraw/zinc/75/55/47/222755547.db2.gz FWAAVBVQVSWINN-HXUWFJFHSA-N 0 0 369.917 5.680 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NCc1cccc2ccccc21 ZINC000222873779 222754834 /nfs/dbraw/zinc/75/48/34/222754834.db2.gz FWAAVBVQVSWINN-FQEVSTJZSA-N 0 0 369.917 5.680 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)Nc2cc(Cl)ccc2Cl)cc1 ZINC000222873926 206426670 /nfs/dbraw/zinc/42/66/70/206426670.db2.gz OQTFVRMAYIKMJH-KRWDZBQOSA-N 0 0 352.261 5.352 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)Nc2cc(Cl)ccc2Cl)cc1 ZINC000222873984 206426864 /nfs/dbraw/zinc/42/68/64/206426864.db2.gz OQTFVRMAYIKMJH-QGZVFWFLSA-N 0 0 352.261 5.352 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)NCc2ccc(Cl)cc2Cl)cc1 ZINC000222875668 222755447 /nfs/dbraw/zinc/75/54/47/222755447.db2.gz APBJUIHUPKZZCH-SFHVURJKSA-N 0 0 366.288 5.030 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)NCc2ccc(Cl)cc2Cl)cc1 ZINC000222875728 568574907 /nfs/dbraw/zinc/57/49/07/568574907.db2.gz APBJUIHUPKZZCH-GOSISDBHSA-N 0 0 366.288 5.030 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)Nc2ccccc2C(F)(F)F)cc1 ZINC000222877157 568574993 /nfs/dbraw/zinc/57/49/93/568574993.db2.gz WGWNMULJARKCBM-KRWDZBQOSA-N 0 0 351.368 5.064 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)Nc2ccccc2C(F)(F)F)cc1 ZINC000222877218 206427315 /nfs/dbraw/zinc/42/73/15/206427315.db2.gz WGWNMULJARKCBM-QGZVFWFLSA-N 0 0 351.368 5.064 40 0 FKABRN O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1ccc(Cl)cc1F ZINC000222882191 568575416 /nfs/dbraw/zinc/57/54/16/568575416.db2.gz AHRVNYGMHWJLAS-UHFFFAOYSA-N 0 0 352.114 5.404 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000222885934 568575959 /nfs/dbraw/zinc/57/59/59/568575959.db2.gz BFFDKWQJZFLAGP-KRWDZBQOSA-N 0 0 352.261 5.352 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000222885990 568575944 /nfs/dbraw/zinc/57/59/44/568575944.db2.gz BFFDKWQJZFLAGP-QGZVFWFLSA-N 0 0 352.261 5.352 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000222889424 568576274 /nfs/dbraw/zinc/57/62/74/568576274.db2.gz MTMCXDUCNYKOTD-QHCPKHFHSA-N 0 0 373.496 5.312 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000222889493 568576287 /nfs/dbraw/zinc/57/62/87/568576287.db2.gz MTMCXDUCNYKOTD-HSZRJFAPSA-N 0 0 373.496 5.312 40 0 FKABRN O=C(CCCSc1ccc(Cl)cc1)NCc1cccc2ccccc21 ZINC000222890584 568576259 /nfs/dbraw/zinc/57/62/59/568576259.db2.gz ARXQXDWTEWQHJG-UHFFFAOYSA-N 0 0 369.917 5.682 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000222891400 568576325 /nfs/dbraw/zinc/57/63/25/568576325.db2.gz NBQSBKIQOTXLMC-JTSKRJEESA-N 0 0 367.533 5.581 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000222891461 222755259 /nfs/dbraw/zinc/75/52/59/222755259.db2.gz NBQSBKIQOTXLMC-HTAPYJJXSA-N 0 0 367.533 5.581 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000222891522 568576321 /nfs/dbraw/zinc/57/63/21/568576321.db2.gz NBQSBKIQOTXLMC-VGSWGCGISA-N 0 0 367.533 5.581 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000222891596 568576306 /nfs/dbraw/zinc/57/63/06/568576306.db2.gz NBQSBKIQOTXLMC-VGOFRKELSA-N 0 0 367.533 5.581 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)NCc1cccc2ccccc21 ZINC000222892758 568576411 /nfs/dbraw/zinc/57/64/11/568576411.db2.gz NFKIRQFWMBEECQ-OAQYLSRUSA-N 0 0 367.876 5.275 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)NCc1cccc2ccccc21 ZINC000222892818 568576330 /nfs/dbraw/zinc/57/63/30/568576330.db2.gz NFKIRQFWMBEECQ-NRFANRHFSA-N 0 0 367.876 5.275 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCc2cccc3ccccc32)c1 ZINC000222893397 568576376 /nfs/dbraw/zinc/57/63/76/568576376.db2.gz BNFLWJTXQLAQHE-SFHVURJKSA-N 0 0 361.485 5.355 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCc2cccc3ccccc32)c1 ZINC000222893466 568576357 /nfs/dbraw/zinc/57/63/57/568576357.db2.gz BNFLWJTXQLAQHE-GOSISDBHSA-N 0 0 361.485 5.355 40 0 FKABRN Cc1ccc([C@@H](NC(=O)C2(c3ccccc3)CCCC2)c2ccccc2)cc1 ZINC000222893868 568576526 /nfs/dbraw/zinc/57/65/26/568576526.db2.gz AHHLHCMQBMJZCW-DEOSSOPVSA-N 0 0 369.508 5.713 40 0 FKABRN Cc1ccc([C@H](NC(=O)C2(c3ccccc3)CCCC2)c2ccccc2)cc1 ZINC000222893931 568576543 /nfs/dbraw/zinc/57/65/43/568576543.db2.gz AHHLHCMQBMJZCW-XMMPIXPASA-N 0 0 369.508 5.713 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](C)Oc2cccc3c2CCCC3)cc1 ZINC000222895119 206427089 /nfs/dbraw/zinc/42/70/89/206427089.db2.gz FTVWNWLNBXYHRR-QGZVFWFLSA-N 0 0 351.490 5.314 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](C)Oc2cccc3c2CCCC3)cc1 ZINC000222895179 568576545 /nfs/dbraw/zinc/57/65/45/568576545.db2.gz FTVWNWLNBXYHRR-KRWDZBQOSA-N 0 0 351.490 5.314 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1F)NCc1cccc2ccccc21 ZINC000222895409 568576524 /nfs/dbraw/zinc/57/65/24/568576524.db2.gz HIJIRPDZTFEEAA-UHFFFAOYSA-N 0 0 373.880 5.182 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)Nc2ccc(OC3CCCC3)cc2)cc1 ZINC000222895424 568576461 /nfs/dbraw/zinc/57/64/61/568576461.db2.gz ZJGPYFJJBKVKNN-QFIPXVFZSA-N 0 0 367.489 5.367 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)Nc2ccc(OC3CCCC3)cc2)cc1 ZINC000222895490 568576474 /nfs/dbraw/zinc/57/64/74/568576474.db2.gz ZJGPYFJJBKVKNN-JOCHJYFZSA-N 0 0 367.489 5.367 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](CC(C)C)c2ccccc2)cc1 ZINC000222896069 568576619 /nfs/dbraw/zinc/57/66/19/568576619.db2.gz MKHQWAWQYNFBSY-VXKWHMMOSA-N 0 0 353.506 5.310 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](CC(C)C)c2ccccc2)cc1 ZINC000222896131 568576635 /nfs/dbraw/zinc/57/66/35/568576635.db2.gz MKHQWAWQYNFBSY-FCHUYYIVSA-N 0 0 353.506 5.310 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@H](CC(C)C)c2ccccc2)cc1 ZINC000222896188 206426800 /nfs/dbraw/zinc/42/68/00/206426800.db2.gz MKHQWAWQYNFBSY-YADHBBJMSA-N 0 0 353.506 5.310 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](CC(C)C)c2ccccc2)cc1 ZINC000222896241 568576627 /nfs/dbraw/zinc/57/66/27/568576627.db2.gz MKHQWAWQYNFBSY-FGZHOGPDSA-N 0 0 353.506 5.310 40 0 FKABRN O=C(Nc1ccc(CSc2ccccc2)cc1)c1ccc(Cl)cc1F ZINC000222897420 568576672 /nfs/dbraw/zinc/57/66/72/568576672.db2.gz WFMARBDQIMSMRJ-UHFFFAOYSA-N 0 0 371.864 6.024 40 0 FKABRN O=C(CCc1ccc(Cl)c(Cl)c1)NCc1cccc2ccccc21 ZINC000222897940 568576820 /nfs/dbraw/zinc/57/68/20/568576820.db2.gz ZMHGTXWIPPVPEI-UHFFFAOYSA-N 0 0 358.268 5.396 40 0 FKABRN O=C(CCc1c(Cl)cccc1Cl)NCc1cccc2ccccc21 ZINC000222898050 568576802 /nfs/dbraw/zinc/57/68/02/568576802.db2.gz JAKOIAPWAWCRTP-UHFFFAOYSA-N 0 0 358.268 5.396 40 0 FKABRN O=C(CCc1ccc(Cl)cc1Cl)NCc1cccc2ccccc21 ZINC000222898140 568576759 /nfs/dbraw/zinc/57/67/59/568576759.db2.gz OEXLYDQNPYSVFJ-UHFFFAOYSA-N 0 0 358.268 5.396 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](CC)c2ccc(C)c(C)c2)cc1 ZINC000222899704 568577025 /nfs/dbraw/zinc/57/70/25/568577025.db2.gz APVURQZFHVFDOF-VXKWHMMOSA-N 0 0 353.506 5.291 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](CC)c2ccc(C)c(C)c2)cc1 ZINC000222899763 568577060 /nfs/dbraw/zinc/57/70/60/568577060.db2.gz APVURQZFHVFDOF-FCHUYYIVSA-N 0 0 353.506 5.291 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@H](CC)c2ccc(C)c(C)c2)cc1 ZINC000222899834 209741791 /nfs/dbraw/zinc/74/17/91/209741791.db2.gz APVURQZFHVFDOF-YADHBBJMSA-N 0 0 353.506 5.291 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](CC)c2ccc(C)c(C)c2)cc1 ZINC000222899902 222756125 /nfs/dbraw/zinc/75/61/25/222756125.db2.gz APVURQZFHVFDOF-FGZHOGPDSA-N 0 0 353.506 5.291 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](CC)c2ccc(C)cc2C)cc1 ZINC000222899990 209741711 /nfs/dbraw/zinc/74/17/11/209741711.db2.gz RZGRSUJTUNEHME-VXKWHMMOSA-N 0 0 353.506 5.291 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](CC)c2ccc(C)cc2C)cc1 ZINC000222900053 568576963 /nfs/dbraw/zinc/57/69/63/568576963.db2.gz RZGRSUJTUNEHME-FCHUYYIVSA-N 0 0 353.506 5.291 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@H](CC)c2ccc(C)cc2C)cc1 ZINC000222900127 206426833 /nfs/dbraw/zinc/42/68/33/206426833.db2.gz RZGRSUJTUNEHME-YADHBBJMSA-N 0 0 353.506 5.291 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](CC)c2ccc(C)cc2C)cc1 ZINC000222900193 568577160 /nfs/dbraw/zinc/57/71/60/568577160.db2.gz RZGRSUJTUNEHME-FGZHOGPDSA-N 0 0 353.506 5.291 40 0 FKABRN C[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000222901746 568577241 /nfs/dbraw/zinc/57/72/41/568577241.db2.gz IOCUCRKMDOOFAP-CFRMROPGSA-N 0 0 374.311 5.763 40 0 FKABRN C[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000222901817 568577264 /nfs/dbraw/zinc/57/72/64/568577264.db2.gz IOCUCRKMDOOFAP-MARXPDLDSA-N 0 0 374.311 5.763 40 0 FKABRN C[C@@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000222902687 568577184 /nfs/dbraw/zinc/57/71/84/568577184.db2.gz MCSNJWXIPTYTSB-QIPHDZALSA-N 0 0 361.529 5.754 40 0 FKABRN C[C@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000222902743 568577199 /nfs/dbraw/zinc/57/71/99/568577199.db2.gz MCSNJWXIPTYTSB-FYXHJSOBSA-N 0 0 361.529 5.754 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)NCCCc2ccc(C(C)C)cc2)cc1 ZINC000222903177 568577316 /nfs/dbraw/zinc/57/73/16/568577316.db2.gz ZBSXLSGJFWSKQB-QHCPKHFHSA-N 0 0 367.533 5.279 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)NCCCc2ccc(C(C)C)cc2)cc1 ZINC000222903237 222755968 /nfs/dbraw/zinc/75/59/68/222755968.db2.gz ZBSXLSGJFWSKQB-HSZRJFAPSA-N 0 0 367.533 5.279 40 0 FKABRN C[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222903431 209741706 /nfs/dbraw/zinc/74/17/06/209741706.db2.gz GJUJGUZTYHFNHP-CQSZACIVSA-N 0 0 359.922 5.188 40 0 FKABRN C[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222903496 568577342 /nfs/dbraw/zinc/57/73/42/568577342.db2.gz GJUJGUZTYHFNHP-AWEZNQCLSA-N 0 0 359.922 5.188 40 0 FKABRN C[C@@H](NC(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222903577 209742311 /nfs/dbraw/zinc/74/23/11/209742311.db2.gz CTNCQMHPFMJPNP-HUUCEWRRSA-N 0 0 373.949 5.577 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222903648 568577310 /nfs/dbraw/zinc/57/73/10/568577310.db2.gz CTNCQMHPFMJPNP-LSDHHAIUSA-N 0 0 373.949 5.577 40 0 FKABRN C[C@@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222903718 568577300 /nfs/dbraw/zinc/57/73/00/568577300.db2.gz CTNCQMHPFMJPNP-CABCVRRESA-N 0 0 373.949 5.577 40 0 FKABRN C[C@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222903775 206427066 /nfs/dbraw/zinc/42/70/66/206427066.db2.gz CTNCQMHPFMJPNP-GJZGRUSLSA-N 0 0 373.949 5.577 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000222904604 222756556 /nfs/dbraw/zinc/75/65/56/222756556.db2.gz VMNLXCGCOSLASW-SFHVURJKSA-N 0 0 367.558 5.293 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000222904660 209741576 /nfs/dbraw/zinc/74/15/76/209741576.db2.gz VMNLXCGCOSLASW-GOSISDBHSA-N 0 0 367.558 5.293 40 0 FKABRN C[C@@H](NC(=O)CSCc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000222904747 568577463 /nfs/dbraw/zinc/57/74/63/568577463.db2.gz KJLIKMMBBLITAF-OAHLLOKOSA-N 0 0 373.949 5.329 40 0 FKABRN C[C@H](NC(=O)CSCc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000222904798 568577467 /nfs/dbraw/zinc/57/74/67/568577467.db2.gz KJLIKMMBBLITAF-HNNXBMFYSA-N 0 0 373.949 5.329 40 0 FKABRN C[C@@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000222904889 222756140 /nfs/dbraw/zinc/75/61/40/222756140.db2.gz RVJXJZBUBWSWMQ-OAHLLOKOSA-N 0 0 373.949 5.329 40 0 FKABRN C[C@H](NC(=O)CSCc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000222904951 222756205 /nfs/dbraw/zinc/75/62/05/222756205.db2.gz RVJXJZBUBWSWMQ-HNNXBMFYSA-N 0 0 373.949 5.329 40 0 FKABRN C[C@@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222905037 222756212 /nfs/dbraw/zinc/75/62/12/222756212.db2.gz FLJHFLNBGAFMHB-OAHLLOKOSA-N 0 0 373.949 5.329 40 0 FKABRN C[C@H](NC(=O)CSCc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222905092 568577551 /nfs/dbraw/zinc/57/75/51/568577551.db2.gz FLJHFLNBGAFMHB-HNNXBMFYSA-N 0 0 373.949 5.329 40 0 FKABRN C[C@@H](NC(=O)[C@@H](C)SCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000222905575 568577570 /nfs/dbraw/zinc/57/75/70/568577570.db2.gz RXSOHVACKZFZMJ-IAGOWNOFSA-N 0 0 353.531 5.065 40 0 FKABRN C[C@@H](SCc1ccccc1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222905625 568577559 /nfs/dbraw/zinc/57/75/59/568577559.db2.gz RXSOHVACKZFZMJ-DLBZAZTESA-N 0 0 353.531 5.065 40 0 FKABRN C[C@@H](NC(=O)[C@H](C)SCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000222905688 568577579 /nfs/dbraw/zinc/57/75/79/568577579.db2.gz RXSOHVACKZFZMJ-SJORKVTESA-N 0 0 353.531 5.065 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(C(C)C)cc1 ZINC000222905713 222756015 /nfs/dbraw/zinc/75/60/15/222756015.db2.gz UDHMMYHMNGIAFS-OAQYLSRUSA-N 0 0 353.506 5.904 40 0 FKABRN C[C@H](NC(=O)[C@H](C)SCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000222905739 206426880 /nfs/dbraw/zinc/42/68/80/206426880.db2.gz RXSOHVACKZFZMJ-IRXDYDNUSA-N 0 0 353.531 5.065 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(C(C)C)cc1 ZINC000222905777 568577685 /nfs/dbraw/zinc/57/76/85/568577685.db2.gz UDHMMYHMNGIAFS-NRFANRHFSA-N 0 0 353.506 5.904 40 0 FKABRN C[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222906272 222756135 /nfs/dbraw/zinc/75/61/35/222756135.db2.gz DIXNUCTUPXHACE-OAHLLOKOSA-N 0 0 373.949 5.578 40 0 FKABRN C[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222906329 568577812 /nfs/dbraw/zinc/57/78/12/568577812.db2.gz DIXNUCTUPXHACE-HNNXBMFYSA-N 0 0 373.949 5.578 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc2ccccc21 ZINC000222906607 568577783 /nfs/dbraw/zinc/57/77/83/568577783.db2.gz LMGOCDJKFJZVLG-JOCHJYFZSA-N 0 0 361.485 5.933 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc2ccccc21 ZINC000222906672 568577788 /nfs/dbraw/zinc/57/77/88/568577788.db2.gz LMGOCDJKFJZVLG-QFIPXVFZSA-N 0 0 361.485 5.933 40 0 FKABRN C[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc2c(c1)CCCC2 ZINC000222907088 568577833 /nfs/dbraw/zinc/57/78/33/568577833.db2.gz QTNHRIASMFMKPW-ZDSQJECRSA-N 0 0 371.480 5.576 40 0 FKABRN C[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc2c(c1)CCCC2 ZINC000222907135 568577852 /nfs/dbraw/zinc/57/78/52/568577852.db2.gz QTNHRIASMFMKPW-KHCKMINHSA-N 0 0 371.480 5.576 40 0 FKABRN CCOc1ccccc1NC(=O)[C@@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222907360 222756144 /nfs/dbraw/zinc/75/61/44/222756144.db2.gz YBCDOMFXKUXBMR-LJQANCHMSA-N 0 0 355.478 5.179 40 0 FKABRN CCOc1ccccc1NC(=O)[C@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222907429 568577857 /nfs/dbraw/zinc/57/78/57/568577857.db2.gz YBCDOMFXKUXBMR-IBGZPJMESA-N 0 0 355.478 5.179 40 0 FKABRN CCOc1ccc(NC(=O)[C@@H](CC)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000222907517 568577778 /nfs/dbraw/zinc/57/77/78/568577778.db2.gz OKSYEXFGHVFZPM-HXUWFJFHSA-N 0 0 355.478 5.179 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222907555 568577823 /nfs/dbraw/zinc/57/78/23/568577823.db2.gz WMEPJBBHMLZZGT-IRXDYDNUSA-N 0 0 353.531 5.232 40 0 FKABRN CCOc1ccc(NC(=O)[C@H](CC)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000222907569 568577789 /nfs/dbraw/zinc/57/77/89/568577789.db2.gz OKSYEXFGHVFZPM-FQEVSTJZSA-N 0 0 355.478 5.179 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222907627 568577836 /nfs/dbraw/zinc/57/78/36/568577836.db2.gz WMEPJBBHMLZZGT-DLBZAZTESA-N 0 0 353.531 5.232 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222907697 568577861 /nfs/dbraw/zinc/57/78/61/568577861.db2.gz WMEPJBBHMLZZGT-SJORKVTESA-N 0 0 353.531 5.232 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222907765 209741683 /nfs/dbraw/zinc/74/16/83/209741683.db2.gz WMEPJBBHMLZZGT-IAGOWNOFSA-N 0 0 353.531 5.232 40 0 FKABRN Cc1ccc(SCCC(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222907856 568577918 /nfs/dbraw/zinc/57/79/18/568577918.db2.gz URUKXLRKZFDRHA-KRWDZBQOSA-N 0 0 353.531 5.233 40 0 FKABRN Cc1ccc(SCCC(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222907920 568577982 /nfs/dbraw/zinc/57/79/82/568577982.db2.gz URUKXLRKZFDRHA-QGZVFWFLSA-N 0 0 353.531 5.233 40 0 FKABRN C[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)CCCC2 ZINC000222908135 206426588 /nfs/dbraw/zinc/42/65/88/206426588.db2.gz DAAKONBLSDWLGB-GOSISDBHSA-N 0 0 355.481 5.723 40 0 FKABRN C[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)CCCC2 ZINC000222908196 209741201 /nfs/dbraw/zinc/74/12/01/209741201.db2.gz DAAKONBLSDWLGB-SFHVURJKSA-N 0 0 355.481 5.723 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)NCCCc2ccc(C(C)C)cc2)c1 ZINC000222908993 568577972 /nfs/dbraw/zinc/57/79/72/568577972.db2.gz YYQSXAYCCXYQAB-UHFFFAOYSA-N 0 0 367.533 5.370 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCSc1ccccc1 ZINC000222910899 568578105 /nfs/dbraw/zinc/57/81/05/568578105.db2.gz YJAMMSGZSFRMOC-HXUWFJFHSA-N 0 0 371.546 5.050 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCSc1ccccc1 ZINC000222910964 568578042 /nfs/dbraw/zinc/57/80/42/568578042.db2.gz YJAMMSGZSFRMOC-FQEVSTJZSA-N 0 0 371.546 5.050 40 0 FKABRN C[C@@H](Oc1cccc2c1CCCC2)C(=O)Nc1ccccc1-c1ccccc1 ZINC000222911008 568578058 /nfs/dbraw/zinc/57/80/58/568578058.db2.gz SPHAWZUVIUSIOR-GOSISDBHSA-N 0 0 371.480 5.638 40 0 FKABRN C[C@H](Oc1cccc2c1CCCC2)C(=O)Nc1ccccc1-c1ccccc1 ZINC000222911065 206428872 /nfs/dbraw/zinc/42/88/72/206428872.db2.gz SPHAWZUVIUSIOR-SFHVURJKSA-N 0 0 371.480 5.638 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc(Cl)cc1 ZINC000222912123 209742027 /nfs/dbraw/zinc/74/20/27/209742027.db2.gz KXPUQCAAEOQMPN-LJQANCHMSA-N 0 0 359.897 5.111 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc(Cl)cc1 ZINC000222912193 568578121 /nfs/dbraw/zinc/57/81/21/568578121.db2.gz KXPUQCAAEOQMPN-IBGZPJMESA-N 0 0 359.897 5.111 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(C)ccc1OC ZINC000222913800 206428083 /nfs/dbraw/zinc/42/80/83/206428083.db2.gz QCYYQNHLAPJSGB-LJQANCHMSA-N 0 0 355.478 5.097 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(C)ccc1OC ZINC000222913870 568578205 /nfs/dbraw/zinc/57/82/05/568578205.db2.gz QCYYQNHLAPJSGB-IBGZPJMESA-N 0 0 355.478 5.097 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(Cl)cc1C ZINC000222913962 568578169 /nfs/dbraw/zinc/57/81/69/568578169.db2.gz IKGAZORPNPEXOV-LJQANCHMSA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(Cl)cc1C ZINC000222914029 568578233 /nfs/dbraw/zinc/57/82/33/568578233.db2.gz IKGAZORPNPEXOV-IBGZPJMESA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(Cl)ccc1C ZINC000222914116 568578134 /nfs/dbraw/zinc/57/81/34/568578134.db2.gz SSIGKSSAOINCIC-LJQANCHMSA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cc(Cl)ccc1C ZINC000222914175 568578186 /nfs/dbraw/zinc/57/81/86/568578186.db2.gz SSIGKSSAOINCIC-IBGZPJMESA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(Cl)c1C ZINC000222914277 568578184 /nfs/dbraw/zinc/57/81/84/568578184.db2.gz GNOAONZSIZYUHM-LJQANCHMSA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(Cl)c1C ZINC000222914342 568578192 /nfs/dbraw/zinc/57/81/92/568578192.db2.gz GNOAONZSIZYUHM-IBGZPJMESA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(C)c(Cl)c1 ZINC000222914430 568578225 /nfs/dbraw/zinc/57/82/25/568578225.db2.gz KGDBOEIGIJOHNB-LJQANCHMSA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(C)c(Cl)c1 ZINC000222914503 568578149 /nfs/dbraw/zinc/57/81/49/568578149.db2.gz KGDBOEIGIJOHNB-IBGZPJMESA-N 0 0 359.897 5.742 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(SC)c1 ZINC000222917008 568578334 /nfs/dbraw/zinc/57/83/34/568578334.db2.gz AJVPTKQVWOYRFI-LJQANCHMSA-N 0 0 357.519 5.502 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(SC)c1 ZINC000222917072 568578271 /nfs/dbraw/zinc/57/82/71/568578271.db2.gz AJVPTKQVWOYRFI-IBGZPJMESA-N 0 0 357.519 5.502 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(F)c(Cl)c1 ZINC000222917589 568578299 /nfs/dbraw/zinc/57/82/99/568578299.db2.gz ZLICVCXNTJGHBQ-GOSISDBHSA-N 0 0 363.860 5.573 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(F)c(Cl)c1 ZINC000222917647 568578318 /nfs/dbraw/zinc/57/83/18/568578318.db2.gz ZLICVCXNTJGHBQ-SFHVURJKSA-N 0 0 363.860 5.573 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c(C)cc(C)cc1C ZINC000222919633 568578465 /nfs/dbraw/zinc/57/84/65/568578465.db2.gz KGUHOEMJUUFWQR-HXUWFJFHSA-N 0 0 353.506 5.705 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c(C)cc(C)cc1C ZINC000222919694 568578430 /nfs/dbraw/zinc/57/84/30/568578430.db2.gz KGUHOEMJUUFWQR-FQEVSTJZSA-N 0 0 353.506 5.705 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222919773 568578419 /nfs/dbraw/zinc/57/84/19/568578419.db2.gz DESYJDNBLCNOPZ-OAQYLSRUSA-N 0 0 367.533 5.905 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222919831 222757318 /nfs/dbraw/zinc/75/73/18/222757318.db2.gz DESYJDNBLCNOPZ-NRFANRHFSA-N 0 0 367.533 5.905 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1C(C)C ZINC000222920202 568578398 /nfs/dbraw/zinc/57/83/98/568578398.db2.gz DRWTXVWOKGZLEM-OAQYLSRUSA-N 0 0 353.506 5.904 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1C(C)C ZINC000222920255 568578446 /nfs/dbraw/zinc/57/84/46/568578446.db2.gz DRWTXVWOKGZLEM-NRFANRHFSA-N 0 0 353.506 5.904 40 0 FKABRN CCc1cccc(C)c1NC(=O)[C@@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222920340 568578390 /nfs/dbraw/zinc/57/83/90/568578390.db2.gz AARBOOIPUOZYLG-HXUWFJFHSA-N 0 0 353.506 5.651 40 0 FKABRN CCc1cccc(C)c1NC(=O)[C@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222920411 568578560 /nfs/dbraw/zinc/57/85/60/568578560.db2.gz AARBOOIPUOZYLG-FQEVSTJZSA-N 0 0 353.506 5.651 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccccc1Cl ZINC000222920784 209741447 /nfs/dbraw/zinc/74/14/47/209741447.db2.gz JZIYTPNWPMLBQO-LJQANCHMSA-N 0 0 359.897 5.111 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccccc1Cl ZINC000222920851 568578572 /nfs/dbraw/zinc/57/85/72/568578572.db2.gz JZIYTPNWPMLBQO-IBGZPJMESA-N 0 0 359.897 5.111 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c(C)cccc1C(C)C ZINC000222921824 568578649 /nfs/dbraw/zinc/57/86/49/568578649.db2.gz KWRSMAUJLSUGPL-OAQYLSRUSA-N 0 0 367.533 6.212 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1c(C)cccc1C(C)C ZINC000222921885 568578628 /nfs/dbraw/zinc/57/86/28/568578628.db2.gz KWRSMAUJLSUGPL-NRFANRHFSA-N 0 0 367.533 6.212 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1SC ZINC000222922275 568578596 /nfs/dbraw/zinc/57/85/96/568578596.db2.gz SKFFDPABXINZIO-GOSISDBHSA-N 0 0 357.519 5.502 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1SC ZINC000222922338 568578651 /nfs/dbraw/zinc/57/86/51/568578651.db2.gz SKFFDPABXINZIO-SFHVURJKSA-N 0 0 357.519 5.502 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](CC)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000222922416 568578669 /nfs/dbraw/zinc/57/86/69/568578669.db2.gz NFKADRBPJGMLCD-JOCHJYFZSA-N 0 0 367.533 6.123 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](CC)Oc2ccc(C(C)(C)C)cc2)cc1 ZINC000222922472 222757293 /nfs/dbraw/zinc/75/72/93/222757293.db2.gz NFKADRBPJGMLCD-QFIPXVFZSA-N 0 0 367.533 6.123 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000222923845 568578801 /nfs/dbraw/zinc/57/88/01/568578801.db2.gz XTNILNSQFSJAPF-OAQYLSRUSA-N 0 0 369.505 5.567 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000222923909 568578785 /nfs/dbraw/zinc/57/87/85/568578785.db2.gz XTNILNSQFSJAPF-NRFANRHFSA-N 0 0 369.505 5.567 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(OC(C)C)c1 ZINC000222923994 209741745 /nfs/dbraw/zinc/74/17/45/209741745.db2.gz YSSPVSDJJQOTMN-OAQYLSRUSA-N 0 0 369.505 5.567 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(OC(C)C)c1 ZINC000222924057 568578781 /nfs/dbraw/zinc/57/87/81/568578781.db2.gz YSSPVSDJJQOTMN-NRFANRHFSA-N 0 0 369.505 5.567 40 0 FKABRN Cc1ccc2c(c1)[C@@H](NC(=O)C1(c3ccccc3)CCCC1)CC(C)(C)O2 ZINC000222925455 222757904 /nfs/dbraw/zinc/75/79/04/222757904.db2.gz MGZLKXLFWOZQPU-FQEVSTJZSA-N 0 0 363.501 5.225 40 0 FKABRN Cc1ccc2c(c1)[C@H](NC(=O)C1(c3ccccc3)CCCC1)CC(C)(C)O2 ZINC000222925510 568578956 /nfs/dbraw/zinc/57/89/56/568578956.db2.gz MGZLKXLFWOZQPU-HXUWFJFHSA-N 0 0 363.501 5.225 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000222925914 568579072 /nfs/dbraw/zinc/57/90/72/568579072.db2.gz JQBVYGRTKOBIOF-PGRDOPGGSA-N 0 0 367.533 5.279 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)CCc1ccccc1 ZINC000222925969 568579076 /nfs/dbraw/zinc/57/90/76/568579076.db2.gz JQBVYGRTKOBIOF-AVRDEDQJSA-N 0 0 367.533 5.279 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)CCc1ccccc1 ZINC000222926025 568579096 /nfs/dbraw/zinc/57/90/96/568579096.db2.gz JQBVYGRTKOBIOF-XMSQKQJNSA-N 0 0 367.533 5.279 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)CCc1ccccc1 ZINC000222926091 568579059 /nfs/dbraw/zinc/57/90/59/568579059.db2.gz JQBVYGRTKOBIOF-GCJKJVERSA-N 0 0 367.533 5.279 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCCc2ccccc21 ZINC000222927336 535817756 /nfs/dbraw/zinc/81/77/56/535817756.db2.gz MPYQXBDELSGHBM-OAQYLSRUSA-N 0 0 351.490 5.121 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCCc2ccccc21 ZINC000222927399 536044146 /nfs/dbraw/zinc/04/41/46/536044146.db2.gz MPYQXBDELSGHBM-NRFANRHFSA-N 0 0 351.490 5.121 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccc(F)cc1 ZINC000222929545 568579399 /nfs/dbraw/zinc/57/93/99/568579399.db2.gz AZEJKEUGUYFYPB-OAQYLSRUSA-N 0 0 371.496 5.030 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccc(F)cc1 ZINC000222929601 568579375 /nfs/dbraw/zinc/57/93/75/568579375.db2.gz AZEJKEUGUYFYPB-NRFANRHFSA-N 0 0 371.496 5.030 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccc(C)cc1 ZINC000222930918 568579561 /nfs/dbraw/zinc/57/95/61/568579561.db2.gz QJLDMZSZAXAQRD-JOCHJYFZSA-N 0 0 367.533 5.199 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1ccc(C)cc1 ZINC000222930982 206428424 /nfs/dbraw/zinc/42/84/24/206428424.db2.gz QJLDMZSZAXAQRD-QFIPXVFZSA-N 0 0 367.533 5.199 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1cccc(C)c1 ZINC000222931068 568579554 /nfs/dbraw/zinc/57/95/54/568579554.db2.gz ASUGJEMYDWGXJO-JOCHJYFZSA-N 0 0 367.533 5.199 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCCc1cccc(C)c1 ZINC000222931133 568579530 /nfs/dbraw/zinc/57/95/30/568579530.db2.gz ASUGJEMYDWGXJO-QFIPXVFZSA-N 0 0 367.533 5.199 40 0 FKABRN CCOc1cccc(NC(=O)[C@@H](CC)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000222931659 568579552 /nfs/dbraw/zinc/57/95/52/568579552.db2.gz SGFSZYABOWNXSG-HXUWFJFHSA-N 0 0 355.478 5.179 40 0 FKABRN CCOc1cccc(NC(=O)[C@H](CC)Oc2ccc(C(C)(C)C)cc2)c1 ZINC000222931720 568579656 /nfs/dbraw/zinc/57/96/56/568579656.db2.gz SGFSZYABOWNXSG-FQEVSTJZSA-N 0 0 355.478 5.179 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1Cl)NCc1cccc(C(F)(F)F)c1 ZINC000222934267 568579745 /nfs/dbraw/zinc/57/97/45/568579745.db2.gz NNOWHZJRTFENIF-FNORWQNLSA-N 0 0 374.189 5.342 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H]1CCCc2ccccc21 ZINC000222934578 568579868 /nfs/dbraw/zinc/57/98/68/568579868.db2.gz FPDNHDKNKXUNTC-FGZHOGPDSA-N 0 0 365.517 5.335 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H]1CCCc2ccccc21 ZINC000222934640 206428728 /nfs/dbraw/zinc/42/87/28/206428728.db2.gz FPDNHDKNKXUNTC-YADHBBJMSA-N 0 0 365.517 5.335 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H]1CCCc2ccccc21 ZINC000222934713 222757760 /nfs/dbraw/zinc/75/77/60/222757760.db2.gz FPDNHDKNKXUNTC-FCHUYYIVSA-N 0 0 365.517 5.335 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H]1CCCc2ccccc21 ZINC000222934778 568579892 /nfs/dbraw/zinc/57/98/92/568579892.db2.gz FPDNHDKNKXUNTC-VXKWHMMOSA-N 0 0 365.517 5.335 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(C)cc1 ZINC000222934859 222757817 /nfs/dbraw/zinc/75/78/17/222757817.db2.gz CSZFYZSTRPWBSG-LAUBAEHRSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(C)cc1 ZINC000222934923 568579847 /nfs/dbraw/zinc/57/98/47/568579847.db2.gz CSZFYZSTRPWBSG-UWJYYQICSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccc(C)cc1 ZINC000222934976 222757197 /nfs/dbraw/zinc/75/71/97/222757197.db2.gz CSZFYZSTRPWBSG-DYESRHJHSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccc(C)cc1 ZINC000222935030 222757897 /nfs/dbraw/zinc/75/78/97/222757897.db2.gz CSZFYZSTRPWBSG-UTKZUKDTSA-N 0 0 353.506 5.327 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000222935091 568579867 /nfs/dbraw/zinc/57/98/67/568579867.db2.gz UDWQWOWKUQONHI-MGPUTAFESA-N 0 0 357.469 5.158 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc(F)cc1 ZINC000222935160 568579843 /nfs/dbraw/zinc/57/98/43/568579843.db2.gz UDWQWOWKUQONHI-YWZLYKJASA-N 0 0 357.469 5.158 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000222935217 209743323 /nfs/dbraw/zinc/74/33/23/209743323.db2.gz UDWQWOWKUQONHI-FOIQADDNSA-N 0 0 357.469 5.158 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccc(F)cc1 ZINC000222935273 568579856 /nfs/dbraw/zinc/57/98/56/568579856.db2.gz UDWQWOWKUQONHI-QRWLVFNGSA-N 0 0 357.469 5.158 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222936262 222757425 /nfs/dbraw/zinc/75/74/25/222757425.db2.gz CGLHSPWICZDLFA-LJQANCHMSA-N 0 0 371.546 5.892 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](CC)Oc1ccc(C(C)(C)C)cc1 ZINC000222936322 568579998 /nfs/dbraw/zinc/57/99/98/568579998.db2.gz CGLHSPWICZDLFA-IBGZPJMESA-N 0 0 371.546 5.892 40 0 FKABRN C[C@@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc2c(c1)CCCC2 ZINC000222938657 568580169 /nfs/dbraw/zinc/58/01/69/568580169.db2.gz GDJFGXZMHQUIEP-MRXNPFEDSA-N 0 0 369.464 5.956 40 0 FKABRN C[C@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc2c(c1)CCCC2 ZINC000222938717 568580228 /nfs/dbraw/zinc/58/02/28/568580228.db2.gz GDJFGXZMHQUIEP-INIZCTEOSA-N 0 0 369.464 5.956 40 0 FKABRN C[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000222940503 568580301 /nfs/dbraw/zinc/58/03/01/568580301.db2.gz JXESGFCTAMFXIR-GOSISDBHSA-N 0 0 363.545 5.673 40 0 FKABRN C[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000222940556 568580325 /nfs/dbraw/zinc/58/03/25/568580325.db2.gz JXESGFCTAMFXIR-SFHVURJKSA-N 0 0 363.545 5.673 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000222945810 568580795 /nfs/dbraw/zinc/58/07/95/568580795.db2.gz FHDSTZCZZUNFTK-MRXNPFEDSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000222945865 568580790 /nfs/dbraw/zinc/58/07/90/568580790.db2.gz FHDSTZCZZUNFTK-INIZCTEOSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000222946366 568581013 /nfs/dbraw/zinc/58/10/13/568581013.db2.gz SMMFYOYXOLFXOZ-MRXNPFEDSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000222946423 568580926 /nfs/dbraw/zinc/58/09/26/568580926.db2.gz SMMFYOYXOLFXOZ-INIZCTEOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000222946676 206429029 /nfs/dbraw/zinc/42/90/29/206429029.db2.gz DTWLHTHHRYPSIS-MRXNPFEDSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)Nc1cc(Cl)ccc1Cl ZINC000222946745 568580940 /nfs/dbraw/zinc/58/09/40/568580940.db2.gz DTWLHTHHRYPSIS-INIZCTEOSA-N 0 0 352.261 5.406 40 0 FKABRN C[C@@H](NC(=O)c1ccc(N2CCCCC2)cc1)c1ccc2c(c1)CCCC2 ZINC000222946785 132278206 /nfs/dbraw/zinc/27/82/06/132278206.db2.gz KXZDFMPRALSAPF-GOSISDBHSA-N 0 0 362.517 5.047 40 0 FKABRN C[C@H](NC(=O)c1ccc(N2CCCCC2)cc1)c1ccc2c(c1)CCCC2 ZINC000222946854 132278043 /nfs/dbraw/zinc/27/80/43/132278043.db2.gz KXZDFMPRALSAPF-SFHVURJKSA-N 0 0 362.517 5.047 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)NCc1ccc(Cl)cc1Cl ZINC000222948428 568581085 /nfs/dbraw/zinc/58/10/85/568581085.db2.gz WIPJTVZOVGFXOB-QGZVFWFLSA-N 0 0 366.288 5.084 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)NCc1ccc(Cl)cc1Cl ZINC000222948482 222759315 /nfs/dbraw/zinc/75/93/15/222759315.db2.gz WIPJTVZOVGFXOB-KRWDZBQOSA-N 0 0 366.288 5.084 40 0 FKABRN C[C@@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222948984 568581241 /nfs/dbraw/zinc/58/12/41/568581241.db2.gz QXMLKKJXVQLABU-MRXNPFEDSA-N 0 0 371.908 5.255 40 0 FKABRN C[C@H](NC(=O)CCCOc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000222949047 222758413 /nfs/dbraw/zinc/75/84/13/222758413.db2.gz QXMLKKJXVQLABU-INIZCTEOSA-N 0 0 371.908 5.255 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)Nc1ccccc1C(F)(F)F ZINC000222949937 568581475 /nfs/dbraw/zinc/58/14/75/568581475.db2.gz RQMZHADAJKXZTB-MRXNPFEDSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)Nc1ccccc1C(F)(F)F ZINC000222950003 206428793 /nfs/dbraw/zinc/42/87/93/206428793.db2.gz RQMZHADAJKXZTB-INIZCTEOSA-N 0 0 351.368 5.118 40 0 FKABRN COc1ccc(CCC(=O)N[C@@H](c2ccccc2)c2cccc(C)c2)cc1C ZINC000222954796 206428865 /nfs/dbraw/zinc/42/88/65/206428865.db2.gz QAFARXUPIBCBJX-VWLOTQADSA-N 0 0 373.496 5.150 40 0 FKABRN COc1ccc(CCC(=O)N[C@H](c2ccccc2)c2cccc(C)c2)cc1C ZINC000222954859 568581858 /nfs/dbraw/zinc/58/18/58/568581858.db2.gz QAFARXUPIBCBJX-RUZDIDTESA-N 0 0 373.496 5.150 40 0 FKABRN COc1ccc([C@@H](CC(C)C)NC(=O)CCc2ccc(C)c(C)c2)cc1 ZINC000222955901 568581856 /nfs/dbraw/zinc/58/18/56/568581856.db2.gz DDQOIKFHRWEKEN-JOCHJYFZSA-N 0 0 353.506 5.148 40 0 FKABRN COc1ccc([C@H](CC(C)C)NC(=O)CCc2ccc(C)c(C)c2)cc1 ZINC000222955971 568581906 /nfs/dbraw/zinc/58/19/06/568581906.db2.gz DDQOIKFHRWEKEN-QFIPXVFZSA-N 0 0 353.506 5.148 40 0 FKABRN Cc1cc(OCC(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc(C)c1Cl ZINC000222956350 568582034 /nfs/dbraw/zinc/58/20/34/568582034.db2.gz QFOYAMVSQCBBDW-INIZCTEOSA-N 0 0 371.908 5.092 40 0 FKABRN Cc1cc(OCC(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc(C)c1Cl ZINC000222956417 222758384 /nfs/dbraw/zinc/75/83/84/222758384.db2.gz QFOYAMVSQCBBDW-MRXNPFEDSA-N 0 0 371.908 5.092 40 0 FKABRN C[C@@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000222956507 568581980 /nfs/dbraw/zinc/58/19/80/568581980.db2.gz RKQXWMRPSBMJSX-QGZVFWFLSA-N 0 0 365.517 5.119 40 0 FKABRN C[C@H](NC(=O)COc1ccc(C(C)(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000222956568 568581941 /nfs/dbraw/zinc/58/19/41/568581941.db2.gz RKQXWMRPSBMJSX-KRWDZBQOSA-N 0 0 365.517 5.119 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000222957694 568582145 /nfs/dbraw/zinc/58/21/45/568582145.db2.gz WOTIEAHIFJGQCX-MRXNPFEDSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000222957747 568582141 /nfs/dbraw/zinc/58/21/41/568582141.db2.gz WOTIEAHIFJGQCX-INIZCTEOSA-N 0 0 351.368 5.118 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000222958282 568582280 /nfs/dbraw/zinc/58/22/80/568582280.db2.gz KNYGZTDTDNRTER-MRXNPFEDSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000222958344 568582293 /nfs/dbraw/zinc/58/22/93/568582293.db2.gz KNYGZTDTDNRTER-INIZCTEOSA-N 0 0 352.261 5.406 40 0 FKABRN CCc1cccc(CC)c1NC(=O)CSCc1ccc(Cl)cc1F ZINC000222958384 568582282 /nfs/dbraw/zinc/58/22/82/568582282.db2.gz OBZSTRYQAPFBPD-UHFFFAOYSA-N 0 0 365.901 5.476 40 0 FKABRN C[C@@H](NC(=O)CCSCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000222958412 568582241 /nfs/dbraw/zinc/58/22/41/568582241.db2.gz UTCZFAFFEKURLO-QGZVFWFLSA-N 0 0 353.531 5.066 40 0 FKABRN C[C@H](NC(=O)CCSCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000222958477 209743351 /nfs/dbraw/zinc/74/33/51/209743351.db2.gz UTCZFAFFEKURLO-KRWDZBQOSA-N 0 0 353.531 5.066 40 0 FKABRN C[C@@H](NC(=O)[C@@H](C)Oc1ccc2ccccc2c1)c1ccc2c(c1)CCCC2 ZINC000222958851 568582346 /nfs/dbraw/zinc/58/23/46/568582346.db2.gz CLVPSNGDPDOPDX-QZTJIDSGSA-N 0 0 373.496 5.363 40 0 FKABRN C[C@@H](Oc1ccc2ccccc2c1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222958903 568582417 /nfs/dbraw/zinc/58/24/17/568582417.db2.gz CLVPSNGDPDOPDX-ZWKOTPCHSA-N 0 0 373.496 5.363 40 0 FKABRN C[C@@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc2c(c1)CCCC2 ZINC000222958962 568582377 /nfs/dbraw/zinc/58/23/77/568582377.db2.gz CLVPSNGDPDOPDX-MSOLQXFVSA-N 0 0 373.496 5.363 40 0 FKABRN C[C@H](NC(=O)[C@H](C)Oc1ccc2ccccc2c1)c1ccc2c(c1)CCCC2 ZINC000222959018 568582352 /nfs/dbraw/zinc/58/23/52/568582352.db2.gz CLVPSNGDPDOPDX-ROUUACIJSA-N 0 0 373.496 5.363 40 0 FKABRN C[C@@H](NC(=O)[C@@H](C)Oc1cccc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000222959101 568582513 /nfs/dbraw/zinc/58/25/13/568582513.db2.gz ITUHWYIGVXZRCX-QZTJIDSGSA-N 0 0 373.496 5.363 40 0 FKABRN C[C@@H](Oc1cccc2ccccc21)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222959162 568582541 /nfs/dbraw/zinc/58/25/41/568582541.db2.gz ITUHWYIGVXZRCX-ZWKOTPCHSA-N 0 0 373.496 5.363 40 0 FKABRN C[C@@H](NC(=O)[C@H](C)Oc1cccc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000222959232 568582554 /nfs/dbraw/zinc/58/25/54/568582554.db2.gz ITUHWYIGVXZRCX-MSOLQXFVSA-N 0 0 373.496 5.363 40 0 FKABRN C[C@H](NC(=O)[C@H](C)Oc1cccc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000222959295 568582525 /nfs/dbraw/zinc/58/25/25/568582525.db2.gz ITUHWYIGVXZRCX-ROUUACIJSA-N 0 0 373.496 5.363 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000222961666 568582733 /nfs/dbraw/zinc/58/27/33/568582733.db2.gz QUBWTXSXMBZRJS-JOCHJYFZSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000222961724 568582773 /nfs/dbraw/zinc/58/27/73/568582773.db2.gz QUBWTXSXMBZRJS-QFIPXVFZSA-N 0 0 373.496 5.367 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222963738 568582908 /nfs/dbraw/zinc/58/29/08/568582908.db2.gz YWQUVJGTSKCPCF-GHTZIAJQSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222963796 568582885 /nfs/dbraw/zinc/58/28/85/568582885.db2.gz YWQUVJGTSKCPCF-RXVVDRJESA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222963858 568582839 /nfs/dbraw/zinc/58/28/39/568582839.db2.gz YWQUVJGTSKCPCF-WIYYLYMNSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222963914 568582889 /nfs/dbraw/zinc/58/28/89/568582889.db2.gz YWQUVJGTSKCPCF-NQIIRXRSSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000222967604 568583196 /nfs/dbraw/zinc/58/31/96/568583196.db2.gz NVTLDTGPEZLDFG-OAQYLSRUSA-N 0 0 367.489 5.421 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000222967670 568583226 /nfs/dbraw/zinc/58/32/26/568583226.db2.gz NVTLDTGPEZLDFG-NRFANRHFSA-N 0 0 367.489 5.421 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222968181 222759939 /nfs/dbraw/zinc/75/99/39/222759939.db2.gz UFRZBAASZZYXGV-ROUUACIJSA-N 0 0 365.517 5.334 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000222968226 568583224 /nfs/dbraw/zinc/58/32/24/568583224.db2.gz PPPOGYJWUWWUSS-LEWJYISDSA-N 0 0 353.506 5.364 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222968247 568583222 /nfs/dbraw/zinc/58/32/22/568583222.db2.gz UFRZBAASZZYXGV-ZWKOTPCHSA-N 0 0 365.517 5.334 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000222968280 568583220 /nfs/dbraw/zinc/58/32/20/568583220.db2.gz PPPOGYJWUWWUSS-SFTDATJTSA-N 0 0 353.506 5.364 40 0 FKABRN CC(C)c1ccccc1O[C@@H](C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222968299 568583181 /nfs/dbraw/zinc/58/31/81/568583181.db2.gz UFRZBAASZZYXGV-MSOLQXFVSA-N 0 0 365.517 5.334 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000222968346 206429929 /nfs/dbraw/zinc/42/99/29/206429929.db2.gz PPPOGYJWUWWUSS-NHCUHLMSSA-N 0 0 353.506 5.364 40 0 FKABRN CC(C)c1ccccc1O[C@H](C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222968364 222759639 /nfs/dbraw/zinc/75/96/39/222759639.db2.gz UFRZBAASZZYXGV-QZTJIDSGSA-N 0 0 365.517 5.334 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000222968400 568583213 /nfs/dbraw/zinc/58/32/13/568583213.db2.gz PPPOGYJWUWWUSS-RTWAWAEBSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222969505 222759663 /nfs/dbraw/zinc/75/96/63/222759663.db2.gz BEZWOFIORYCWAL-MGPUTAFESA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222969565 568583432 /nfs/dbraw/zinc/58/34/32/568583432.db2.gz BEZWOFIORYCWAL-YWZLYKJASA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222969621 568583394 /nfs/dbraw/zinc/58/33/94/568583394.db2.gz BEZWOFIORYCWAL-FOIQADDNSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222969688 568583456 /nfs/dbraw/zinc/58/34/56/568583456.db2.gz BEZWOFIORYCWAL-QRWLVFNGSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222969766 568583435 /nfs/dbraw/zinc/58/34/35/568583435.db2.gz MTXCDYZXZPRPFR-YCRPNKLZSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222969829 568583380 /nfs/dbraw/zinc/58/33/80/568583380.db2.gz MTXCDYZXZPRPFR-BTYIYWSLSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222969900 568583425 /nfs/dbraw/zinc/58/34/25/568583425.db2.gz MTXCDYZXZPRPFR-QVKFZJNVSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222969965 568583586 /nfs/dbraw/zinc/58/35/86/568583586.db2.gz MTXCDYZXZPRPFR-VFNWGFHPSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222970334 568583545 /nfs/dbraw/zinc/58/35/45/568583545.db2.gz BYHPJYCZUUYQCX-FDDCHVKYSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222970400 517831542 /nfs/dbraw/zinc/83/15/42/517831542.db2.gz BYHPJYCZUUYQCX-MBSDFSHPSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222970457 222760191 /nfs/dbraw/zinc/76/01/91/222760191.db2.gz BYHPJYCZUUYQCX-WZONZLPQSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222970518 568583536 /nfs/dbraw/zinc/58/35/36/568583536.db2.gz BYHPJYCZUUYQCX-JPYJTQIMSA-N 0 0 365.517 5.217 40 0 FKABRN O=C(COc1cccc2c1CCCC2)Nc1ccc(Oc2ccccc2)cc1 ZINC000222971270 568583670 /nfs/dbraw/zinc/58/36/70/568583670.db2.gz ZFHXEIGOFXZEBB-UHFFFAOYSA-N 0 0 373.452 5.375 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222971439 568583800 /nfs/dbraw/zinc/58/38/00/568583800.db2.gz ILWZFAIBVCQYCI-PGRDOPGGSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222971494 568583820 /nfs/dbraw/zinc/58/38/20/568583820.db2.gz ILWZFAIBVCQYCI-AVRDEDQJSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222971540 568583779 /nfs/dbraw/zinc/58/37/79/568583779.db2.gz ILWZFAIBVCQYCI-XMSQKQJNSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222971592 568583774 /nfs/dbraw/zinc/58/37/74/568583774.db2.gz ILWZFAIBVCQYCI-GCJKJVERSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222971684 206429306 /nfs/dbraw/zinc/42/93/06/206429306.db2.gz CEMMBBXYXFWWED-PGRDOPGGSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222971752 568583752 /nfs/dbraw/zinc/58/37/52/568583752.db2.gz CEMMBBXYXFWWED-AVRDEDQJSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222971811 568583797 /nfs/dbraw/zinc/58/37/97/568583797.db2.gz CEMMBBXYXFWWED-XMSQKQJNSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222971864 568583796 /nfs/dbraw/zinc/58/37/96/568583796.db2.gz CEMMBBXYXFWWED-GCJKJVERSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc(C)cc1C)c1ccc(C)c(C)c1 ZINC000222972008 206430224 /nfs/dbraw/zinc/43/02/24/206430224.db2.gz QMWGNOOWWSHKSM-NHCUHLMSSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](CC)c1ccc(C)c(C)c1 ZINC000222972073 568583817 /nfs/dbraw/zinc/58/38/17/568583817.db2.gz QMWGNOOWWSHKSM-LEWJYISDSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccc(C)cc1C)c1ccc(C)c(C)c1 ZINC000222972140 568583956 /nfs/dbraw/zinc/58/39/56/568583956.db2.gz QMWGNOOWWSHKSM-RTWAWAEBSA-N 0 0 353.506 5.345 40 0 FKABRN COc1cc2ccccc2cc1C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222972189 568583928 /nfs/dbraw/zinc/58/39/28/568583928.db2.gz HCWRPHBARAZFEI-INIZCTEOSA-N 0 0 359.469 5.218 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccc(C)cc1C)c1ccc(C)c(C)c1 ZINC000222972198 568583925 /nfs/dbraw/zinc/58/39/25/568583925.db2.gz QMWGNOOWWSHKSM-SFTDATJTSA-N 0 0 353.506 5.345 40 0 FKABRN COc1cc2ccccc2cc1C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222972255 568583938 /nfs/dbraw/zinc/58/39/38/568583938.db2.gz HCWRPHBARAZFEI-MRXNPFEDSA-N 0 0 359.469 5.218 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc(C)cc1C)c1ccc(C)cc1C ZINC000222972289 568583959 /nfs/dbraw/zinc/58/39/59/568583959.db2.gz GEQNMKVBCMPGJB-NHCUHLMSSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](CC)c1ccc(C)cc1C ZINC000222972345 209744222 /nfs/dbraw/zinc/74/42/22/209744222.db2.gz GEQNMKVBCMPGJB-LEWJYISDSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccc(C)cc1C)c1ccc(C)cc1C ZINC000222972407 222759745 /nfs/dbraw/zinc/75/97/45/222759745.db2.gz GEQNMKVBCMPGJB-RTWAWAEBSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccc(C)cc1C)c1ccc(C)cc1C ZINC000222972467 568583926 /nfs/dbraw/zinc/58/39/26/568583926.db2.gz GEQNMKVBCMPGJB-SFTDATJTSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(OC)c(C)c1 ZINC000222974416 568584181 /nfs/dbraw/zinc/58/41/81/568584181.db2.gz MGFOUQQJNKZSLN-QGZVFWFLSA-N 0 0 363.910 5.017 40 0 FKABRN CC[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(OC)c(C)c1 ZINC000222974480 568584167 /nfs/dbraw/zinc/58/41/67/568584167.db2.gz MGFOUQQJNKZSLN-KRWDZBQOSA-N 0 0 363.910 5.017 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000222975295 568584299 /nfs/dbraw/zinc/58/42/99/568584299.db2.gz QBNSGKDICPVFGY-JOCHJYFZSA-N 0 0 367.533 5.333 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000222975353 222760264 /nfs/dbraw/zinc/76/02/64/222760264.db2.gz QBNSGKDICPVFGY-QFIPXVFZSA-N 0 0 367.533 5.333 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000222977400 206429730 /nfs/dbraw/zinc/42/97/30/206429730.db2.gz VXHJECHCHWTOBA-QGZVFWFLSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000222977463 206430010 /nfs/dbraw/zinc/43/00/10/206430010.db2.gz VXHJECHCHWTOBA-KRWDZBQOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222978316 568584845 /nfs/dbraw/zinc/58/48/45/568584845.db2.gz ZKBPSCMKIKWNAW-YCRPNKLZSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222978365 568584851 /nfs/dbraw/zinc/58/48/51/568584851.db2.gz ZKBPSCMKIKWNAW-BTYIYWSLSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222978422 568584865 /nfs/dbraw/zinc/58/48/65/568584865.db2.gz ZKBPSCMKIKWNAW-QVKFZJNVSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222978486 568584912 /nfs/dbraw/zinc/58/49/12/568584912.db2.gz ZKBPSCMKIKWNAW-VFNWGFHPSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)NCc1ccc(Cl)cc1Cl ZINC000222979120 568585082 /nfs/dbraw/zinc/58/50/82/568585082.db2.gz CHLNESIEHDEGEO-GOSISDBHSA-N 0 0 366.288 5.084 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)NCc1ccc(Cl)cc1Cl ZINC000222979172 568585053 /nfs/dbraw/zinc/58/50/53/568585053.db2.gz CHLNESIEHDEGEO-SFHVURJKSA-N 0 0 366.288 5.084 40 0 FKABRN CC(C)Sc1ccccc1C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222979599 568585051 /nfs/dbraw/zinc/58/50/51/568585051.db2.gz FMETUTJHATVOOM-INIZCTEOSA-N 0 0 353.531 5.557 40 0 FKABRN CC(C)Sc1ccccc1C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222979657 568584976 /nfs/dbraw/zinc/58/49/76/568584976.db2.gz FMETUTJHATVOOM-MRXNPFEDSA-N 0 0 353.531 5.557 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1Cl ZINC000222979864 568585156 /nfs/dbraw/zinc/58/51/56/568585156.db2.gz ZNFMOEMILNVFKS-AWEZNQCLSA-N 0 0 359.897 5.527 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1Cl ZINC000222979924 568585133 /nfs/dbraw/zinc/58/51/33/568585133.db2.gz ZNFMOEMILNVFKS-CQSZACIVSA-N 0 0 359.897 5.527 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222992628 209744516 /nfs/dbraw/zinc/74/45/16/209744516.db2.gz FRUUGIJKGWFWQN-PGRDOPGGSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222992690 568587391 /nfs/dbraw/zinc/58/73/91/568587391.db2.gz FRUUGIJKGWFWQN-AVRDEDQJSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222992759 222761431 /nfs/dbraw/zinc/76/14/31/222761431.db2.gz FRUUGIJKGWFWQN-XMSQKQJNSA-N 0 0 367.533 5.636 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000222992807 222761570 /nfs/dbraw/zinc/76/15/70/222761570.db2.gz FRUUGIJKGWFWQN-GCJKJVERSA-N 0 0 367.533 5.636 40 0 FKABRN C[C@@H](NC(=O)CCc1cccc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000222993480 568587774 /nfs/dbraw/zinc/58/77/74/568587774.db2.gz FDRVPDWIFOEMBI-GOSISDBHSA-N 0 0 357.497 5.529 40 0 FKABRN C[C@H](NC(=O)CCc1cccc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000222993550 568587776 /nfs/dbraw/zinc/58/77/76/568587776.db2.gz FDRVPDWIFOEMBI-SFHVURJKSA-N 0 0 357.497 5.529 40 0 FKABRN C[C@@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc2c(c1)CCCC2 ZINC000222995068 568588045 /nfs/dbraw/zinc/58/80/45/568588045.db2.gz DHNZNYVLOWCLBQ-QGZVFWFLSA-N 0 0 365.517 5.119 40 0 FKABRN C[C@H](NC(=O)COc1ccccc1C(C)(C)C)c1ccc2c(c1)CCCC2 ZINC000222995126 568587987 /nfs/dbraw/zinc/58/79/87/568587987.db2.gz DHNZNYVLOWCLBQ-KRWDZBQOSA-N 0 0 365.517 5.119 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)ccc1Cl ZINC000222995789 568588251 /nfs/dbraw/zinc/58/82/51/568588251.db2.gz IMYMCTZCARQFJL-HOTGVXAUSA-N 0 0 371.908 5.172 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)ccc1Cl ZINC000222995852 222761098 /nfs/dbraw/zinc/76/10/98/222761098.db2.gz IMYMCTZCARQFJL-JKSUJKDBSA-N 0 0 371.908 5.172 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)ccc1Cl ZINC000222995917 568588165 /nfs/dbraw/zinc/58/81/65/568588165.db2.gz IMYMCTZCARQFJL-CVEARBPZSA-N 0 0 371.908 5.172 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)ccc1Cl ZINC000222995979 568588162 /nfs/dbraw/zinc/58/81/62/568588162.db2.gz IMYMCTZCARQFJL-HZPDHXFCSA-N 0 0 371.908 5.172 40 0 FKABRN C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000222996022 209745648 /nfs/dbraw/zinc/74/56/48/209745648.db2.gz WOQGEHYXPJIDMY-GFCCVEGCSA-N 0 0 364.272 5.278 40 0 FKABRN C[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000222996077 568588245 /nfs/dbraw/zinc/58/82/45/568588245.db2.gz WOQGEHYXPJIDMY-LBPRGKRZSA-N 0 0 364.272 5.278 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222996085 209745278 /nfs/dbraw/zinc/74/52/78/209745278.db2.gz CLPSOAZZMLOGCG-SBUREZEXSA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222996151 568588415 /nfs/dbraw/zinc/58/84/15/568588415.db2.gz CLPSOAZZMLOGCG-GAJHUEQPSA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222996226 222761370 /nfs/dbraw/zinc/76/13/70/222761370.db2.gz CLPSOAZZMLOGCG-HXOBKFHXSA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1 ZINC000222996289 568588447 /nfs/dbraw/zinc/58/84/47/568588447.db2.gz CLPSOAZZMLOGCG-UZUQRXQVSA-N 0 0 365.517 5.163 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000222996600 568588412 /nfs/dbraw/zinc/58/84/12/568588412.db2.gz QTMNMMNJGQYVML-JOCHJYFZSA-N 0 0 367.489 5.421 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222996618 568588409 /nfs/dbraw/zinc/58/84/09/568588409.db2.gz AKXNMOPWBYZDGB-PGRDOPGGSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000222996661 206429253 /nfs/dbraw/zinc/42/92/53/206429253.db2.gz QTMNMMNJGQYVML-QFIPXVFZSA-N 0 0 367.489 5.421 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222996679 206429523 /nfs/dbraw/zinc/42/95/23/206429523.db2.gz AKXNMOPWBYZDGB-AVRDEDQJSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222996737 568588424 /nfs/dbraw/zinc/58/84/24/568588424.db2.gz AKXNMOPWBYZDGB-XMSQKQJNSA-N 0 0 365.517 5.217 40 0 FKABRN CCc1ccc(CC)c(CNC(=O)/C(=C/c2ccccc2)c2ccccc2)c1 ZINC000222996795 568588443 /nfs/dbraw/zinc/58/84/43/568588443.db2.gz JEZIJCAOLUOGFG-XIEYBQDHSA-N 0 0 369.508 5.668 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222996804 568588334 /nfs/dbraw/zinc/58/83/34/568588334.db2.gz AKXNMOPWBYZDGB-GCJKJVERSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222996881 209744622 /nfs/dbraw/zinc/74/46/22/209744622.db2.gz KPANCGMACMETNK-FDDCHVKYSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000222996931 568588362 /nfs/dbraw/zinc/58/83/62/568588362.db2.gz KPANCGMACMETNK-MBSDFSHPSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222996997 568588485 /nfs/dbraw/zinc/58/84/85/568588485.db2.gz KPANCGMACMETNK-WZONZLPQSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 ZINC000222997058 568588318 /nfs/dbraw/zinc/58/83/18/568588318.db2.gz KPANCGMACMETNK-JPYJTQIMSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000222997225 206429280 /nfs/dbraw/zinc/42/92/80/206429280.db2.gz ZISGOUPFEWDPCU-FCHUYYIVSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000222997280 568588708 /nfs/dbraw/zinc/58/87/08/568588708.db2.gz ZISGOUPFEWDPCU-VXKWHMMOSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000222997356 568588611 /nfs/dbraw/zinc/58/86/11/568588611.db2.gz ZISGOUPFEWDPCU-FGZHOGPDSA-N 0 0 353.506 5.364 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000222997415 568588706 /nfs/dbraw/zinc/58/87/06/568588706.db2.gz ZISGOUPFEWDPCU-YADHBBJMSA-N 0 0 353.506 5.364 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000222998811 209745906 /nfs/dbraw/zinc/74/59/06/209745906.db2.gz OIWVSONLDPEGTO-SFHVURJKSA-N 0 0 365.517 5.253 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c1 ZINC000222998874 568588842 /nfs/dbraw/zinc/58/88/42/568588842.db2.gz OIWVSONLDPEGTO-GOSISDBHSA-N 0 0 365.517 5.253 40 0 FKABRN COc1ccc(CCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1C ZINC000222999345 568589212 /nfs/dbraw/zinc/58/92/12/568589212.db2.gz QZSZECIADSWVJN-UHFFFAOYSA-N 0 0 371.786 5.247 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)CCCOc2ccccc2)c2ccccc2O1 ZINC000223000057 568589124 /nfs/dbraw/zinc/58/91/24/568589124.db2.gz FSBOMSCHSPEXQN-HXUWFJFHSA-N 0 0 367.489 5.044 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)CCCOc2ccccc2)c2ccccc2O1 ZINC000223000113 222761151 /nfs/dbraw/zinc/76/11/51/222761151.db2.gz FSBOMSCHSPEXQN-FQEVSTJZSA-N 0 0 367.489 5.044 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1Cl ZINC000223000728 568589336 /nfs/dbraw/zinc/58/93/36/568589336.db2.gz OJTFVPSCIMVGLJ-AWEZNQCLSA-N 0 0 357.881 5.109 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1Cl ZINC000223000793 206429425 /nfs/dbraw/zinc/42/94/25/206429425.db2.gz OJTFVPSCIMVGLJ-CQSZACIVSA-N 0 0 357.881 5.109 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1cc(C)cc(C)c1)c1ccc(C)c(C)c1 ZINC000223000851 568589381 /nfs/dbraw/zinc/58/93/81/568589381.db2.gz LXAIATZBPXIVMB-FGZHOGPDSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](CC)c1ccc(C)c(C)c1 ZINC000223000912 568589382 /nfs/dbraw/zinc/58/93/82/568589382.db2.gz LXAIATZBPXIVMB-FCHUYYIVSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1cc(C)cc(C)c1)c1ccc(C)c(C)c1 ZINC000223000966 568589357 /nfs/dbraw/zinc/58/93/57/568589357.db2.gz LXAIATZBPXIVMB-YADHBBJMSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1cc(C)cc(C)c1)c1ccc(C)c(C)c1 ZINC000223001027 568589378 /nfs/dbraw/zinc/58/93/78/568589378.db2.gz LXAIATZBPXIVMB-VXKWHMMOSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1cc(C)cc(C)c1)c1ccc(C)cc1C ZINC000223001113 568589583 /nfs/dbraw/zinc/58/95/83/568589583.db2.gz XYEYJGONRIAPCT-FGZHOGPDSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](CC)c1ccc(C)cc1C ZINC000223001174 209745286 /nfs/dbraw/zinc/74/52/86/209745286.db2.gz XYEYJGONRIAPCT-FCHUYYIVSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1cc(C)cc(C)c1)c1ccc(C)cc1C ZINC000223001236 222761165 /nfs/dbraw/zinc/76/11/65/222761165.db2.gz XYEYJGONRIAPCT-YADHBBJMSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1cc(C)cc(C)c1)c1ccc(C)cc1C ZINC000223001298 568589604 /nfs/dbraw/zinc/58/96/04/568589604.db2.gz XYEYJGONRIAPCT-VXKWHMMOSA-N 0 0 353.506 5.345 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000223004459 222761539 /nfs/dbraw/zinc/76/15/39/222761539.db2.gz KLAOJRYWDOPUEC-HSZRJFAPSA-N 0 0 367.533 5.333 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000223004539 568590024 /nfs/dbraw/zinc/59/00/24/568590024.db2.gz KLAOJRYWDOPUEC-QHCPKHFHSA-N 0 0 367.533 5.333 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc2ccccc21 ZINC000223006685 222761019 /nfs/dbraw/zinc/76/10/19/222761019.db2.gz IJYZMKIOYGPQJV-HXUWFJFHSA-N 0 0 353.849 5.598 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc2ccccc21 ZINC000223006742 568590473 /nfs/dbraw/zinc/59/04/73/568590473.db2.gz IJYZMKIOYGPQJV-FQEVSTJZSA-N 0 0 353.849 5.598 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000223007597 568590594 /nfs/dbraw/zinc/59/05/94/568590594.db2.gz RYDOQXRTCMNTPI-MRXNPFEDSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000223007659 568590590 /nfs/dbraw/zinc/59/05/90/568590590.db2.gz RYDOQXRTCMNTPI-INIZCTEOSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000223008167 568590732 /nfs/dbraw/zinc/59/07/32/568590732.db2.gz OQJXLHQTUHLSKU-MRXNPFEDSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000223008225 568590783 /nfs/dbraw/zinc/59/07/83/568590783.db2.gz OQJXLHQTUHLSKU-INIZCTEOSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000223008499 568590743 /nfs/dbraw/zinc/59/07/43/568590743.db2.gz ATHUYXAXJWSWJH-MRXNPFEDSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000223008553 568590739 /nfs/dbraw/zinc/59/07/39/568590739.db2.gz ATHUYXAXJWSWJH-INIZCTEOSA-N 0 0 372.679 5.751 40 0 FKABRN COc1cc(C)c(C(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)cc1C(C)C ZINC000223009345 568590935 /nfs/dbraw/zinc/59/09/35/568590935.db2.gz YNAXBLDZTZGXDS-KRWDZBQOSA-N 0 0 365.517 5.497 40 0 FKABRN COc1cc(C)c(C(=O)N[C@H](C)c2ccc3c(c2)CCCC3)cc1C(C)C ZINC000223009412 222761245 /nfs/dbraw/zinc/76/12/45/222761245.db2.gz YNAXBLDZTZGXDS-QGZVFWFLSA-N 0 0 365.517 5.497 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)ccc1OC ZINC000223010849 222761791 /nfs/dbraw/zinc/76/17/91/222761791.db2.gz KZNMUTLDQNYGKQ-MRXNPFEDSA-N 0 0 368.260 5.107 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)ccc1OC ZINC000223010904 568591350 /nfs/dbraw/zinc/59/13/50/568591350.db2.gz KZNMUTLDQNYGKQ-INIZCTEOSA-N 0 0 368.260 5.107 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(Cl)cc1C ZINC000223011109 568591271 /nfs/dbraw/zinc/59/12/71/568591271.db2.gz FZEKKZVWWZISQK-QGZVFWFLSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(Cl)cc1C ZINC000223011166 568591338 /nfs/dbraw/zinc/59/13/38/568591338.db2.gz FZEKKZVWWZISQK-KRWDZBQOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)ccc1C ZINC000223011246 568591268 /nfs/dbraw/zinc/59/12/68/568591268.db2.gz WYSCXGFVZRDERY-QGZVFWFLSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cc(Cl)ccc1C ZINC000223011309 222760928 /nfs/dbraw/zinc/76/09/28/222760928.db2.gz WYSCXGFVZRDERY-KRWDZBQOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc(Cl)c1C ZINC000223011396 568591342 /nfs/dbraw/zinc/59/13/42/568591342.db2.gz CDNWCHXNBCSZSZ-QGZVFWFLSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc(Cl)c1C ZINC000223011456 568591346 /nfs/dbraw/zinc/59/13/46/568591346.db2.gz CDNWCHXNBCSZSZ-KRWDZBQOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(C)c(Cl)c1 ZINC000223011541 568591277 /nfs/dbraw/zinc/59/12/77/568591277.db2.gz RVBBCJAPEIYTSU-QGZVFWFLSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(C)c(Cl)c1 ZINC000223011606 568591336 /nfs/dbraw/zinc/59/13/36/568591336.db2.gz RVBBCJAPEIYTSU-KRWDZBQOSA-N 0 0 352.261 5.406 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccccc1C(F)(F)F ZINC000223011694 206430518 /nfs/dbraw/zinc/43/05/18/206430518.db2.gz JSBRDOIVVAUPLC-MRXNPFEDSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccccc1C(F)(F)F ZINC000223011757 568591295 /nfs/dbraw/zinc/59/12/95/568591295.db2.gz JSBRDOIVVAUPLC-INIZCTEOSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000223011987 568591475 /nfs/dbraw/zinc/59/14/75/568591475.db2.gz FMEAVPOLOBTUSZ-MRXNPFEDSA-N 0 0 368.260 5.107 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000223012037 568591485 /nfs/dbraw/zinc/59/14/85/568591485.db2.gz FMEAVPOLOBTUSZ-INIZCTEOSA-N 0 0 368.260 5.107 40 0 FKABRN CC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000223012783 568591514 /nfs/dbraw/zinc/59/15/14/568591514.db2.gz JHHUNTPNIKYTFU-LJQANCHMSA-N 0 0 362.300 5.753 40 0 FKABRN CC[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCCC2 ZINC000223012854 222762845 /nfs/dbraw/zinc/76/28/45/222762845.db2.gz JHHUNTPNIKYTFU-IBGZPJMESA-N 0 0 362.300 5.753 40 0 FKABRN CC[C@@H](NC(=O)c1ccc(Br)cc1)c1ccc2c(c1)CCCC2 ZINC000223013507 568591680 /nfs/dbraw/zinc/59/16/80/568591680.db2.gz SNAWRQJNHHINHK-LJQANCHMSA-N 0 0 372.306 5.209 40 0 FKABRN CC[C@H](NC(=O)c1ccc(Br)cc1)c1ccc2c(c1)CCCC2 ZINC000223013569 209745943 /nfs/dbraw/zinc/74/59/43/209745943.db2.gz SNAWRQJNHHINHK-IBGZPJMESA-N 0 0 372.306 5.209 40 0 FKABRN CC[C@@H](NC(=O)/C=C/c1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000223014416 568591869 /nfs/dbraw/zinc/59/18/69/568591869.db2.gz NJWQXWKHNSSJHX-QZMUEMGWSA-N 0 0 353.893 5.500 40 0 FKABRN CC[C@H](NC(=O)/C=C/c1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000223014485 206430898 /nfs/dbraw/zinc/43/08/98/206430898.db2.gz NJWQXWKHNSSJHX-ARKBFRDHSA-N 0 0 353.893 5.500 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(F)c(Cl)c1 ZINC000223014983 568591840 /nfs/dbraw/zinc/59/18/40/568591840.db2.gz YMMNXGHDXANLHA-MRXNPFEDSA-N 0 0 356.224 5.237 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(F)c(Cl)c1 ZINC000223015049 568591889 /nfs/dbraw/zinc/59/18/89/568591889.db2.gz YMMNXGHDXANLHA-INIZCTEOSA-N 0 0 356.224 5.237 40 0 FKABRN CC[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223016255 568592025 /nfs/dbraw/zinc/59/20/25/568592025.db2.gz XZADYFFECLVWBT-ZGQNHIEXSA-N 0 0 353.893 5.500 40 0 FKABRN CC[C@H](NC(=O)/C=C/c1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223016305 222762457 /nfs/dbraw/zinc/76/24/57/222762457.db2.gz XZADYFFECLVWBT-PBAKHKOTSA-N 0 0 353.893 5.500 40 0 FKABRN CC[C@@H](NC(=O)CSc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223016684 568592070 /nfs/dbraw/zinc/59/20/70/568592070.db2.gz IMSTUXRIYQLCJB-OAQYLSRUSA-N 0 0 353.531 5.233 40 0 FKABRN CC[C@H](NC(=O)CSc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223016748 568592037 /nfs/dbraw/zinc/59/20/37/568592037.db2.gz IMSTUXRIYQLCJB-NRFANRHFSA-N 0 0 353.531 5.233 40 0 FKABRN CC[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223016823 222762461 /nfs/dbraw/zinc/76/24/61/222762461.db2.gz UBBPIMLGEIOGQM-HXUWFJFHSA-N 0 0 373.949 5.578 40 0 FKABRN CC[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223016876 568592017 /nfs/dbraw/zinc/59/20/17/568592017.db2.gz UBBPIMLGEIOGQM-FQEVSTJZSA-N 0 0 373.949 5.578 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@@H](CC)Oc1ccc(Cl)c(C)c1 ZINC000223017017 568592078 /nfs/dbraw/zinc/59/20/78/568592078.db2.gz MVGTVGAENZFZTO-LJQANCHMSA-N 0 0 359.897 5.569 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@H](CC)Oc1ccc(Cl)c(C)c1 ZINC000223017076 209745679 /nfs/dbraw/zinc/74/56/79/209745679.db2.gz MVGTVGAENZFZTO-IBGZPJMESA-N 0 0 359.897 5.569 40 0 FKABRN CC[C@@H](NC(=O)CSCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223017495 568592219 /nfs/dbraw/zinc/59/22/19/568592219.db2.gz DMYVDDMCMRUUAH-OAQYLSRUSA-N 0 0 353.531 5.066 40 0 FKABRN CC[C@H](NC(=O)CSCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223017554 568592246 /nfs/dbraw/zinc/59/22/46/568592246.db2.gz DMYVDDMCMRUUAH-NRFANRHFSA-N 0 0 353.531 5.066 40 0 FKABRN CC[C@@H](NC(=O)CSCc1ccccc1C)c1ccc2c(c1)CCCC2 ZINC000223017635 209744830 /nfs/dbraw/zinc/74/48/30/209744830.db2.gz OPLGGRCGVIRYKU-JOCHJYFZSA-N 0 0 367.558 5.375 40 0 FKABRN CC[C@H](NC(=O)CSCc1ccccc1C)c1ccc2c(c1)CCCC2 ZINC000223017704 209745468 /nfs/dbraw/zinc/74/54/68/209745468.db2.gz OPLGGRCGVIRYKU-QFIPXVFZSA-N 0 0 367.558 5.375 40 0 FKABRN CC[C@@H](NC(=O)CSCc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223017780 222762361 /nfs/dbraw/zinc/76/23/61/222762361.db2.gz JPSNQVHTEZKTEO-JOCHJYFZSA-N 0 0 367.558 5.375 40 0 FKABRN CC[C@H](NC(=O)CSCc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223017830 568592225 /nfs/dbraw/zinc/59/22/25/568592225.db2.gz JPSNQVHTEZKTEO-QFIPXVFZSA-N 0 0 367.558 5.375 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Sc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223018654 568592407 /nfs/dbraw/zinc/59/24/07/568592407.db2.gz LIAXENCYQXRAJX-IIBYNOLFSA-N 0 0 353.531 5.314 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Sc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223018719 568592401 /nfs/dbraw/zinc/59/24/01/568592401.db2.gz LIAXENCYQXRAJX-IERDGZPVSA-N 0 0 353.531 5.314 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Sc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223018785 222762630 /nfs/dbraw/zinc/76/26/30/222762630.db2.gz LIAXENCYQXRAJX-HRAATJIYSA-N 0 0 353.531 5.314 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Sc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223018843 568592392 /nfs/dbraw/zinc/59/23/92/568592392.db2.gz LIAXENCYQXRAJX-KKSFZXQISA-N 0 0 353.531 5.314 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1c(C)cccc1C(C)C ZINC000223018854 568592369 /nfs/dbraw/zinc/59/23/69/568592369.db2.gz XRYDIJFHTABHJL-LJQANCHMSA-N 0 0 359.897 5.876 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1c(C)cccc1C(C)C ZINC000223018906 568592387 /nfs/dbraw/zinc/59/23/87/568592387.db2.gz XRYDIJFHTABHJL-IBGZPJMESA-N 0 0 359.897 5.876 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)SCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223018924 568592366 /nfs/dbraw/zinc/59/23/66/568592366.db2.gz LGOJGLMGUJAGNG-VGOFRKELSA-N 0 0 367.558 5.455 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)SCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223018986 568592380 /nfs/dbraw/zinc/59/23/80/568592380.db2.gz LGOJGLMGUJAGNG-VGSWGCGISA-N 0 0 367.558 5.455 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)SCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223019059 209747323 /nfs/dbraw/zinc/74/73/23/209747323.db2.gz LGOJGLMGUJAGNG-HTAPYJJXSA-N 0 0 367.558 5.455 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)SCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223019123 568592360 /nfs/dbraw/zinc/59/23/60/568592360.db2.gz LGOJGLMGUJAGNG-JTSKRJEESA-N 0 0 367.558 5.455 40 0 FKABRN CCCCc1ccc(NC(=O)[C@@H](CC)Oc2ccc(Cl)c(C)c2)cc1 ZINC000223019288 222762486 /nfs/dbraw/zinc/76/24/86/222762486.db2.gz LGQIHNFOGXPICP-HXUWFJFHSA-N 0 0 359.897 5.787 40 0 FKABRN CCCCc1ccc(NC(=O)[C@H](CC)Oc2ccc(Cl)c(C)c2)cc1 ZINC000223019344 568592377 /nfs/dbraw/zinc/59/23/77/568592377.db2.gz LGQIHNFOGXPICP-FQEVSTJZSA-N 0 0 359.897 5.787 40 0 FKABRN CC(C)Oc1cccc(NC(=O)CSCc2ccc(Cl)cc2F)c1 ZINC000223019374 568592375 /nfs/dbraw/zinc/59/23/75/568592375.db2.gz XMEACJOIQGFRHV-UHFFFAOYSA-N 0 0 367.873 5.138 40 0 FKABRN CC[C@@H](NC(=O)CCSc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223019526 568592535 /nfs/dbraw/zinc/59/25/35/568592535.db2.gz YLJYMFQRAMLHCR-OAQYLSRUSA-N 0 0 353.531 5.315 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000223019570 568592563 /nfs/dbraw/zinc/59/25/63/568592563.db2.gz BHLAHFWNFWKNSY-MRXNPFEDSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@H](NC(=O)CCSc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223019600 568592557 /nfs/dbraw/zinc/59/25/57/568592557.db2.gz YLJYMFQRAMLHCR-NRFANRHFSA-N 0 0 353.531 5.315 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000223019635 206430969 /nfs/dbraw/zinc/43/09/69/206430969.db2.gz BHLAHFWNFWKNSY-INIZCTEOSA-N 0 0 372.679 5.751 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000223020428 209747535 /nfs/dbraw/zinc/74/75/35/209747535.db2.gz YWLLAIPPMSVCHN-LJQANCHMSA-N 0 0 361.869 5.232 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000223020496 568592675 /nfs/dbraw/zinc/59/26/75/568592675.db2.gz YWLLAIPPMSVCHN-IBGZPJMESA-N 0 0 361.869 5.232 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc(OC(C)C)c1 ZINC000223020582 222762540 /nfs/dbraw/zinc/76/25/40/222762540.db2.gz MFZZDQLFRJHOAS-LJQANCHMSA-N 0 0 361.869 5.232 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)Nc1cccc(OC(C)C)c1 ZINC000223020652 568592710 /nfs/dbraw/zinc/59/27/10/568592710.db2.gz MFZZDQLFRJHOAS-IBGZPJMESA-N 0 0 361.869 5.232 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Sc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223021760 568592916 /nfs/dbraw/zinc/59/29/16/568592916.db2.gz MDXRTDSUHWLJEK-VGOFRKELSA-N 0 0 367.558 5.622 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Sc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223021826 568592914 /nfs/dbraw/zinc/59/29/14/568592914.db2.gz MDXRTDSUHWLJEK-VGSWGCGISA-N 0 0 367.558 5.622 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Sc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223021886 206431526 /nfs/dbraw/zinc/43/15/26/206431526.db2.gz MDXRTDSUHWLJEK-HTAPYJJXSA-N 0 0 367.558 5.622 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Sc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223021945 568593104 /nfs/dbraw/zinc/59/31/04/568593104.db2.gz MDXRTDSUHWLJEK-JTSKRJEESA-N 0 0 367.558 5.622 40 0 FKABRN CC[C@@H](NC(=O)CCSc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223022049 568593074 /nfs/dbraw/zinc/59/30/74/568593074.db2.gz VHAULQBTWKVWND-JOCHJYFZSA-N 0 0 367.558 5.624 40 0 FKABRN CC[C@H](NC(=O)CCSc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223022113 568593100 /nfs/dbraw/zinc/59/31/00/568593100.db2.gz VHAULQBTWKVWND-QFIPXVFZSA-N 0 0 367.558 5.624 40 0 FKABRN CC[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)CCCC2 ZINC000223022478 206430729 /nfs/dbraw/zinc/43/07/29/206430729.db2.gz AAXAZWCVQPYPAW-RUZDIDTESA-N 0 0 369.508 6.114 40 0 FKABRN CC[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc2c(c1)CCCC2 ZINC000223022550 568593037 /nfs/dbraw/zinc/59/30/37/568593037.db2.gz AAXAZWCVQPYPAW-VWLOTQADSA-N 0 0 369.508 6.114 40 0 FKABRN CC[C@@H](NC(=O)c1ccccc1Br)c1ccc2c(c1)CCCC2 ZINC000223024889 568593649 /nfs/dbraw/zinc/59/36/49/568593649.db2.gz LUIIBAXEGDSBOY-LJQANCHMSA-N 0 0 372.306 5.209 40 0 FKABRN CC[C@H](NC(=O)c1ccccc1Br)c1ccc2c(c1)CCCC2 ZINC000223024950 568593544 /nfs/dbraw/zinc/59/35/44/568593544.db2.gz LUIIBAXEGDSBOY-IBGZPJMESA-N 0 0 372.306 5.209 40 0 FKABRN Cc1ccc(CCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1C ZINC000223025176 568593634 /nfs/dbraw/zinc/59/36/34/568593634.db2.gz YMIYGDWQQGXXGU-UHFFFAOYSA-N 0 0 357.497 5.465 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000223029209 568594602 /nfs/dbraw/zinc/59/46/02/568594602.db2.gz WLMBBNMPPGPVCV-LEWJYISDSA-N 0 0 373.924 5.709 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 ZINC000223029274 568594587 /nfs/dbraw/zinc/59/45/87/568594587.db2.gz WLMBBNMPPGPVCV-SFTDATJTSA-N 0 0 373.924 5.709 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000223029338 222762081 /nfs/dbraw/zinc/76/20/81/222762081.db2.gz WLMBBNMPPGPVCV-NHCUHLMSSA-N 0 0 373.924 5.709 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@H](CC(C)C)c1ccccc1 ZINC000223029393 209746981 /nfs/dbraw/zinc/74/69/81/209746981.db2.gz WLMBBNMPPGPVCV-RTWAWAEBSA-N 0 0 373.924 5.709 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](CC)Oc1ccc(Cl)c(C)c1 ZINC000223029868 568594790 /nfs/dbraw/zinc/59/47/90/568594790.db2.gz LBIHEVLAOLVBKY-QGZVFWFLSA-N 0 0 363.910 5.557 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](CC)Oc1ccc(Cl)c(C)c1 ZINC000223029919 568594787 /nfs/dbraw/zinc/59/47/87/568594787.db2.gz LBIHEVLAOLVBKY-KRWDZBQOSA-N 0 0 363.910 5.557 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc(Cl)c(C)c1)c1ccc(C)c(C)c1 ZINC000223032707 568595247 /nfs/dbraw/zinc/59/52/47/568595247.db2.gz RXCKMEYUDHCIAK-NHCUHLMSSA-N 0 0 373.924 5.690 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](CC)c1ccc(C)c(C)c1 ZINC000223032759 568595307 /nfs/dbraw/zinc/59/53/07/568595307.db2.gz RXCKMEYUDHCIAK-LEWJYISDSA-N 0 0 373.924 5.690 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccc(Cl)c(C)c1)c1ccc(C)c(C)c1 ZINC000223032822 568595261 /nfs/dbraw/zinc/59/52/61/568595261.db2.gz RXCKMEYUDHCIAK-RTWAWAEBSA-N 0 0 373.924 5.690 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccc(Cl)c(C)c1)c1ccc(C)c(C)c1 ZINC000223032881 568595248 /nfs/dbraw/zinc/59/52/48/568595248.db2.gz RXCKMEYUDHCIAK-SFTDATJTSA-N 0 0 373.924 5.690 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc(Cl)c(C)c1)c1ccc(C)cc1C ZINC000223032979 568595278 /nfs/dbraw/zinc/59/52/78/568595278.db2.gz XBWZBDHBVCBPAX-NHCUHLMSSA-N 0 0 373.924 5.690 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](CC)c1ccc(C)cc1C ZINC000223033029 568595239 /nfs/dbraw/zinc/59/52/39/568595239.db2.gz XBWZBDHBVCBPAX-LEWJYISDSA-N 0 0 373.924 5.690 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccc(Cl)c(C)c1)c1ccc(C)cc1C ZINC000223033083 568595296 /nfs/dbraw/zinc/59/52/96/568595296.db2.gz XBWZBDHBVCBPAX-RTWAWAEBSA-N 0 0 373.924 5.690 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccc(Cl)c(C)c1)c1ccc(C)cc1C ZINC000223033127 568595284 /nfs/dbraw/zinc/59/52/84/568595284.db2.gz XBWZBDHBVCBPAX-SFTDATJTSA-N 0 0 373.924 5.690 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](CC)Oc1ccc2c(c1)CCCC2 ZINC000223047509 209746465 /nfs/dbraw/zinc/74/64/65/209746465.db2.gz UGLYXNANTNMTHC-HXUWFJFHSA-N 0 0 369.530 5.474 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](CC)Oc1ccc2c(c1)CCCC2 ZINC000223047565 568600369 /nfs/dbraw/zinc/60/03/69/568600369.db2.gz UGLYXNANTNMTHC-FQEVSTJZSA-N 0 0 369.530 5.474 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)Cc3ccc(OC)c(C)c3)ccc21 ZINC000223049015 568601228 /nfs/dbraw/zinc/60/12/28/568601228.db2.gz OMRANLAUGKHLLM-UHFFFAOYSA-N 0 0 372.468 5.313 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)c1 ZINC000223053358 206430766 /nfs/dbraw/zinc/43/07/66/206430766.db2.gz CYFKTPUDZOHFEH-AWEZNQCLSA-N 0 0 365.395 5.543 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccccc2C(F)(F)F)c1 ZINC000223053409 568602690 /nfs/dbraw/zinc/60/26/90/568602690.db2.gz CYFKTPUDZOHFEH-CQSZACIVSA-N 0 0 365.395 5.543 40 0 FKABRN O=C(CCc1ccc(F)cc1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000223057892 568603463 /nfs/dbraw/zinc/60/34/63/568603463.db2.gz SBPSPQQSVFUZIE-UHFFFAOYSA-N 0 0 369.823 5.843 40 0 FKABRN CC[C@@H](NC(=O)c1cc2cccc(OC)c2o1)c1ccc2c(c1)CCCC2 ZINC000223069028 568604842 /nfs/dbraw/zinc/60/48/42/568604842.db2.gz LYGJBUKWUOQEEO-LJQANCHMSA-N 0 0 363.457 5.201 40 0 FKABRN CC[C@H](NC(=O)c1cc2cccc(OC)c2o1)c1ccc2c(c1)CCCC2 ZINC000223069105 222764092 /nfs/dbraw/zinc/76/40/92/222764092.db2.gz LYGJBUKWUOQEEO-IBGZPJMESA-N 0 0 363.457 5.201 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223072564 206431470 /nfs/dbraw/zinc/43/14/70/206431470.db2.gz XXKNNJRYHGERCE-QVKFZJNVSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223072630 568605623 /nfs/dbraw/zinc/60/56/23/568605623.db2.gz XXKNNJRYHGERCE-VFNWGFHPSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223072682 568605642 /nfs/dbraw/zinc/60/56/42/568605642.db2.gz XXKNNJRYHGERCE-YCRPNKLZSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223072748 209747318 /nfs/dbraw/zinc/74/73/18/209747318.db2.gz XXKNNJRYHGERCE-BTYIYWSLSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](NC(=O)CCCOc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223074005 568605857 /nfs/dbraw/zinc/60/58/57/568605857.db2.gz FOUVNQOCSDIJES-HSZRJFAPSA-N 0 0 365.517 5.300 40 0 FKABRN CC[C@H](NC(=O)CCCOc1ccc(C)cc1)c1ccc2c(c1)CCCC2 ZINC000223074068 209746674 /nfs/dbraw/zinc/74/66/74/209746674.db2.gz FOUVNQOCSDIJES-QHCPKHFHSA-N 0 0 365.517 5.300 40 0 FKABRN CC[C@@H](NC(=O)COc1cccc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000223082424 222765356 /nfs/dbraw/zinc/76/53/56/222765356.db2.gz AXFJPSHICSLHPD-HSZRJFAPSA-N 0 0 373.496 5.365 40 0 FKABRN CC[C@H](NC(=O)COc1cccc2ccccc21)c1ccc2c(c1)CCCC2 ZINC000223082479 568607114 /nfs/dbraw/zinc/60/71/14/568607114.db2.gz AXFJPSHICSLHPD-QHCPKHFHSA-N 0 0 373.496 5.365 40 0 FKABRN CC[C@@H](NC(=O)COc1ccc(Cl)c(C)c1)c1ccc2c(c1)CCCC2 ZINC000223082871 222765095 /nfs/dbraw/zinc/76/50/95/222765095.db2.gz ZEHWTDUVOUGJRH-OAQYLSRUSA-N 0 0 371.908 5.174 40 0 FKABRN CC[C@H](NC(=O)COc1ccc(Cl)c(C)c1)c1ccc2c(c1)CCCC2 ZINC000223082937 222765154 /nfs/dbraw/zinc/76/51/54/222765154.db2.gz ZEHWTDUVOUGJRH-NRFANRHFSA-N 0 0 371.908 5.174 40 0 FKABRN CC[C@@H](NC(=O)COc1ccc(C(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000223083427 568607296 /nfs/dbraw/zinc/60/72/96/568607296.db2.gz RTCRRZONQMJLKX-HSZRJFAPSA-N 0 0 365.517 5.335 40 0 FKABRN CC[C@H](NC(=O)COc1ccc(C(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000223083490 209748802 /nfs/dbraw/zinc/74/88/02/209748802.db2.gz RTCRRZONQMJLKX-QHCPKHFHSA-N 0 0 365.517 5.335 40 0 FKABRN CC[C@@H](NC(=O)COc1cc(C)cc(C)c1C)c1ccc2c(c1)CCCC2 ZINC000223083559 568607390 /nfs/dbraw/zinc/60/73/90/568607390.db2.gz SPPRYSXTWUDJPH-JOCHJYFZSA-N 0 0 365.517 5.137 40 0 FKABRN CC[C@H](NC(=O)COc1cc(C)cc(C)c1C)c1ccc2c(c1)CCCC2 ZINC000223083621 568607318 /nfs/dbraw/zinc/60/73/18/568607318.db2.gz SPPRYSXTWUDJPH-QFIPXVFZSA-N 0 0 365.517 5.137 40 0 FKABRN CCCOc1ccc(C(=O)N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1 ZINC000223084100 222764816 /nfs/dbraw/zinc/76/48/16/222764816.db2.gz MHIWUAHXGISSQN-QFIPXVFZSA-N 0 0 351.490 5.235 40 0 FKABRN CCCOc1ccc(C(=O)N[C@H](CC)c2ccc3c(c2)CCCC3)cc1 ZINC000223084170 222765317 /nfs/dbraw/zinc/76/53/17/222765317.db2.gz MHIWUAHXGISSQN-JOCHJYFZSA-N 0 0 351.490 5.235 40 0 FKABRN CC[C@@H](NC(=O)c1ccc(OC(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000223084264 206432281 /nfs/dbraw/zinc/43/22/81/206432281.db2.gz GZCSQDOZPRUIFF-JOCHJYFZSA-N 0 0 351.490 5.234 40 0 FKABRN CC[C@H](NC(=O)c1ccc(OC(C)C)cc1)c1ccc2c(c1)CCCC2 ZINC000223084327 568607572 /nfs/dbraw/zinc/60/75/72/568607572.db2.gz GZCSQDOZPRUIFF-QFIPXVFZSA-N 0 0 351.490 5.234 40 0 FKABRN CC[C@@H](NC(=O)CCSCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223084718 568607585 /nfs/dbraw/zinc/60/75/85/568607585.db2.gz JLRXPMQCPXAMFD-JOCHJYFZSA-N 0 0 367.558 5.456 40 0 FKABRN CC[C@H](NC(=O)CCSCc1ccccc1)c1ccc2c(c1)CCCC2 ZINC000223084771 568607567 /nfs/dbraw/zinc/60/75/67/568607567.db2.gz JLRXPMQCPXAMFD-QFIPXVFZSA-N 0 0 367.558 5.456 40 0 FKABRN CCc1ccc(CC)c(CNC(=O)CSCc2ccccc2Cl)c1 ZINC000223085671 568607773 /nfs/dbraw/zinc/60/77/73/568607773.db2.gz QEOUGNRSHFWUAU-UHFFFAOYSA-N 0 0 361.938 5.014 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000223085940 568607716 /nfs/dbraw/zinc/60/77/16/568607716.db2.gz CTIJFJQKHJOSLI-FOIQADDNSA-N 0 0 371.908 5.254 40 0 FKABRN O=C(COc1cccc2c1CCCC2)Nc1ccccc1-c1ccccc1 ZINC000223085989 222765496 /nfs/dbraw/zinc/76/54/96/222765496.db2.gz YEMAFVWXCPTYOM-UHFFFAOYSA-N 0 0 357.453 5.250 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000223086004 568607782 /nfs/dbraw/zinc/60/77/82/568607782.db2.gz CTIJFJQKHJOSLI-QRWLVFNGSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000223086062 568607766 /nfs/dbraw/zinc/60/77/66/568607766.db2.gz CTIJFJQKHJOSLI-MGPUTAFESA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000223086118 568607711 /nfs/dbraw/zinc/60/77/11/568607711.db2.gz CTIJFJQKHJOSLI-YWZLYKJASA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1cc(C)ccc1C)c1ccc2c(c1)CCCC2 ZINC000223086209 568607723 /nfs/dbraw/zinc/60/77/23/568607723.db2.gz LZAAVXPDZVKMAT-XMSQKQJNSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1cc(C)ccc1C)c1ccc2c(c1)CCCC2 ZINC000223086277 568607728 /nfs/dbraw/zinc/60/77/28/568607728.db2.gz LZAAVXPDZVKMAT-GCJKJVERSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1cc(C)ccc1C)c1ccc2c(c1)CCCC2 ZINC000223086334 568607713 /nfs/dbraw/zinc/60/77/13/568607713.db2.gz LZAAVXPDZVKMAT-PGRDOPGGSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1cc(C)ccc1C)c1ccc2c(c1)CCCC2 ZINC000223086397 568607970 /nfs/dbraw/zinc/60/79/70/568607970.db2.gz LZAAVXPDZVKMAT-AVRDEDQJSA-N 0 0 365.517 5.217 40 0 FKABRN CCc1ccc(CC)c(CNC(=O)/C=C/c2ccc(Cl)cc2Cl)c1 ZINC000223087792 568608037 /nfs/dbraw/zinc/60/80/37/568608037.db2.gz UPWKXYOQNDBPCY-CSKARUKUSA-N 0 0 362.300 5.448 40 0 FKABRN O=C(Nc1cc(-c2cccc(F)c2)[nH]n1)c1ccc(-c2ccccc2)cc1 ZINC000223088374 209748776 /nfs/dbraw/zinc/74/87/76/209748776.db2.gz ZRCGQRBBCNBGTD-UHFFFAOYSA-N 0 0 357.388 5.135 40 0 FKABRN COC(=O)c1cc2cc(NC(=O)c3ccc(C(C)(C)C)cc3)ccc2s1 ZINC000223089528 206432079 /nfs/dbraw/zinc/43/20/79/206432079.db2.gz FKMZXLNPQRUJCI-UHFFFAOYSA-N 0 0 367.470 5.238 40 0 FKABRN O=C(NCCSCc1cccc(Cl)c1)C1(c2ccccc2)CCCC1 ZINC000223090782 568608733 /nfs/dbraw/zinc/60/87/33/568608733.db2.gz FXLKWOFDBQEXJN-UHFFFAOYSA-N 0 0 373.949 5.201 40 0 FKABRN CC[C@@H](NC(=O)CSCc1ccc(F)cc1)c1ccc2c(c1)CCCC2 ZINC000223093312 568609040 /nfs/dbraw/zinc/60/90/40/568609040.db2.gz WOCKZVGCBADTIW-OAQYLSRUSA-N 0 0 371.521 5.205 40 0 FKABRN CC[C@H](NC(=O)CSCc1ccc(F)cc1)c1ccc2c(c1)CCCC2 ZINC000223093380 568609010 /nfs/dbraw/zinc/60/90/10/568609010.db2.gz WOCKZVGCBADTIW-NRFANRHFSA-N 0 0 371.521 5.205 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000223095927 206431809 /nfs/dbraw/zinc/43/18/09/206431809.db2.gz ZXBIYXGXPKCYPU-QVKFZJNVSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](NC(=O)[C@@H](C)Oc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000223095988 568609624 /nfs/dbraw/zinc/60/96/24/568609624.db2.gz ZXBIYXGXPKCYPU-VFNWGFHPSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@@H](NC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000223096035 568609605 /nfs/dbraw/zinc/60/96/05/568609605.db2.gz ZXBIYXGXPKCYPU-YCRPNKLZSA-N 0 0 371.908 5.254 40 0 FKABRN CC[C@H](NC(=O)[C@H](C)Oc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000223096096 568609651 /nfs/dbraw/zinc/60/96/51/568609651.db2.gz ZXBIYXGXPKCYPU-BTYIYWSLSA-N 0 0 371.908 5.254 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@@H](CC)c1ccc2c(c1)CCCC2 ZINC000223096173 222764780 /nfs/dbraw/zinc/76/47/80/222764780.db2.gz KFRLLSXPIQMPAJ-JTSKRJEESA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@@H](CC)c1ccc2c(c1)CCCC2 ZINC000223096232 568609647 /nfs/dbraw/zinc/60/96/47/568609647.db2.gz KFRLLSXPIQMPAJ-VGSWGCGISA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccccc1O[C@@H](C)C(=O)N[C@H](CC)c1ccc2c(c1)CCCC2 ZINC000223096286 568609621 /nfs/dbraw/zinc/60/96/21/568609621.db2.gz KFRLLSXPIQMPAJ-HTAPYJJXSA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccccc1O[C@H](C)C(=O)N[C@H](CC)c1ccc2c(c1)CCCC2 ZINC000223096343 209748441 /nfs/dbraw/zinc/74/84/41/209748441.db2.gz KFRLLSXPIQMPAJ-VGOFRKELSA-N 0 0 365.517 5.163 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](C)Oc1cccc(C)c1C)c1ccc2c(c1)CCCC2 ZINC000223096929 568609885 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FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccccc1C)c1ccc2c(c1)CCCC2 ZINC000223097303 209748184 /nfs/dbraw/zinc/74/81/84/209748184.db2.gz ZTERZWLWDRZTKE-YADHBBJMSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccccc1C)c1ccc2c(c1)CCCC2 ZINC000223097352 568609945 /nfs/dbraw/zinc/60/99/45/568609945.db2.gz ZTERZWLWDRZTKE-VXKWHMMOSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1cccc(C)c1)c1ccc2c(c1)CCCC2 ZINC000223097434 568609966 /nfs/dbraw/zinc/60/99/66/568609966.db2.gz VSUOZUHBYIWDNG-DHIUTWEWSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1)C(=O)N[C@@H](CC)c1ccc2c(c1)CCCC2 ZINC000223097484 222765545 /nfs/dbraw/zinc/76/55/45/222765545.db2.gz VSUOZUHBYIWDNG-XZOQPEGZSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1cccc(C)c1)c1ccc2c(c1)CCCC2 ZINC000223097543 568610080 /nfs/dbraw/zinc/61/00/80/568610080.db2.gz VSUOZUHBYIWDNG-PKTZIBPZSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1cccc(C)c1)c1ccc2c(c1)CCCC2 ZINC000223097597 568610181 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ZINC000223132651 568614184 /nfs/dbraw/zinc/61/41/84/568614184.db2.gz OWLMUYMUTKHWGG-HXUWFJFHSA-N 0 0 359.872 5.168 40 0 FKABRN CC[C@H](NC(=O)Cc1ccc(Cl)cc1F)c1ccc2c(c1)CCCC2 ZINC000223132712 568614186 /nfs/dbraw/zinc/61/41/86/568614186.db2.gz OWLMUYMUTKHWGG-FQEVSTJZSA-N 0 0 359.872 5.168 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1C ZINC000223133228 222767316 /nfs/dbraw/zinc/76/73/16/222767316.db2.gz DPNIEPVSLFBXCK-NRFANRHFSA-N 0 0 351.490 5.154 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](CC)c2ccc3c(c2)CCCC3)cc1C ZINC000223133292 568614497 /nfs/dbraw/zinc/61/44/97/568614497.db2.gz DPNIEPVSLFBXCK-OAQYLSRUSA-N 0 0 351.490 5.154 40 0 FKABRN CCCCc1ccc(NC(=O)c2cc3cc4ccccc4nc3s2)cc1 ZINC000223133453 568614432 /nfs/dbraw/zinc/61/44/32/568614432.db2.gz UEEQFHKOJRCELV-UHFFFAOYSA-N 0 0 360.482 6.044 40 0 FKABRN Cc1ccccc1[C@@H](NC(=O)C1(c2ccccc2)CCCC1)c1ccccc1 ZINC000223133462 209749226 /nfs/dbraw/zinc/74/92/26/209749226.db2.gz RJFHRFJSDAOJRA-DEOSSOPVSA-N 0 0 369.508 5.713 40 0 FKABRN CC[C@@H](NC(=O)c1ccc(OC)c(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000223133516 568614450 /nfs/dbraw/zinc/61/44/50/568614450.db2.gz YRCRNUUCGRMGGH-LJQANCHMSA-N 0 0 357.881 5.109 40 0 FKABRN Cc1ccccc1[C@H](NC(=O)C1(c2ccccc2)CCCC1)c1ccccc1 ZINC000223133518 206433497 /nfs/dbraw/zinc/43/34/97/206433497.db2.gz RJFHRFJSDAOJRA-XMMPIXPASA-N 0 0 369.508 5.713 40 0 FKABRN CSc1ccccc1NC(=O)c1cc2cc3ccccc3nc2s1 ZINC000223133539 568614512 /nfs/dbraw/zinc/61/45/12/568614512.db2.gz SKSDXLYRTKWJCQ-UHFFFAOYSA-N 0 0 350.468 5.424 40 0 FKABRN CC[C@H](NC(=O)c1ccc(OC)c(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000223133568 568614508 /nfs/dbraw/zinc/61/45/08/568614508.db2.gz YRCRNUUCGRMGGH-IBGZPJMESA-N 0 0 357.881 5.109 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](CC)c2ccc3c(c2)CCCC3)cc1Cl ZINC000223133657 568614513 /nfs/dbraw/zinc/61/45/13/568614513.db2.gz YUGAEKFOONPHLJ-FQEVSTJZSA-N 0 0 371.908 5.499 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](CC)c2ccc3c(c2)CCCC3)cc1Cl ZINC000223133708 222767125 /nfs/dbraw/zinc/76/71/25/222767125.db2.gz YUGAEKFOONPHLJ-HXUWFJFHSA-N 0 0 371.908 5.499 40 0 FKABRN CCc1cccc(CC)c1NC(=O)c1cc2cc3ccccc3nc2s1 ZINC000223133788 568614499 /nfs/dbraw/zinc/61/44/99/568614499.db2.gz ZIDFBPAAZCEWBI-UHFFFAOYSA-N 0 0 360.482 5.827 40 0 FKABRN CC[C@@H](NC(=O)CCc1ccc(OC)c(C)c1)c1ccc2c(c1)CCCC2 ZINC000223133799 206433810 /nfs/dbraw/zinc/43/38/10/206433810.db2.gz XKYUZIDEYAZQSQ-JOCHJYFZSA-N 0 0 365.517 5.083 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)c1cc2cc3ccccc3nc2s1 ZINC000223133860 568614495 /nfs/dbraw/zinc/61/44/95/568614495.db2.gz MEDFIAXZJCEPBF-UHFFFAOYSA-N 0 0 360.482 6.134 40 0 FKABRN CC[C@H](NC(=O)CCc1ccc(OC)c(C)c1)c1ccc2c(c1)CCCC2 ZINC000223133865 568614472 /nfs/dbraw/zinc/61/44/72/568614472.db2.gz XKYUZIDEYAZQSQ-QFIPXVFZSA-N 0 0 365.517 5.083 40 0 FKABRN C[C@@H](NC(=O)c1cc2cc3ccccc3nc2s1)c1ccc(Cl)cc1 ZINC000223134718 206434102 /nfs/dbraw/zinc/43/41/02/206434102.db2.gz VAUHHBQCNCWVEW-GFCCVEGCSA-N 0 0 366.873 5.594 40 0 FKABRN C[C@H](NC(=O)c1cc2cc3ccccc3nc2s1)c1ccc(Cl)cc1 ZINC000223134776 206433613 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CC[C@H](NC(=O)C1(c2ccccc2)CCCC1)c1ccc2c(c1)CCCC2 ZINC000223136413 222767186 /nfs/dbraw/zinc/76/71/86/222767186.db2.gz FIBRAMYHPQAHOR-QHCPKHFHSA-N 0 0 361.529 5.645 40 0 FKABRN COc1ccc2nc(C)c(C(=O)Nc3c(Cl)cccc3Cl)cc2c1 ZINC000223137642 206434114 /nfs/dbraw/zinc/43/41/14/206434114.db2.gz GIBRSYYBANGOJJ-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN CC[C@@H](NC(=O)CCc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223140742 568616010 /nfs/dbraw/zinc/61/60/10/568616010.db2.gz GGHHWGKTNFYHGA-OAQYLSRUSA-N 0 0 355.909 5.419 40 0 FKABRN CC[C@H](NC(=O)CCc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223140795 568616040 /nfs/dbraw/zinc/61/60/40/568616040.db2.gz GGHHWGKTNFYHGA-NRFANRHFSA-N 0 0 355.909 5.419 40 0 FKABRN CC[C@@H](NC(=S)Nc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223142694 206433212 /nfs/dbraw/zinc/43/32/12/206433212.db2.gz VDMCMFRQDAPUBY-LJQANCHMSA-N 0 0 358.938 5.657 40 0 FKABRN CC[C@H](NC(=S)Nc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000223142756 206433762 /nfs/dbraw/zinc/43/37/62/206433762.db2.gz 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/nfs/dbraw/zinc/61/82/70/568618270.db2.gz KYNUPYKVHKCVDN-NRFANRHFSA-N 0 0 367.489 5.149 40 0 FKABRN C[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCC2 ZINC000223149794 568618572 /nfs/dbraw/zinc/61/85/72/568618572.db2.gz GKESFRPAXCEWFK-AORWBKJGSA-N 0 0 360.284 5.373 40 0 FKABRN C[C@H](NC(=O)/C=C/c1ccc(Cl)cc1Cl)c1ccc2c(c1)CCC2 ZINC000223149849 568618688 /nfs/dbraw/zinc/61/86/88/568618688.db2.gz GKESFRPAXCEWFK-FROQITRMSA-N 0 0 360.284 5.373 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc2c(c1)CCC2 ZINC000223151703 568618841 /nfs/dbraw/zinc/61/88/41/568618841.db2.gz YZEZLLUCRIWVIW-UONOGXRCSA-N 0 0 359.922 5.187 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccc2c(c1)CCC2 ZINC000223151756 568618791 /nfs/dbraw/zinc/61/87/91/568618791.db2.gz YZEZLLUCRIWVIW-KBPBESRZSA-N 0 0 359.922 5.187 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccc2c(c1)CCC2 ZINC000223151812 568618811 /nfs/dbraw/zinc/61/88/11/568618811.db2.gz YZEZLLUCRIWVIW-ZIAGYGMSSA-N 0 0 359.922 5.187 40 0 FKABRN C[C@@H](NC(=O)[C@H](C)Sc1ccc(Cl)cc1)c1ccc2c(c1)CCC2 ZINC000223151875 568619182 /nfs/dbraw/zinc/61/91/82/568619182.db2.gz YZEZLLUCRIWVIW-KGLIPLIRSA-N 0 0 359.922 5.187 40 0 FKABRN C[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc2c(c1)CCC2 ZINC000223154360 568619755 /nfs/dbraw/zinc/61/97/55/568619755.db2.gz NYPJMGUWPLBFRS-CQSZACIVSA-N 0 0 359.922 5.188 40 0 FKABRN C[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1ccc2c(c1)CCC2 ZINC000223154418 568619649 /nfs/dbraw/zinc/61/96/49/568619649.db2.gz NYPJMGUWPLBFRS-AWEZNQCLSA-N 0 0 359.922 5.188 40 0 FKABRN C[C@@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc2c(c1)CCC2 ZINC000223155209 568619928 /nfs/dbraw/zinc/61/99/28/568619928.db2.gz ZHQUWDFRIFKSRF-BXDFRRGMSA-N 0 0 357.453 5.186 40 0 FKABRN C[C@H](NC(=O)/C(=C/c1ccco1)c1ccccc1)c1ccc2c(c1)CCC2 ZINC000223155271 568619884 /nfs/dbraw/zinc/61/98/84/568619884.db2.gz ZHQUWDFRIFKSRF-CSUZIONRSA-N 0 0 357.453 5.186 40 0 FKABRN C[C@@H](NC(=O)/C(=C/c1ccccc1)c1ccccc1)c1ccc2c(c1)CCC2 ZINC000223157263 568620270 /nfs/dbraw/zinc/62/02/70/568620270.db2.gz SDKGLPSZXADFHV-WZGTUUFSSA-N 0 0 367.492 5.593 40 0 FKABRN C[C@H](NC(=O)/C(=C/c1ccccc1)c1ccccc1)c1ccc2c(c1)CCC2 ZINC000223157323 209750092 /nfs/dbraw/zinc/75/00/92/209750092.db2.gz SDKGLPSZXADFHV-HLNOYYKJSA-N 0 0 367.492 5.593 40 0 FKABRN CCSc1ccccc1NC(=O)CSCc1ccc(Cl)cc1F ZINC000223173359 568621854 /nfs/dbraw/zinc/62/18/54/568621854.db2.gz QPWRBXQQTMSIOE-UHFFFAOYSA-N 0 0 369.914 5.463 40 0 FKABRN CN(Cc1ccc(Cl)cc1)C(=O)CSCc1ccc(Cl)cc1F ZINC000223179463 222767910 /nfs/dbraw/zinc/76/79/10/222767910.db2.gz IRVNXXOBIGPEKN-UHFFFAOYSA-N 0 0 372.292 5.024 40 0 FKABRN O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(Cl)cc1F ZINC000223182853 568622684 /nfs/dbraw/zinc/62/26/84/568622684.db2.gz OCTFYVXKCJJPFD-UHFFFAOYSA-N 0 0 352.114 5.404 40 0 FKABRN C[C@@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc2c(c1)CCC2 ZINC000223187851 206433031 /nfs/dbraw/zinc/43/30/31/206433031.db2.gz SLDASBJNDWRBPN-OAHLLOKOSA-N 0 0 355.437 5.566 40 0 FKABRN C[C@H](NC(=O)c1cc2c(ccc3ccccc23)o1)c1ccc2c(c1)CCC2 ZINC000223187917 206433175 /nfs/dbraw/zinc/43/31/75/206433175.db2.gz SLDASBJNDWRBPN-HNNXBMFYSA-N 0 0 355.437 5.566 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)CSc2ccc(C)cc2)c2ccccc2O1 ZINC000223193835 568624402 /nfs/dbraw/zinc/62/44/02/568624402.db2.gz DRSUFQABMDZRPI-LJQANCHMSA-N 0 0 369.530 5.286 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)CSc2ccc(C)cc2)c2ccccc2O1 ZINC000223193899 568624378 /nfs/dbraw/zinc/62/43/78/568624378.db2.gz DRSUFQABMDZRPI-IBGZPJMESA-N 0 0 369.530 5.286 40 0 FKABRN Cc1ccc([C@@H](NC(=O)CCc2ccc(F)cc2)c2ccccc2)c(C)c1 ZINC000223194804 568624306 /nfs/dbraw/zinc/62/43/06/568624306.db2.gz RBSXUCBQNZPJPD-DEOSSOPVSA-N 0 0 361.460 5.281 40 0 FKABRN Cc1ccc([C@H](NC(=O)CCc2ccc(F)cc2)c2ccccc2)c(C)c1 ZINC000223194855 568624324 /nfs/dbraw/zinc/62/43/24/568624324.db2.gz RBSXUCBQNZPJPD-XMMPIXPASA-N 0 0 361.460 5.281 40 0 FKABRN C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccc2c(c1)CCC2 ZINC000223196936 209750300 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371.908 5.090 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCC3)cc(C)c1Cl ZINC000223198182 209750977 /nfs/dbraw/zinc/75/09/77/209750977.db2.gz BODNKAVRSVVYHQ-CVEARBPZSA-N 0 0 371.908 5.090 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)N[C@H](C)c2ccc3c(c2)CCC3)cc(C)c1Cl ZINC000223198234 568624861 /nfs/dbraw/zinc/62/48/61/568624861.db2.gz BODNKAVRSVVYHQ-HZPDHXFCSA-N 0 0 371.908 5.090 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)Cc2ccc(C)cc2C)c2ccccc2O1 ZINC000223199986 568625130 /nfs/dbraw/zinc/62/51/30/568625130.db2.gz VSGBMZYOVFVXFM-HXUWFJFHSA-N 0 0 351.490 5.045 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)Cc2ccc(C)cc2C)c2ccccc2O1 ZINC000223200044 222768844 /nfs/dbraw/zinc/76/88/44/222768844.db2.gz VSGBMZYOVFVXFM-FQEVSTJZSA-N 0 0 351.490 5.045 40 0 FKABRN CC(C)CSc1nnc(NC(=O)c2ccc(-c3ccccc3)cc2)s1 ZINC000223200603 568625032 /nfs/dbraw/zinc/62/50/32/568625032.db2.gz FQEFETGYCWAHIZ-UHFFFAOYSA-N 0 0 369.515 5.206 40 0 FKABRN O=C(CCc1ccc(F)cc1)Nc1ccccc1Sc1ccccc1 ZINC000223206590 568625515 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Cc1ccc([C@H](NC(=O)CCc2ccccc2F)c2ccccc2)c(C)c1 ZINC000223256751 568631270 /nfs/dbraw/zinc/63/12/70/568631270.db2.gz QTSRNLREIKMQGU-XMMPIXPASA-N 0 0 361.460 5.281 40 0 FKABRN C[C@@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc2c(c1)CCC2 ZINC000223256757 206435638 /nfs/dbraw/zinc/43/56/38/206435638.db2.gz SYORVVNYIMVVJF-CYBMUJFWSA-N 0 0 362.300 5.292 40 0 FKABRN C[C@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccc2c(c1)CCC2 ZINC000223256817 568631283 /nfs/dbraw/zinc/63/12/83/568631283.db2.gz SYORVVNYIMVVJF-ZDUSSCGKSA-N 0 0 362.300 5.292 40 0 FKABRN CCc1ccc(CC)c(CNC(=O)CSCc2ccc(Cl)cc2)c1 ZINC000223257621 568631290 /nfs/dbraw/zinc/63/12/90/568631290.db2.gz GRPSYLFQQXVENW-UHFFFAOYSA-N 0 0 361.938 5.014 40 0 FKABRN COc1cc(C)c(C(=O)N[C@@H](C)c2ccc3c(c2)CCC3)cc1C(C)C ZINC000223259606 568631293 /nfs/dbraw/zinc/63/12/93/568631293.db2.gz AQLJLXCIFZQNKJ-INIZCTEOSA-N 0 0 351.490 5.107 40 0 FKABRN COc1cc(C)c(C(=O)N[C@H](C)c2ccc3c(c2)CCC3)cc1C(C)C ZINC000223259662 568631231 /nfs/dbraw/zinc/63/12/31/568631231.db2.gz AQLJLXCIFZQNKJ-MRXNPFEDSA-N 0 0 351.490 5.107 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)cc1C(C)C ZINC000223263298 568631648 /nfs/dbraw/zinc/63/16/48/568631648.db2.gz LLRDHURHJTYPKZ-QGZVFWFLSA-N 0 0 367.533 5.916 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)cc1C(C)C ZINC000223263347 568631685 /nfs/dbraw/zinc/63/16/85/568631685.db2.gz LLRDHURHJTYPKZ-KRWDZBQOSA-N 0 0 367.533 5.916 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)/C=C/c2ccccc2Cl)cc1C(C)C ZINC000223264744 568631741 /nfs/dbraw/zinc/63/17/41/568631741.db2.gz LLEVGYXPPLJULM-SIFUEBAJSA-N 0 0 371.908 5.671 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)/C=C/c2ccccc2Cl)cc1C(C)C ZINC000223264799 222771577 /nfs/dbraw/zinc/77/15/77/222771577.db2.gz LLEVGYXPPLJULM-OFAQMXQXSA-N 0 0 371.908 5.671 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)/C=C/c2ccc(F)cc2)cc1C(C)C ZINC000223265007 206435979 /nfs/dbraw/zinc/43/59/79/206435979.db2.gz IGDYPGCXVSNCFR-YCABEKBOSA-N 0 0 355.453 5.157 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)/C=C/c2ccc(F)cc2)cc1C(C)C ZINC000223265066 568631756 /nfs/dbraw/zinc/63/17/56/568631756.db2.gz IGDYPGCXVSNCFR-KXKDPZRNSA-N 0 0 355.453 5.157 40 0 FKABRN COc1ccc(/C=C/C(=O)N[C@@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223265135 206436057 /nfs/dbraw/zinc/43/60/57/206436057.db2.gz HSXACCQMKIICBV-KQPPXVQYSA-N 0 0 367.489 5.026 40 0 FKABRN CSc1ccccc1NC(=O)CSCc1ccc(Cl)cc1F ZINC000223265150 568631645 /nfs/dbraw/zinc/63/16/45/568631645.db2.gz YUVRCKYXCLMHDL-UHFFFAOYSA-N 0 0 355.887 5.073 40 0 FKABRN COc1ccc(/C=C/C(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223265185 568631765 /nfs/dbraw/zinc/63/17/65/568631765.db2.gz HSXACCQMKIICBV-XLNAKTSKSA-N 0 0 367.489 5.026 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)/C=C/c2ccc(Cl)cc2)cc1C(C)C ZINC000223266445 206436158 /nfs/dbraw/zinc/43/61/58/206436158.db2.gz MQLZQMWESXZPHN-YCABEKBOSA-N 0 0 371.908 5.671 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)/C=C/c2ccc(Cl)cc2)cc1C(C)C ZINC000223266504 206435931 /nfs/dbraw/zinc/43/59/31/206435931.db2.gz MQLZQMWESXZPHN-KXKDPZRNSA-N 0 0 371.908 5.671 40 0 FKABRN COc1ccccc1/C=C/C(=O)N[C@@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223266574 568631951 /nfs/dbraw/zinc/63/19/51/568631951.db2.gz FOKWGXWHOHSRLS-FLVLSHQESA-N 0 0 367.489 5.026 40 0 FKABRN COc1ccc(CCC(=O)Nc2ccccc2Oc2ccccc2)cc1C ZINC000223266613 222772024 /nfs/dbraw/zinc/77/20/24/222772024.db2.gz HCNORFPLFLVQNG-UHFFFAOYSA-N 0 0 361.441 5.367 40 0 FKABRN COc1ccccc1/C=C/C(=O)N[C@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223266633 568631945 /nfs/dbraw/zinc/63/19/45/568631945.db2.gz FOKWGXWHOHSRLS-FMQWLBJXSA-N 0 0 367.489 5.026 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CSc2ccccc2)cc1C(C)C ZINC000223266708 568631874 /nfs/dbraw/zinc/63/18/74/568631874.db2.gz OQOLMZNKMXPIPL-MRXNPFEDSA-N 0 0 357.519 5.097 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CSc2ccccc2)cc1C(C)C ZINC000223266767 568631872 /nfs/dbraw/zinc/63/18/72/568631872.db2.gz OQOLMZNKMXPIPL-INIZCTEOSA-N 0 0 357.519 5.097 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CSc2ccc(C)cc2)cc1C(C)C ZINC000223266846 568631962 /nfs/dbraw/zinc/63/19/62/568631962.db2.gz FIBLDNZZBGFCJO-QGZVFWFLSA-N 0 0 371.546 5.405 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CSc2ccc(C)cc2)cc1C(C)C ZINC000223266905 568631942 /nfs/dbraw/zinc/63/19/42/568631942.db2.gz FIBLDNZZBGFCJO-KRWDZBQOSA-N 0 0 371.546 5.405 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CSCc2ccccc2)cc1C(C)C ZINC000223267663 568631991 /nfs/dbraw/zinc/63/19/91/568631991.db2.gz ZMJSRFCEBBLURI-QGZVFWFLSA-N 0 0 371.546 5.238 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CSCc2ccccc2)cc1C(C)C ZINC000223267729 209754319 /nfs/dbraw/zinc/75/43/19/209754319.db2.gz ZMJSRFCEBBLURI-KRWDZBQOSA-N 0 0 371.546 5.238 40 0 FKABRN Cc1ccc(-c2nnc(NC(=O)c3ccccc3SC(C)C)s2)cc1 ZINC000223267769 568631966 /nfs/dbraw/zinc/63/19/66/568631966.db2.gz SRVZZJURVNJAGS-UHFFFAOYSA-N 0 0 369.515 5.266 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Sc2ccccc2)cc1C(C)C ZINC000223268771 568632225 /nfs/dbraw/zinc/63/22/25/568632225.db2.gz BMYGDGJDMCQYML-IAGOWNOFSA-N 0 0 371.546 5.485 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Sc2ccccc2)cc1C(C)C ZINC000223268830 568632207 /nfs/dbraw/zinc/63/22/07/568632207.db2.gz BMYGDGJDMCQYML-DLBZAZTESA-N 0 0 371.546 5.485 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Sc2ccccc2)cc1C(C)C ZINC000223268880 568632167 /nfs/dbraw/zinc/63/21/67/568632167.db2.gz BMYGDGJDMCQYML-SJORKVTESA-N 0 0 371.546 5.485 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@H](C)Sc2ccccc2)cc1C(C)C ZINC000223268941 568632154 /nfs/dbraw/zinc/63/21/54/568632154.db2.gz BMYGDGJDMCQYML-IRXDYDNUSA-N 0 0 371.546 5.485 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCSc2ccccc2)cc1C(C)C ZINC000223269509 568632134 /nfs/dbraw/zinc/63/21/34/568632134.db2.gz WFAUWMFKRIWZFR-QGZVFWFLSA-N 0 0 371.546 5.487 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCSc2ccccc2)cc1C(C)C ZINC000223269571 568632178 /nfs/dbraw/zinc/63/21/78/568632178.db2.gz WFAUWMFKRIWZFR-KRWDZBQOSA-N 0 0 371.546 5.487 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccc(C)cc2)cc1C ZINC000223270233 206435576 /nfs/dbraw/zinc/43/55/76/206435576.db2.gz XIMPUOKGNJTVIF-QHCPKHFHSA-N 0 0 359.469 5.222 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](c2ccccc2)c2ccc(C)cc2)cc1C ZINC000223270294 209754045 /nfs/dbraw/zinc/75/40/45/209754045.db2.gz XIMPUOKGNJTVIF-HSZRJFAPSA-N 0 0 359.469 5.222 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)/C=C/c2ccc(C)cc2)cc1C(C)C ZINC000223273284 568632738 /nfs/dbraw/zinc/63/27/38/568632738.db2.gz ZTUMYHCEUAYEDA-IENJSVCTSA-N 0 0 351.490 5.326 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)/C=C/c2ccc(C)cc2)cc1C(C)C ZINC000223273350 206436487 /nfs/dbraw/zinc/43/64/87/206436487.db2.gz ZTUMYHCEUAYEDA-DXRVJIQQSA-N 0 0 351.490 5.326 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)[C@@H](CC)Oc2ccc3c(c2)CCCC3)cc1 ZINC000223273356 568632813 /nfs/dbraw/zinc/63/28/13/568632813.db2.gz CPWWVBUVEDKXQD-UZUQRXQVSA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@@H](CC)Oc2ccc3c(c2)CCCC3)cc1 ZINC000223273417 568632725 /nfs/dbraw/zinc/63/27/25/568632725.db2.gz CPWWVBUVEDKXQD-GAJHUEQPSA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)[C@H](CC)Oc2ccc3c(c2)CCCC3)cc1 ZINC000223273477 568632839 /nfs/dbraw/zinc/63/28/39/568632839.db2.gz CPWWVBUVEDKXQD-HXOBKFHXSA-N 0 0 365.517 5.163 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)[C@H](CC)Oc2ccc3c(c2)CCCC3)cc1 ZINC000223273531 568633206 /nfs/dbraw/zinc/63/32/06/568633206.db2.gz CPWWVBUVEDKXQD-SBUREZEXSA-N 0 0 365.517 5.163 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2ccccc2SC)cc1C(C)C ZINC000223273589 568633209 /nfs/dbraw/zinc/63/32/09/568633209.db2.gz DPUCUFDMYXIKJC-OAHLLOKOSA-N 0 0 357.519 5.340 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2ccccc2SC)cc1C(C)C ZINC000223273660 568633033 /nfs/dbraw/zinc/63/30/33/568633033.db2.gz DPUCUFDMYXIKJC-HNNXBMFYSA-N 0 0 357.519 5.340 40 0 FKABRN CC[C@@H](Oc1cccc2ccccc21)C(=O)NC(C)(C)Cc1ccccc1 ZINC000223276356 568633413 /nfs/dbraw/zinc/63/34/13/568633413.db2.gz OOFINUOFNMKKGC-OAQYLSRUSA-N 0 0 361.485 5.135 40 0 FKABRN CC[C@H](Oc1cccc2ccccc21)C(=O)NC(C)(C)Cc1ccccc1 ZINC000223276423 568633402 /nfs/dbraw/zinc/63/34/02/568633402.db2.gz OOFINUOFNMKKGC-NRFANRHFSA-N 0 0 361.485 5.135 40 0 FKABRN O=C(Cc1cccc(Cl)c1)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000223276840 568633349 /nfs/dbraw/zinc/63/33/49/568633349.db2.gz ZWVPFSAGNHKUHY-UHFFFAOYSA-N 0 0 372.251 5.967 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)NC(C)(C)Cc1ccccc1 ZINC000223297881 568636564 /nfs/dbraw/zinc/63/65/64/568636564.db2.gz GONXIJZAWLXLEB-GOSISDBHSA-N 0 0 361.938 5.348 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)NC(C)(C)Cc1ccccc1 ZINC000223297927 568636501 /nfs/dbraw/zinc/63/65/01/568636501.db2.gz GONXIJZAWLXLEB-SFHVURJKSA-N 0 0 361.938 5.348 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)Cc3ccc(C)cc3C)ccc21 ZINC000223301282 568636991 /nfs/dbraw/zinc/63/69/91/568636991.db2.gz ZIFMBFZEBKFXJH-UHFFFAOYSA-N 0 0 356.469 5.612 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCCSC2CCCCC2)c1 ZINC000223305427 568637836 /nfs/dbraw/zinc/63/78/36/568637836.db2.gz BSGZHZHINBRTRX-KRWDZBQOSA-N 0 0 363.567 5.068 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCCSC2CCCCC2)c1 ZINC000223305482 568637812 /nfs/dbraw/zinc/63/78/12/568637812.db2.gz BSGZHZHINBRTRX-QGZVFWFLSA-N 0 0 363.567 5.068 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Cc2ccc(Cl)cc2)cc1C(C)C ZINC000223309707 209756445 /nfs/dbraw/zinc/75/64/45/209756445.db2.gz WETDJQAOLZAQNJ-OAHLLOKOSA-N 0 0 359.897 5.200 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Cc2ccc(Cl)cc2)cc1C(C)C ZINC000223309770 222772649 /nfs/dbraw/zinc/77/26/49/222772649.db2.gz WETDJQAOLZAQNJ-HNNXBMFYSA-N 0 0 359.897 5.200 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCc2ccc(C)cc2)cc1C(C)C ZINC000223309856 568638162 /nfs/dbraw/zinc/63/81/62/568638162.db2.gz UBMJMCDAVVJNCD-GOSISDBHSA-N 0 0 353.506 5.245 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCc2ccc(C)cc2)cc1C(C)C ZINC000223309929 568638187 /nfs/dbraw/zinc/63/81/87/568638187.db2.gz UBMJMCDAVVJNCD-SFHVURJKSA-N 0 0 353.506 5.245 40 0 FKABRN Cc1cccc([C@@H](NC(=O)CCc2ccc(C)c(C)c2)c2ccccc2)c1 ZINC000223312806 209755152 /nfs/dbraw/zinc/75/51/52/209755152.db2.gz GRRQUDYHVMYHLC-VWLOTQADSA-N 0 0 357.497 5.450 40 0 FKABRN Cc1cccc([C@H](NC(=O)CCc2ccc(C)c(C)c2)c2ccccc2)c1 ZINC000223312876 568638631 /nfs/dbraw/zinc/63/86/31/568638631.db2.gz GRRQUDYHVMYHLC-RUZDIDTESA-N 0 0 357.497 5.450 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H]2CCCc3ccccc32)c1 ZINC000223316160 568639023 /nfs/dbraw/zinc/63/90/23/568639023.db2.gz KVWQDMCUQVVCHP-LAUBAEHRSA-N 0 0 351.490 5.080 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H]2CCCc3ccccc32)c1 ZINC000223316220 568638865 /nfs/dbraw/zinc/63/88/65/568638865.db2.gz KVWQDMCUQVVCHP-DYESRHJHSA-N 0 0 351.490 5.080 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H]2CCCc3ccccc32)c1 ZINC000223316281 568639045 /nfs/dbraw/zinc/63/90/45/568639045.db2.gz KVWQDMCUQVVCHP-UWJYYQICSA-N 0 0 351.490 5.080 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H]2CCCc3ccccc32)c1 ZINC000223316337 568638914 /nfs/dbraw/zinc/63/89/14/568638914.db2.gz KVWQDMCUQVVCHP-UTKZUKDTSA-N 0 0 351.490 5.080 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2cccc(C)c2)cc1C(C)C ZINC000223319109 222774313 /nfs/dbraw/zinc/77/43/13/222774313.db2.gz NTOICUMCTIZWHK-QZTJIDSGSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2cccc(C)c2)cc1C(C)C ZINC000223319173 568639566 /nfs/dbraw/zinc/63/95/66/568639566.db2.gz NTOICUMCTIZWHK-ZWKOTPCHSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2cccc(C)c2)cc1C(C)C ZINC000223319229 568639487 /nfs/dbraw/zinc/63/94/87/568639487.db2.gz NTOICUMCTIZWHK-MSOLQXFVSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2cccc(C)c2)cc1C(C)C ZINC000223319298 568639574 /nfs/dbraw/zinc/63/95/74/568639574.db2.gz NTOICUMCTIZWHK-ROUUACIJSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)COc2cc(C)cc(C)c2)cc1C(C)C ZINC000223319378 568639537 /nfs/dbraw/zinc/63/95/37/568639537.db2.gz HYPYADKTCBHKNH-GOSISDBHSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)COc2cc(C)cc(C)c2)cc1C(C)C ZINC000223319440 209755510 /nfs/dbraw/zinc/75/55/10/209755510.db2.gz HYPYADKTCBHKNH-SFHVURJKSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)COc2ccc(C)c(C)c2)cc1C(C)C ZINC000223320049 568639630 /nfs/dbraw/zinc/63/96/30/568639630.db2.gz ZGKFUQNDRDOSKH-GOSISDBHSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)COc2ccc(C)c(C)c2)cc1C(C)C ZINC000223320112 568639614 /nfs/dbraw/zinc/63/96/14/568639614.db2.gz ZGKFUQNDRDOSKH-SFHVURJKSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCCOc2ccccc2)cc1C(C)C ZINC000223320190 209755683 /nfs/dbraw/zinc/75/56/83/209755683.db2.gz DTCKFOPGIJRAMG-GOSISDBHSA-N 0 0 369.505 5.163 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCCOc2ccccc2)cc1C(C)C ZINC000223320244 209756132 /nfs/dbraw/zinc/75/61/32/209756132.db2.gz DTCKFOPGIJRAMG-SFHVURJKSA-N 0 0 369.505 5.163 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)[C@@H](C)Oc1cc(C)ccc1C(C)C ZINC000223323912 222773915 /nfs/dbraw/zinc/77/39/15/222773915.db2.gz YMHQUAXTLSWRGR-CQSZACIVSA-N 0 0 361.869 5.186 40 0 FKABRN CCc1ccc(CC)c(CNC(=O)/C(=C/c2ccco2)c2ccccc2)c1 ZINC000223324412 568640302 /nfs/dbraw/zinc/64/03/02/568640302.db2.gz ARSFDMPSFGXIDA-XQNSMLJCSA-N 0 0 359.469 5.261 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Cc2ccc(C)c(C)c2)cc1C(C)C ZINC000223327375 222774100 /nfs/dbraw/zinc/77/41/00/222774100.db2.gz PKODLMZIMYFOGV-GOSISDBHSA-N 0 0 353.506 5.164 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Cc2ccc(C)c(C)c2)cc1C(C)C ZINC000223327424 568640614 /nfs/dbraw/zinc/64/06/14/568640614.db2.gz PKODLMZIMYFOGV-SFHVURJKSA-N 0 0 353.506 5.164 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)COc2cc(C)ccc2C)cc1C(C)C ZINC000223329456 568640778 /nfs/dbraw/zinc/64/07/78/568640778.db2.gz AGUREGYRUQAWSC-GOSISDBHSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)COc2cc(C)ccc2C)cc1C(C)C ZINC000223329510 568640784 /nfs/dbraw/zinc/64/07/84/568640784.db2.gz AGUREGYRUQAWSC-SFHVURJKSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(C)cc2)cc1C(C)C ZINC000223330003 209755415 /nfs/dbraw/zinc/75/54/15/209755415.db2.gz PRMPAYIWLWGTMO-QZTJIDSGSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2ccc(C)cc2)cc1C(C)C ZINC000223330064 568640852 /nfs/dbraw/zinc/64/08/52/568640852.db2.gz PRMPAYIWLWGTMO-ZWKOTPCHSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2ccc(C)cc2)cc1C(C)C ZINC000223330131 568640856 /nfs/dbraw/zinc/64/08/56/568640856.db2.gz PRMPAYIWLWGTMO-MSOLQXFVSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2ccc(C)cc2)cc1C(C)C ZINC000223330181 568640809 /nfs/dbraw/zinc/64/08/09/568640809.db2.gz PRMPAYIWLWGTMO-ROUUACIJSA-N 0 0 369.505 5.080 40 0 FKABRN CCCOc1ccc(C(=O)N[C@@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223330400 568641128 /nfs/dbraw/zinc/64/11/28/568641128.db2.gz ZBXJQPHKRKVCMV-KRWDZBQOSA-N 0 0 369.505 5.407 40 0 FKABRN CCCOc1ccc(C(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223330451 209756741 /nfs/dbraw/zinc/75/67/41/209756741.db2.gz ZBXJQPHKRKVCMV-QGZVFWFLSA-N 0 0 369.505 5.407 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2ccc(OC(C)C)cc2)cc1C(C)C ZINC000223330527 568641085 /nfs/dbraw/zinc/64/10/85/568641085.db2.gz VZIBCLUOTOLFLU-QGZVFWFLSA-N 0 0 369.505 5.405 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2ccc(OC(C)C)cc2)cc1C(C)C ZINC000223330579 568641033 /nfs/dbraw/zinc/64/10/33/568641033.db2.gz VZIBCLUOTOLFLU-KRWDZBQOSA-N 0 0 369.505 5.405 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccccc1OC ZINC000223330767 568641023 /nfs/dbraw/zinc/64/10/23/568641023.db2.gz USODYAVECCHWAZ-OXJNMPFZSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@@H](C)c1ccccc1OC ZINC000223330819 568641027 /nfs/dbraw/zinc/64/10/27/568641027.db2.gz USODYAVECCHWAZ-JXFKEZNVSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccccc1OC ZINC000223330871 568641180 /nfs/dbraw/zinc/64/11/80/568641180.db2.gz USODYAVECCHWAZ-OXQOHEQNSA-N 0 0 369.505 5.028 40 0 FKABRN CC[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N[C@H](C)c1ccccc1OC ZINC000223330922 206437600 /nfs/dbraw/zinc/43/76/00/206437600.db2.gz USODYAVECCHWAZ-UZLBHIALSA-N 0 0 369.505 5.028 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccccc2OC(C)C)c1 ZINC000223334057 222774360 /nfs/dbraw/zinc/77/43/60/222774360.db2.gz LRMOFBSZSHQARL-KRWDZBQOSA-N 0 0 355.478 5.312 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccccc2OC(C)C)c1 ZINC000223334113 568641660 /nfs/dbraw/zinc/64/16/60/568641660.db2.gz LRMOFBSZSHQARL-QGZVFWFLSA-N 0 0 355.478 5.312 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cccc2ccccc21 ZINC000223339328 568642054 /nfs/dbraw/zinc/64/20/54/568642054.db2.gz WEBRILLKJPYECT-HSZRJFAPSA-N 0 0 359.469 5.515 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cccc2ccccc21 ZINC000223339392 568642144 /nfs/dbraw/zinc/64/21/44/568642144.db2.gz WEBRILLKJPYECT-QHCPKHFHSA-N 0 0 359.469 5.515 40 0 FKABRN COc1cc(C)c(S(=O)(=O)Nc2ccc(C(C)C)cc2)cc1C(C)C ZINC000223340162 568642427 /nfs/dbraw/zinc/64/24/27/568642427.db2.gz YYMPJBUEQCXLNT-UHFFFAOYSA-N 0 0 361.507 5.051 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Cc2cc(C)ccc2C)cc1C(C)C ZINC000223340494 568642403 /nfs/dbraw/zinc/64/24/03/568642403.db2.gz DKMKKFNZBQTQJS-GOSISDBHSA-N 0 0 353.506 5.164 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Cc2cc(C)ccc2C)cc1C(C)C ZINC000223340550 568642376 /nfs/dbraw/zinc/64/23/76/568642376.db2.gz DKMKKFNZBQTQJS-SFHVURJKSA-N 0 0 353.506 5.164 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2ccccc2C)cc1C(C)C ZINC000223341750 568642654 /nfs/dbraw/zinc/64/26/54/568642654.db2.gz NTDNBMBQROPZLO-QZTJIDSGSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2ccccc2C)cc1C(C)C ZINC000223341812 222775253 /nfs/dbraw/zinc/77/52/53/222775253.db2.gz NTDNBMBQROPZLO-ZWKOTPCHSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2ccccc2C)cc1C(C)C ZINC000223341871 568642708 /nfs/dbraw/zinc/64/27/08/568642708.db2.gz NTDNBMBQROPZLO-MSOLQXFVSA-N 0 0 369.505 5.080 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2ccccc2C)cc1C(C)C ZINC000223341921 209756357 /nfs/dbraw/zinc/75/63/57/209756357.db2.gz NTDNBMBQROPZLO-ROUUACIJSA-N 0 0 369.505 5.080 40 0 FKABRN Cc1ccc(C(=O)NCCSCc2c(Cl)cccc2Cl)cc1C ZINC000223343121 209755990 /nfs/dbraw/zinc/75/59/90/209755990.db2.gz YQTLEMDXCMWYAQ-UHFFFAOYSA-N 0 0 368.329 5.273 40 0 FKABRN CCc1ccc(CCC(=O)N[C@@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223350500 206438594 /nfs/dbraw/zinc/43/85/94/206438594.db2.gz OYMSISDOXHHZIX-SFHVURJKSA-N 0 0 367.533 5.499 40 0 FKABRN CCc1ccc(CCC(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223350560 568643784 /nfs/dbraw/zinc/64/37/84/568643784.db2.gz OYMSISDOXHHZIX-GOSISDBHSA-N 0 0 367.533 5.499 40 0 FKABRN CCSc1ccccc1C(=O)N[C@@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223353814 568644217 /nfs/dbraw/zinc/64/42/17/568644217.db2.gz VVGYKQAZSXAZGA-INIZCTEOSA-N 0 0 371.546 5.730 40 0 FKABRN CCSc1ccccc1C(=O)N[C@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223353876 206439014 /nfs/dbraw/zinc/43/90/14/206439014.db2.gz VVGYKQAZSXAZGA-MRXNPFEDSA-N 0 0 371.546 5.730 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2ccccc2OC(C)C)cc1C(C)C ZINC000223354937 568644449 /nfs/dbraw/zinc/64/44/49/568644449.db2.gz UQNNDBNZBIPKFD-QGZVFWFLSA-N 0 0 369.505 5.405 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2ccccc2OC(C)C)cc1C(C)C ZINC000223354990 206439267 /nfs/dbraw/zinc/43/92/67/206439267.db2.gz UQNNDBNZBIPKFD-KRWDZBQOSA-N 0 0 369.505 5.405 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2cc3ccccc3o2)cc1C(C)C ZINC000223355870 568644467 /nfs/dbraw/zinc/64/44/67/568644467.db2.gz LHXILUGNNXOQLI-OAHLLOKOSA-N 0 0 351.446 5.364 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2cc3ccccc3o2)cc1C(C)C ZINC000223355934 568644455 /nfs/dbraw/zinc/64/44/55/568644455.db2.gz LHXILUGNNXOQLI-HNNXBMFYSA-N 0 0 351.446 5.364 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223356007 568644550 /nfs/dbraw/zinc/64/45/50/568644550.db2.gz CSPSZHKRUZCOIN-INIZCTEOSA-N 0 0 355.478 5.017 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223356065 206439420 /nfs/dbraw/zinc/43/94/20/206439420.db2.gz CSPSZHKRUZCOIN-MRXNPFEDSA-N 0 0 355.478 5.017 40 0 FKABRN CC[C@@H](NC(=O)CCSc1ccc(C)cc1)c1ccc(OC)c(C)c1 ZINC000223356081 568644594 /nfs/dbraw/zinc/64/45/94/568644594.db2.gz MBBFDTJVIKEZDM-LJQANCHMSA-N 0 0 357.519 5.062 40 0 FKABRN CC[C@H](NC(=O)CCSc1ccc(C)cc1)c1ccc(OC)c(C)c1 ZINC000223356130 568644536 /nfs/dbraw/zinc/64/45/36/568644536.db2.gz MBBFDTJVIKEZDM-IBGZPJMESA-N 0 0 357.519 5.062 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCc2ccccc2Cl)cc1C(C)C ZINC000223358279 568645146 /nfs/dbraw/zinc/64/51/46/568645146.db2.gz IGCHLOMAVCTSDB-MRXNPFEDSA-N 0 0 373.924 5.590 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCc2ccccc2Cl)cc1C(C)C ZINC000223358343 568645049 /nfs/dbraw/zinc/64/50/49/568645049.db2.gz IGCHLOMAVCTSDB-INIZCTEOSA-N 0 0 373.924 5.590 40 0 FKABRN CC(C)c1ccccc1NC(=O)CSCc1ccc(Cl)cc1F ZINC000223365187 568645751 /nfs/dbraw/zinc/64/57/51/568645751.db2.gz VAVWMZMEQNMYSL-UHFFFAOYSA-N 0 0 351.874 5.474 40 0 FKABRN Cc1ccc([C@@H](NC(=O)c2ccc(Cl)cc2F)c2ccccc2)c(C)c1 ZINC000223366471 568646071 /nfs/dbraw/zinc/64/60/71/568646071.db2.gz PZVMUNYNPDISAJ-NRFANRHFSA-N 0 0 367.851 5.615 40 0 FKABRN Cc1ccc([C@H](NC(=O)c2ccc(Cl)cc2F)c2ccccc2)c(C)c1 ZINC000223366530 568646078 /nfs/dbraw/zinc/64/60/78/568646078.db2.gz PZVMUNYNPDISAJ-OAQYLSRUSA-N 0 0 367.851 5.615 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Nc2cccc(Cl)c2)cc1C(C)C ZINC000223368728 209758459 /nfs/dbraw/zinc/75/84/59/209758459.db2.gz GPOALXOUUKYPJI-CQSZACIVSA-N 0 0 360.885 5.663 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Nc2cccc(Cl)c2)cc1C(C)C ZINC000223368777 568646332 /nfs/dbraw/zinc/64/63/32/568646332.db2.gz GPOALXOUUKYPJI-AWEZNQCLSA-N 0 0 360.885 5.663 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Nc2ccc(Cl)cc2)cc1C(C)C ZINC000223368864 568646337 /nfs/dbraw/zinc/64/63/37/568646337.db2.gz JMEUAHJSBSJBSB-CQSZACIVSA-N 0 0 360.885 5.663 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Nc2ccc(Cl)cc2)cc1C(C)C ZINC000223368918 222776671 /nfs/dbraw/zinc/77/66/71/222776671.db2.gz JMEUAHJSBSJBSB-AWEZNQCLSA-N 0 0 360.885 5.663 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)COc2cccc(C)c2C)cc1C(C)C ZINC000223371201 209758191 /nfs/dbraw/zinc/75/81/91/209758191.db2.gz GVIHECUENMIEJH-GOSISDBHSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)COc2cccc(C)c2C)cc1C(C)C ZINC000223371252 568646808 /nfs/dbraw/zinc/64/68/08/568646808.db2.gz GVIHECUENMIEJH-SFHVURJKSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)COc2ccc(C)cc2C)cc1C(C)C ZINC000223371324 568646803 /nfs/dbraw/zinc/64/68/03/568646803.db2.gz JPOBEKYMOHEVIH-GOSISDBHSA-N 0 0 369.505 5.000 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)COc2ccc(C)cc2C)cc1C(C)C ZINC000223371379 568646749 /nfs/dbraw/zinc/64/67/49/568646749.db2.gz JPOBEKYMOHEVIH-SFHVURJKSA-N 0 0 369.505 5.000 40 0 FKABRN CC[C@@H](Oc1ccccc1)C(=O)N[C@@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223371862 568646786 /nfs/dbraw/zinc/64/67/86/568646786.db2.gz JYFPDYQDXKOQLT-LAUBAEHRSA-N 0 0 369.505 5.162 40 0 FKABRN CC[C@H](Oc1ccccc1)C(=O)N[C@@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223371918 568646697 /nfs/dbraw/zinc/64/66/97/568646697.db2.gz JYFPDYQDXKOQLT-UWJYYQICSA-N 0 0 369.505 5.162 40 0 FKABRN CC(C)(C)c1ccc(OCCNC(=O)c2ccc(Cl)cc2Cl)cc1 ZINC000223371943 206438560 /nfs/dbraw/zinc/43/85/60/206438560.db2.gz HOUYFMVRZLCZHE-UHFFFAOYSA-N 0 0 366.288 5.100 40 0 FKABRN CC[C@@H](Oc1ccccc1)C(=O)N[C@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223371974 568646719 /nfs/dbraw/zinc/64/67/19/568646719.db2.gz JYFPDYQDXKOQLT-DYESRHJHSA-N 0 0 369.505 5.162 40 0 FKABRN CC[C@H](Oc1ccccc1)C(=O)N[C@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223372025 568646790 /nfs/dbraw/zinc/64/67/90/568646790.db2.gz JYFPDYQDXKOQLT-UTKZUKDTSA-N 0 0 369.505 5.162 40 0 FKABRN CC(C)(C)c1ccc(OCCNC(=O)c2ccc(C(C)(C)C)cc2)cc1 ZINC000223372697 222776880 /nfs/dbraw/zinc/77/68/80/222776880.db2.gz GUQUHNMDOZYRSB-UHFFFAOYSA-N 0 0 353.506 5.090 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Cc2cccc(Cl)c2)cc1C(C)C ZINC000223376785 568647412 /nfs/dbraw/zinc/64/74/12/568647412.db2.gz YORLRAHSWJJNSI-OAHLLOKOSA-N 0 0 359.897 5.200 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Cc2cccc(Cl)c2)cc1C(C)C ZINC000223376852 568647425 /nfs/dbraw/zinc/64/74/25/568647425.db2.gz YORLRAHSWJJNSI-HNNXBMFYSA-N 0 0 359.897 5.200 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Cc2ccc(C)cc2C)cc1C(C)C ZINC000223377238 568647399 /nfs/dbraw/zinc/64/73/99/568647399.db2.gz AENLSOSOBJZYFV-GOSISDBHSA-N 0 0 353.506 5.164 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Cc2ccc(C)cc2C)cc1C(C)C ZINC000223377304 222776795 /nfs/dbraw/zinc/77/67/95/222776795.db2.gz AENLSOSOBJZYFV-SFHVURJKSA-N 0 0 353.506 5.164 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](C)c2cc(C(C)C)c(OC)cc2C)cc1C ZINC000223377523 568647601 /nfs/dbraw/zinc/64/76/01/568647601.db2.gz WHNVCUCWDDSBND-KRWDZBQOSA-N 0 0 369.505 5.325 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1C ZINC000223377581 568647679 /nfs/dbraw/zinc/64/76/79/568647679.db2.gz WHNVCUCWDDSBND-QGZVFWFLSA-N 0 0 369.505 5.325 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2ccc(Cl)cc2F)cc1C(C)C ZINC000223377663 568647599 /nfs/dbraw/zinc/64/75/99/568647599.db2.gz DKLJGZMQWVBEIN-CYBMUJFWSA-N 0 0 363.860 5.411 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2ccc(Cl)cc2F)cc1C(C)C ZINC000223377710 568647631 /nfs/dbraw/zinc/64/76/31/568647631.db2.gz DKLJGZMQWVBEIN-ZDUSSCGKSA-N 0 0 363.860 5.411 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCc2ccc(C)c(C)c2)cc1C(C)C ZINC000223378770 568647939 /nfs/dbraw/zinc/64/79/39/568647939.db2.gz ZCPHFYQGMBJNJX-LJQANCHMSA-N 0 0 367.533 5.554 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCc2ccc(C)c(C)c2)cc1C(C)C ZINC000223378827 568647903 /nfs/dbraw/zinc/64/79/03/568647903.db2.gz ZCPHFYQGMBJNJX-IBGZPJMESA-N 0 0 367.533 5.554 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCc2ccccc2F)cc1C(C)C ZINC000223379976 568647968 /nfs/dbraw/zinc/64/79/68/568647968.db2.gz PGFCLEDJFCLXDO-MRXNPFEDSA-N 0 0 357.469 5.076 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCc2ccccc2F)cc1C(C)C ZINC000223380050 568648018 /nfs/dbraw/zinc/64/80/18/568648018.db2.gz PGFCLEDJFCLXDO-INIZCTEOSA-N 0 0 357.469 5.076 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCc2ccc(F)cc2)cc1C(C)C ZINC000223380136 568647921 /nfs/dbraw/zinc/64/79/21/568647921.db2.gz OPOWGZVBAGKNIY-MRXNPFEDSA-N 0 0 357.469 5.076 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCc2ccc(F)cc2)cc1C(C)C ZINC000223380207 568648222 /nfs/dbraw/zinc/64/82/22/568648222.db2.gz OPOWGZVBAGKNIY-INIZCTEOSA-N 0 0 357.469 5.076 40 0 FKABRN CCc1ccc(CC(=O)N[C@@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223380283 209758429 /nfs/dbraw/zinc/75/84/29/209758429.db2.gz YQGVWOIZBJAVKM-KRWDZBQOSA-N 0 0 353.506 5.109 40 0 FKABRN CCc1ccc(CC(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)cc1 ZINC000223380337 568648171 /nfs/dbraw/zinc/64/81/71/568648171.db2.gz YQGVWOIZBJAVKM-QGZVFWFLSA-N 0 0 353.506 5.109 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 ZINC000223384519 206438442 /nfs/dbraw/zinc/43/84/42/206438442.db2.gz IWMCDGOAVKWZAN-XNTDXEJSSA-N 0 0 369.464 6.535 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1 ZINC000223384897 206438917 /nfs/dbraw/zinc/43/89/17/206438917.db2.gz XGCGJNKMKZZDTM-MDWZMJQESA-N 0 0 370.496 5.622 40 0 FKABRN CCCc1ccc(OCCNC(=O)/C=C/c2ccc(C(C)(C)C)cc2)cc1 ZINC000223385280 568648969 /nfs/dbraw/zinc/64/89/69/568648969.db2.gz YUKAJZLZOOHLPJ-LFIBNONCSA-N 0 0 365.517 5.145 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)Nc2ccc3c4c(cccc42)CC3)cc1 ZINC000223385368 568648901 /nfs/dbraw/zinc/64/89/01/568648901.db2.gz RKMUKORPHNHXHY-CXUHLZMHSA-N 0 0 355.481 5.888 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)CCc2ccc(Cl)cc2)cc1C(C)C ZINC000223386014 568648914 /nfs/dbraw/zinc/64/89/14/568648914.db2.gz MGLIPOPGFRYGCL-MRXNPFEDSA-N 0 0 373.924 5.590 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)CCc2ccc(Cl)cc2)cc1C(C)C ZINC000223386071 568648950 /nfs/dbraw/zinc/64/89/50/568648950.db2.gz MGLIPOPGFRYGCL-INIZCTEOSA-N 0 0 373.924 5.590 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)Cc2ccccc2Cl)cc1C(C)C ZINC000223387546 568649118 /nfs/dbraw/zinc/64/91/18/568649118.db2.gz ODQNKPYPVCOMLJ-OAHLLOKOSA-N 0 0 359.897 5.200 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)Cc2ccccc2Cl)cc1C(C)C ZINC000223387603 206439177 /nfs/dbraw/zinc/43/91/77/206439177.db2.gz ODQNKPYPVCOMLJ-HNNXBMFYSA-N 0 0 359.897 5.200 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=S)Nc2ccc(C)cc2)cc1C(C)C ZINC000223387819 568649147 /nfs/dbraw/zinc/64/91/47/568649147.db2.gz VSEZHGVQAFXRFR-MRXNPFEDSA-N 0 0 356.535 5.483 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=S)Nc2ccc(C)cc2)cc1C(C)C ZINC000223387870 568649131 /nfs/dbraw/zinc/64/91/31/568649131.db2.gz VSEZHGVQAFXRFR-INIZCTEOSA-N 0 0 356.535 5.483 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=S)Nc2ccc(F)cc2)cc1C(C)C ZINC000223387953 206438484 /nfs/dbraw/zinc/43/84/84/206438484.db2.gz VEVWEXQWXIUIIX-CQSZACIVSA-N 0 0 360.498 5.314 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=S)Nc2ccc(F)cc2)cc1C(C)C ZINC000223388015 222777965 /nfs/dbraw/zinc/77/79/65/222777965.db2.gz VEVWEXQWXIUIIX-AWEZNQCLSA-N 0 0 360.498 5.314 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2ccc3c(c2)CCCC3)cc1C(C)C ZINC000223390143 222777971 /nfs/dbraw/zinc/77/79/71/222777971.db2.gz CDRBJNYJEDZZIF-QGZVFWFLSA-N 0 0 365.517 5.497 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2ccc3c(c2)CCCC3)cc1C(C)C ZINC000223390206 568649405 /nfs/dbraw/zinc/64/94/05/568649405.db2.gz CDRBJNYJEDZZIF-KRWDZBQOSA-N 0 0 365.517 5.497 40 0 FKABRN COc1cc(C)c([C@@H](C)NC(=O)c2cc(C)c(C)cc2C)cc1C(C)C ZINC000223390287 518131925 /nfs/dbraw/zinc/13/19/25/518131925.db2.gz QSDXXFDOTNDFPU-GOSISDBHSA-N 0 0 353.506 5.543 40 0 FKABRN COc1cc(C)c([C@H](C)NC(=O)c2cc(C)c(C)cc2C)cc1C(C)C ZINC000223390352 206440091 /nfs/dbraw/zinc/44/00/91/206440091.db2.gz QSDXXFDOTNDFPU-SFHVURJKSA-N 0 0 353.506 5.543 40 0 FKABRN COc1cccc(NC(=O)N[C@@H](C)c2cc(C(C)C)c(OC)cc2C)c1 ZINC000223391469 209757629 /nfs/dbraw/zinc/75/76/29/209757629.db2.gz OUHXGKINWQWOMD-HNNXBMFYSA-N 0 0 356.466 5.018 40 0 FKABRN COc1cccc(NC(=O)N[C@H](C)c2cc(C(C)C)c(OC)cc2C)c1 ZINC000223391524 209757193 /nfs/dbraw/zinc/75/71/93/209757193.db2.gz OUHXGKINWQWOMD-OAHLLOKOSA-N 0 0 356.466 5.018 40 0 FKABRN COc1ccccc1NC(=O)N[C@@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223391601 568649765 /nfs/dbraw/zinc/64/97/65/568649765.db2.gz PJSVTFCBUGSZCX-HNNXBMFYSA-N 0 0 356.466 5.018 40 0 FKABRN COc1ccccc1NC(=O)N[C@H](C)c1cc(C(C)C)c(OC)cc1C ZINC000223391646 568649692 /nfs/dbraw/zinc/64/96/92/568649692.db2.gz PJSVTFCBUGSZCX-OAHLLOKOSA-N 0 0 356.466 5.018 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000223392196 568649695 /nfs/dbraw/zinc/64/96/95/568649695.db2.gz BQHRKGCJJBIDKY-CYBMUJFWSA-N 0 0 367.901 5.711 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000223392255 206440714 /nfs/dbraw/zinc/44/07/14/206440714.db2.gz BQHRKGCJJBIDKY-ZDUSSCGKSA-N 0 0 367.901 5.711 40 0 FKABRN CC(C)(C)CC(C)(C)NC(=O)c1ccc(CSc2ccccc2)cc1 ZINC000223392631 568649968 /nfs/dbraw/zinc/64/99/68/568649968.db2.gz XSJQFASEVGBBIX-UHFFFAOYSA-N 0 0 355.547 5.924 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)COc2ccc(Cl)cc2Cl)cc1C ZINC000223392747 568649946 /nfs/dbraw/zinc/64/99/46/568649946.db2.gz XSQAQPQAQWDBAV-CQSZACIVSA-N 0 0 366.288 5.175 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)COc2ccc(Cl)cc2Cl)cc1C ZINC000223392815 222778284 /nfs/dbraw/zinc/77/82/84/222778284.db2.gz XSQAQPQAQWDBAV-AWEZNQCLSA-N 0 0 366.288 5.175 40 0 FKABRN CCCC[C@@H](CC)CNC(=O)c1ccc(CSc2ccccc2)cc1 ZINC000223392844 568649918 /nfs/dbraw/zinc/64/99/18/568649918.db2.gz IXQOLUYMWWZETI-GOSISDBHSA-N 0 0 355.547 5.925 40 0 FKABRN CCCC[C@H](CC)CNC(=O)c1ccc(CSc2ccccc2)cc1 ZINC000223392884 222778302 /nfs/dbraw/zinc/77/83/02/222778302.db2.gz IXQOLUYMWWZETI-SFHVURJKSA-N 0 0 355.547 5.925 40 0 FKABRN O=C(NCCc1ccc(F)cc1)c1ccc(CSc2ccccc2)cc1 ZINC000223393051 568649993 /nfs/dbraw/zinc/64/99/93/568649993.db2.gz NXDOFSNCRUIFLX-UHFFFAOYSA-N 0 0 365.473 5.091 40 0 FKABRN C[C@@H](CNC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1 ZINC000223393211 209757580 /nfs/dbraw/zinc/75/75/80/209757580.db2.gz UEZGBCNAGOLBBE-SFHVURJKSA-N 0 0 361.510 5.512 40 0 FKABRN C[C@H](CNC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1 ZINC000223393262 568649927 /nfs/dbraw/zinc/64/99/27/568649927.db2.gz UEZGBCNAGOLBBE-GOSISDBHSA-N 0 0 361.510 5.512 40 0 FKABRN COCc1cccc(NC(=O)c2ccc(CSc3ccccc3)cc2)c1 ZINC000223394047 568649977 /nfs/dbraw/zinc/64/99/77/568649977.db2.gz CKAIPTMMQNHPFF-UHFFFAOYSA-N 0 0 363.482 5.378 40 0 FKABRN O=C(NCC1=CCCCC1)c1ccc(CSc2ccc(Cl)cc2)cc1 ZINC000223394364 222777929 /nfs/dbraw/zinc/77/79/29/222777929.db2.gz FXOVXQUPUFFTFI-UHFFFAOYSA-N 0 0 371.933 5.863 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)/C=C/c2ccc(Cl)cc2Cl)cc1C ZINC000223395006 222777766 /nfs/dbraw/zinc/77/77/66/222777766.db2.gz CPXDOKRKBYKQIH-PMGBHYCQSA-N 0 0 362.300 5.809 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)/C=C/c2ccc(Cl)cc2Cl)cc1C ZINC000223395064 568650181 /nfs/dbraw/zinc/65/01/81/568650181.db2.gz CPXDOKRKBYKQIH-VFADXPBXSA-N 0 0 362.300 5.809 40 0 FKABRN CC(C)(Cc1ccccc1)NC(=O)/C(=C/c1ccccc1)c1ccccc1 ZINC000223395165 568650271 /nfs/dbraw/zinc/65/02/71/568650271.db2.gz MRYUMBAGRFIDKA-PTGBLXJZSA-N 0 0 355.481 5.365 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000223397125 568650488 /nfs/dbraw/zinc/65/04/88/568650488.db2.gz CHKABGRRIXKJPN-HZPDHXFCSA-N 0 0 361.938 5.623 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000223397172 568650463 /nfs/dbraw/zinc/65/04/63/568650463.db2.gz CHKABGRRIXKJPN-JKSUJKDBSA-N 0 0 361.938 5.623 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000223397229 568650486 /nfs/dbraw/zinc/65/04/86/568650486.db2.gz CHKABGRRIXKJPN-CVEARBPZSA-N 0 0 361.938 5.623 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000223397297 568650453 /nfs/dbraw/zinc/65/04/53/568650453.db2.gz CHKABGRRIXKJPN-HOTGVXAUSA-N 0 0 361.938 5.623 40 0 FKABRN Cc1ccccc1CSCC(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000223397759 568650405 /nfs/dbraw/zinc/65/04/05/568650405.db2.gz HISMPPYUIVGKDJ-UHFFFAOYSA-N 0 0 361.466 5.766 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)N[C@@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223398092 209758286 /nfs/dbraw/zinc/75/82/86/209758286.db2.gz ZJSMRCHFEAJSKN-IBGZPJMESA-N 0 0 355.547 5.339 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)N[C@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223398157 568650363 /nfs/dbraw/zinc/65/03/63/568650363.db2.gz ZJSMRCHFEAJSKN-LJQANCHMSA-N 0 0 355.547 5.339 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CSCc2ccccc2Cl)cc1C ZINC000223398247 568650499 /nfs/dbraw/zinc/65/04/99/568650499.db2.gz FFSJCHWAMPBKMD-MRXNPFEDSA-N 0 0 361.938 5.376 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CSCc2ccccc2Cl)cc1C ZINC000223398306 568650509 /nfs/dbraw/zinc/65/05/09/568650509.db2.gz FFSJCHWAMPBKMD-INIZCTEOSA-N 0 0 361.938 5.376 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CSCc2cccc(Cl)c2)cc1C ZINC000223398387 206440657 /nfs/dbraw/zinc/44/06/57/206440657.db2.gz ODFKLIUWUSIEJP-MRXNPFEDSA-N 0 0 361.938 5.376 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CSCc2cccc(Cl)c2)cc1C ZINC000223398451 568650688 /nfs/dbraw/zinc/65/06/88/568650688.db2.gz ODFKLIUWUSIEJP-INIZCTEOSA-N 0 0 361.938 5.376 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CSCc2ccc(Cl)cc2)cc1C ZINC000223398539 568650718 /nfs/dbraw/zinc/65/07/18/568650718.db2.gz BAHYXNBPRPRIMP-MRXNPFEDSA-N 0 0 361.938 5.376 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CSCc2ccc(Cl)cc2)cc1C ZINC000223398598 568650680 /nfs/dbraw/zinc/65/06/80/568650680.db2.gz BAHYXNBPRPRIMP-INIZCTEOSA-N 0 0 361.938 5.376 40 0 FKABRN Cc1ccc(CSCC(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 ZINC000223399631 209758617 /nfs/dbraw/zinc/75/86/17/209758617.db2.gz VIMMQJQXZAZNRS-UHFFFAOYSA-N 0 0 361.466 5.766 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CCSc2ccc(Cl)cc2)cc1C ZINC000223399782 568650705 /nfs/dbraw/zinc/65/07/05/568650705.db2.gz WOSYJMHFZUISEM-MRXNPFEDSA-N 0 0 361.938 5.625 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CCSc2ccc(Cl)cc2)cc1C ZINC000223399840 568650696 /nfs/dbraw/zinc/65/06/96/568650696.db2.gz WOSYJMHFZUISEM-INIZCTEOSA-N 0 0 361.938 5.625 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)/C(=C/c2ccco2)c2ccccc2)cc1C ZINC000223400578 568650673 /nfs/dbraw/zinc/65/06/73/568650673.db2.gz PXRBSIAIOGJXER-SYVPYPDPSA-N 0 0 359.469 5.623 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)/C(=C/c2ccco2)c2ccccc2)cc1C ZINC000223400638 568650692 /nfs/dbraw/zinc/65/06/92/568650692.db2.gz PXRBSIAIOGJXER-CKMDTHJYSA-N 0 0 359.469 5.623 40 0 FKABRN Cc1cc(C)cc(CSCC(=O)Nc2ccc3c4c(cccc42)CC3)c1 ZINC000223402247 568650881 /nfs/dbraw/zinc/65/08/81/568650881.db2.gz NCKRTPLQJBAUHT-UHFFFAOYSA-N 0 0 361.510 5.427 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)/C(=C/c2ccccc2)c2ccccc2)cc1C ZINC000223402795 568650907 /nfs/dbraw/zinc/65/09/07/568650907.db2.gz WCBJTGUQLPKDPW-YZYPULCFSA-N 0 0 369.508 6.030 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)/C(=C/c2ccccc2)c2ccccc2)cc1C ZINC000223402853 222778061 /nfs/dbraw/zinc/77/80/61/222778061.db2.gz WCBJTGUQLPKDPW-DIWDRYHZSA-N 0 0 369.508 6.030 40 0 FKABRN O=C(CSCc1ccccc1Cl)Nc1ccc2c3c(cccc31)CC2 ZINC000223403926 568651151 /nfs/dbraw/zinc/65/11/51/568651151.db2.gz NAWTVCXGFBTPOG-UHFFFAOYSA-N 0 0 367.901 5.464 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)Nc1ccc2c3c(cccc31)CC2 ZINC000223405573 222777486 /nfs/dbraw/zinc/77/74/86/222777486.db2.gz QCAHATPBEZCDDO-UHFFFAOYSA-N 0 0 367.901 5.464 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1)Nc1ccc2c3c(cccc31)CC2 ZINC000223407192 209759483 /nfs/dbraw/zinc/75/94/83/209759483.db2.gz SMETUPVNUIIYSD-UHFFFAOYSA-N 0 0 367.901 5.464 40 0 FKABRN Cc1ccc([C@@H](NC(=O)CCc2ccc(C)c(C)c2)c2ccccc2)c(C)c1 ZINC000223408803 568651615 /nfs/dbraw/zinc/65/16/15/568651615.db2.gz QMACSEUDNIWMIW-SANMLTNESA-N 0 0 371.524 5.759 40 0 FKABRN Cc1ccc([C@H](NC(=O)CCc2ccc(C)c(C)c2)c2ccccc2)c(C)c1 ZINC000223408856 568651728 /nfs/dbraw/zinc/65/17/28/568651728.db2.gz QMACSEUDNIWMIW-AREMUKBSSA-N 0 0 371.524 5.759 40 0 FKABRN C[C@@H](SCc1ccccc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000223412449 206440068 /nfs/dbraw/zinc/44/00/68/206440068.db2.gz BDSGIPSWDOOHDY-OAHLLOKOSA-N 0 0 361.466 5.846 40 0 FKABRN C[C@H](SCc1ccccc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000223412490 222779019 /nfs/dbraw/zinc/77/90/19/222779019.db2.gz BDSGIPSWDOOHDY-HNNXBMFYSA-N 0 0 361.466 5.846 40 0 FKABRN O=C(NCC1=CCCCC1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000223422421 222779602 /nfs/dbraw/zinc/77/96/02/222779602.db2.gz MAQVSTLVZGNHQK-HMMYKYKNSA-N 0 0 351.877 5.497 40 0 FKABRN CC(C)(C)CC(C)(C)NC(=O)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000223422586 222779297 /nfs/dbraw/zinc/77/92/97/222779297.db2.gz PZRKCFZJCOCWHO-XDJHFCHBSA-N 0 0 369.936 6.212 40 0 FKABRN CCCC[C@@H](CC)CNC(=O)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000223422799 568653263 /nfs/dbraw/zinc/65/32/63/568653263.db2.gz KUWVBPDMPBBGFF-WKSXIXGESA-N 0 0 369.936 6.213 40 0 FKABRN CCCC[C@H](CC)CNC(=O)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000223422846 568653293 /nfs/dbraw/zinc/65/32/93/568653293.db2.gz KUWVBPDMPBBGFF-SAGAUJLNSA-N 0 0 369.936 6.213 40 0 FKABRN O=C(NCC1CCCCC1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000223424484 568653555 /nfs/dbraw/zinc/65/35/55/568653555.db2.gz BQILQAROBQOWFV-HMMYKYKNSA-N 0 0 353.893 5.577 40 0 FKABRN COc1ccc(/C=C(/C(=O)NC(C)(C)CC(C)(C)C)c2ccccc2)cc1 ZINC000223427066 222778812 /nfs/dbraw/zinc/77/88/12/222778812.db2.gz FOSDPGSZVIWZEQ-LTGZKZEYSA-N 0 0 365.517 5.567 40 0 FKABRN CCCC[C@@H](CC)CNC(=O)/C(=C/c1ccc(OC)cc1)c1ccccc1 ZINC000223427319 568653689 /nfs/dbraw/zinc/65/36/89/568653689.db2.gz AYZKBFLXJSLQJX-BFWROUECSA-N 0 0 365.517 5.568 40 0 FKABRN CCCC[C@H](CC)CNC(=O)/C(=C/c1ccc(OC)cc1)c1ccccc1 ZINC000223427374 568653749 /nfs/dbraw/zinc/65/37/49/568653749.db2.gz AYZKBFLXJSLQJX-SNAUHIFDSA-N 0 0 365.517 5.568 40 0 FKABRN COc1ccc(/C=C(/C(=O)NC[C@@H](C)c2ccccc2)c2ccccc2)cc1 ZINC000223427730 568653769 /nfs/dbraw/zinc/65/37/69/568653769.db2.gz RZTVDECZRSWNMM-FEQHDXENSA-N 0 0 371.480 5.156 40 0 FKABRN COc1ccc(/C=C(/C(=O)NC[C@H](C)c2ccccc2)c2ccccc2)cc1 ZINC000223427786 568653828 /nfs/dbraw/zinc/65/38/28/568653828.db2.gz RZTVDECZRSWNMM-QUESDIRFSA-N 0 0 371.480 5.156 40 0 FKABRN COCc1cccc(NC(=O)/C(=C/c2ccc(OC)cc2)c2ccccc2)c1 ZINC000223428758 568653743 /nfs/dbraw/zinc/65/37/43/568653743.db2.gz QXAOWKQSDBTNIF-XQNSMLJCSA-N 0 0 373.452 5.021 40 0 FKABRN O=C(Nc1ccc2c3c(cccc31)CC2)/C(=C/c1ccco1)c1ccccc1 ZINC000223431286 568654189 /nfs/dbraw/zinc/65/41/89/568654189.db2.gz ZMPAFCJFYIVFLO-CJLVFECKSA-N 0 0 365.432 5.711 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)c2cc3c(ccc4ccccc34)o2)cc1C ZINC000223432158 206439999 /nfs/dbraw/zinc/43/99/99/206439999.db2.gz UPMFWNSPAPYXAS-QGZVFWFLSA-N 0 0 357.453 6.002 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)c2cc3c(ccc4ccccc34)o2)cc1C ZINC000223432212 568654304 /nfs/dbraw/zinc/65/43/04/568654304.db2.gz UPMFWNSPAPYXAS-KRWDZBQOSA-N 0 0 357.453 6.002 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CCc2ccc(C(C)(C)C)cc2)cc1C ZINC000223433969 206439685 /nfs/dbraw/zinc/43/96/85/206439685.db2.gz GBNOTDJJARPDRI-LJQANCHMSA-N 0 0 351.534 5.719 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CCc2ccc(C(C)(C)C)cc2)cc1C ZINC000223434028 222779160 /nfs/dbraw/zinc/77/91/60/222779160.db2.gz GBNOTDJJARPDRI-IBGZPJMESA-N 0 0 351.534 5.719 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cc(Cl)ccc1OC ZINC000223434699 568654758 /nfs/dbraw/zinc/65/47/58/568654758.db2.gz QTOQMKABSMZXFK-LJQANCHMSA-N 0 0 373.880 5.024 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cc(Cl)ccc1OC ZINC000223434762 568654684 /nfs/dbraw/zinc/65/46/84/568654684.db2.gz QTOQMKABSMZXFK-IBGZPJMESA-N 0 0 373.880 5.024 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000223435788 568654763 /nfs/dbraw/zinc/65/47/63/568654763.db2.gz ZKSZILIGSYNNFI-JOCHJYFZSA-N 0 0 367.489 5.149 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccc(OC(C)C)cc1 ZINC000223435841 568654795 /nfs/dbraw/zinc/65/47/95/568654795.db2.gz ZKSZILIGSYNNFI-QFIPXVFZSA-N 0 0 367.489 5.149 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc(C)cc1C)c1ccc(OC)c(C)c1 ZINC000223438705 568655358 /nfs/dbraw/zinc/65/53/58/568655358.db2.gz LWVRXQDCFJWBCW-WOJBJXKFSA-N 0 0 369.505 5.045 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](CC)c1ccc(OC)c(C)c1 ZINC000223438756 568655332 /nfs/dbraw/zinc/65/53/32/568655332.db2.gz LWVRXQDCFJWBCW-VQTJNVASSA-N 0 0 369.505 5.045 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccc(C)cc1C)c1ccc(OC)c(C)c1 ZINC000223438815 568655277 /nfs/dbraw/zinc/65/52/77/568655277.db2.gz LWVRXQDCFJWBCW-UXHICEINSA-N 0 0 369.505 5.045 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccc(C)cc1C)c1ccc(OC)c(C)c1 ZINC000223438870 568655241 /nfs/dbraw/zinc/65/52/41/568655241.db2.gz LWVRXQDCFJWBCW-PMACEKPBSA-N 0 0 369.505 5.045 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 ZINC000223438880 568655218 /nfs/dbraw/zinc/65/52/18/568655218.db2.gz HOMTVGAEYUEZEN-HNNXBMFYSA-N 0 0 361.466 6.014 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 ZINC000223438930 222779868 /nfs/dbraw/zinc/77/98/68/222779868.db2.gz HOMTVGAEYUEZEN-OAHLLOKOSA-N 0 0 361.466 6.014 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1 ZINC000223439478 568655270 /nfs/dbraw/zinc/65/52/70/568655270.db2.gz ZPTHVWDQZDIGLO-KRWDZBQOSA-N 0 0 362.498 5.100 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1 ZINC000223439543 568655177 /nfs/dbraw/zinc/65/51/77/568655177.db2.gz ZPTHVWDQZDIGLO-QGZVFWFLSA-N 0 0 362.498 5.100 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)c2ccc(N3CCCCC3)cc2)cc1C ZINC000223440952 132279198 /nfs/dbraw/zinc/27/91/98/132279198.db2.gz SLGCMEOZCJCFJB-LJQANCHMSA-N 0 0 350.506 5.093 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)c2ccc(N3CCCCC3)cc2)cc1C ZINC000223441008 132279165 /nfs/dbraw/zinc/27/91/65/132279165.db2.gz SLGCMEOZCJCFJB-IBGZPJMESA-N 0 0 350.506 5.093 40 0 FKABRN Cc1ccc(SCCC(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 ZINC000223441202 568655710 /nfs/dbraw/zinc/65/57/10/568655710.db2.gz UDMSXFYIYLTLJW-UHFFFAOYSA-N 0 0 361.466 6.015 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000223441248 568655813 /nfs/dbraw/zinc/65/58/13/568655813.db2.gz GXFMBMNVGZQRAT-RTBURBONSA-N 0 0 367.533 5.554 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000223441307 222779931 /nfs/dbraw/zinc/77/99/31/222779931.db2.gz GXFMBMNVGZQRAT-RBUKOAKNSA-N 0 0 367.533 5.554 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000223441364 568655655 /nfs/dbraw/zinc/65/56/55/568655655.db2.gz GXFMBMNVGZQRAT-MOPGFXCFSA-N 0 0 367.533 5.554 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)cc1C ZINC000223441421 209759985 /nfs/dbraw/zinc/75/99/85/209759985.db2.gz GXFMBMNVGZQRAT-OALUTQOASA-N 0 0 367.533 5.554 40 0 FKABRN Cc1ccc(SCCC(=O)Nc2ccc(Cc3ccncc3)cc2)cc1 ZINC000223441537 568655719 /nfs/dbraw/zinc/65/57/19/568655719.db2.gz QLANUYKMPZRMBR-UHFFFAOYSA-N 0 0 362.498 5.102 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000223442344 568655770 /nfs/dbraw/zinc/65/57/70/568655770.db2.gz MGHOKLAOWJZLNQ-QZTJIDSGSA-N 0 0 373.924 5.527 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000223442390 568655783 /nfs/dbraw/zinc/65/57/83/568655783.db2.gz MGHOKLAOWJZLNQ-ZWKOTPCHSA-N 0 0 373.924 5.527 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000223442439 568655715 /nfs/dbraw/zinc/65/57/15/568655715.db2.gz MGHOKLAOWJZLNQ-MSOLQXFVSA-N 0 0 373.924 5.527 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)cc1C ZINC000223442494 209759688 /nfs/dbraw/zinc/75/96/88/209759688.db2.gz MGHOKLAOWJZLNQ-ROUUACIJSA-N 0 0 373.924 5.527 40 0 FKABRN CC(C)(C)CC(C)(C)NC(=O)CSCc1c(Cl)cccc1Cl ZINC000223442788 568655767 /nfs/dbraw/zinc/65/57/67/568655767.db2.gz OMURBYCWBZZJOC-UHFFFAOYSA-N 0 0 362.366 5.558 40 0 FKABRN CCCC[C@@H](CC)CNC(=O)CSCc1c(Cl)cccc1Cl ZINC000223442976 568655646 /nfs/dbraw/zinc/65/56/46/568655646.db2.gz CGGDVFHQLIXYMU-CYBMUJFWSA-N 0 0 362.366 5.559 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CCCOc2ccc(Cl)cc2)cc1C ZINC000223442987 568655665 /nfs/dbraw/zinc/65/56/65/568655665.db2.gz GRNUICJMBIEZEC-QGZVFWFLSA-N 0 0 359.897 5.302 40 0 FKABRN CCCC[C@H](CC)CNC(=O)CSCc1c(Cl)cccc1Cl ZINC000223443013 568655763 /nfs/dbraw/zinc/65/57/63/568655763.db2.gz CGGDVFHQLIXYMU-ZDUSSCGKSA-N 0 0 362.366 5.559 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CCCOc2ccc(Cl)cc2)cc1C ZINC000223443043 568655795 /nfs/dbraw/zinc/65/57/95/568655795.db2.gz GRNUICJMBIEZEC-KRWDZBQOSA-N 0 0 359.897 5.302 40 0 FKABRN C[C@@H](CNC(=O)CSCc1c(Cl)cccc1Cl)c1ccccc1 ZINC000223443297 568656053 /nfs/dbraw/zinc/65/60/53/568656053.db2.gz MMFOLZISWLLBOL-ZDUSSCGKSA-N 0 0 368.329 5.147 40 0 FKABRN C[C@H](CNC(=O)CSCc1c(Cl)cccc1Cl)c1ccccc1 ZINC000223443355 568656063 /nfs/dbraw/zinc/65/60/63/568656063.db2.gz MMFOLZISWLLBOL-CYBMUJFWSA-N 0 0 368.329 5.147 40 0 FKABRN COCc1cccc(NC(=O)CSCc2c(Cl)cccc2Cl)c1 ZINC000223444132 568655991 /nfs/dbraw/zinc/65/59/91/568655991.db2.gz QWNXTZNAYHTLDI-UHFFFAOYSA-N 0 0 370.301 5.012 40 0 FKABRN O=C(Nc1ccc(Cc2ccncc2)cc1)c1ccc(-c2ccccc2)cc1 ZINC000223445896 568655999 /nfs/dbraw/zinc/65/59/99/568655999.db2.gz DTIOBYPOITTXES-UHFFFAOYSA-N 0 0 364.448 5.592 40 0 FKABRN CC(C)(C)c1ccc(OCCNC(=O)c2ccc(-c3ccccc3)cc2)cc1 ZINC000223446066 568656041 /nfs/dbraw/zinc/65/60/41/568656041.db2.gz LSKOHLXRFVSIRK-UHFFFAOYSA-N 0 0 373.496 5.460 40 0 FKABRN CCCc1ccc(OCCNC(=O)c2ccc(-c3ccccc3)cc2)cc1 ZINC000223446147 568655918 /nfs/dbraw/zinc/65/59/18/568655918.db2.gz JXUCLKDAXSDODJ-UHFFFAOYSA-N 0 0 359.469 5.115 40 0 FKABRN O=C(NCCc1ccc(Cl)cc1)/C(=C/c1ccccc1)c1ccccc1 ZINC000223447593 568656196 /nfs/dbraw/zinc/65/61/96/568656196.db2.gz HQBYPWXPMZAJBF-OQKWZONESA-N 0 0 361.872 5.240 40 0 FKABRN Cc1ccc(OCCNC(=O)/C(=C/c2ccccc2)c2ccccc2)c(C)c1 ZINC000223448850 568656508 /nfs/dbraw/zinc/65/65/08/568656508.db2.gz GOPDXSYXRGIVFK-PTGBLXJZSA-N 0 0 371.480 5.039 40 0 FKABRN Cc1ccc(OCCNC(=O)/C(=C/c2ccccc2)c2ccccc2)cc1C ZINC000223449010 206441805 /nfs/dbraw/zinc/44/18/05/206441805.db2.gz WIHMNYSNXCFNBT-HKOYGPOVSA-N 0 0 371.480 5.039 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)COc2cc(C)c(Cl)c(C)c2)cc1C ZINC000223451128 568656633 /nfs/dbraw/zinc/65/66/33/568656633.db2.gz PFZJBMDNNHUQLG-QGZVFWFLSA-N 0 0 359.897 5.138 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)COc2cc(C)c(Cl)c(C)c2)cc1C ZINC000223451187 568656728 /nfs/dbraw/zinc/65/67/28/568656728.db2.gz PFZJBMDNNHUQLG-KRWDZBQOSA-N 0 0 359.897 5.138 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)COc2ccc(C(C)(C)C)cc2)cc1C ZINC000223451268 568656662 /nfs/dbraw/zinc/65/66/62/568656662.db2.gz URIVUVKRSJFECD-GOSISDBHSA-N 0 0 353.506 5.166 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)COc2ccc(C(C)(C)C)cc2)cc1C ZINC000223451342 568656660 /nfs/dbraw/zinc/65/66/60/568656660.db2.gz URIVUVKRSJFECD-SFHVURJKSA-N 0 0 353.506 5.166 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)c2cccc(OCc3ccccc3)c2)cc1C ZINC000223452547 568656644 /nfs/dbraw/zinc/65/66/44/568656644.db2.gz UOUSBRWORJOERK-HXUWFJFHSA-N 0 0 373.496 5.682 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)c2cccc(OCc3ccccc3)c2)cc1C ZINC000223452607 568656640 /nfs/dbraw/zinc/65/66/40/568656640.db2.gz UOUSBRWORJOERK-FQEVSTJZSA-N 0 0 373.496 5.682 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)c2ccccc2OCc2ccccc2)cc1C ZINC000223452990 568656926 /nfs/dbraw/zinc/65/69/26/568656926.db2.gz HEFMKPQXDHNLGQ-HXUWFJFHSA-N 0 0 373.496 5.682 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)c2ccccc2OCc2ccccc2)cc1C ZINC000223453050 568656847 /nfs/dbraw/zinc/65/68/47/568656847.db2.gz HEFMKPQXDHNLGQ-FQEVSTJZSA-N 0 0 373.496 5.682 40 0 FKABRN CC(C)(C)CC(C)(C)NC(=O)CSCc1ccc(Br)cc1 ZINC000223453331 568656956 /nfs/dbraw/zinc/65/69/56/568656956.db2.gz QSNQNNKLQOLSMG-UHFFFAOYSA-N 0 0 372.372 5.013 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)c2ccccc2CCc2ccccc2)cc1C ZINC000223453421 568656867 /nfs/dbraw/zinc/65/68/67/568656867.db2.gz OLPVUQRQKVUXRR-OAQYLSRUSA-N 0 0 371.524 5.888 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)c2ccccc2CCc2ccccc2)cc1C ZINC000223453482 568656893 /nfs/dbraw/zinc/65/68/93/568656893.db2.gz OLPVUQRQKVUXRR-NRFANRHFSA-N 0 0 371.524 5.888 40 0 FKABRN CCCC[C@@H](CC)CNC(=O)CSCc1ccc(Br)cc1 ZINC000223453571 568656854 /nfs/dbraw/zinc/65/68/54/568656854.db2.gz KOXQGHOPYPIVJC-CQSZACIVSA-N 0 0 372.372 5.015 40 0 FKABRN CCCC[C@H](CC)CNC(=O)CSCc1ccc(Br)cc1 ZINC000223453625 568656919 /nfs/dbraw/zinc/65/69/19/568656919.db2.gz KOXQGHOPYPIVJC-AWEZNQCLSA-N 0 0 372.372 5.015 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1C ZINC000223453713 222779964 /nfs/dbraw/zinc/77/99/64/222779964.db2.gz VBXAVKFYYHKLHI-RTBURBONSA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2ccc3ccccc3c2)cc1C ZINC000223453761 568656966 /nfs/dbraw/zinc/65/69/66/568656966.db2.gz VBXAVKFYYHKLHI-RBUKOAKNSA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1C ZINC000223453818 209761244 /nfs/dbraw/zinc/76/12/44/209761244.db2.gz VBXAVKFYYHKLHI-MOPGFXCFSA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2ccc3ccccc3c2)cc1C ZINC000223453875 568656861 /nfs/dbraw/zinc/65/68/61/568656861.db2.gz VBXAVKFYYHKLHI-OALUTQOASA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2cccc3ccccc32)cc1C ZINC000223453969 568657219 /nfs/dbraw/zinc/65/72/19/568657219.db2.gz LYMWUVBKFUTTPX-RTBURBONSA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2cccc3ccccc32)cc1C ZINC000223454026 568657136 /nfs/dbraw/zinc/65/71/36/568657136.db2.gz LYMWUVBKFUTTPX-RBUKOAKNSA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2cccc3ccccc32)cc1C ZINC000223454092 206441561 /nfs/dbraw/zinc/44/15/61/206441561.db2.gz LYMWUVBKFUTTPX-MOPGFXCFSA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2cccc3ccccc32)cc1C ZINC000223454138 568657140 /nfs/dbraw/zinc/65/71/40/568657140.db2.gz LYMWUVBKFUTTPX-OALUTQOASA-N 0 0 361.485 5.410 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1C ZINC000223455710 568657317 /nfs/dbraw/zinc/65/73/17/568657317.db2.gz XBWGOZZZPOGMPW-OAQYLSRUSA-N 0 0 371.524 6.011 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CC(c2ccccc2)c2ccccc2)cc1C ZINC000223455768 209761037 /nfs/dbraw/zinc/76/10/37/209761037.db2.gz XBWGOZZZPOGMPW-NRFANRHFSA-N 0 0 371.524 6.011 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NCC3=CCCCC3)cc2)cc1 ZINC000223457413 568657645 /nfs/dbraw/zinc/65/76/45/568657645.db2.gz BWSIRQPSDFJYNL-UHFFFAOYSA-N 0 0 351.515 5.518 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NC(C)(C)CC(C)(C)C)cc2)cc1 ZINC000223457551 568657565 /nfs/dbraw/zinc/65/75/65/568657565.db2.gz GFRMKXSZSYUWPV-UHFFFAOYSA-N 0 0 369.574 6.232 40 0 FKABRN CCCC[C@@H](CC)CNC(=O)c1ccc(CSc2ccc(C)cc2)cc1 ZINC000223457727 568657660 /nfs/dbraw/zinc/65/76/60/568657660.db2.gz WYCDYLZOFILHDT-LJQANCHMSA-N 0 0 369.574 6.234 40 0 FKABRN CCCC[C@H](CC)CNC(=O)c1ccc(CSc2ccc(C)cc2)cc1 ZINC000223457785 568657691 /nfs/dbraw/zinc/65/76/91/568657691.db2.gz WYCDYLZOFILHDT-IBGZPJMESA-N 0 0 369.574 6.234 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NCC3CCCCC3)cc2)cc1 ZINC000223459424 568657791 /nfs/dbraw/zinc/65/77/91/568657791.db2.gz RQVNNRZQWWELEM-UHFFFAOYSA-N 0 0 353.531 5.597 40 0 FKABRN C[C@@H](Oc1cccc2c1CCCC2)C(=O)Nc1cccc(Cl)c1Cl ZINC000223460565 568657893 /nfs/dbraw/zinc/65/78/93/568657893.db2.gz MQQSIPRDWAVHOC-GFCCVEGCSA-N 0 0 364.272 5.278 40 0 FKABRN C[C@H](Oc1cccc2c1CCCC2)C(=O)Nc1cccc(Cl)c1Cl ZINC000223460609 568658053 /nfs/dbraw/zinc/65/80/53/568658053.db2.gz MQQSIPRDWAVHOC-LBPRGKRZSA-N 0 0 364.272 5.278 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2ccccc2C(C)C)cc1C ZINC000223464048 209761162 /nfs/dbraw/zinc/76/11/62/209761162.db2.gz JVRLLAHIPKPWCZ-RTBURBONSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2ccccc2C(C)C)cc1C ZINC000223464105 568658415 /nfs/dbraw/zinc/65/84/15/568658415.db2.gz JVRLLAHIPKPWCZ-RBUKOAKNSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2ccccc2C(C)C)cc1C ZINC000223464179 222781311 /nfs/dbraw/zinc/78/13/11/222781311.db2.gz JVRLLAHIPKPWCZ-MOPGFXCFSA-N 0 0 353.506 5.380 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2ccccc2C(C)C)cc1C ZINC000223464233 568658397 /nfs/dbraw/zinc/65/83/97/568658397.db2.gz JVRLLAHIPKPWCZ-OALUTQOASA-N 0 0 353.506 5.380 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223465189 568658624 /nfs/dbraw/zinc/65/86/24/568658624.db2.gz GZLKGXOWOHOSQB-QFBILLFUSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223465241 568658479 /nfs/dbraw/zinc/65/84/79/568658479.db2.gz GZLKGXOWOHOSQB-LPHOPBHVSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223465289 568658841 /nfs/dbraw/zinc/65/88/41/568658841.db2.gz GZLKGXOWOHOSQB-VQIMIIECSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](Oc1ccccc1Cl)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223465359 568658786 /nfs/dbraw/zinc/65/87/86/568658786.db2.gz GZLKGXOWOHOSQB-APWZRJJASA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223465430 568658775 /nfs/dbraw/zinc/65/87/75/568658775.db2.gz SWAGHTVUODJJRW-OXJNMPFZSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223465481 568658823 /nfs/dbraw/zinc/65/88/23/568658823.db2.gz SWAGHTVUODJJRW-JXFKEZNVSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223465524 568658678 /nfs/dbraw/zinc/65/86/78/568658678.db2.gz SWAGHTVUODJJRW-OXQOHEQNSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223465588 206442201 /nfs/dbraw/zinc/44/22/01/206442201.db2.gz SWAGHTVUODJJRW-UZLBHIALSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223465907 568658740 /nfs/dbraw/zinc/65/87/40/568658740.db2.gz MIVFLHROUMALBM-SIKLNZKXSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223465968 568658750 /nfs/dbraw/zinc/65/87/50/568658750.db2.gz MIVFLHROUMALBM-UGKGYDQZSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223466029 568658830 /nfs/dbraw/zinc/65/88/30/568658830.db2.gz MIVFLHROUMALBM-DENIHFKCSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1ccc(C)c(C)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223466085 568658819 /nfs/dbraw/zinc/65/88/19/568658819.db2.gz MIVFLHROUMALBM-KNQAVFIVSA-N 0 0 353.506 5.264 40 0 FKABRN CCc1ccc([C@@H](C)NC(=O)CSCc2c(F)cccc2Cl)cc1 ZINC000223466163 222781261 /nfs/dbraw/zinc/78/12/61/222781261.db2.gz UBFQGVPJCRVDKG-CYBMUJFWSA-N 0 0 365.901 5.152 40 0 FKABRN CCc1ccc([C@H](C)NC(=O)CSCc2c(F)cccc2Cl)cc1 ZINC000223466218 568659000 /nfs/dbraw/zinc/65/90/00/568659000.db2.gz UBFQGVPJCRVDKG-ZDUSSCGKSA-N 0 0 365.901 5.152 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223466894 568658912 /nfs/dbraw/zinc/65/89/12/568658912.db2.gz CBYFOKRVQOFICK-PZJWPPBQSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223466943 568658946 /nfs/dbraw/zinc/65/89/46/568658946.db2.gz CBYFOKRVQOFICK-FPOVZHCZSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223466999 568659032 /nfs/dbraw/zinc/65/90/32/568659032.db2.gz CBYFOKRVQOFICK-TZIWHRDSSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1cccc(C)c1C)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223467049 568659037 /nfs/dbraw/zinc/65/90/37/568659037.db2.gz CBYFOKRVQOFICK-CTNGQTDRSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223467140 568658914 /nfs/dbraw/zinc/65/89/14/568658914.db2.gz XHMPBHWWWHRYSH-PZJWPPBQSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223467195 209761068 /nfs/dbraw/zinc/76/10/68/209761068.db2.gz XHMPBHWWWHRYSH-FPOVZHCZSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223467247 568659107 /nfs/dbraw/zinc/65/91/07/568659107.db2.gz XHMPBHWWWHRYSH-TZIWHRDSSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1cc(C)ccc1C)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223467298 568658992 /nfs/dbraw/zinc/65/89/92/568658992.db2.gz XHMPBHWWWHRYSH-CTNGQTDRSA-N 0 0 353.506 5.264 40 0 FKABRN O=C(CCc1ccc(F)cc1)Nc1ccc(CSc2ccccc2)cc1 ZINC000223472785 568659471 /nfs/dbraw/zinc/65/94/71/568659471.db2.gz KZHKXQUGAWSRRU-UHFFFAOYSA-N 0 0 365.473 5.689 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223473366 222781370 /nfs/dbraw/zinc/78/13/70/222781370.db2.gz KFDCANCNGLQSGH-OXJNMPFZSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223473410 209760843 /nfs/dbraw/zinc/76/08/43/209760843.db2.gz KFDCANCNGLQSGH-JXFKEZNVSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223473463 568659414 /nfs/dbraw/zinc/65/94/14/568659414.db2.gz KFDCANCNGLQSGH-OXQOHEQNSA-N 0 0 359.897 5.300 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223473519 222781560 /nfs/dbraw/zinc/78/15/60/222781560.db2.gz KFDCANCNGLQSGH-UZLBHIALSA-N 0 0 359.897 5.300 40 0 FKABRN Cc1ccc(-c2nnc(NC(=O)CCc3cccc4ccccc43)s2)cc1 ZINC000223479143 568660344 /nfs/dbraw/zinc/66/03/44/568660344.db2.gz PZKXVTSVLMRICJ-UHFFFAOYSA-N 0 0 373.481 5.238 40 0 FKABRN Cc1ccc(C)c(C(=O)NCCSCc2ccc(Cl)c(Cl)c2)c1 ZINC000223483806 568660869 /nfs/dbraw/zinc/66/08/69/568660869.db2.gz GSZVKZJMGKVBGA-UHFFFAOYSA-N 0 0 368.329 5.273 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)COc2ccccc2C(C)(C)C)cc1C ZINC000223490596 568661284 /nfs/dbraw/zinc/66/12/84/568661284.db2.gz HWWBHUMDFBYRAF-GOSISDBHSA-N 0 0 353.506 5.166 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)COc2ccccc2C(C)(C)C)cc1C ZINC000223490666 568661245 /nfs/dbraw/zinc/66/12/45/568661245.db2.gz HWWBHUMDFBYRAF-SFHVURJKSA-N 0 0 353.506 5.166 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(Cl)c(C)c2)cc1C ZINC000223491322 568661281 /nfs/dbraw/zinc/66/12/81/568661281.db2.gz VGNLIXLDXBZMLM-IAGOWNOFSA-N 0 0 359.897 5.218 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@@H](C)Oc2ccc(Cl)c(C)c2)cc1C ZINC000223491381 568661218 /nfs/dbraw/zinc/66/12/18/568661218.db2.gz VGNLIXLDXBZMLM-DLBZAZTESA-N 0 0 359.897 5.218 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)[C@H](C)Oc2ccc(Cl)c(C)c2)cc1C ZINC000223491428 568661231 /nfs/dbraw/zinc/66/12/31/568661231.db2.gz VGNLIXLDXBZMLM-SJORKVTESA-N 0 0 359.897 5.218 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)[C@H](C)Oc2ccc(Cl)c(C)c2)cc1C ZINC000223491491 222782308 /nfs/dbraw/zinc/78/23/08/222782308.db2.gz VGNLIXLDXBZMLM-IRXDYDNUSA-N 0 0 359.897 5.218 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@@H](C)c2cc(C)c(C)cc2C)cc1 ZINC000223491847 568661310 /nfs/dbraw/zinc/66/13/10/568661310.db2.gz VTPJMWDKLHRYNZ-AVRDEDQJSA-N 0 0 353.506 5.209 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@@H](C)c2cc(C)c(C)cc2C)cc1 ZINC000223491903 568661315 /nfs/dbraw/zinc/66/13/15/568661315.db2.gz VTPJMWDKLHRYNZ-PGRDOPGGSA-N 0 0 353.506 5.209 40 0 FKABRN CCc1ccc(O[C@@H](CC)C(=O)N[C@H](C)c2cc(C)c(C)cc2C)cc1 ZINC000223491962 568661509 /nfs/dbraw/zinc/66/15/09/568661509.db2.gz VTPJMWDKLHRYNZ-GCJKJVERSA-N 0 0 353.506 5.209 40 0 FKABRN CCc1ccc(O[C@H](CC)C(=O)N[C@H](C)c2cc(C)c(C)cc2C)cc1 ZINC000223492008 568661511 /nfs/dbraw/zinc/66/15/11/568661511.db2.gz VTPJMWDKLHRYNZ-XMSQKQJNSA-N 0 0 353.506 5.209 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223492345 568661517 /nfs/dbraw/zinc/66/15/17/568661517.db2.gz JUPIYJMMPUQLKS-PZJWPPBQSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223492400 568661472 /nfs/dbraw/zinc/66/14/72/568661472.db2.gz JUPIYJMMPUQLKS-FPOVZHCZSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223492465 568661427 /nfs/dbraw/zinc/66/14/27/568661427.db2.gz JUPIYJMMPUQLKS-TZIWHRDSSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1C)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223492532 568661474 /nfs/dbraw/zinc/66/14/74/568661474.db2.gz JUPIYJMMPUQLKS-CTNGQTDRSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223492612 568661430 /nfs/dbraw/zinc/66/14/30/568661430.db2.gz BWQBUUIJXKWONP-SIKLNZKXSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223492670 568661432 /nfs/dbraw/zinc/66/14/32/568661432.db2.gz BWQBUUIJXKWONP-UGKGYDQZSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223492729 568661570 /nfs/dbraw/zinc/66/15/70/568661570.db2.gz BWQBUUIJXKWONP-DENIHFKCSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@H](Oc1cc(C)cc(C)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223492777 568661554 /nfs/dbraw/zinc/66/15/54/568661554.db2.gz BWQBUUIJXKWONP-KNQAVFIVSA-N 0 0 353.506 5.264 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223492867 568661565 /nfs/dbraw/zinc/66/15/65/568661565.db2.gz IHMOMRCRUCSJMG-LAUBAEHRSA-N 0 0 373.924 5.608 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@@H](C)c1cc(C)c(C)cc1C ZINC000223492937 222782144 /nfs/dbraw/zinc/78/21/44/222782144.db2.gz IHMOMRCRUCSJMG-UWJYYQICSA-N 0 0 373.924 5.608 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223492992 568661448 /nfs/dbraw/zinc/66/14/48/568661448.db2.gz IHMOMRCRUCSJMG-DYESRHJHSA-N 0 0 373.924 5.608 40 0 FKABRN CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)N[C@H](C)c1cc(C)c(C)cc1C ZINC000223493060 222782168 /nfs/dbraw/zinc/78/21/68/222782168.db2.gz IHMOMRCRUCSJMG-UTKZUKDTSA-N 0 0 373.924 5.608 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)N[C@@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223495160 568661733 /nfs/dbraw/zinc/66/17/33/568661733.db2.gz UQIDYCXRYJKGGH-IBGZPJMESA-N 0 0 353.506 5.300 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)N[C@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223495215 568661808 /nfs/dbraw/zinc/66/18/08/568661808.db2.gz UQIDYCXRYJKGGH-LJQANCHMSA-N 0 0 353.506 5.300 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223495308 568661830 /nfs/dbraw/zinc/66/18/30/568661830.db2.gz HNFOSLJZNCQWPN-PMACEKPBSA-N 0 0 367.533 5.688 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223495355 568661812 /nfs/dbraw/zinc/66/18/12/568661812.db2.gz HNFOSLJZNCQWPN-VQTJNVASSA-N 0 0 367.533 5.688 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223495422 568661696 /nfs/dbraw/zinc/66/16/96/568661696.db2.gz HNFOSLJZNCQWPN-UXHICEINSA-N 0 0 367.533 5.688 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)c2cc(C)c(C)cc2C)c1 ZINC000223495479 568661666 /nfs/dbraw/zinc/66/16/66/568661666.db2.gz HNFOSLJZNCQWPN-WOJBJXKFSA-N 0 0 367.533 5.688 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CCc2ccc(Cl)c(Cl)c2)cc1C ZINC000223503114 568662570 /nfs/dbraw/zinc/66/25/70/568662570.db2.gz MSLULVXMSLQUEQ-OAHLLOKOSA-N 0 0 364.316 5.729 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CCc2ccc(Cl)c(Cl)c2)cc1C ZINC000223503177 568662634 /nfs/dbraw/zinc/66/26/34/568662634.db2.gz MSLULVXMSLQUEQ-HNNXBMFYSA-N 0 0 364.316 5.729 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CCc2c(Cl)cccc2Cl)cc1C ZINC000223503264 568662496 /nfs/dbraw/zinc/66/24/96/568662496.db2.gz HBHKFGSEKGZVGN-OAHLLOKOSA-N 0 0 364.316 5.729 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CCc2c(Cl)cccc2Cl)cc1C ZINC000223503323 222782528 /nfs/dbraw/zinc/78/25/28/222782528.db2.gz HBHKFGSEKGZVGN-HNNXBMFYSA-N 0 0 364.316 5.729 40 0 FKABRN Cc1cc(C)c([C@@H](C)NC(=O)CCc2ccc(Cl)cc2Cl)cc1C ZINC000223503407 568662541 /nfs/dbraw/zinc/66/25/41/568662541.db2.gz HUYFSNFOPHLJLL-OAHLLOKOSA-N 0 0 364.316 5.729 40 0 FKABRN Cc1cc(C)c([C@H](C)NC(=O)CCc2ccc(Cl)cc2Cl)cc1C ZINC000223503466 568662574 /nfs/dbraw/zinc/66/25/74/568662574.db2.gz HUYFSNFOPHLJLL-HNNXBMFYSA-N 0 0 364.316 5.729 40 0 FKABRN COc1cc(C)c(C(=O)N[C@@H](C)c2cc(C)c(C)cc2C)cc1C(C)C ZINC000223505992 222782452 /nfs/dbraw/zinc/78/24/52/222782452.db2.gz JOWJBTZJZOHXDU-SFHVURJKSA-N 0 0 353.506 5.543 40 0 FKABRN COc1cc(C)c(C(=O)N[C@H](C)c2cc(C)c(C)cc2C)cc1C(C)C ZINC000223506045 568662940 /nfs/dbraw/zinc/66/29/40/568662940.db2.gz JOWJBTZJZOHXDU-GOSISDBHSA-N 0 0 353.506 5.543 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)[C@@H](C)Sc2ccccc2)c2ccccc2O1 ZINC000223507546 222782040 /nfs/dbraw/zinc/78/20/40/222782040.db2.gz RUDAEZOSETTYSK-VQIMIIECSA-N 0 0 369.530 5.366 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)[C@@H](C)Sc2ccccc2)c2ccccc2O1 ZINC000223507595 568662905 /nfs/dbraw/zinc/66/29/05/568662905.db2.gz RUDAEZOSETTYSK-APWZRJJASA-N 0 0 369.530 5.366 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)[C@H](C)Sc2ccccc2)c2ccccc2O1 ZINC000223507653 222782188 /nfs/dbraw/zinc/78/21/88/222782188.db2.gz RUDAEZOSETTYSK-QFBILLFUSA-N 0 0 369.530 5.366 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)[C@H](C)Sc2ccccc2)c2ccccc2O1 ZINC000223507719 568662870 /nfs/dbraw/zinc/66/28/70/568662870.db2.gz RUDAEZOSETTYSK-LPHOPBHVSA-N 0 0 369.530 5.366 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)NCCOc2cccc3ccccc32)cc1 ZINC000223508157 568663178 /nfs/dbraw/zinc/66/31/78/568663178.db2.gz PZPUAJBUUNHYGB-DTQAZKPQSA-N 0 0 373.496 5.346 40 0 FKABRN O=C(Nc1ccccc1Oc1ccccc1)C1(c2ccccc2)CCOCC1 ZINC000223516416 568664158 /nfs/dbraw/zinc/66/41/58/568664158.db2.gz QJBZBPYDJTYDKV-UHFFFAOYSA-N 0 0 373.452 5.166 40 0 FKABRN CCSc1ccccc1NC(=O)[C@@H](C)Oc1cc(C)ccc1C(C)C ZINC000223545721 568667581 /nfs/dbraw/zinc/66/75/81/568667581.db2.gz XHDWNWAREXJSDY-MRXNPFEDSA-N 0 0 357.519 5.636 40 0 FKABRN CCSc1ccccc1NC(=O)[C@H](C)Oc1cc(C)ccc1C(C)C ZINC000223545779 568667415 /nfs/dbraw/zinc/66/74/15/568667415.db2.gz XHDWNWAREXJSDY-INIZCTEOSA-N 0 0 357.519 5.636 40 0 FKABRN Cc1ccc(C(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)cc1C ZINC000223554937 206442586 /nfs/dbraw/zinc/44/25/86/206442586.db2.gz QIVSFFKNMJXBSM-SFHVURJKSA-N 0 0 372.468 5.047 40 0 FKABRN Cc1ccc(C(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)cc1C ZINC000223554990 568668803 /nfs/dbraw/zinc/66/88/03/568668803.db2.gz QIVSFFKNMJXBSM-GOSISDBHSA-N 0 0 372.468 5.047 40 0 FKABRN CC(C)Sc1ccccc1C(=O)NCCOc1cccc2ccccc21 ZINC000223558513 568669250 /nfs/dbraw/zinc/66/92/50/568669250.db2.gz XDRLFZVYZFBFPQ-UHFFFAOYSA-N 0 0 365.498 5.149 40 0 FKABRN COc1ccc(C(=O)N[C@@H](c2ccccc2)c2cccc(C)c2)cc1Cl ZINC000223566458 222784580 /nfs/dbraw/zinc/78/45/80/222784580.db2.gz HFPVLRKMYCYMOO-NRFANRHFSA-N 0 0 365.860 5.176 40 0 FKABRN COc1ccc(C(=O)N[C@H](c2ccccc2)c2cccc(C)c2)cc1Cl ZINC000223566515 209762823 /nfs/dbraw/zinc/76/28/23/209762823.db2.gz HFPVLRKMYCYMOO-OAQYLSRUSA-N 0 0 365.860 5.176 40 0 FKABRN O=C(Cc1cccc(Cl)c1)N[C@@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000223569717 222784539 /nfs/dbraw/zinc/78/45/39/222784539.db2.gz ZYFZWACEQFJKJB-LJQANCHMSA-N 0 0 369.892 5.225 40 0 FKABRN O=C(Cc1cccc(Cl)c1)N[C@H]1CC2(CCCCC2)Oc2ccccc21 ZINC000223569774 209761658 /nfs/dbraw/zinc/76/16/58/209761658.db2.gz ZYFZWACEQFJKJB-IBGZPJMESA-N 0 0 369.892 5.225 40 0 FKABRN O=C(CCc1cccc2ccccc21)NCCOc1cccc2ccccc21 ZINC000223569912 568671151 /nfs/dbraw/zinc/67/11/51/568671151.db2.gz GMWIXEWOUSNCHF-UHFFFAOYSA-N 0 0 369.464 5.121 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)c2ccccc2OC(C)C)c2ccccc2O1 ZINC000223577137 568671782 /nfs/dbraw/zinc/67/17/82/568671782.db2.gz POODFHUOZDHVKS-LJQANCHMSA-N 0 0 367.489 5.286 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)c2ccccc2OC(C)C)c2ccccc2O1 ZINC000223577199 209764801 /nfs/dbraw/zinc/76/48/01/209764801.db2.gz POODFHUOZDHVKS-IBGZPJMESA-N 0 0 367.489 5.286 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)c2ccccc2SC)c2ccccc2O1 ZINC000223579899 568672070 /nfs/dbraw/zinc/67/20/70/568672070.db2.gz VBUCBGLLFSINKC-QGZVFWFLSA-N 0 0 355.503 5.221 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)c2ccccc2SC)c2ccccc2O1 ZINC000223579945 568672108 /nfs/dbraw/zinc/67/21/08/568672108.db2.gz VBUCBGLLFSINKC-KRWDZBQOSA-N 0 0 355.503 5.221 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)NCCOc2ccc3ccccc3c2)cc1 ZINC000223580824 568672239 /nfs/dbraw/zinc/67/22/39/568672239.db2.gz RTYNQNZQPPPBOL-XNTDXEJSSA-N 0 0 373.496 5.346 40 0 FKABRN O=C(NCCOc1ccc2ccccc2c1)c1ccc(-c2ccccc2)cc1 ZINC000223583169 568672514 /nfs/dbraw/zinc/67/25/14/568672514.db2.gz HLZZLEYWXNQQAH-UHFFFAOYSA-N 0 0 367.448 5.316 40 0 FKABRN C[C@@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(C(C)(C)C)cc1 ZINC000223592507 222786682 /nfs/dbraw/zinc/78/66/82/222786682.db2.gz UFNMFEACHKTWIH-QGZVFWFLSA-N 0 0 365.517 5.119 40 0 FKABRN C[C@H](NC(=O)COc1cccc2c1CCCC2)c1ccc(C(C)(C)C)cc1 ZINC000223592556 568673956 /nfs/dbraw/zinc/67/39/56/568673956.db2.gz UFNMFEACHKTWIH-KRWDZBQOSA-N 0 0 365.517 5.119 40 0 FKABRN CCCOc1ccc(C(=O)N[C@@H]2CC(CC)(CC)Oc3ccccc32)cc1 ZINC000223609867 568678990 /nfs/dbraw/zinc/67/89/90/568678990.db2.gz OFBNHRUVNBOVOT-HXUWFJFHSA-N 0 0 367.489 5.288 40 0 FKABRN CCCOc1ccc(C(=O)N[C@H]2CC(CC)(CC)Oc3ccccc32)cc1 ZINC000223609921 222785707 /nfs/dbraw/zinc/78/57/07/222785707.db2.gz OFBNHRUVNBOVOT-FQEVSTJZSA-N 0 0 367.489 5.288 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)CSCc1ccc(Cl)cc1F ZINC000223630688 568684589 /nfs/dbraw/zinc/68/45/89/568684589.db2.gz YFMSTYFXXNVJBX-UHFFFAOYSA-N 0 0 358.265 5.313 40 0 FKABRN O=C(CCc1cccc2ccccc21)NCCOc1ccc2ccccc2c1 ZINC000223638439 568686289 /nfs/dbraw/zinc/68/62/89/568686289.db2.gz HLKHPVHLIFYYMB-UHFFFAOYSA-N 0 0 369.464 5.121 40 0 FKABRN COc1ccc(C(=O)Nc2ccccc2Oc2ccccc2)cc1Cl ZINC000223641760 568687664 /nfs/dbraw/zinc/68/76/64/568687664.db2.gz BIRVIOARNNSWHR-UHFFFAOYSA-N 0 0 353.805 5.393 40 0 FKABRN CC(C)(C)c1ccc(OCCNC(=S)Nc2ccc(Cl)cc2)cc1 ZINC000223661178 568693188 /nfs/dbraw/zinc/69/31/88/568693188.db2.gz QTCKIYHABQBBQR-UHFFFAOYSA-N 0 0 362.926 5.003 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)/C=C/c2ccc(Cl)cc2)c2ccccc2O1 ZINC000223661362 568693411 /nfs/dbraw/zinc/69/34/11/568693411.db2.gz AQPFPEBABIFJNR-FIIODCPWSA-N 0 0 369.892 5.552 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)/C=C/c2ccc(Cl)cc2)c2ccccc2O1 ZINC000223661418 568693349 /nfs/dbraw/zinc/69/33/49/568693349.db2.gz AQPFPEBABIFJNR-VUVZNRFTSA-N 0 0 369.892 5.552 40 0 FKABRN Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc2c(c1)CCC(C)(C)O2 ZINC000223663256 568693873 /nfs/dbraw/zinc/69/38/73/568693873.db2.gz TZMQPRVOMWDPPU-UHFFFAOYSA-N 0 0 373.518 5.023 40 0 FKABRN CC(C)(C)c1ccccc1OCCNC(=O)c1ccc(Cl)cc1Cl ZINC000223664366 517392020 /nfs/dbraw/zinc/39/20/20/517392020.db2.gz UUTQACAFLFIRCX-UHFFFAOYSA-N 0 0 366.288 5.100 40 0 FKABRN CC(C)(C)c1ccc(C(=O)NCCOc2ccccc2C(C)(C)C)cc1 ZINC000223664461 568694117 /nfs/dbraw/zinc/69/41/17/568694117.db2.gz RWXVGIXLRGAMFJ-UHFFFAOYSA-N 0 0 353.506 5.090 40 0 FKABRN CC(C)(C)c1ccccc1OCCNC(=O)c1ccc(-c2ccccc2)cc1 ZINC000223669912 568695573 /nfs/dbraw/zinc/69/55/73/568695573.db2.gz SFEMUMZTHWZFMK-UHFFFAOYSA-N 0 0 373.496 5.460 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)c1 ZINC000223684046 568700112 /nfs/dbraw/zinc/70/01/12/568700112.db2.gz PCOBCIKMBGGPEC-UGKGYDQZSA-N 0 0 367.533 5.789 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](CC(C)C)c2ccccc2)c1 ZINC000223684099 568700032 /nfs/dbraw/zinc/70/00/32/568700032.db2.gz PCOBCIKMBGGPEC-KNQAVFIVSA-N 0 0 367.533 5.789 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)c1 ZINC000223684137 568700063 /nfs/dbraw/zinc/70/00/63/568700063.db2.gz PCOBCIKMBGGPEC-SIKLNZKXSA-N 0 0 367.533 5.789 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](CC(C)C)c2ccccc2)c1 ZINC000223684197 568700221 /nfs/dbraw/zinc/70/02/21/568700221.db2.gz PCOBCIKMBGGPEC-DENIHFKCSA-N 0 0 367.533 5.789 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)N[C@@H](C)CC(C)(C)c2ccccc2)c1 ZINC000223688875 568701303 /nfs/dbraw/zinc/70/13/03/568701303.db2.gz CHRKIAGKXFFWLE-IBGZPJMESA-N 0 0 367.533 5.370 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)N[C@H](C)CC(C)(C)c2ccccc2)c1 ZINC000223688924 568701339 /nfs/dbraw/zinc/70/13/39/568701339.db2.gz CHRKIAGKXFFWLE-LJQANCHMSA-N 0 0 367.533 5.370 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)Cc2ccc(Cl)cc2)c2ccccc2O1 ZINC000223689113 568701373 /nfs/dbraw/zinc/70/13/73/568701373.db2.gz AVKHUEYHILPUFM-GOSISDBHSA-N 0 0 357.881 5.081 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)Cc2ccc(Cl)cc2)c2ccccc2O1 ZINC000223689167 568701433 /nfs/dbraw/zinc/70/14/33/568701433.db2.gz AVKHUEYHILPUFM-SFHVURJKSA-N 0 0 357.881 5.081 40 0 FKABRN Cc1ccc(CCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1C ZINC000223693680 568703160 /nfs/dbraw/zinc/70/31/60/568703160.db2.gz ZGDDUYGMEFXXOO-UHFFFAOYSA-N 0 0 355.787 5.547 40 0 FKABRN CC(C)Sc1ccccc1C(=O)NCCOc1ccccc1C(C)(C)C ZINC000223719543 568710745 /nfs/dbraw/zinc/71/07/45/568710745.db2.gz LWLVDRMFCQLQFH-UHFFFAOYSA-N 0 0 371.546 5.293 40 0 FKABRN O=C(Cc1cccs1)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1 ZINC000223737304 568715850 /nfs/dbraw/zinc/71/58/50/568715850.db2.gz PFVFLYCWPNEGAK-UHFFFAOYSA-N 0 0 351.515 5.397 40 0 FKABRN CC(C)(C)c1ccccc1OCCNC(=S)Nc1ccc(Cl)cc1 ZINC000223740595 568716992 /nfs/dbraw/zinc/71/69/92/568716992.db2.gz QPWHYWANBXRXGZ-UHFFFAOYSA-N 0 0 362.926 5.003 40 0 FKABRN CC(C)c1ccccc1OCCNC(=O)C(c1ccccc1)c1ccccc1 ZINC000223743157 568717662 /nfs/dbraw/zinc/71/76/62/568717662.db2.gz AMNSCAQSFFQOAC-UHFFFAOYSA-N 0 0 373.496 5.137 40 0 FKABRN CC(C)c1ccccc1OCCNC(=O)/C=C/c1ccc(C(C)(C)C)cc1 ZINC000223745463 568718420 /nfs/dbraw/zinc/71/84/20/568718420.db2.gz GPEWOYLSTRAXBZ-NTCAYCPXSA-N 0 0 365.517 5.316 40 0 FKABRN O=C(Cc1cccs1)Nc1ccccc1SCc1ccc(Cl)cc1 ZINC000223746841 222792465 /nfs/dbraw/zinc/79/24/65/222792465.db2.gz PYSGNFKSXBSIMD-UHFFFAOYSA-N 0 0 373.930 5.875 40 0 FKABRN CC(C)c1ccccc1OCCNC(=O)c1ccc(-c2ccccc2)cc1 ZINC000223748486 568719188 /nfs/dbraw/zinc/71/91/88/568719188.db2.gz MNJJDFOXPLHRDW-UHFFFAOYSA-N 0 0 359.469 5.286 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](C)CCc2ccccc2)c1 ZINC000223764479 222793515 /nfs/dbraw/zinc/79/35/15/222793515.db2.gz WFYBUZSYORNGCS-OALUTQOASA-N 0 0 353.506 5.023 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](C)CCc2ccccc2)c1 ZINC000223764536 568722991 /nfs/dbraw/zinc/72/29/91/568722991.db2.gz WFYBUZSYORNGCS-RBUKOAKNSA-N 0 0 353.506 5.023 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](C)CCc2ccccc2)c1 ZINC000223764575 568722899 /nfs/dbraw/zinc/72/28/99/568722899.db2.gz WFYBUZSYORNGCS-MOPGFXCFSA-N 0 0 353.506 5.023 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](C)CCc2ccccc2)c1 ZINC000223764628 568722983 /nfs/dbraw/zinc/72/29/83/568722983.db2.gz WFYBUZSYORNGCS-RTBURBONSA-N 0 0 353.506 5.023 40 0 FKABRN CC(C)c1ccccc1OCCNC(=O)c1cc2c(ccc3ccccc23)o1 ZINC000223770462 568724823 /nfs/dbraw/zinc/72/48/23/568724823.db2.gz AJZNJTSBTGFZJT-UHFFFAOYSA-N 0 0 373.452 5.518 40 0 FKABRN CC(C)c1ccccc1OCCNC(=O)CCc1ccc(C(C)(C)C)cc1 ZINC000223771454 568725317 /nfs/dbraw/zinc/72/53/17/568725317.db2.gz YWLRRTWOEPIRFK-UHFFFAOYSA-N 0 0 367.533 5.235 40 0 FKABRN COc1ccc(CCC(=O)N[C@@H](c2ccccc2)c2ccc(C)cc2)cc1C ZINC000223775014 568726151 /nfs/dbraw/zinc/72/61/51/568726151.db2.gz WBUHXEYHYZNAAE-VWLOTQADSA-N 0 0 373.496 5.150 40 0 FKABRN COc1ccc(CCC(=O)N[C@H](c2ccccc2)c2ccc(C)cc2)cc1C ZINC000223775059 222793780 /nfs/dbraw/zinc/79/37/80/222793780.db2.gz WBUHXEYHYZNAAE-RUZDIDTESA-N 0 0 373.496 5.150 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccccc1C(C)C ZINC000223781484 568727711 /nfs/dbraw/zinc/72/77/11/568727711.db2.gz AUQNYKHAGGTPNT-JOCHJYFZSA-N 0 0 351.490 5.485 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccccc1C(C)C ZINC000223781546 222794681 /nfs/dbraw/zinc/79/46/81/222794681.db2.gz AUQNYKHAGGTPNT-QFIPXVFZSA-N 0 0 351.490 5.485 40 0 FKABRN CC(C)Sc1ccccc1C(=O)NCCOc1ccccc1C(C)C ZINC000223797308 568731758 /nfs/dbraw/zinc/73/17/58/568731758.db2.gz JFKNXKJJLBRVGH-UHFFFAOYSA-N 0 0 357.519 5.119 40 0 FKABRN Cc1ccc([C@@H](NC(=O)CCc2ccc(C)c(C)c2)c2ccccc2)cc1 ZINC000223801723 568732829 /nfs/dbraw/zinc/73/28/29/568732829.db2.gz XOUBKYUATSGMPW-VWLOTQADSA-N 0 0 357.497 5.450 40 0 FKABRN Cc1ccc([C@H](NC(=O)CCc2ccc(C)c(C)c2)c2ccccc2)cc1 ZINC000223801770 209769715 /nfs/dbraw/zinc/76/97/15/209769715.db2.gz XOUBKYUATSGMPW-RUZDIDTESA-N 0 0 357.497 5.450 40 0 FKABRN CCCOc1ccccc1CCCNC(=O)C1(c2ccccc2)CCCC1 ZINC000223831032 570969888 /nfs/dbraw/zinc/96/98/88/570969888.db2.gz CJTGULKYGOAFCM-UHFFFAOYSA-N 0 0 365.517 5.036 40 0 FKABRN O=C(OC1CCCCCCCCCCC1)c1snnc1-c1ccccc1 ZINC000223831985 570969817 /nfs/dbraw/zinc/96/98/17/570969817.db2.gz POTQDKRIOJVIHH-UHFFFAOYSA-N 0 0 372.534 6.035 40 0 FKABRN COc1cc(C)c(C(=O)NCCOc2ccccc2C(C)C)cc1C(C)C ZINC000223837984 570969827 /nfs/dbraw/zinc/96/98/27/570969827.db2.gz ZXAITTUTPDEPGJ-UHFFFAOYSA-N 0 0 369.505 5.059 40 0 FKABRN CCc1ccc(CC)c(CNC(=O)[C@@H](C)Oc2cc(C)c(Cl)c(C)c2)c1 ZINC000223845732 222796553 /nfs/dbraw/zinc/79/65/53/222796553.db2.gz BUQHZMBVAXLZIC-MRXNPFEDSA-N 0 0 373.924 5.165 40 0 FKABRN CCc1ccc(CC)c(CNC(=O)[C@H](C)Oc2cc(C)c(Cl)c(C)c2)c1 ZINC000223845780 222796229 /nfs/dbraw/zinc/79/62/29/222796229.db2.gz BUQHZMBVAXLZIC-INIZCTEOSA-N 0 0 373.924 5.165 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)/C=C/c2ccccc2Cl)c2ccccc2O1 ZINC000223849856 570970528 /nfs/dbraw/zinc/97/05/28/570970528.db2.gz DYQHRSYZPZJMGM-JKIKYLSZSA-N 0 0 369.892 5.552 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)/C=C/c2ccccc2Cl)c2ccccc2O1 ZINC000223849917 570970364 /nfs/dbraw/zinc/97/03/64/570970364.db2.gz DYQHRSYZPZJMGM-KQDNUWKFSA-N 0 0 369.892 5.552 40 0 FKABRN O=C(OC1CCCCCCCCCCC1)c1snnc1-c1cccnc1 ZINC000223850087 206449955 /nfs/dbraw/zinc/44/99/55/206449955.db2.gz ICYBNUPOYHYEPB-UHFFFAOYSA-N 0 0 373.522 5.430 40 0 FKABRN Cc1cc(C)c(S(=O)(=O)Nc2ccc3c(c2)oc2ccccc23)c(C)c1 ZINC000223854171 570970220 /nfs/dbraw/zinc/97/02/20/570970220.db2.gz NLQKRVUVQAUHGU-UHFFFAOYSA-N 0 0 365.454 5.312 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1F)Nc1ccc(F)c(Cl)c1 ZINC000223870353 570970861 /nfs/dbraw/zinc/97/08/61/570970861.db2.gz SKIQZMAHTKJOMN-UHFFFAOYSA-N 0 0 362.228 5.144 40 0 FKABRN Cc1ccc([C@@H](NC(=O)Cc2ccc(Cl)cc2F)c2ccccc2)cc1 ZINC000223879078 570970828 /nfs/dbraw/zinc/97/08/28/570970828.db2.gz IQECFFUYDFARES-QFIPXVFZSA-N 0 0 367.851 5.236 40 0 FKABRN Cc1ccc([C@H](NC(=O)Cc2ccc(Cl)cc2F)c2ccccc2)cc1 ZINC000223879127 570970662 /nfs/dbraw/zinc/97/06/62/570970662.db2.gz IQECFFUYDFARES-JOCHJYFZSA-N 0 0 367.851 5.236 40 0 FKABRN O=C(Cc1cccc(Cl)c1)Nc1ccc(OCc2ccccc2)cc1 ZINC000223879432 570970931 /nfs/dbraw/zinc/97/09/31/570970931.db2.gz TXDZQMNJYWPKAY-UHFFFAOYSA-N 0 0 351.833 5.100 40 0 FKABRN CC(C)(C)NC(=S)Nc1ccc(Nc2ccc3ccccc3c2)nc1 ZINC000223883762 570970765 /nfs/dbraw/zinc/97/07/65/570970765.db2.gz PWIAKMINRKMEIK-UHFFFAOYSA-N 0 0 350.491 5.063 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cccc(OC(C)C)c1 ZINC000223890738 570970742 /nfs/dbraw/zinc/97/07/42/570970742.db2.gz OWVAECWGKUOWDD-JOCHJYFZSA-N 0 0 367.489 5.149 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cccc(OC(C)C)c1 ZINC000223890790 570970853 /nfs/dbraw/zinc/97/08/53/570970853.db2.gz OWVAECWGKUOWDD-QFIPXVFZSA-N 0 0 367.489 5.149 40 0 FKABRN COc1ccc(CCC(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)cc1C ZINC000223892568 570971133 /nfs/dbraw/zinc/97/11/33/570971133.db2.gz UDVTUIOTYYQHQF-KRWDZBQOSA-N 0 0 353.506 5.111 40 0 FKABRN COc1ccc(CCC(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)cc1C ZINC000223892623 570971321 /nfs/dbraw/zinc/97/13/21/570971321.db2.gz UDVTUIOTYYQHQF-QGZVFWFLSA-N 0 0 353.506 5.111 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000223898096 570971221 /nfs/dbraw/zinc/97/12/21/570971221.db2.gz FPUQVVKYHBFLOQ-FDDCHVKYSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](C)c1cc(C)ccc1C ZINC000223898154 222799181 /nfs/dbraw/zinc/79/91/81/222799181.db2.gz FPUQVVKYHBFLOQ-MBSDFSHPSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000223898205 570971080 /nfs/dbraw/zinc/97/10/80/570971080.db2.gz FPUQVVKYHBFLOQ-WZONZLPQSA-N 0 0 365.517 5.217 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@H](C)c1cc(C)ccc1C ZINC000223898254 570971088 /nfs/dbraw/zinc/97/10/88/570971088.db2.gz FPUQVVKYHBFLOQ-JPYJTQIMSA-N 0 0 365.517 5.217 40 0 FKABRN Cc1cccc(OCCNC(=O)/C(=C/c2ccccc2)c2ccccc2)c1C ZINC000223901961 570971176 /nfs/dbraw/zinc/97/11/76/570971176.db2.gz MNKBTYGEROBLPZ-PTGBLXJZSA-N 0 0 371.480 5.039 40 0 FKABRN S=C(NCc1ccco1)Nc1ccc(Nc2ccc3ccccc3c2)nc1 ZINC000223903467 570971129 /nfs/dbraw/zinc/97/11/29/570971129.db2.gz CAJOCGGCYMXONG-UHFFFAOYSA-N 0 0 374.469 5.058 40 0 FKABRN Cc1cc(C)nc(NC(=S)NCc2ccc(-c3ccc(Cl)cc3)o2)c1 ZINC000223915312 222800517 /nfs/dbraw/zinc/80/05/17/222800517.db2.gz VNLPDSFYNAZGFY-UHFFFAOYSA-N 0 0 371.893 5.098 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NC(C)(C)Cc2ccccc2)c1 ZINC000223923631 206451253 /nfs/dbraw/zinc/45/12/53/206451253.db2.gz GOYXBGJRKLSWPB-SFHVURJKSA-N 0 0 353.506 5.023 40 0 FKABRN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NC(C)(C)Cc2ccccc2)c1 ZINC000223923689 570971631 /nfs/dbraw/zinc/97/16/31/570971631.db2.gz GOYXBGJRKLSWPB-GOSISDBHSA-N 0 0 353.506 5.023 40 0 FKABRN Cc1cccc(OCCNC(=O)c2cc3c(ccc4ccccc34)o2)c1C ZINC000223925685 570972089 /nfs/dbraw/zinc/97/20/89/570972089.db2.gz DQGPYQFSRPJULC-UHFFFAOYSA-N 0 0 359.425 5.012 40 0 FKABRN S=C(NCc1ccc(Cl)cc1)Nc1ccc(Oc2ccccc2)nc1 ZINC000223931322 222800905 /nfs/dbraw/zinc/80/09/05/222800905.db2.gz LDVYEDFKCSCFPC-UHFFFAOYSA-N 0 0 369.877 5.014 40 0 FKABRN S=C(NCc1ccccc1Cl)Nc1ccc(Oc2ccccc2)nc1 ZINC000223936083 570972094 /nfs/dbraw/zinc/97/20/94/570972094.db2.gz WSHBZKRHEAEPLJ-UHFFFAOYSA-N 0 0 369.877 5.014 40 0 FKABRN Cc1cccc(OCCNC(=O)CC(c2ccccc2)c2ccccc2)c1C ZINC000223939272 570972497 /nfs/dbraw/zinc/97/24/97/570972497.db2.gz ZZTGKKNZDUQZKM-UHFFFAOYSA-N 0 0 373.496 5.021 40 0 FKABRN Cc1ccc(CNC(=S)Nc2ccc(Sc3ccccc3)nc2)cc1 ZINC000223944697 570972752 /nfs/dbraw/zinc/97/27/52/570972752.db2.gz LKPRRTNQNOQCAH-UHFFFAOYSA-N 0 0 365.527 5.028 40 0 FKABRN O=C(Cc1cccc(Cl)c1)Nc1ccccc1Sc1ccccc1 ZINC000223946290 222802279 /nfs/dbraw/zinc/80/22/79/222802279.db2.gz DEMLUHSAEBKVNA-UHFFFAOYSA-N 0 0 353.874 5.672 40 0 FKABRN C[C@@H](NC(=S)Nc1ccc(Sc2ccccc2)nc1)c1ccccc1 ZINC000223958725 570973024 /nfs/dbraw/zinc/97/30/24/570973024.db2.gz HIWGKNGHXDPIJW-OAHLLOKOSA-N 0 0 365.527 5.280 40 0 FKABRN C[C@H](NC(=S)Nc1ccc(Sc2ccccc2)nc1)c1ccccc1 ZINC000223958786 570972993 /nfs/dbraw/zinc/97/29/93/570972993.db2.gz HIWGKNGHXDPIJW-HNNXBMFYSA-N 0 0 365.527 5.280 40 0 FKABRN Cc1ccccc1Nc1ccc(NC(=S)N[C@@H](C)c2ccccc2)cn1 ZINC000223959410 570973068 /nfs/dbraw/zinc/97/30/68/570973068.db2.gz XOQNJLPZWWPXHD-INIZCTEOSA-N 0 0 362.502 5.181 40 0 FKABRN Cc1ccccc1Nc1ccc(NC(=S)N[C@H](C)c2ccccc2)cn1 ZINC000223959464 570973107 /nfs/dbraw/zinc/97/31/07/570973107.db2.gz XOQNJLPZWWPXHD-MRXNPFEDSA-N 0 0 362.502 5.181 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1cccc(C)c1C)c1ccc(OC)c(C)c1 ZINC000223959510 570972966 /nfs/dbraw/zinc/97/29/66/570972966.db2.gz NDNJUPJILPDHQH-WOJBJXKFSA-N 0 0 369.505 5.045 40 0 FKABRN Cc1cccc(Nc2ccc(NC(=S)N[C@@H](C)c3ccccc3)cn2)c1 ZINC000223959547 570973092 /nfs/dbraw/zinc/97/30/92/570973092.db2.gz DMABBVJXPAGYKJ-INIZCTEOSA-N 0 0 362.502 5.181 40 0 FKABRN CC[C@@H](Oc1cccc(C)c1C)C(=O)N[C@@H](CC)c1ccc(OC)c(C)c1 ZINC000223959569 570973096 /nfs/dbraw/zinc/97/30/96/570973096.db2.gz NDNJUPJILPDHQH-VQTJNVASSA-N 0 0 369.505 5.045 40 0 FKABRN Cc1cccc(Nc2ccc(NC(=S)N[C@H](C)c3ccccc3)cn2)c1 ZINC000223959599 206451932 /nfs/dbraw/zinc/45/19/32/206451932.db2.gz DMABBVJXPAGYKJ-MRXNPFEDSA-N 0 0 362.502 5.181 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1cccc(C)c1C)c1ccc(OC)c(C)c1 ZINC000223959628 570972985 /nfs/dbraw/zinc/97/29/85/570972985.db2.gz NDNJUPJILPDHQH-UXHICEINSA-N 0 0 369.505 5.045 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1cccc(C)c1C)c1ccc(OC)c(C)c1 ZINC000223959675 206452145 /nfs/dbraw/zinc/45/21/45/206452145.db2.gz NDNJUPJILPDHQH-PMACEKPBSA-N 0 0 369.505 5.045 40 0 FKABRN Cc1ccc(Nc2ccc(NC(=S)N[C@@H](C)c3ccccc3)cn2)cc1 ZINC000223959679 570973100 /nfs/dbraw/zinc/97/31/00/570973100.db2.gz JHPCZFJLYPXYDE-INIZCTEOSA-N 0 0 362.502 5.181 40 0 FKABRN Cc1ccc(Nc2ccc(NC(=S)N[C@H](C)c3ccccc3)cn2)cc1 ZINC000223959745 222801665 /nfs/dbraw/zinc/80/16/65/222801665.db2.gz JHPCZFJLYPXYDE-MRXNPFEDSA-N 0 0 362.502 5.181 40 0 FKABRN O=C(Cc1ccc(Cl)cc1F)Nc1ccccc1Oc1ccccc1 ZINC000223972303 570973567 /nfs/dbraw/zinc/97/35/67/570973567.db2.gz VAONGNGGWFUZFH-UHFFFAOYSA-N 0 0 355.796 5.453 40 0 FKABRN Cc1cc(C)nc(NC(=S)NCC2(c3ccc(Cl)cc3)CCCC2)c1 ZINC000223977813 570973406 /nfs/dbraw/zinc/97/34/06/570973406.db2.gz USMZRMXPPXFIRD-UHFFFAOYSA-N 0 0 373.953 5.150 40 0 FKABRN Cc1ccc(C)c(OCCNC(=O)/C(=C/c2ccccc2)c2ccccc2)c1 ZINC000223981523 570973939 /nfs/dbraw/zinc/97/39/39/570973939.db2.gz FSYOROBZUJILEK-PTGBLXJZSA-N 0 0 371.480 5.039 40 0 FKABRN CSc1ccc(S(=O)(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 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ZINC000224591321 570994037 /nfs/dbraw/zinc/99/40/37/570994037.db2.gz WGNNOXVMENNSBI-NRFANRHFSA-N 0 0 365.517 5.380 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccccc2Oc2ccccc2)cc1Cl ZINC000224596602 222815658 /nfs/dbraw/zinc/81/56/58/222815658.db2.gz HTHCTAAXRDWVAC-UHFFFAOYSA-N 0 0 367.832 5.783 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccc3c(c2)oc2ccccc23)cc1 ZINC000224597380 222815558 /nfs/dbraw/zinc/81/55/58/222815558.db2.gz PNVQRAJSVYLFQZ-UHFFFAOYSA-N 0 0 357.453 6.281 40 0 FKABRN CC(C)c1ccc(CCC(=O)Nc2ccc(Cc3ccncc3)cc2)cc1 ZINC000224597766 222815976 /nfs/dbraw/zinc/81/59/76/222815976.db2.gz YEUZYFLBSCATLJ-UHFFFAOYSA-N 0 0 358.485 5.367 40 0 FKABRN CC(C)c1ccc(CCC(=O)NCCOc2ccc(C(C)(C)C)cc2)cc1 ZINC000224597910 222816504 /nfs/dbraw/zinc/81/65/04/222816504.db2.gz AOEZQYBVCISZME-UHFFFAOYSA-N 0 0 367.533 5.235 40 0 FKABRN COc1ccccc1O[C@@H](C)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000224600791 570994073 /nfs/dbraw/zinc/99/40/73/570994073.db2.gz COBHRGIXBVVFPE-AWEZNQCLSA-N 0 0 361.397 5.001 40 0 FKABRN COc1ccccc1O[C@H](C)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000224600834 570993791 /nfs/dbraw/zinc/99/37/91/570993791.db2.gz COBHRGIXBVVFPE-CQSZACIVSA-N 0 0 361.397 5.001 40 0 FKABRN Cc1ccc(O[C@@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1C ZINC000224603940 222816307 /nfs/dbraw/zinc/81/63/07/222816307.db2.gz JFTWTMVBEVVVHR-INIZCTEOSA-N 0 0 359.425 5.609 40 0 FKABRN Cc1ccc(O[C@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)cc1C ZINC000224603992 570994225 /nfs/dbraw/zinc/99/42/25/570994225.db2.gz JFTWTMVBEVVVHR-MRXNPFEDSA-N 0 0 359.425 5.609 40 0 FKABRN CCCCNC(=O)c1ccc(OCC)c(COc2cc(C)cc(C)c2C)c1 ZINC000224606036 570994298 /nfs/dbraw/zinc/99/42/98/570994298.db2.gz XIXRGGFLFVDPNH-UHFFFAOYSA-N 0 0 369.505 5.119 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](C)CC)cc1COc1cc(C)cc(C)c1C ZINC000224606182 570994391 /nfs/dbraw/zinc/99/43/91/570994391.db2.gz MQFNZSWQCAZJQU-KRWDZBQOSA-N 0 0 369.505 5.118 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](C)CC)cc1COc1cc(C)cc(C)c1C ZINC000224606246 570994453 /nfs/dbraw/zinc/99/44/53/570994453.db2.gz MQFNZSWQCAZJQU-QGZVFWFLSA-N 0 0 369.505 5.118 40 0 FKABRN CCOc1ccc(C(=O)NC(C)(C)C)cc1COc1cc(C)cc(C)c1C ZINC000224606317 570994292 /nfs/dbraw/zinc/99/42/92/570994292.db2.gz VCCAGPUCKXYYLA-UHFFFAOYSA-N 0 0 369.505 5.118 40 0 FKABRN Cc1ccc(O[C@@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)c(C)c1 ZINC000224607217 570994277 /nfs/dbraw/zinc/99/42/77/570994277.db2.gz AQBMGIAQFNAZJG-INIZCTEOSA-N 0 0 359.425 5.609 40 0 FKABRN Cc1ccc(O[C@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)c(C)c1 ZINC000224607265 570994273 /nfs/dbraw/zinc/99/42/73/570994273.db2.gz AQBMGIAQFNAZJG-MRXNPFEDSA-N 0 0 359.425 5.609 40 0 FKABRN O=C(Cc1ccc(Cl)cc1F)Nc1cc(C(F)(F)F)ccc1Cl ZINC000224608069 209789161 /nfs/dbraw/zinc/78/91/61/209789161.db2.gz ZNEISVKTNPJMCF-UHFFFAOYSA-N 0 0 366.141 5.333 40 0 FKABRN Cc1cc(C)cc(O[C@@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)c1 ZINC000224610397 570994405 /nfs/dbraw/zinc/99/44/05/570994405.db2.gz HLBUWZMLHVYZST-INIZCTEOSA-N 0 0 359.425 5.609 40 0 FKABRN Cc1cc(C)cc(O[C@H](C)C(=O)Nc2ccc3c(c2)oc2ccccc23)c1 ZINC000224610448 570994422 /nfs/dbraw/zinc/99/44/22/570994422.db2.gz HLBUWZMLHVYZST-MRXNPFEDSA-N 0 0 359.425 5.609 40 0 FKABRN CCOc1ccc(C(=O)N(CC)CC)cc1COc1cc(C)cc(C)c1C ZINC000224612817 206461661 /nfs/dbraw/zinc/46/16/61/206461661.db2.gz IVNVZPFXSVFNDJ-UHFFFAOYSA-N 0 0 369.505 5.072 40 0 FKABRN CC[C@@H](Oc1ccccc1F)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000224616692 570994679 /nfs/dbraw/zinc/99/46/79/570994679.db2.gz RZEYFVDPCPCLQG-GOSISDBHSA-N 0 0 363.388 5.521 40 0 FKABRN CC[C@H](Oc1ccccc1F)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000224616739 570994702 /nfs/dbraw/zinc/99/47/02/570994702.db2.gz RZEYFVDPCPCLQG-SFHVURJKSA-N 0 0 363.388 5.521 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1c(C)cccc1C(C)C ZINC000224618731 570994694 /nfs/dbraw/zinc/99/46/94/570994694.db2.gz UAMROGNFYZALBF-JOCHJYFZSA-N 0 0 365.517 5.793 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1c(C)cccc1C(C)C ZINC000224618779 570994898 /nfs/dbraw/zinc/99/48/98/570994898.db2.gz UAMROGNFYZALBF-QFIPXVFZSA-N 0 0 365.517 5.793 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000224619780 570994742 /nfs/dbraw/zinc/99/47/42/570994742.db2.gz KUARFTPSZWTKLY-HXUWFJFHSA-N 0 0 359.425 5.691 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000224619832 570994669 /nfs/dbraw/zinc/99/46/69/570994669.db2.gz KUARFTPSZWTKLY-FQEVSTJZSA-N 0 0 359.425 5.691 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000224624075 222817497 /nfs/dbraw/zinc/81/74/97/222817497.db2.gz YSUSJPJERCWEPF-HXUWFJFHSA-N 0 0 365.860 5.388 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000224624128 570995142 /nfs/dbraw/zinc/99/51/42/570995142.db2.gz YSUSJPJERCWEPF-FQEVSTJZSA-N 0 0 365.860 5.388 40 0 FKABRN CCCCCNC(=O)c1ccc(OCC)c(COc2ccc(C)c(C)c2)c1 ZINC000224625441 570995158 /nfs/dbraw/zinc/99/51/58/570995158.db2.gz YQEYCBMBBKFHJG-UHFFFAOYSA-N 0 0 369.505 5.201 40 0 FKABRN CCOc1ccc(C(=O)NCCC(C)C)cc1COc1ccc(C)c(C)c1 ZINC000224625499 570995125 /nfs/dbraw/zinc/99/51/25/570995125.db2.gz MHHKDDYNFWSDGG-UHFFFAOYSA-N 0 0 369.505 5.057 40 0 FKABRN CCC[C@@H](C)NC(=O)c1ccc(OCC)c(COc2ccc(C)c(C)c2)c1 ZINC000224625563 222817071 /nfs/dbraw/zinc/81/70/71/222817071.db2.gz NQCXZCUWOSRGJM-GOSISDBHSA-N 0 0 369.505 5.200 40 0 FKABRN CCC[C@H](C)NC(=O)c1ccc(OCC)c(COc2ccc(C)c(C)c2)c1 ZINC000224625608 570995145 /nfs/dbraw/zinc/99/51/45/570995145.db2.gz NQCXZCUWOSRGJM-SFHVURJKSA-N 0 0 369.505 5.200 40 0 FKABRN CC(C)Sc1ccccc1C(=O)Nc1ccc2c(c1)oc1ccccc12 ZINC000224640504 570995629 /nfs/dbraw/zinc/99/56/29/570995629.db2.gz IBJCLSAXQKSAHW-UHFFFAOYSA-N 0 0 361.466 6.339 40 0 FKABRN CC(C)Sc1ccccc1C(=O)NCCOc1ccc(C(C)(C)C)cc1 ZINC000224640813 570995651 /nfs/dbraw/zinc/99/56/51/570995651.db2.gz DHPWRZUPCKDBGZ-UHFFFAOYSA-N 0 0 371.546 5.293 40 0 FKABRN CCC1(CC)C[C@@H](NC(=O)Cc2cc(C)ccc2C)c2ccccc2O1 ZINC000224644537 222817508 /nfs/dbraw/zinc/81/75/08/222817508.db2.gz AFQOINJGYKVCEZ-HXUWFJFHSA-N 0 0 351.490 5.045 40 0 FKABRN CCC1(CC)C[C@H](NC(=O)Cc2cc(C)ccc2C)c2ccccc2O1 ZINC000224644582 570996104 /nfs/dbraw/zinc/99/61/04/570996104.db2.gz AFQOINJGYKVCEZ-FQEVSTJZSA-N 0 0 351.490 5.045 40 0 FKABRN Cc1ccc(CC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c(C)c1 ZINC000224644654 570996109 /nfs/dbraw/zinc/99/61/09/570996109.db2.gz HTYRHUVRBZTSGO-UHFFFAOYSA-N 0 0 365.860 5.930 40 0 FKABRN CCOc1ccc(C(=O)NC2CCCC2)cc1CSc1ccccc1 ZINC000224649179 570996059 /nfs/dbraw/zinc/99/60/59/570996059.db2.gz CELVDNQTVRPFJG-UHFFFAOYSA-N 0 0 355.503 5.050 40 0 FKABRN CCOc1ccc(C(=O)NC2CCCCC2)cc1CSc1ccccc1 ZINC000224649244 570996074 /nfs/dbraw/zinc/99/60/74/570996074.db2.gz QOYKJWBZZFXDPH-UHFFFAOYSA-N 0 0 369.530 5.440 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccccc2)cc1CSc1ccccc1 ZINC000224650241 570996035 /nfs/dbraw/zinc/99/60/35/570996035.db2.gz DGKZTAOZDQTVOK-UHFFFAOYSA-N 0 0 363.482 5.630 40 0 FKABRN CCOc1ccc(C(=O)N2CCCCC2)cc1CSc1ccccc1 ZINC000224654856 209789617 /nfs/dbraw/zinc/78/96/17/209789617.db2.gz WYQDQJJKEGQXSZ-UHFFFAOYSA-N 0 0 355.503 5.004 40 0 FKABRN CCOc1ccc(C(=O)N2CCC(C)CC2)cc1CSc1ccccc1 ZINC000224654918 570996086 /nfs/dbraw/zinc/99/60/86/570996086.db2.gz NVZARNRPZKNJPV-UHFFFAOYSA-N 0 0 369.530 5.250 40 0 FKABRN CCOc1ccc(C(=O)N2CCCCCC2)cc1CSc1ccccc1 ZINC000224655176 222818049 /nfs/dbraw/zinc/81/80/49/222818049.db2.gz GIXMHUKGOCETBT-UHFFFAOYSA-N 0 0 369.530 5.394 40 0 FKABRN CCCCCNC(=O)c1ccc(OCC)c(CSc2ccccc2)c1 ZINC000224656360 209790164 /nfs/dbraw/zinc/79/01/64/209790164.db2.gz GECZXTYMGMMHOD-UHFFFAOYSA-N 0 0 357.519 5.298 40 0 FKABRN CCOc1ccc(C(=O)NCCC(C)C)cc1CSc1ccccc1 ZINC000224656421 570996524 /nfs/dbraw/zinc/99/65/24/570996524.db2.gz MRDSROHHRXONBZ-UHFFFAOYSA-N 0 0 357.519 5.154 40 0 FKABRN CCC[C@@H](C)NC(=O)c1ccc(OCC)c(CSc2ccccc2)c1 ZINC000224656481 206463239 /nfs/dbraw/zinc/46/32/39/206463239.db2.gz LFYBFQFXMMYYMV-MRXNPFEDSA-N 0 0 357.519 5.296 40 0 FKABRN CCC[C@H](C)NC(=O)c1ccc(OCC)c(CSc2ccccc2)c1 ZINC000224656521 570996653 /nfs/dbraw/zinc/99/66/53/570996653.db2.gz LFYBFQFXMMYYMV-INIZCTEOSA-N 0 0 357.519 5.296 40 0 FKABRN CCCCNC(=O)c1ccc(OCC)c(CSc2ccc(C)cc2)c1 ZINC000224659099 570996622 /nfs/dbraw/zinc/99/66/22/570996622.db2.gz WASLBBANDDFLJZ-UHFFFAOYSA-N 0 0 357.519 5.216 40 0 FKABRN CCOc1ccc(C(=O)NCC(C)C)cc1CSc1ccc(C)cc1 ZINC000224659167 570996625 /nfs/dbraw/zinc/99/66/25/570996625.db2.gz OLGITYVBVVTUME-UHFFFAOYSA-N 0 0 357.519 5.072 40 0 FKABRN CCOc1ccc(C(=O)N[C@@H](C)CC)cc1CSc1ccc(C)cc1 ZINC000224659232 570996578 /nfs/dbraw/zinc/99/65/78/570996578.db2.gz RFHNYPDVGUIRBK-INIZCTEOSA-N 0 0 357.519 5.214 40 0 FKABRN CCOc1ccc(C(=O)N[C@H](C)CC)cc1CSc1ccc(C)cc1 ZINC000224659280 570996546 /nfs/dbraw/zinc/99/65/46/570996546.db2.gz RFHNYPDVGUIRBK-MRXNPFEDSA-N 0 0 357.519 5.214 40 0 FKABRN CCOc1ccc(C(=O)NC(C)(C)C)cc1CSc1ccc(C)cc1 ZINC000224659347 222818142 /nfs/dbraw/zinc/81/81/42/222818142.db2.gz LYXOJIZIGGCZAI-UHFFFAOYSA-N 0 0 357.519 5.214 40 0 FKABRN CCOc1ccc(C(=O)NC2CCCC2)cc1CSc1ccc(C)cc1 ZINC000224659567 222818101 /nfs/dbraw/zinc/81/81/01/222818101.db2.gz UDADMJJTFGUEGY-UHFFFAOYSA-N 0 0 369.530 5.358 40 0 FKABRN CCCSc1nnc(NC(=O)c2cc3c(ccc4ccccc34)o2)s1 ZINC000224662025 570996519 /nfs/dbraw/zinc/99/65/19/570996519.db2.gz GDYCWDPGICFXFU-UHFFFAOYSA-N 0 0 369.471 5.192 40 0 FKABRN CCOc1ccc(C(=O)N(CC)CC)cc1CSc1ccc(C)cc1 ZINC000224665314 570996517 /nfs/dbraw/zinc/99/65/17/570996517.db2.gz MSOZINYMKNYTIP-UHFFFAOYSA-N 0 0 357.519 5.168 40 0 FKABRN CCOc1ccc(C(=O)N2CCCCC2)cc1CSc1ccc(C)cc1 ZINC000224665590 570996525 /nfs/dbraw/zinc/99/65/25/570996525.db2.gz BQCFPOJTXKBTCV-UHFFFAOYSA-N 0 0 369.530 5.312 40 0 FKABRN CCCCCNC(=O)c1ccc(OCC)c(CSc2ccc(C)cc2)c1 ZINC000224667074 570996602 /nfs/dbraw/zinc/99/66/02/570996602.db2.gz HAWOZSNUIUIGMO-UHFFFAOYSA-N 0 0 371.546 5.606 40 0 FKABRN CCOc1ccc(C(=O)NCCC(C)C)cc1CSc1ccc(C)cc1 ZINC000224667139 570996527 /nfs/dbraw/zinc/99/65/27/570996527.db2.gz BSHAZCDUTRUWQO-UHFFFAOYSA-N 0 0 371.546 5.462 40 0 FKABRN CCC[C@@H](C)NC(=O)c1ccc(OCC)c(CSc2ccc(C)cc2)c1 ZINC000224667208 570996547 /nfs/dbraw/zinc/99/65/47/570996547.db2.gz BIAOXWMOJQZYJG-QGZVFWFLSA-N 0 0 371.546 5.604 40 0 FKABRN CCC[C@H](C)NC(=O)c1ccc(OCC)c(CSc2ccc(C)cc2)c1 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PUINLSPFNODSDM-UHFFFAOYSA-N 0 0 363.379 5.165 40 0 FKABRN CCOc1ccc(NC(=O)C2(c3ccccc3)CCCC2)c2ccccc12 ZINC000225676477 209828119 /nfs/dbraw/zinc/82/81/19/209828119.db2.gz GMXMQSIWAORRLY-UHFFFAOYSA-N 0 0 359.469 5.689 40 0 FKABRN CCCOc1ccc(NC(=O)C2(c3ccccc3)CCCC2)c2ccccc12 ZINC000225676525 571054752 /nfs/dbraw/zinc/05/47/52/571054752.db2.gz UXXAQPVRWZMPKS-UHFFFAOYSA-N 0 0 373.496 6.079 40 0 FKABRN CC(C)Oc1ccc(NC(=O)C2(c3ccccc3)CCCC2)c2ccccc12 ZINC000225676569 571055031 /nfs/dbraw/zinc/05/50/31/571055031.db2.gz FRJNBBIAZDNRBF-UHFFFAOYSA-N 0 0 373.496 6.078 40 0 FKABRN Cc1ccc(NC(=S)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)c(C)c1 ZINC000225676908 222859956 /nfs/dbraw/zinc/85/99/56/222859956.db2.gz SWSJRVLDNKDIEW-GOSISDBHSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc(NC(=S)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)c(C)c1 ZINC000225676923 222859793 /nfs/dbraw/zinc/85/97/93/222859793.db2.gz SWSJRVLDNKDIEW-SFHVURJKSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc(C)c(NC(=S)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)c1 ZINC000225676939 571055245 /nfs/dbraw/zinc/05/52/45/571055245.db2.gz TVKDIPWSWUKCSZ-GOSISDBHSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc(C)c(NC(=S)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)c1 ZINC000225676955 571055085 /nfs/dbraw/zinc/05/50/85/571055085.db2.gz TVKDIPWSWUKCSZ-SFHVURJKSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=S)Nc1cc(C)cc(C)c1 ZINC000225676973 571055113 /nfs/dbraw/zinc/05/51/13/571055113.db2.gz VNDUPYPRUDXDSH-SFHVURJKSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=S)Nc1cc(C)cc(C)c1 ZINC000225676986 571055156 /nfs/dbraw/zinc/05/51/56/571055156.db2.gz VNDUPYPRUDXDSH-GOSISDBHSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=S)Nc1ccc(C)c(C)c1 ZINC000225677008 206493121 /nfs/dbraw/zinc/49/31/21/206493121.db2.gz UEPTXPMRUOIDLD-SFHVURJKSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=S)Nc1ccc(C)c(C)c1 ZINC000225677023 571055176 /nfs/dbraw/zinc/05/51/76/571055176.db2.gz UEPTXPMRUOIDLD-GOSISDBHSA-N 0 0 354.519 5.201 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=S)Nc1ccc(C(C)C)cc1 ZINC000225677048 571055165 /nfs/dbraw/zinc/05/51/65/571055165.db2.gz ITNNAZWVDGHNEJ-IBGZPJMESA-N 0 0 368.546 5.707 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=S)Nc1ccc(C(C)C)cc1 ZINC000225677063 571055122 /nfs/dbraw/zinc/05/51/22/571055122.db2.gz ITNNAZWVDGHNEJ-LJQANCHMSA-N 0 0 368.546 5.707 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=S)Nc1ccccc1Cl ZINC000225677090 571055199 /nfs/dbraw/zinc/05/51/99/571055199.db2.gz YSGKRFDSYHVKEG-INIZCTEOSA-N 0 0 360.910 5.237 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=S)Nc1ccccc1Cl ZINC000225677117 571055117 /nfs/dbraw/zinc/05/51/17/571055117.db2.gz YSGKRFDSYHVKEG-MRXNPFEDSA-N 0 0 360.910 5.237 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=S)Nc1cccc(Cl)c1 ZINC000225677143 206493036 /nfs/dbraw/zinc/49/30/36/206493036.db2.gz KIHTZEXXLOHSKC-INIZCTEOSA-N 0 0 360.910 5.237 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=S)Nc1cccc(Cl)c1 ZINC000225677164 206493493 /nfs/dbraw/zinc/49/34/93/206493493.db2.gz KIHTZEXXLOHSKC-MRXNPFEDSA-N 0 0 360.910 5.237 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=S)Nc1ccc(Cl)cc1 ZINC000225677183 571055223 /nfs/dbraw/zinc/05/52/23/571055223.db2.gz UHKJWJAWGKQFTI-INIZCTEOSA-N 0 0 360.910 5.237 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=S)Nc1ccc(Cl)cc1 ZINC000225677192 571055173 /nfs/dbraw/zinc/05/51/73/571055173.db2.gz UHKJWJAWGKQFTI-MRXNPFEDSA-N 0 0 360.910 5.237 40 0 FKABRN CCc1ccc(NC(=S)N[C@@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 ZINC000225677558 571055233 /nfs/dbraw/zinc/05/52/33/571055233.db2.gz QEFFLYYMQKNOCP-GOSISDBHSA-N 0 0 354.519 5.146 40 0 FKABRN CCc1ccc(NC(=S)N[C@H]2CC(C)(C)Oc3cc(C)ccc32)cc1 ZINC000225677573 571055053 /nfs/dbraw/zinc/05/50/53/571055053.db2.gz QEFFLYYMQKNOCP-SFHVURJKSA-N 0 0 354.519 5.146 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccccc1OC ZINC000225677597 571055098 /nfs/dbraw/zinc/05/50/98/571055098.db2.gz HDZYEGLRRMVIGG-SCLBCKFNSA-N 0 0 363.910 5.097 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C)c1ccccc1OC ZINC000225677611 571055189 /nfs/dbraw/zinc/05/51/89/571055189.db2.gz HDZYEGLRRMVIGG-UGSOOPFHSA-N 0 0 363.910 5.097 40 0 FKABRN CC[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccccc1OC ZINC000225677633 571055194 /nfs/dbraw/zinc/05/51/94/571055194.db2.gz HDZYEGLRRMVIGG-FZKQIMNGSA-N 0 0 363.910 5.097 40 0 FKABRN CC[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C)c1ccccc1OC ZINC000225677657 571055250 /nfs/dbraw/zinc/05/52/50/571055250.db2.gz HDZYEGLRRMVIGG-ACJLOTCBSA-N 0 0 363.910 5.097 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@@H]2NC(=S)Nc1ccc(C)c(Cl)c1 ZINC000225677778 571055127 /nfs/dbraw/zinc/05/51/27/571055127.db2.gz MIDJRUMGNQZBGS-KRWDZBQOSA-N 0 0 374.937 5.546 40 0 FKABRN Cc1ccc2c(c1)OC(C)(C)C[C@H]2NC(=S)Nc1ccc(C)c(Cl)c1 ZINC000225677807 571055254 /nfs/dbraw/zinc/05/52/54/571055254.db2.gz MIDJRUMGNQZBGS-QGZVFWFLSA-N 0 0 374.937 5.546 40 0 FKABRN Cc1cccc(C(C)C)c1NC(=O)CSCc1ccc(Cl)cc1F ZINC000225678929 571055139 /nfs/dbraw/zinc/05/51/39/571055139.db2.gz KEROXAQCBDYEFJ-UHFFFAOYSA-N 0 0 365.901 5.783 40 0 FKABRN COc1ccc(NC(=O)C2(c3cccc(C)c3)CCCC2)c2ccccc12 ZINC000225679338 571055389 /nfs/dbraw/zinc/05/53/89/571055389.db2.gz OLNCZGAHIMYFMM-UHFFFAOYSA-N 0 0 359.469 5.607 40 0 FKABRN CCOc1ccc(NC(=O)C2(c3cccc(C)c3)CCCC2)c2ccccc12 ZINC000225679380 571055517 /nfs/dbraw/zinc/05/55/17/571055517.db2.gz BHXLNLNHHLGEJV-UHFFFAOYSA-N 0 0 373.496 5.997 40 0 FKABRN CC[C@@H](NC(=O)[C@@H](CC)Oc1ccc2c(c1)CCCC2)c1ccc(C)cc1 ZINC000225679555 571055406 /nfs/dbraw/zinc/05/54/06/571055406.db2.gz IQCXNOUPRZGRBY-DHIUTWEWSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N[C@@H](CC)c1ccc(C)cc1 ZINC000225679585 571055551 /nfs/dbraw/zinc/05/55/51/571055551.db2.gz IQCXNOUPRZGRBY-XZOQPEGZSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@@H](NC(=O)[C@H](CC)Oc1ccc2c(c1)CCCC2)c1ccc(C)cc1 ZINC000225679612 222860232 /nfs/dbraw/zinc/86/02/32/222860232.db2.gz IQCXNOUPRZGRBY-PKTZIBPZSA-N 0 0 365.517 5.299 40 0 FKABRN CC[C@H](NC(=O)[C@H](CC)Oc1ccc2c(c1)CCCC2)c1ccc(C)cc1 ZINC000225679639 571055386 /nfs/dbraw/zinc/05/53/86/571055386.db2.gz IQCXNOUPRZGRBY-GOTSBHOMSA-N 0 0 365.517 5.299 40 0 FKABRN COc1ccc(NC(=O)C2(c3ccc(C)cc3)CCCC2)c2ccccc12 ZINC000225680768 571055513 /nfs/dbraw/zinc/05/55/13/571055513.db2.gz YAIFQRIMYZZWOR-UHFFFAOYSA-N 0 0 359.469 5.607 40 0 FKABRN CCOc1ccc(NC(=O)C2(c3ccc(C)cc3)CCCC2)c2ccccc12 ZINC000225680809 571055478 /nfs/dbraw/zinc/05/54/78/571055478.db2.gz YXPCEVIVSBWZCM-UHFFFAOYSA-N 0 0 373.496 5.997 40 0 FKABRN CC(C)Oc1ccc(CCCNC(=O)C2(c3ccccc3)CCCC2)cc1 ZINC000225682120 222860147 /nfs/dbraw/zinc/86/01/47/222860147.db2.gz NVBXBANYRBPEMR-UHFFFAOYSA-N 0 0 365.517 5.035 40 0 FKABRN COc1ccc(NC(=O)C2(c3ccccc3F)CCCC2)c2ccccc12 ZINC000225682388 571055457 /nfs/dbraw/zinc/05/54/57/571055457.db2.gz LSXHKWSOCOVICH-UHFFFAOYSA-N 0 0 363.432 5.438 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cccc(Cl)c1C ZINC000225683591 571055416 /nfs/dbraw/zinc/05/54/16/571055416.db2.gz QNKJQBVBBBPLHE-HXUWFJFHSA-N 0 0 357.881 5.323 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1cccc(Cl)c1C ZINC000225683614 571055436 /nfs/dbraw/zinc/05/54/36/571055436.db2.gz QNKJQBVBBBPLHE-FQEVSTJZSA-N 0 0 357.881 5.323 40 0 FKABRN COc1ccc(NC(=O)C2(c3ccc(F)cc3)CCCC2)c2ccccc12 ZINC000225683996 571055497 /nfs/dbraw/zinc/05/54/97/571055497.db2.gz PPLNLXLNVLQVPQ-UHFFFAOYSA-N 0 0 363.432 5.438 40 0 FKABRN CCO[C@@](C)(CC)C(=O)Nc1cc(C)c(OCc2ccccc2)c(C)c1 ZINC000225686836 571055872 /nfs/dbraw/zinc/05/58/72/571055872.db2.gz HQTXWGLLFWSGIU-QFIPXVFZSA-N 0 0 355.478 5.026 40 0 FKABRN CCO[C@](C)(CC)C(=O)Nc1cc(C)c(OCc2ccccc2)c(C)c1 ZINC000225686866 571055825 /nfs/dbraw/zinc/05/58/25/571055825.db2.gz HQTXWGLLFWSGIU-JOCHJYFZSA-N 0 0 355.478 5.026 40 0 FKABRN CCO[C@@](C)(CC(C)C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000225687857 571055895 /nfs/dbraw/zinc/05/58/95/571055895.db2.gz ZWYZXDIBPJUJFU-QFIPXVFZSA-N 0 0 355.478 5.045 40 0 FKABRN CCO[C@](C)(CC(C)C)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000225687884 571055865 /nfs/dbraw/zinc/05/58/65/571055865.db2.gz ZWYZXDIBPJUJFU-JOCHJYFZSA-N 0 0 355.478 5.045 40 0 FKABRN CCO[C@@](C)(CC(C)C)C(=O)Nc1ccc(OCc2ccccc2)c(C)c1 ZINC000225690271 571056261 /nfs/dbraw/zinc/05/62/61/571056261.db2.gz HHJHFIKCGZMCOZ-QHCPKHFHSA-N 0 0 369.505 5.354 40 0 FKABRN CCO[C@](C)(CC(C)C)C(=O)Nc1ccc(OCc2ccccc2)c(C)c1 ZINC000225690296 571056221 /nfs/dbraw/zinc/05/62/21/571056221.db2.gz HHJHFIKCGZMCOZ-HSZRJFAPSA-N 0 0 369.505 5.354 40 0 FKABRN O=C(NCCSCc1ccccc1Cl)C1(c2ccccc2)CCCC1 ZINC000225691237 571056179 /nfs/dbraw/zinc/05/61/79/571056179.db2.gz STJKXFJCGBDUCP-UHFFFAOYSA-N 0 0 373.949 5.201 40 0 FKABRN CCC[C@@](C)(OCC)C(=O)Nc1ccc(OCc2ccccc2)c(C)c1 ZINC000225694263 571056168 /nfs/dbraw/zinc/05/61/68/571056168.db2.gz NTQAVNHFBLIPGF-JOCHJYFZSA-N 0 0 355.478 5.108 40 0 FKABRN CCC[C@](C)(OCC)C(=O)Nc1ccc(OCc2ccccc2)c(C)c1 ZINC000225694279 571056616 /nfs/dbraw/zinc/05/66/16/571056616.db2.gz NTQAVNHFBLIPGF-QFIPXVFZSA-N 0 0 355.478 5.108 40 0 FKABRN CCC[C@@](C)(OCC)C(=O)Nc1cc(C)c(OCc2ccccc2)c(C)c1 ZINC000225694857 571056682 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WTYYCIJQQTVLFN-CQSZACIVSA-N 0 0 361.869 5.186 40 0 FKABRN COc1ccc(NC(=O)[C@H](C)Oc2cc(C)ccc2C(C)C)cc1Cl ZINC000225697353 571056506 /nfs/dbraw/zinc/05/65/06/571056506.db2.gz WTYYCIJQQTVLFN-AWEZNQCLSA-N 0 0 361.869 5.186 40 0 FKABRN CCOC(CC(C)C)(CC(C)C)C(=O)Nc1ccc(OC)c(Cl)c1 ZINC000225697445 571056587 /nfs/dbraw/zinc/05/65/87/571056587.db2.gz GJZKBBGXNJVCGI-UHFFFAOYSA-N 0 0 355.906 5.155 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2ccc(C)cc2C)c2ccccc2)c1 ZINC000225697532 206494337 /nfs/dbraw/zinc/49/43/37/206494337.db2.gz ABBVKOBKWGKVMA-QFIPXVFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2ccc(C)cc2C)c2ccccc2)c1 ZINC000225697563 571056669 /nfs/dbraw/zinc/05/66/69/571056669.db2.gz ABBVKOBKWGKVMA-JOCHJYFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2cc(C)ccc2C)c2ccccc2)c1 ZINC000225697597 571056474 /nfs/dbraw/zinc/05/64/74/571056474.db2.gz VAHIWFQUJUGUIX-QFIPXVFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2cc(C)ccc2C)c2ccccc2)c1 ZINC000225697620 571056544 /nfs/dbraw/zinc/05/65/44/571056544.db2.gz VAHIWFQUJUGUIX-JOCHJYFZSA-N 0 0 360.526 5.688 40 0 FKABRN CCOc1ccc(NC(=O)C(CC(C)C)(CC(C)C)OCC)cc1Cl ZINC000225697631 571056928 /nfs/dbraw/zinc/05/69/28/571056928.db2.gz SJWWOJLRPHQHQT-UHFFFAOYSA-N 0 0 369.933 5.545 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2cc(C)cc(C)c2)c2ccccc2)c1 ZINC000225697660 206494279 /nfs/dbraw/zinc/49/42/79/206494279.db2.gz GOXSZONODZYJAW-QFIPXVFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2cc(C)cc(C)c2)c2ccccc2)c1 ZINC000225697684 571057000 /nfs/dbraw/zinc/05/70/00/571057000.db2.gz GOXSZONODZYJAW-JOCHJYFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2ccc(C)c(C)c2)c2ccccc2)c1 ZINC000225697723 571056790 /nfs/dbraw/zinc/05/67/90/571056790.db2.gz SEWQDZPGOQBGDS-QFIPXVFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2ccc(C)c(C)c2)c2ccccc2)c1 ZINC000225697754 571056955 /nfs/dbraw/zinc/05/69/55/571056955.db2.gz SEWQDZPGOQBGDS-JOCHJYFZSA-N 0 0 360.526 5.688 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2ccc(C(C)C)cc2)c2ccccc2)c1 ZINC000225697796 571056946 /nfs/dbraw/zinc/05/69/46/571056946.db2.gz LOSPGZRQUSXDMB-QHCPKHFHSA-N 0 0 374.553 6.194 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2ccc(C(C)C)cc2)c2ccccc2)c1 ZINC000225697822 571056903 /nfs/dbraw/zinc/05/69/03/571056903.db2.gz LOSPGZRQUSXDMB-HSZRJFAPSA-N 0 0 374.553 6.194 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)CSCc1ccc(Cl)cc1F ZINC000225697858 571057014 /nfs/dbraw/zinc/05/70/14/571057014.db2.gz SHYIQXBSDVYBHO-UHFFFAOYSA-N 0 0 358.265 5.313 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2ccccc2Cl)c2ccccc2)c1 ZINC000225697861 571056757 /nfs/dbraw/zinc/05/67/57/571056757.db2.gz JDUWLIJRMBWPTN-FQEVSTJZSA-N 0 0 366.917 5.724 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2ccccc2Cl)c2ccccc2)c1 ZINC000225697880 571056752 /nfs/dbraw/zinc/05/67/52/571056752.db2.gz JDUWLIJRMBWPTN-HXUWFJFHSA-N 0 0 366.917 5.724 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2cccc(Cl)c2)c2ccccc2)c1 ZINC000225697912 571056961 /nfs/dbraw/zinc/05/69/61/571056961.db2.gz FGRVFDSFXLQACP-FQEVSTJZSA-N 0 0 366.917 5.724 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2cccc(Cl)c2)c2ccccc2)c1 ZINC000225697934 571056995 /nfs/dbraw/zinc/05/69/95/571056995.db2.gz FGRVFDSFXLQACP-HXUWFJFHSA-N 0 0 366.917 5.724 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2ccc(Cl)cc2)c2ccccc2)c1 ZINC000225697976 571056833 /nfs/dbraw/zinc/05/68/33/571056833.db2.gz DDXMDKWPCYKVPF-FQEVSTJZSA-N 0 0 366.917 5.724 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2ccc(Cl)cc2)c2ccccc2)c1 ZINC000225698000 571056837 /nfs/dbraw/zinc/05/68/37/571056837.db2.gz DDXMDKWPCYKVPF-HXUWFJFHSA-N 0 0 366.917 5.724 40 0 FKABRN COc1cccc(NC(=S)N[C@@H](c2ccccc2)c2cccc(C)c2)c1 ZINC000225698159 571056749 /nfs/dbraw/zinc/05/67/49/571056749.db2.gz SMCQWIGGDBGBQX-NRFANRHFSA-N 0 0 362.498 5.080 40 0 FKABRN COc1cccc(NC(=S)N[C@H](c2ccccc2)c2cccc(C)c2)c1 ZINC000225698183 571056881 /nfs/dbraw/zinc/05/68/81/571056881.db2.gz SMCQWIGGDBGBQX-OAQYLSRUSA-N 0 0 362.498 5.080 40 0 FKABRN COc1ccc(NC(=S)N[C@@H](c2ccccc2)c2cccc(C)c2)cc1 ZINC000225698214 206494176 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0 0 350.462 5.210 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2ccc(F)cc2F)c2ccccc2)c1 ZINC000225699418 222861739 /nfs/dbraw/zinc/86/17/39/222861739.db2.gz AJQMBKVGVVLBPH-FQEVSTJZSA-N 0 0 368.452 5.349 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2ccc(F)cc2F)c2ccccc2)c1 ZINC000225699443 571056886 /nfs/dbraw/zinc/05/68/86/571056886.db2.gz AJQMBKVGVVLBPH-HXUWFJFHSA-N 0 0 368.452 5.349 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2c(F)cccc2F)c2ccccc2)c1 ZINC000225699799 571057024 /nfs/dbraw/zinc/05/70/24/571057024.db2.gz PWJKJLBVSPFFNK-IBGZPJMESA-N 0 0 368.452 5.349 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2c(F)cccc2F)c2ccccc2)c1 ZINC000225699824 571056814 /nfs/dbraw/zinc/05/68/14/571056814.db2.gz PWJKJLBVSPFFNK-LJQANCHMSA-N 0 0 368.452 5.349 40 0 FKABRN Cc1cccc([C@@H](NC(=S)Nc2ccc(F)c(F)c2)c2ccccc2)c1 ZINC000225699863 571056781 /nfs/dbraw/zinc/05/67/81/571056781.db2.gz WQMFCCHSPSZEJD-FQEVSTJZSA-N 0 0 368.452 5.349 40 0 FKABRN Cc1cccc([C@H](NC(=S)Nc2ccc(F)c(F)c2)c2ccccc2)c1 ZINC000225699886 206494367 /nfs/dbraw/zinc/49/43/67/206494367.db2.gz WQMFCCHSPSZEJD-HXUWFJFHSA-N 0 0 368.452 5.349 40 0 FKABRN CCCC[C@@](C)(OCC)C(=O)Nc1ccc(OCc2ccccc2)c(C)c1 ZINC000225700758 571056769 /nfs/dbraw/zinc/05/67/69/571056769.db2.gz ZKUITJYALIPEEY-HSZRJFAPSA-N 0 0 369.505 5.498 40 0 FKABRN CCCC[C@](C)(OCC)C(=O)Nc1ccc(OCc2ccccc2)c(C)c1 ZINC000225700781 222862098 /nfs/dbraw/zinc/86/20/98/222862098.db2.gz ZKUITJYALIPEEY-QHCPKHFHSA-N 0 0 369.505 5.498 40 0 FKABRN COc1ccc2c(c1)CCC[C@@H]2NC(=S)Nc1ccc(C(C)C)cc1 ZINC000225702281 571057364 /nfs/dbraw/zinc/05/73/64/571057364.db2.gz DAMDHEZIPNOFBA-FQEVSTJZSA-N 0 0 354.519 5.183 40 0 FKABRN COc1ccc2c(c1)CCC[C@H]2NC(=S)Nc1ccc(C(C)C)cc1 ZINC000225702295 571057340 /nfs/dbraw/zinc/05/73/40/571057340.db2.gz DAMDHEZIPNOFBA-HXUWFJFHSA-N 0 0 354.519 5.183 40 0 FKABRN CCCCC[C@@](C)(OCC)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000225702345 571057254 /nfs/dbraw/zinc/05/72/54/571057254.db2.gz LUEUSFVRURCSKP-HSZRJFAPSA-N 0 0 369.505 5.580 40 0 FKABRN CCCCC[C@](C)(OCC)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000225702359 571057393 /nfs/dbraw/zinc/05/73/93/571057393.db2.gz LUEUSFVRURCSKP-QHCPKHFHSA-N 0 0 369.505 5.580 40 0 FKABRN COc1ccc2c(c1)CCC[C@@H]2NC(=S)Nc1ccc(C)c(Cl)c1 ZINC000225703059 571057378 /nfs/dbraw/zinc/05/73/78/571057378.db2.gz YRBSQONDSXORLD-SFHVURJKSA-N 0 0 360.910 5.021 40 0 FKABRN COc1ccc2c(c1)CCC[C@H]2NC(=S)Nc1ccc(C)c(Cl)c1 ZINC000225703085 571057336 /nfs/dbraw/zinc/05/73/36/571057336.db2.gz YRBSQONDSXORLD-GOSISDBHSA-N 0 0 360.910 5.021 40 0 FKABRN CCCCC[C@@](C)(OCC)C(=O)Nc1ccc(OC2CCCC2)c(C)c1 ZINC000225704736 206494291 /nfs/dbraw/zinc/49/42/91/206494291.db2.gz GVZMGGHTNLCPQA-JOCHJYFZSA-N 0 0 361.526 5.630 40 0 FKABRN CCCCC[C@](C)(OCC)C(=O)Nc1ccc(OC2CCCC2)c(C)c1 ZINC000225704762 571057635 /nfs/dbraw/zinc/05/76/35/571057635.db2.gz GVZMGGHTNLCPQA-QFIPXVFZSA-N 0 0 361.526 5.630 40 0 FKABRN CC[C@@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(OC)c(C)c1 ZINC000225705015 222861866 /nfs/dbraw/zinc/86/18/66/222861866.db2.gz NQJPTYMZJLEENU-OAQYLSRUSA-N 0 0 367.533 5.501 40 0 FKABRN CC[C@H](NC(=O)CCc1ccc(C(C)(C)C)cc1)c1ccc(OC)c(C)c1 ZINC000225705039 571057684 /nfs/dbraw/zinc/05/76/84/571057684.db2.gz NQJPTYMZJLEENU-NRFANRHFSA-N 0 0 367.533 5.501 40 0 FKABRN CCCCC[C@@](C)(OCC)C(=O)Nc1cc(C)c(OCCCC)c(C)c1 ZINC000225705117 571057735 /nfs/dbraw/zinc/05/77/35/571057735.db2.gz CQXWRXZSEZMUBN-JOCHJYFZSA-N 0 0 363.542 5.796 40 0 FKABRN CCCCC[C@](C)(OCC)C(=O)Nc1cc(C)c(OCCCC)c(C)c1 ZINC000225705144 206494842 /nfs/dbraw/zinc/49/48/42/206494842.db2.gz CQXWRXZSEZMUBN-QFIPXVFZSA-N 0 0 363.542 5.796 40 0 FKABRN CCCCC[C@@](C)(OCC)C(=O)Nc1cc(C)c(O[C@@H](C)CC)c(C)c1 ZINC000225705182 571057761 /nfs/dbraw/zinc/05/77/61/571057761.db2.gz VGMIENIVHSNCAB-PGRDOPGGSA-N 0 0 363.542 5.795 40 0 FKABRN CCCCC[C@](C)(OCC)C(=O)Nc1cc(C)c(O[C@@H](C)CC)c(C)c1 ZINC000225705213 206494384 /nfs/dbraw/zinc/49/43/84/206494384.db2.gz VGMIENIVHSNCAB-AVRDEDQJSA-N 0 0 363.542 5.795 40 0 FKABRN CCCCC[C@@](C)(OCC)C(=O)Nc1cc(C)c(O[C@H](C)CC)c(C)c1 ZINC000225705236 571057753 /nfs/dbraw/zinc/05/77/53/571057753.db2.gz VGMIENIVHSNCAB-XMSQKQJNSA-N 0 0 363.542 5.795 40 0 FKABRN CCCCC[C@](C)(OCC)C(=O)Nc1cc(C)c(O[C@H](C)CC)c(C)c1 ZINC000225705268 222862059 /nfs/dbraw/zinc/86/20/59/222862059.db2.gz VGMIENIVHSNCAB-GCJKJVERSA-N 0 0 363.542 5.795 40 0 FKABRN CCCCC[C@@](C)(OCC)C(=O)Nc1cc(C)c(OCC(C)C)c(C)c1 ZINC000225705309 571057688 /nfs/dbraw/zinc/05/76/88/571057688.db2.gz WRUMBBJZQBYGMM-JOCHJYFZSA-N 0 0 363.542 5.652 40 0 FKABRN CCCCC[C@](C)(OCC)C(=O)Nc1cc(C)c(OCC(C)C)c(C)c1 ZINC000225705335 571057756 /nfs/dbraw/zinc/05/77/56/571057756.db2.gz WRUMBBJZQBYGMM-QFIPXVFZSA-N 0 0 363.542 5.652 40 0 FKABRN CCCCC[C@@](C)(OCC)C(=O)Nc1ccc(OCCC)c(Cl)c1 ZINC000225705829 206493957 /nfs/dbraw/zinc/49/39/57/206493957.db2.gz PPZPZRJVJZELKW-LJQANCHMSA-N 0 0 355.906 5.443 40 0 FKABRN CCCCC[C@](C)(OCC)C(=O)Nc1ccc(OCCC)c(Cl)c1 ZINC000225705855 571057664 /nfs/dbraw/zinc/05/76/64/571057664.db2.gz PPZPZRJVJZELKW-IBGZPJMESA-N 0 0 355.906 5.443 40 0 FKABRN 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/nfs/dbraw/zinc/06/69/18/571066918.db2.gz PRTWZBGITAFMMC-OPAMFIHVSA-N 0 0 357.494 5.407 40 0 FKABRN CC[C@H](C)Oc1ccc(NC(=O)[C@@](C)(CC(C)C)OC)c2ccccc12 ZINC000225794317 571066885 /nfs/dbraw/zinc/06/68/85/571066885.db2.gz PRTWZBGITAFMMC-KSFYIVLOSA-N 0 0 357.494 5.407 40 0 FKABRN CC[C@@H](C)Oc1ccc(NC(=O)[C@](C)(CC(C)C)OC)c2ccccc12 ZINC000225794335 206500048 /nfs/dbraw/zinc/50/00/48/206500048.db2.gz PRTWZBGITAFMMC-ZHRRBRCNSA-N 0 0 357.494 5.407 40 0 FKABRN CC[C@H](C)Oc1ccc(NC(=O)[C@](C)(CC(C)C)OC)c2ccccc12 ZINC000225794365 206500467 /nfs/dbraw/zinc/50/04/67/206500467.db2.gz PRTWZBGITAFMMC-AOMKIAJQSA-N 0 0 357.494 5.407 40 0 FKABRN CO[C@@](C)(CC(C)C)C(=O)Nc1ccc(OCC(C)C)c2ccccc12 ZINC000225794401 571066958 /nfs/dbraw/zinc/06/69/58/571066958.db2.gz HRSFLYOALJZFPH-QFIPXVFZSA-N 0 0 357.494 5.264 40 0 FKABRN CO[C@](C)(CC(C)C)C(=O)Nc1ccc(OCC(C)C)c2ccccc12 ZINC000225794425 571066931 /nfs/dbraw/zinc/06/69/31/571066931.db2.gz HRSFLYOALJZFPH-JOCHJYFZSA-N 0 0 357.494 5.264 40 0 FKABRN COc1cc(C)c(S(=O)(=O)Nc2cccc3ccccc32)cc1C(C)C ZINC000225794710 571066872 /nfs/dbraw/zinc/06/68/72/571066872.db2.gz ZNBKPHZEHFHMIB-UHFFFAOYSA-N 0 0 369.486 5.081 40 0 FKABRN COc1ccc(NC(=O)C(CC(C)C)(CC(C)C)OC)c2ccccc12 ZINC000225799039 571067334 /nfs/dbraw/zinc/06/73/34/571067334.db2.gz CXYYNMRAWKRZOB-UHFFFAOYSA-N 0 0 357.494 5.264 40 0 FKABRN CCOc1ccc(NC(=O)C(CC(C)C)(CC(C)C)OC)c2ccccc12 ZINC000225799065 571067256 /nfs/dbraw/zinc/06/72/56/571067256.db2.gz LJMYNWXUFPCOOZ-UHFFFAOYSA-N 0 0 371.521 5.654 40 0 FKABRN CCCCOc1ccc(NC(=O)[C@@](C)(CCCC)OC)c2ccccc12 ZINC000225801142 222869293 /nfs/dbraw/zinc/86/92/93/222869293.db2.gz MKIBRQJTEUQUJI-JOCHJYFZSA-N 0 0 357.494 5.553 40 0 FKABRN CCCCOc1ccc(NC(=O)[C@](C)(CCCC)OC)c2ccccc12 ZINC000225801166 571067239 /nfs/dbraw/zinc/06/72/39/571067239.db2.gz MKIBRQJTEUQUJI-QFIPXVFZSA-N 0 0 357.494 5.553 40 0 FKABRN CCCC[C@@](C)(OC)C(=O)Nc1ccc(O[C@@H](C)CC)c2ccccc12 ZINC000225801197 571067365 /nfs/dbraw/zinc/06/73/65/571067365.db2.gz BYODNHRMXRZCSZ-KSFYIVLOSA-N 0 0 357.494 5.551 40 0 FKABRN CCCC[C@](C)(OC)C(=O)Nc1ccc(O[C@@H](C)CC)c2ccccc12 ZINC000225801214 222869752 /nfs/dbraw/zinc/86/97/52/222869752.db2.gz BYODNHRMXRZCSZ-AOMKIAJQSA-N 0 0 357.494 5.551 40 0 FKABRN CCCC[C@@](C)(OC)C(=O)Nc1ccc(O[C@H](C)CC)c2ccccc12 ZINC000225801238 571067361 /nfs/dbraw/zinc/06/73/61/571067361.db2.gz BYODNHRMXRZCSZ-OPAMFIHVSA-N 0 0 357.494 5.551 40 0 FKABRN CCCC[C@](C)(OC)C(=O)Nc1ccc(O[C@H](C)CC)c2ccccc12 ZINC000225801262 571067234 /nfs/dbraw/zinc/06/72/34/571067234.db2.gz BYODNHRMXRZCSZ-ZHRRBRCNSA-N 0 0 357.494 5.551 40 0 FKABRN CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccc(F)c(Cl)c1 ZINC000225801280 571067247 /nfs/dbraw/zinc/06/72/47/571067247.db2.gz ZLLAFDSEQSYFSP-LJQANCHMSA-N 0 0 361.844 5.154 40 0 FKABRN CCCC[C@@](C)(OC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12 ZINC000225801299 571067175 /nfs/dbraw/zinc/06/71/75/571067175.db2.gz FXQYWPOWZNCWGC-JOCHJYFZSA-N 0 0 357.494 5.408 40 0 FKABRN CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)Nc1ccc(F)c(Cl)c1 ZINC000225801305 571067352 /nfs/dbraw/zinc/06/73/52/571067352.db2.gz ZLLAFDSEQSYFSP-IBGZPJMESA-N 0 0 361.844 5.154 40 0 FKABRN CCCC[C@](C)(OC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12 ZINC000225801322 571067370 /nfs/dbraw/zinc/06/73/70/571067370.db2.gz FXQYWPOWZNCWGC-QFIPXVFZSA-N 0 0 357.494 5.408 40 0 FKABRN CCCCC[C@@](C)(OC)C(=O)Nc1ccc(OCC)c(C(F)(F)F)c1 ZINC000225801407 571067304 /nfs/dbraw/zinc/06/73/04/571067304.db2.gz GPOIZWSCXGPZRD-QGZVFWFLSA-N 0 0 361.404 5.028 40 0 FKABRN CCCCC[C@](C)(OC)C(=O)Nc1ccc(OCC)c(C(F)(F)F)c1 ZINC000225801435 571067260 /nfs/dbraw/zinc/06/72/60/571067260.db2.gz GPOIZWSCXGPZRD-KRWDZBQOSA-N 0 0 361.404 5.028 40 0 FKABRN COc1ccc(SCCCNC(=S)Nc2ccc(C(C)C)cc2)cc1 ZINC000225802324 571067658 /nfs/dbraw/zinc/06/76/58/571067658.db2.gz ZCQWSQQKVJQPRC-UHFFFAOYSA-N 0 0 374.575 5.287 40 0 FKABRN CCCCC[C@@](C)(OC)C(=O)Nc1ccc(OCCC)c2ccccc12 ZINC000225803324 571067662 /nfs/dbraw/zinc/06/76/62/571067662.db2.gz LCNBPZGQOYHOFB-JOCHJYFZSA-N 0 0 357.494 5.553 40 0 FKABRN CCCCC[C@](C)(OC)C(=O)Nc1ccc(OCCC)c2ccccc12 ZINC000225803342 571067637 /nfs/dbraw/zinc/06/76/37/571067637.db2.gz LCNBPZGQOYHOFB-QFIPXVFZSA-N 0 0 357.494 5.553 40 0 FKABRN CCCCC[C@@](C)(OC)C(=O)Nc1ccc(OC(C)C)c2ccccc12 ZINC000225803382 571067612 /nfs/dbraw/zinc/06/76/12/571067612.db2.gz IODULDLISRFZLL-JOCHJYFZSA-N 0 0 357.494 5.551 40 0 FKABRN CCCCC[C@](C)(OC)C(=O)Nc1ccc(OC(C)C)c2ccccc12 ZINC000225803400 571067629 /nfs/dbraw/zinc/06/76/29/571067629.db2.gz IODULDLISRFZLL-QFIPXVFZSA-N 0 0 357.494 5.551 40 0 FKABRN CCCCC[C@@](C)(OC)C(=O)Nc1ccc(OCCCC)c2ccccc12 ZINC000225803429 571067617 /nfs/dbraw/zinc/06/76/17/571067617.db2.gz GRMCSPGQMJUWIJ-HSZRJFAPSA-N 0 0 371.521 5.943 40 0 FKABRN CCCCC[C@](C)(OC)C(=O)Nc1ccc(OCCCC)c2ccccc12 ZINC000225803454 571067673 /nfs/dbraw/zinc/06/76/73/571067673.db2.gz GRMCSPGQMJUWIJ-QHCPKHFHSA-N 0 0 371.521 5.943 40 0 FKABRN CCCCC[C@@](C)(OC)C(=O)Nc1ccc(O[C@@H](C)CC)c2ccccc12 ZINC000225803476 571067687 /nfs/dbraw/zinc/06/76/87/571067687.db2.gz RFRKTVYGTWDEEF-GAJHUEQPSA-N 0 0 371.521 5.941 40 0 FKABRN CCCCC[C@](C)(OC)C(=O)Nc1ccc(O[C@@H](C)CC)c2ccccc12 ZINC000225803499 571067623 /nfs/dbraw/zinc/06/76/23/571067623.db2.gz RFRKTVYGTWDEEF-SBUREZEXSA-N 0 0 371.521 5.941 40 0 FKABRN CCCCC[C@@](C)(OC)C(=O)Nc1ccc(O[C@H](C)CC)c2ccccc12 ZINC000225803524 571067604 /nfs/dbraw/zinc/06/76/04/571067604.db2.gz RFRKTVYGTWDEEF-UZUQRXQVSA-N 0 0 371.521 5.941 40 0 FKABRN CCCCC[C@](C)(OC)C(=O)Nc1ccc(O[C@H](C)CC)c2ccccc12 ZINC000225803547 222870657 /nfs/dbraw/zinc/87/06/57/222870657.db2.gz RFRKTVYGTWDEEF-HXOBKFHXSA-N 0 0 371.521 5.941 40 0 FKABRN CCCCC[C@@](C)(OC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12 ZINC000225803571 206500184 /nfs/dbraw/zinc/50/01/84/206500184.db2.gz UHEQWBUXLSKZSP-HSZRJFAPSA-N 0 0 371.521 5.799 40 0 FKABRN CCCCC[C@](C)(OC)C(=O)Nc1ccc(OCC(C)C)c2ccccc12 ZINC000225803585 571067708 /nfs/dbraw/zinc/06/77/08/571067708.db2.gz UHEQWBUXLSKZSP-QHCPKHFHSA-N 0 0 371.521 5.799 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@@H](C)Oc1cccc2c1CCCC2 ZINC000225804215 571067671 /nfs/dbraw/zinc/06/76/71/571067671.db2.gz JWZCPLKMONGNLN-MRXNPFEDSA-N 0 0 351.490 5.096 40 0 FKABRN CCc1cccc(CC)c1NC(=O)[C@H](C)Oc1cccc2c1CCCC2 ZINC000225804233 209837362 /nfs/dbraw/zinc/83/73/62/209837362.db2.gz JWZCPLKMONGNLN-INIZCTEOSA-N 0 0 351.490 5.096 40 0 FKABRN CCCCOc1ccc(NC(=O)C2(OC)CCCCC2)c2ccccc12 ZINC000225805942 571068150 /nfs/dbraw/zinc/06/81/50/571068150.db2.gz CNODFNUGFBLQGD-UHFFFAOYSA-N 0 0 355.478 5.307 40 0 FKABRN CC[C@@H](C)Oc1ccc(NC(=O)C2(OC)CCCCC2)c2ccccc12 ZINC000225805971 571068037 /nfs/dbraw/zinc/06/80/37/571068037.db2.gz ZLKRGHQBRJYFJF-MRXNPFEDSA-N 0 0 355.478 5.305 40 0 FKABRN CC[C@H](C)Oc1ccc(NC(=O)C2(OC)CCCCC2)c2ccccc12 ZINC000225805996 571068161 /nfs/dbraw/zinc/06/81/61/571068161.db2.gz ZLKRGHQBRJYFJF-INIZCTEOSA-N 0 0 355.478 5.305 40 0 FKABRN COC1(C(=O)Nc2ccc(OCC(C)C)c3ccccc23)CCCCC1 ZINC000225806024 571068109 /nfs/dbraw/zinc/06/81/09/571068109.db2.gz RKAZBKPAARSUEW-UHFFFAOYSA-N 0 0 355.478 5.162 40 0 FKABRN CC(C)c1ccc(CCCNC(=S)Nc2ccc(C(C)C)cc2)cc1 ZINC000225806110 571068173 /nfs/dbraw/zinc/06/81/73/571068173.db2.gz JMTLSCAUBATCPC-UHFFFAOYSA-N 0 0 354.563 5.853 40 0 FKABRN CCOc1ccccc1NC(=S)NCCCc1ccc(C(C)C)cc1 ZINC000225806309 571068199 /nfs/dbraw/zinc/06/81/99/571068199.db2.gz QHCDYBNKKCQFCM-UHFFFAOYSA-N 0 0 356.535 5.128 40 0 FKABRN CCOc1ccc(NC(=S)NCCCc2ccc(C(C)C)cc2)cc1 ZINC000225806329 222870228 /nfs/dbraw/zinc/87/02/28/222870228.db2.gz VRIHEVBRYQXWRA-UHFFFAOYSA-N 0 0 356.535 5.128 40 0 FKABRN Cc1ccc(NC(=S)NCCCc2ccc(C(C)C)cc2)cc1Cl ZINC000225806541 571068167 /nfs/dbraw/zinc/06/81/67/571068167.db2.gz IKSBNEQAEIAFBB-UHFFFAOYSA-N 0 0 360.954 5.691 40 0 FKABRN CC(C)c1ccc(CCCNC(=S)Nc2ccc(F)c(Cl)c2)cc1 ZINC000225806791 571067952 /nfs/dbraw/zinc/06/79/52/571067952.db2.gz PFTIOXYXGOMUPN-UHFFFAOYSA-N 0 0 364.917 5.522 40 0 FKABRN CCCOc1ccc(NC(=O)C2(OC)CCCCCC2)c2ccccc12 ZINC000225806855 571068017 /nfs/dbraw/zinc/06/80/17/571068017.db2.gz CSYDZVCGVJPYIP-UHFFFAOYSA-N 0 0 355.478 5.307 40 0 FKABRN COC1(C(=O)Nc2ccc(OC(C)C)c3ccccc23)CCCCCC1 ZINC000225806877 571068060 /nfs/dbraw/zinc/06/80/60/571068060.db2.gz HCVKANSZQCZYBJ-UHFFFAOYSA-N 0 0 355.478 5.305 40 0 FKABRN CCCCOc1ccc(NC(=O)C2(OC)CCCCCC2)c2ccccc12 ZINC000225806896 209837216 /nfs/dbraw/zinc/83/72/16/209837216.db2.gz WZCKZJOUSSCBHC-UHFFFAOYSA-N 0 0 369.505 5.697 40 0 FKABRN CC[C@@H](C)Oc1ccc(NC(=O)C2(OC)CCCCCC2)c2ccccc12 ZINC000225806921 222870237 /nfs/dbraw/zinc/87/02/37/222870237.db2.gz UJOHLJQXGGCHIF-QGZVFWFLSA-N 0 0 369.505 5.695 40 0 FKABRN CC[C@H](C)Oc1ccc(NC(=O)C2(OC)CCCCCC2)c2ccccc12 ZINC000225806941 571068030 /nfs/dbraw/zinc/06/80/30/571068030.db2.gz UJOHLJQXGGCHIF-KRWDZBQOSA-N 0 0 369.505 5.695 40 0 FKABRN COC1(C(=O)Nc2ccc(OCC(C)C)c3ccccc23)CCCCCC1 ZINC000225806960 222870193 /nfs/dbraw/zinc/87/01/93/222870193.db2.gz KJCKUIRNOHLRLS-UHFFFAOYSA-N 0 0 369.505 5.553 40 0 FKABRN CCOc1cccc(NC(=S)NCCCc2ccc(C(C)C)cc2)c1 ZINC000225807119 571068020 /nfs/dbraw/zinc/06/80/20/571068020.db2.gz FYTYYDUOQJWSPV-UHFFFAOYSA-N 0 0 356.535 5.128 40 0 FKABRN CC(C)Oc1ccc(NC(=S)NCCCc2ccc(C(C)C)cc2)cc1 ZINC000225807401 206501097 /nfs/dbraw/zinc/50/10/97/206501097.db2.gz LCYMVMBIYNTLMR-UHFFFAOYSA-N 0 0 370.562 5.516 40 0 FKABRN CC(C)Oc1cccc(NC(=S)NCCCc2ccc(C(C)C)cc2)c1 ZINC000225807431 222870048 /nfs/dbraw/zinc/87/00/48/222870048.db2.gz KKJAFUMDKXJYCE-UHFFFAOYSA-N 0 0 370.562 5.516 40 0 FKABRN CC(C)c1ccc(NC(=O)CCc2nc(-c3cccc(Cl)c3)no2)cc1 ZINC000225808010 571068568 /nfs/dbraw/zinc/06/85/68/571068568.db2.gz VIGUOKOXTHNDKJ-UHFFFAOYSA-N 0 0 369.852 5.085 40 0 FKABRN CC(C)c1ccc(NC(=S)NCCCc2cccc3ccccc32)cc1 ZINC000225808081 571068540 /nfs/dbraw/zinc/06/85/40/571068540.db2.gz IVVIBRITHPUDNO-UHFFFAOYSA-N 0 0 362.542 5.882 40 0 FKABRN S=C(NCCCc1cccc2ccccc21)Nc1ccccc1Cl ZINC000225808108 571068591 /nfs/dbraw/zinc/06/85/91/571068591.db2.gz KTXKMGCDBXPOCL-UHFFFAOYSA-N 0 0 354.906 5.412 40 0 FKABRN S=C(NCCCc1cccc2ccccc21)Nc1cccc(Cl)c1 ZINC000225808131 209837514 /nfs/dbraw/zinc/83/75/14/209837514.db2.gz GWPRUDWTOGNZKU-UHFFFAOYSA-N 0 0 354.906 5.412 40 0 FKABRN S=C(NCCCc1cccc2ccccc21)Nc1ccc(Cl)cc1 ZINC000225808155 206500925 /nfs/dbraw/zinc/50/09/25/206500925.db2.gz DFXNITLWRKITKZ-UHFFFAOYSA-N 0 0 354.906 5.412 40 0 FKABRN CCOc1ccccc1NC(=S)NCCCc1cccc2ccccc21 ZINC000225808257 571068501 /nfs/dbraw/zinc/06/85/01/571068501.db2.gz SOBHFEQGISEATJ-UHFFFAOYSA-N 0 0 364.514 5.158 40 0 FKABRN CCOc1ccc(NC(=S)NCCCc2cccc3ccccc32)cc1 ZINC000225808280 571068576 /nfs/dbraw/zinc/06/85/76/571068576.db2.gz QDSHCVSEIRVVLN-UHFFFAOYSA-N 0 0 364.514 5.158 40 0 FKABRN Cc1ccc(NC(=S)NCCCc2cccc3ccccc32)cc1Cl ZINC000225808487 571068504 /nfs/dbraw/zinc/06/85/04/571068504.db2.gz XAPSKIUSBNKPPN-UHFFFAOYSA-N 0 0 368.933 5.721 40 0 FKABRN Fc1ccc(NC(=S)NCCCc2cccc3ccccc32)cc1Cl ZINC000225808680 206501479 /nfs/dbraw/zinc/50/14/79/206501479.db2.gz PWATYNNXMOFVAE-UHFFFAOYSA-N 0 0 372.896 5.552 40 0 FKABRN Fc1ccc(NC(=S)NCCCc2cccc3ccccc32)c(F)c1 ZINC000225808702 571068513 /nfs/dbraw/zinc/06/85/13/571068513.db2.gz RSDXCESWVUGENY-UHFFFAOYSA-N 0 0 356.441 5.037 40 0 FKABRN Fc1cccc(F)c1NC(=S)NCCCc1cccc2ccccc21 ZINC000225808842 571068593 /nfs/dbraw/zinc/06/85/93/571068593.db2.gz PXODCYKQEFDHPO-UHFFFAOYSA-N 0 0 356.441 5.037 40 0 FKABRN Fc1ccc(NC(=S)NCCCc2cccc3ccccc32)cc1F ZINC000225808900 571068606 /nfs/dbraw/zinc/06/86/06/571068606.db2.gz AZAIHCCZVGJIBB-UHFFFAOYSA-N 0 0 356.441 5.037 40 0 FKABRN CCOc1cccc(NC(=S)NCCCc2cccc3ccccc32)c1 ZINC000225808995 571068520 /nfs/dbraw/zinc/06/85/20/571068520.db2.gz ABACMEJSBIOGHN-UHFFFAOYSA-N 0 0 364.514 5.158 40 0 FKABRN O=C(COc1cccc(C(F)(F)F)c1)Nc1cc(Cl)cc(Cl)c1 ZINC000225809555 571068580 /nfs/dbraw/zinc/06/85/80/571068580.db2.gz KIXDGXRTNMZTOK-UHFFFAOYSA-N 0 0 364.150 5.030 40 0 FKABRN Cc1ccc(NC(=S)NCC2(c3ccc(F)cc3)CCCC2)c(C)c1 ZINC000225809718 571068515 /nfs/dbraw/zinc/06/85/15/571068515.db2.gz MGMIPJURYKFZEL-UHFFFAOYSA-N 0 0 356.510 5.241 40 0 FKABRN Cc1ccc(C)c(NC(=S)NCC2(c3ccc(F)cc3)CCCC2)c1 ZINC000225809742 571068609 /nfs/dbraw/zinc/06/86/09/571068609.db2.gz AVRBIZJKOSLZKH-UHFFFAOYSA-N 0 0 356.510 5.241 40 0 FKABRN Cc1cc(C)cc(NC(=S)NCC2(c3ccc(F)cc3)CCCC2)c1 ZINC000225809757 571068522 /nfs/dbraw/zinc/06/85/22/571068522.db2.gz ZIUIAFSWIAYVJV-UHFFFAOYSA-N 0 0 356.510 5.241 40 0 FKABRN Cc1ccc(NC(=S)NCC2(c3ccc(F)cc3)CCCC2)cc1C ZINC000225809773 571068488 /nfs/dbraw/zinc/06/84/88/571068488.db2.gz DFZWCDPLYOTBAR-UHFFFAOYSA-N 0 0 356.510 5.241 40 0 FKABRN CC(C)c1ccc(NC(=S)NCC2(c3ccc(F)cc3)CCCC2)cc1 ZINC000225809789 571068925 /nfs/dbraw/zinc/06/89/25/571068925.db2.gz HUYILFIHFRITAZ-UHFFFAOYSA-N 0 0 370.537 5.748 40 0 FKABRN Fc1ccc(C2(CNC(=S)Nc3ccccc3Cl)CCCC2)cc1 ZINC000225809812 571068896 /nfs/dbraw/zinc/06/88/96/571068896.db2.gz BEEVQDVYYRRZIE-UHFFFAOYSA-N 0 0 362.901 5.278 40 0 FKABRN Fc1ccc(C2(CNC(=S)Nc3cccc(Cl)c3)CCCC2)cc1 ZINC000225809837 222871190 /nfs/dbraw/zinc/87/11/90/222871190.db2.gz CBDCZHVXKSDILW-UHFFFAOYSA-N 0 0 362.901 5.278 40 0 FKABRN Fc1ccc(C2(CNC(=S)Nc3ccc(Cl)cc3)CCCC2)cc1 ZINC000225809859 571068963 /nfs/dbraw/zinc/06/89/63/571068963.db2.gz 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363.255 5.226 40 0 FKABRN CC[C@@]12CCC3=C(C1=CC[C@H]2OC(C)=O)[C@@H](C)Cc1cc(OC)ccc13 ZINC000229780163 222894948 /nfs/dbraw/zinc/89/49/48/222894948.db2.gz GIYSITPKERYJBK-NNIZRDCOSA-N 0 0 352.474 5.093 40 0 FKABRN CC[C@]12CCC3=C(C1=CC[C@H]2OC(C)=O)[C@@H](C)Cc1cc(OC)ccc13 ZINC000229780175 571095293 /nfs/dbraw/zinc/09/52/93/571095293.db2.gz GIYSITPKERYJBK-RUGFAHKUSA-N 0 0 352.474 5.093 40 0 FKABRN Cc1ccc(C(=O)c2cn(CCC[C@@H](C)F)c3ccccc23)c2ccccc12 ZINC000230602539 571319094 /nfs/dbraw/zinc/31/90/94/571319094.db2.gz UIDBGAPPHLZBPM-GOSISDBHSA-N 0 0 373.471 6.472 40 0 in-vitro FKABRN Cc1ccc(C(=O)c2cn(CCC[C@H](C)F)c3ccccc23)c2ccccc12 ZINC000230602561 571319087 /nfs/dbraw/zinc/31/90/87/571319087.db2.gz UIDBGAPPHLZBPM-SFHVURJKSA-N 0 0 373.471 6.472 40 0 in-vitro FKABRN CC[C@H](F)CCn1cc(C(=O)c2ccc(C)c3ccccc23)c2ccccc21 ZINC000230636524 571319099 /nfs/dbraw/zinc/31/90/99/571319099.db2.gz KEFSMRMUICTKBX-SFHVURJKSA-N 0 0 373.471 6.472 40 0 in-vitro FKABRN 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OUPDCYDORAMWNW-CEWLAPEOSA-N 0 0 364.485 5.258 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(F)cc2F)cc(-c2ccccc2)n1 ZINC000242688848 571316606 /nfs/dbraw/zinc/31/66/06/571316606.db2.gz CWOMYKTYCBUMKX-CYBMUJFWSA-N 0 0 354.404 5.376 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(F)cc2F)cc(-c2ccccc2)n1 ZINC000242688849 206116981 /nfs/dbraw/zinc/11/69/81/206116981.db2.gz CWOMYKTYCBUMKX-ZDUSSCGKSA-N 0 0 354.404 5.376 40 0 FKABRN COc1ccccc1CNc1cc(-c2ccccc2)nc(NC2CCCC2)n1 ZINC000242729690 571316590 /nfs/dbraw/zinc/31/65/90/571316590.db2.gz DCJQPAHGIRXCDU-UHFFFAOYSA-N 0 0 374.488 5.119 40 0 FKABRN CC(C)(C)Nc1nc(NCc2ccccc2Cl)cc(-c2ccccc2)n1 ZINC000242761232 571316636 /nfs/dbraw/zinc/31/66/36/571316636.db2.gz DMMYDKMYTADMNI-UHFFFAOYSA-N 0 0 366.896 5.620 40 0 FKABRN S=C(NCCCc1ccccc1)Nc1ccc(Nc2ccccc2)cc1 ZINC000242762062 570517573 /nfs/dbraw/zinc/51/75/73/570517573.db2.gz DMYUKODOXVGRTQ-UHFFFAOYSA-N 0 0 361.514 5.349 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(F)c(F)c2)cc(-c2ccccc2)n1 ZINC000242809282 571316632 /nfs/dbraw/zinc/31/66/32/571316632.db2.gz FINLCJSZWLLYLT-CYBMUJFWSA-N 0 0 354.404 5.376 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(F)c(F)c2)cc(-c2ccccc2)n1 ZINC000242809283 571316613 /nfs/dbraw/zinc/31/66/13/571316613.db2.gz FINLCJSZWLLYLT-ZDUSSCGKSA-N 0 0 354.404 5.376 40 0 FKABRN FC(F)(F)c1ccc(Nc2cc(-c3ccccc3)nc(NC3CC3)n2)cc1 ZINC000242830716 571316627 /nfs/dbraw/zinc/31/66/27/571316627.db2.gz FQFIOTPWLAAGHW-UHFFFAOYSA-N 0 0 370.378 5.480 40 0 FKABRN S=C(NCCCc1ccccc1)Nc1ccc(Oc2ccccc2)cc1 ZINC000242849531 571316549 /nfs/dbraw/zinc/31/65/49/571316549.db2.gz FYVADXDOAXNFKJ-UHFFFAOYSA-N 0 0 362.498 5.398 40 0 FKABRN CC(C)(C)Nc1nc(Nc2c(F)cccc2F)cc(-c2ccccc2)n1 ZINC000242855092 571316539 /nfs/dbraw/zinc/31/65/39/571316539.db2.gz GBXIVNDHQVGFKN-UHFFFAOYSA-N 0 0 354.404 5.376 40 0 FKABRN CC(C)Nc1nc(Nc2ccc(F)c(F)c2F)cc(-c2ccccc2)n1 ZINC000242874862 571316631 /nfs/dbraw/zinc/31/66/31/571316631.db2.gz GIJIJYJNTRXSGW-UHFFFAOYSA-N 0 0 358.367 5.125 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(F)c(F)c2F)cc(-c2ccccc2)n1 ZINC000242877812 571316596 /nfs/dbraw/zinc/31/65/96/571316596.db2.gz GJYXVESRHBHHDJ-UHFFFAOYSA-N 0 0 372.394 5.515 40 0 FKABRN CC[C@H](C)Nc1nc(NCc2ccc(F)cc2)cc(-c2ccccc2)n1 ZINC000242955408 571316602 /nfs/dbraw/zinc/31/66/02/571316602.db2.gz HHJUSYLMKJBNBF-HNNXBMFYSA-N 0 0 350.441 5.105 40 0 FKABRN CC[C@@H](C)Nc1nc(NCc2ccc(F)cc2)cc(-c2ccccc2)n1 ZINC000242955409 571316611 /nfs/dbraw/zinc/31/66/11/571316611.db2.gz HHJUSYLMKJBNBF-OAHLLOKOSA-N 0 0 350.441 5.105 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(Cl)cc2)cc(-c2ccccc2)n1 ZINC000242989735 206118241 /nfs/dbraw/zinc/11/82/41/206118241.db2.gz HTGGAAYEPYOLOQ-UHFFFAOYSA-N 0 0 352.869 5.751 40 0 FKABRN Fc1ccc(Nc2cc(-c3ccccc3)nc(NC3CC3)n2)cc1Cl ZINC000243036311 206118894 /nfs/dbraw/zinc/11/88/94/206118894.db2.gz IDAPCADMZNKFCO-UHFFFAOYSA-N 0 0 354.816 5.254 40 0 FKABRN Cc1ccc(OCCCC(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 ZINC000243165516 571316542 /nfs/dbraw/zinc/31/65/42/571316542.db2.gz JRTXSEJMDPFUOZ-UHFFFAOYSA-N 0 0 361.441 5.585 40 0 FKABRN Fc1ccccc1CNc1cc(-c2ccccc2)nc(NC2CCCC2)n1 ZINC000243190338 571316554 /nfs/dbraw/zinc/31/65/54/571316554.db2.gz JZIQDHYTHYCXFI-UHFFFAOYSA-N 0 0 362.452 5.249 40 0 FKABRN CC(C)Nc1nc(NCc2ccccc2Cl)cc(-c2ccccc2)n1 ZINC000243250479 222921494 /nfs/dbraw/zinc/92/14/94/222921494.db2.gz KPILJWWZJAFDHA-UHFFFAOYSA-N 0 0 352.869 5.229 40 0 FKABRN COc1ccccc1Nc1cc(-c2ccccc2)nc(NC2CCCC2)n1 ZINC000243267032 571316568 /nfs/dbraw/zinc/31/65/68/571316568.db2.gz KWKHAKSHYSKBKA-UHFFFAOYSA-N 0 0 360.461 5.250 40 0 FKABRN FC(F)(F)c1ccccc1Nc1cc(-c2ccccc2)nc(NC2CC2)n1 ZINC000243316976 206120361 /nfs/dbraw/zinc/12/03/61/206120361.db2.gz LLANZFZTOAQONC-UHFFFAOYSA-N 0 0 370.378 5.480 40 0 FKABRN COc1ccc(Cl)cc1Nc1cc(-c2ccccc2)nc(NC(C)C)n1 ZINC000243380809 209366143 /nfs/dbraw/zinc/36/61/43/209366143.db2.gz MGPZTTQFKORROF-UHFFFAOYSA-N 0 0 368.868 5.370 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccccc2Cl)cc(-c2ccccc2)n1 ZINC000243418289 571316561 /nfs/dbraw/zinc/31/65/61/571316561.db2.gz MSDPFSUYASCNNX-UHFFFAOYSA-N 0 0 352.869 5.751 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(F)c(F)c2)cc(-c2ccccc2)n1 ZINC000243504001 206120342 /nfs/dbraw/zinc/12/03/42/206120342.db2.gz NXBKFHFTGBALAO-UHFFFAOYSA-N 0 0 354.404 5.376 40 0 FKABRN CC[C@H](C)Nc1nc(NCc2ccccc2F)cc(-c2ccccc2)n1 ZINC000243526520 571316609 /nfs/dbraw/zinc/31/66/09/571316609.db2.gz OAVSGEITXUDFDG-HNNXBMFYSA-N 0 0 350.441 5.105 40 0 FKABRN CC[C@@H](C)Nc1nc(NCc2ccccc2F)cc(-c2ccccc2)n1 ZINC000243526521 206120621 /nfs/dbraw/zinc/12/06/21/206120621.db2.gz OAVSGEITXUDFDG-OAHLLOKOSA-N 0 0 350.441 5.105 40 0 FKABRN Cc1ccc(OCCCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000243758570 571316575 /nfs/dbraw/zinc/31/65/75/571316575.db2.gz QAKROSFEVVJWBZ-UHFFFAOYSA-N 0 0 371.786 5.465 40 0 FKABRN CC(C)Nc1nc(NCc2ccc(Cl)cc2)cc(-c2ccccc2)n1 ZINC000243782914 209365986 /nfs/dbraw/zinc/36/59/86/209365986.db2.gz QGHQJWDIUJTCGN-UHFFFAOYSA-N 0 0 352.869 5.229 40 0 FKABRN CC(C)(C)Nc1nc(Nc2cccc(Cl)c2)cc(-c2ccccc2)n1 ZINC000243783226 571316640 /nfs/dbraw/zinc/31/66/40/571316640.db2.gz QGMJKECAQKIVDS-UHFFFAOYSA-N 0 0 352.869 5.751 40 0 FKABRN Fc1ccc(CNc2cc(-c3ccccc3)nc(NC3CCCC3)n2)cc1 ZINC000243817334 209366192 /nfs/dbraw/zinc/36/61/92/209366192.db2.gz QTEXNURIPSSSID-UHFFFAOYSA-N 0 0 362.452 5.249 40 0 FKABRN CCOc1ccc(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)cc1 ZINC000243821788 209365607 /nfs/dbraw/zinc/36/56/07/209365607.db2.gz QVQBOVPVTMXAAM-UHFFFAOYSA-N 0 0 362.477 5.496 40 0 FKABRN Cc1ccc(Nc2cc(-c3ccccc3)nc(NC3CC3)n2)cc1Cl ZINC000243868570 571316604 /nfs/dbraw/zinc/31/66/04/571316604.db2.gz RLMCWOAZKNFNJD-UHFFFAOYSA-N 0 0 350.853 5.423 40 0 FKABRN COc1ccc(Cl)cc1Nc1cc(-c2ccccc2)nc(NC2CC2)n1 ZINC000244039715 209365925 /nfs/dbraw/zinc/36/59/25/209365925.db2.gz SXWGESQNFHMBQM-UHFFFAOYSA-N 0 0 366.852 5.124 40 0 FKABRN CC(C)(C)Nc1nc(NCc2ccccc2F)cc(-c2ccccc2)n1 ZINC000244097231 570770236 /nfs/dbraw/zinc/77/02/36/570770236.db2.gz UHCOQKWWMDDOQD-UHFFFAOYSA-N 0 0 350.441 5.105 40 0 FKABRN CC(C)Nc1nc(Nc2ccc(C(F)(F)F)cc2)cc(-c2ccccc2)n1 ZINC000244139010 209365794 /nfs/dbraw/zinc/36/57/94/209365794.db2.gz UODXYCYIDJTDOP-UHFFFAOYSA-N 0 0 372.394 5.726 40 0 FKABRN COc1cccc(Nc2cc(-c3ccccc3)nc(NC3CCCC3)n2)c1 ZINC000244144862 206119303 /nfs/dbraw/zinc/11/93/03/206119303.db2.gz URLAFOKZBWHRRV-UHFFFAOYSA-N 0 0 360.461 5.250 40 0 FKABRN CCOc1ccc(Nc2cc(-c3ccccc3)nc(N[C@@H](C)CC)n2)cc1 ZINC000244148861 571316624 /nfs/dbraw/zinc/31/66/24/571316624.db2.gz UTRSPQVSILFACD-INIZCTEOSA-N 0 0 362.477 5.496 40 0 FKABRN CCOc1ccc(Nc2cc(-c3ccccc3)nc(N[C@H](C)CC)n2)cc1 ZINC000244148862 209366350 /nfs/dbraw/zinc/36/63/50/209366350.db2.gz UTRSPQVSILFACD-MRXNPFEDSA-N 0 0 362.477 5.496 40 0 FKABRN FC(F)(F)c1cccc(Nc2cc(-c3ccccc3)nc(NC3CC3)n2)c1 ZINC000244165443 209366454 /nfs/dbraw/zinc/36/64/54/209366454.db2.gz VAKXIJOBDXNDFH-UHFFFAOYSA-N 0 0 370.378 5.480 40 0 FKABRN CC(C)Nc1nc(Nc2ccc(F)c(Cl)c2)cc(-c2ccccc2)n1 ZINC000244238627 209366399 /nfs/dbraw/zinc/36/63/99/209366399.db2.gz WFQQEPDTUQIQOA-UHFFFAOYSA-N 0 0 356.832 5.500 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(F)cc2F)cc(-c2ccccc2)n1 ZINC000244310837 571316635 /nfs/dbraw/zinc/31/66/35/571316635.db2.gz XDHDCDQDQGYXCK-UHFFFAOYSA-N 0 0 354.404 5.376 40 0 FKABRN CC(C)Nc1nc(Nc2cccc(C(F)(F)F)c2)cc(-c2ccccc2)n1 ZINC000244330321 222924949 /nfs/dbraw/zinc/92/49/49/222924949.db2.gz XNPDQLUFKUAADN-UHFFFAOYSA-N 0 0 372.394 5.726 40 0 FKABRN Cc1ccc(Cl)cc1Nc1cc(-c2ccccc2)nc(NC2CC2)n1 ZINC000244445766 571316629 /nfs/dbraw/zinc/31/66/29/571316629.db2.gz YYUQHZCSQGYDBV-UHFFFAOYSA-N 0 0 350.853 5.423 40 0 FKABRN CC(C)(C)Nc1nc(NCc2ccc(F)cc2)cc(-c2ccccc2)n1 ZINC000244474926 571316685 /nfs/dbraw/zinc/31/66/85/571316685.db2.gz ZIQGYWLNHIIGGB-UHFFFAOYSA-N 0 0 350.441 5.105 40 0 FKABRN CCCCC[C@H]1CC[C@H](c2ccc(I)cc2)CC1 ZINC000245224621 571120389 /nfs/dbraw/zinc/12/03/89/571120389.db2.gz ZVJXAYCOQJDVMP-SHTZXODSSA-N 0 0 356.291 6.145 40 0 FKABRN N#COc1ccc([C@@H]2C[C@H]3[C@@H]4C[C@H](c5ccc(OC#N)cc5)[C@@H](C4)[C@H]3C2)cc1 ZINC000245224624 571316761 /nfs/dbraw/zinc/31/67/61/571316761.db2.gz ZYDCNZOJNSJLMS-FEXDQFBZSA-N 0 0 370.452 5.340 40 0 FKABRN CCCCN=c1scc(-c2ccc(Br)cc2)n1CCCC ZINC000245242043 571316793 /nfs/dbraw/zinc/31/67/93/571316793.db2.gz XVCZAJKRKGVUHX-UHFFFAOYSA-N 0 0 367.356 5.480 40 0 FKABRN FC(F)(F)c1ccc2sc(Cc3cccc(Br)c3)nc2c1 ZINC000247663447 570481390 /nfs/dbraw/zinc/48/13/90/570481390.db2.gz USNKGIKWXHWWSL-UHFFFAOYSA-N 0 0 372.209 5.668 40 0 FKABRN O=C(CCSc1ccc(Cl)cc1)Nc1c(Cl)cccc1Cl ZINC000247806554 571316875 /nfs/dbraw/zinc/31/68/75/571316875.db2.gz ZWCXMQHSUJRMQM-UHFFFAOYSA-N 0 0 360.693 5.768 40 0 FKABRN Cc1ccc(SCCC(=O)Nc2ccc(Br)cc2F)cc1 ZINC000248034167 571317033 /nfs/dbraw/zinc/31/70/33/571317033.db2.gz REFWSYDPIQIUDC-UHFFFAOYSA-N 0 0 368.271 5.018 40 0 FKABRN CC1=C(C(=O)O[C@@H]2C[C@H](C)CC[C@H]2C(C)C)C(=O)C(c2ccccc2)N1 ZINC000248041735 571317081 /nfs/dbraw/zinc/31/70/81/571317081.db2.gz PFCVPDHSSAWHDG-FHLIZLRMSA-N 0 0 355.478 5.313 40 0 FKABRN CC1=C(C(=O)O[C@@H]2C[C@@H](C)CC[C@H]2C(C)C)C(=O)C(c2ccccc2)N1 ZINC000248041740 571316999 /nfs/dbraw/zinc/31/69/99/571316999.db2.gz PFCVPDHSSAWHDG-JCGIZDLHSA-N 0 0 355.478 5.313 40 0 FKABRN CC[C@H]1CC[C@H](C2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1 ZINC000248167172 568413789 /nfs/dbraw/zinc/41/37/89/568413789.db2.gz PBIFTROFCZATFC-MJYONLJCSA-N 0 0 354.456 7.075 40 0 FKABRN CC(=O)Oc1ccc(O)c(C[C@]2(C)[C@H](C)CC[C@]3(C)C(C)=CCC[C@@H]23)c1 ZINC000248329668 571317291 /nfs/dbraw/zinc/31/72/91/571317291.db2.gz DRSPVCXBVVVLIJ-HKDUHGGJSA-N 0 0 356.506 5.659 40 0 FKABRN CC(=O)Oc1ccc(O)c(C[C@]2(C)[C@H](C)CC[C@@]3(C)C(C)=CCC[C@H]32)c1 ZINC000248329670 571317282 /nfs/dbraw/zinc/31/72/82/571317282.db2.gz DRSPVCXBVVVLIJ-LTFXSFKNSA-N 0 0 356.506 5.659 40 0 FKABRN CC(=O)Oc1ccc(O)c(C[C@]2(C)[C@H](C)CC[C@]3(C)C(C)=CCC[C@H]23)c1 ZINC000248329672 571317298 /nfs/dbraw/zinc/31/72/98/571317298.db2.gz DRSPVCXBVVVLIJ-OVSDDOEQSA-N 0 0 356.506 5.659 40 0 FKABRN CC[C@H]1CC[C@H](c2ccc(-c3ccc([C@H]4CC[C@H](C)CC4)cc3)cc2)CC1 ZINC000249691997 571317296 /nfs/dbraw/zinc/31/72/96/571317296.db2.gz MEXURWLRXYTWGT-KBQPQWKXSA-N 0 0 360.585 8.331 40 0 FKABRN C[C@@H]1CCC[C@H](N2Cn3c4ccccc4nc3N(Cc3ccccc3)C2)[C@H]1C ZINC000251656705 571317308 /nfs/dbraw/zinc/31/73/08/571317308.db2.gz FVTHMBPMOXVALS-DXIQSLLYSA-N 0 0 374.532 5.098 40 0 FKABRN C[C@@H]1CCC[C@@H](N2Cn3c4ccccc4nc3N(Cc3ccccc3)C2)[C@H]1C ZINC000251656712 571317259 /nfs/dbraw/zinc/31/72/59/571317259.db2.gz FVTHMBPMOXVALS-XQBPLPMBSA-N 0 0 374.532 5.098 40 0 FKABRN Cc1sc(Nc2ccc(F)cc2)nc1-c1ccc(Br)cc1 ZINC000252017165 571317265 /nfs/dbraw/zinc/31/72/65/571317265.db2.gz WEMHZNKBYVECDZ-UHFFFAOYSA-N 0 0 363.255 5.764 40 0 FKABRN Cn1nccc1/C=C1\C[C@@H]2[C@H]3CC[C@H]4CCCC[C@]4(C)[C@@H]3CC[C@]2(C)[C@@H]1O ZINC000253369295 571317501 /nfs/dbraw/zinc/31/75/01/571317501.db2.gz ARYVICLZGFZHAR-GWHITLBSSA-N 0 0 368.565 5.207 40 0 FKABRN Cn1nccc1/C=C1\C[C@@H]2[C@H]3CC[C@H]4CCCC[C@]4(C)[C@@H]3CC[C@]2(C)[C@H]1O ZINC000253369296 571317478 /nfs/dbraw/zinc/31/74/78/571317478.db2.gz ARYVICLZGFZHAR-HENAEDKUSA-N 0 0 368.565 5.207 40 0 FKABRN Cn1cc(/C=C2\C[C@@H]3[C@H]4CC[C@H]5CCCC[C@]5(C)[C@@H]4CC[C@]3(C)[C@@H]2O)cn1 ZINC000253369879 571317515 /nfs/dbraw/zinc/31/75/15/571317515.db2.gz JHTFPRFKUMCPIU-RVNBKRMPSA-N 0 0 368.565 5.207 40 0 FKABRN Cn1cc(/C=C2\C[C@@H]3[C@H]4CC[C@H]5CCCC[C@]5(C)[C@@H]4CC[C@]3(C)[C@H]2O)cn1 ZINC000253369880 571317498 /nfs/dbraw/zinc/31/74/98/571317498.db2.gz JHTFPRFKUMCPIU-RZZHNXQKSA-N 0 0 368.565 5.207 40 0 FKABRN CCCOc1cccc(C(=O)Nc2ccc(Br)cc2Cl)c1 ZINC000253375979 571317531 /nfs/dbraw/zinc/31/75/31/571317531.db2.gz RQDVMHMQVTVAED-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN O=C(/C=C/c1ccccc1Cl)Nc1ccc(Cl)cc1C(F)(F)F ZINC000253459940 571234819 /nfs/dbraw/zinc/23/48/19/571234819.db2.gz PIHPTCBBDQJQGV-VMPITWQZSA-N 0 0 360.162 5.664 40 0 FKABRN CN(C)c1ccc(C2O[C@@H](c3ccccc3)C[C@H](c3ccccc3)O2)cc1 ZINC000253476164 571317529 /nfs/dbraw/zinc/31/75/29/571317529.db2.gz SJRMPIVJJKXQPC-DHIUTWEWSA-N 0 0 359.469 5.671 40 0 FKABRN Cc1ccc(/C=C2\C[C@@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@@H]2O)o1 ZINC000253497908 571317614 /nfs/dbraw/zinc/31/76/14/571317614.db2.gz ZMDCSLTVAOWENP-LCUZVQNPSA-N 0 0 368.561 6.375 40 0 FKABRN Cc1ccc(/C=C2\C[C@@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@@H]4CC[C@]3(C)[C@H]2O)o1 ZINC000253497910 571317623 /nfs/dbraw/zinc/31/76/23/571317623.db2.gz ZMDCSLTVAOWENP-NOWXPOJSSA-N 0 0 368.561 6.375 40 0 FKABRN Cc1ccc(/C=C2\C[C@@H]3[C@@H]4CC[C@@H]5CCCC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2O)o1 ZINC000253497912 571317631 /nfs/dbraw/zinc/31/76/31/571317631.db2.gz ZMDCSLTVAOWENP-YNUQENKGSA-N 0 0 368.561 6.375 40 0 FKABRN C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@@H](O[C@H]5CCCCO5)CC[C@@]43C)[C@H]1CCC2=O ZINC000253504928 525913914 /nfs/dbraw/zinc/91/39/14/525913914.db2.gz NIXXKMPUWREKQR-BLDDEZIESA-N 0 0 372.549 5.430 40 0 biogenic,in-vitro FKABRN C[C@@]12CC[C@@H]3[C@H](CC=C4C[C@@H](O[C@@H]5CCCCO5)CC[C@@]43C)[C@H]1CCC2=O ZINC000253504936 525913614 /nfs/dbraw/zinc/91/36/14/525913614.db2.gz NIXXKMPUWREKQR-ILSOZCRKSA-N 0 0 372.549 5.430 40 0 biogenic,in-vitro FKABRN Cn1nccc1/C=C1\C[C@@H]2[C@H]3CC[C@H]4CCCC[C@]4(C)[C@@H]3CC[C@@]2(C)[C@H]1O ZINC000253505184 571317737 /nfs/dbraw/zinc/31/77/37/571317737.db2.gz ARYVICLZGFZHAR-BUKAYYRESA-N 0 0 368.565 5.207 40 0 FKABRN Cn1nccc1/C=C1\C[C@@H]2[C@H]3CC[C@H]4CCCC[C@]4(C)[C@@H]3CC[C@@]2(C)[C@@H]1O ZINC000253505188 571317749 /nfs/dbraw/zinc/31/77/49/571317749.db2.gz ARYVICLZGFZHAR-VJLFMBCXSA-N 0 0 368.565 5.207 40 0 FKABRN Cn1cc(/C=C2\C[C@@H]3[C@H]4CC[C@H]5CCCC[C@]5(C)[C@@H]4CC[C@@]3(C)[C@@H]2O)cn1 ZINC000253505346 571317732 /nfs/dbraw/zinc/31/77/32/571317732.db2.gz JHTFPRFKUMCPIU-IRHDZPSQSA-N 0 0 368.565 5.207 40 0 FKABRN Cn1cc(/C=C2\C[C@@H]3[C@H]4CC[C@H]5CCCC[C@]5(C)[C@@H]4CC[C@@]3(C)[C@H]2O)cn1 ZINC000253505350 571317731 /nfs/dbraw/zinc/31/77/31/571317731.db2.gz JHTFPRFKUMCPIU-LFBHBSJHSA-N 0 0 368.565 5.207 40 0 FKABRN CC(=O)[C@@H]1CC[C@]2(C)C3=C(CC[C@]12C)[C@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3 ZINC000253532253 571317765 /nfs/dbraw/zinc/31/77/65/571317765.db2.gz OXWZCBBGEYDJCU-DSAHMVKASA-N 0 0 356.550 5.894 40 0 FKABRN CC(=O)[C@@H]1CC[C@]2(C)C3=C(CC[C@]12C)[C@]1(C)CCC(=O)C(C)(C)[C@H]1CC3 ZINC000253532254 222992714 /nfs/dbraw/zinc/99/27/14/222992714.db2.gz OXWZCBBGEYDJCU-KBEAJZRGSA-N 0 0 356.550 5.894 40 0 FKABRN CC(=O)[C@@H]1CC[C@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@H]1CC3 ZINC000253532255 571317733 /nfs/dbraw/zinc/31/77/33/571317733.db2.gz OXWZCBBGEYDJCU-LNAWWMEISA-N 0 0 356.550 5.894 40 0 FKABRN Clc1ccccc1CSc1nc(C23CC4CC(CC(C4)C2)C3)n[nH]1 ZINC000253562181 571317763 /nfs/dbraw/zinc/31/77/63/571317763.db2.gz CZDNIIPCOJRLQT-UHFFFAOYSA-N 0 0 359.926 5.218 40 0 FKABRN Clc1ccc(CSc2nc(C34CC5CC(CC(C5)C3)C4)n[nH]2)cc1 ZINC000253572931 571317724 /nfs/dbraw/zinc/31/77/24/571317724.db2.gz QTZPHLCTKQLJAE-UHFFFAOYSA-N 0 0 359.926 5.218 40 0 FKABRN CC1=C(C)[C@H](C)[C@]2(C)N(c3ccc(Br)cc3)N=N[C@]2(C)[C@@H]1C ZINC000253589842 571317745 /nfs/dbraw/zinc/31/77/45/571317745.db2.gz AEIGMGYOVQMLSX-NONVJHHQSA-N 0 0 362.315 5.776 40 0 FKABRN CCCCCCOc1ccc(C(=O)O[C@@H]2C[C@H](C)CC[C@H]2C(C)C)cc1 ZINC000253607969 571317848 /nfs/dbraw/zinc/31/78/48/571317848.db2.gz BLQQANOVYWBZAO-BVYCBKJFSA-N 0 0 360.538 6.263 40 0 FKABRN CCCCCCOc1ccc(C(=O)O[C@@H]2C[C@@H](C)CC[C@H]2C(C)C)cc1 ZINC000253607971 571317868 /nfs/dbraw/zinc/31/78/68/571317868.db2.gz BLQQANOVYWBZAO-YUXAGFNASA-N 0 0 360.538 6.263 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC[C@H]3[C@H]4CC[C@@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000253612224 571317864 /nfs/dbraw/zinc/31/78/64/571317864.db2.gz CRRKVZVYZQXICQ-JPTGAJLTSA-N 0 0 358.522 5.086 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC[C@H]3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000253612225 571317878 /nfs/dbraw/zinc/31/78/78/571317878.db2.gz CRRKVZVYZQXICQ-LSUCQCDESA-N 0 0 358.522 5.086 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC[C@H]3[C@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000253612226 571317880 /nfs/dbraw/zinc/31/78/80/571317880.db2.gz CRRKVZVYZQXICQ-OYIIHGHGSA-N 0 0 358.522 5.086 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC[C@H]3[C@@H]4CC[C@@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000253612227 571317869 /nfs/dbraw/zinc/31/78/69/571317869.db2.gz CRRKVZVYZQXICQ-WWSUJNAZSA-N 0 0 358.522 5.086 40 0 FKABRN CO[C@@H](C)C(=O)Oc1cc(Cl)ccc1Cc1ccc(Cl)cc1Cl ZINC000253613843 571317852 /nfs/dbraw/zinc/31/78/52/571317852.db2.gz OOFAMTSIPWSZND-JTQLQIEISA-N 0 0 373.663 5.178 40 0 FKABRN CO[C@H](C)C(=O)Oc1cc(Cl)ccc1Cc1ccc(Cl)cc1Cl ZINC000253613844 571317859 /nfs/dbraw/zinc/31/78/59/571317859.db2.gz OOFAMTSIPWSZND-SNVBAGLBSA-N 0 0 373.663 5.178 40 0 FKABRN C[C@]12CC[C@H]3[C@@H](CC[C@H]4CCCC[C@@]43C)[C@H]1C/C(=C\c1ccccc1)[C@H]2O ZINC000253617051 571317870 /nfs/dbraw/zinc/31/78/70/571317870.db2.gz LZOCUXGUHLCYSF-DIOANLCASA-N 0 0 364.573 6.474 40 0 FKABRN C[C@@]12CCC[C@@H]1[C@@H]1CC[C@H]3C[C@@H](Cc4ccccc4)CC[C@]3(C)[C@H]1CC2 ZINC000253617550 571317965 /nfs/dbraw/zinc/31/79/65/571317965.db2.gz UYEUVWXDRDBSDY-CMDGYKDHSA-N 0 0 350.590 7.278 40 0 FKABRN C[C@@]12CCC[C@@H]1[C@H]1CC[C@H]3C[C@@H](Cc4ccccc4)CC[C@]3(C)[C@H]1CC2 ZINC000253617551 571317929 /nfs/dbraw/zinc/31/79/29/571317929.db2.gz UYEUVWXDRDBSDY-JOUFPCHASA-N 0 0 350.590 7.278 40 0 FKABRN Cc1ccc(-c2csc(=Nc3ccccc3)n2Cc2ccccc2)cc1 ZINC000254293250 571317997 /nfs/dbraw/zinc/31/79/97/571317997.db2.gz SHZZXAYLFFLORP-UHFFFAOYSA-N 0 0 356.494 5.806 40 0 FKABRN COc1ccc(-c2csc(=Nc3ccccc3)n2-c2ccccc2)cc1 ZINC000254301621 571318011 /nfs/dbraw/zinc/31/80/11/571318011.db2.gz WSOOFVQQOJRHLQ-UHFFFAOYSA-N 0 0 358.466 5.447 40 0 FKABRN Clc1ccc(-c2csc(=Nc3ccccc3)n2Cc2ccco2)cc1 ZINC000254496321 571318037 /nfs/dbraw/zinc/31/80/37/571318037.db2.gz XSZSPGUINNFXLF-UHFFFAOYSA-N 0 0 366.873 5.744 40 0 FKABRN CCn1c(-c2ccc(Br)cc2)csc1=Nc1ccccc1 ZINC000254518503 571317993 /nfs/dbraw/zinc/31/79/93/571317993.db2.gz YRCNIUXLLWXXGR-UHFFFAOYSA-N 0 0 359.292 5.231 40 0 FKABRN C[C@@H]1C[C@H]2C[C@H](C)C[C@@](c3cc(Br)c([O-])c(C=O)c3)(C1)C2 ZINC000254615219 571317989 /nfs/dbraw/zinc/31/79/89/571317989.db2.gz AGMSQKWELKKRGR-BKQKLNMISA-N 0 0 351.284 5.071 40 0 FKABRN CC/C=C/C/C=C/C/C=C/C/C=C/C/C=C\C/C=C\CCC(=O)OCC ZINC000255003994 571121569 /nfs/dbraw/zinc/12/15/69/571121569.db2.gz ITNKVODZACVXDS-NHCWERLYSA-N 0 0 356.550 7.027 40 0 FKABRN CC(C)(C)OC(=O)N1CCC(N(Cc2ccccc2)c2ccccc2)CC1 ZINC000255187941 571318103 /nfs/dbraw/zinc/31/81/03/571318103.db2.gz HULVTHHCVMDEHS-UHFFFAOYSA-N 0 0 366.505 5.093 40 0 FKABRN CCC(=O)Nc1ccc(-c2ccc(NC(=O)CC)c(Cl)c2)cc1Cl ZINC000255189713 571318075 /nfs/dbraw/zinc/31/80/75/571318075.db2.gz ROUIZMOAVSZQNB-UHFFFAOYSA-N 0 0 365.260 5.357 40 0 FKABRN Cc1ccccc1N=c1scc(-c2ccccc2)n1-c1ccccc1C ZINC000256004573 571318229 /nfs/dbraw/zinc/31/82/29/571318229.db2.gz ULZCLLHIHQIUDB-UHFFFAOYSA-N 0 0 356.494 6.055 40 0 FKABRN CCN(CC)c1nc2cc(Cl)ccc2c(-c2ccccc2)c1C(C)=O ZINC000256028126 528315061 /nfs/dbraw/zinc/31/50/61/528315061.db2.gz UZGGDPBHVJZOPR-UHFFFAOYSA-N 0 0 352.865 5.604 40 0 FKABRN Clc1ccc(Cl)c2c1CCc1ccc(Br)cc1CC2 ZINC000256055184 571321658 /nfs/dbraw/zinc/32/16/58/571321658.db2.gz ZPKPJZTWTUQQBF-UHFFFAOYSA-N 0 0 356.090 5.640 40 0 FKABRN CCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCC[C@@H](C)CCCC(C)C ZINC000256109114 528032931 /nfs/dbraw/zinc/03/29/31/528032931.db2.gz KRYOQEAJTHSPKQ-ASDGIDEWSA-N 0 0 366.718 9.668 40 0 FKABRN CCC[C@H](C)CCC[C@H](C)CCC[C@@H](C)CCC[C@H](C)CCCC(C)C ZINC000256109115 528032903 /nfs/dbraw/zinc/03/29/03/528032903.db2.gz KRYOQEAJTHSPKQ-QYOOZWMWSA-N 0 0 366.718 9.668 40 0 FKABRN CCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C ZINC000256109116 571318218 /nfs/dbraw/zinc/31/82/18/571318218.db2.gz KRYOQEAJTHSPKQ-ROXDYWFKSA-N 0 0 366.718 9.668 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC=C3[C@@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000256464532 206589959 /nfs/dbraw/zinc/58/99/59/206589959.db2.gz VYIIGPBTHBMATO-CCIGOFLESA-N 0 0 356.506 5.006 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC=C3[C@H]4CC[C@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000256464539 571318256 /nfs/dbraw/zinc/31/82/56/571318256.db2.gz VYIIGPBTHBMATO-JEOSHJBNSA-N 0 0 356.506 5.006 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC=C3[C@@H]4CC[C@@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000256464545 571318237 /nfs/dbraw/zinc/31/82/37/571318237.db2.gz VYIIGPBTHBMATO-JOAYKTOKSA-N 0 0 356.506 5.006 40 0 FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC=C3[C@H]4CC[C@@H](C(C)=O)[C@@]4(C)CC[C@@H]32)C1 ZINC000256464552 571318279 /nfs/dbraw/zinc/31/82/79/571318279.db2.gz VYIIGPBTHBMATO-VGAXUYSNSA-N 0 0 356.506 5.006 40 0 FKABRN CCCCC/C=C/C/C=C/C/C=C/C/C=C\CCCC(=O)N[C@H](C)CO ZINC000256930368 203913418 /nfs/dbraw/zinc/91/34/18/203913418.db2.gz SQKRUBZPTNJQEM-HSEKBXBQSA-N 0 0 361.570 5.629 40 0 in-vitro FKABRN CCCCC[C@H]1CC[C@H]([C@H]2CO[C@H](c3ccc(F)c(F)c3)OC2)CC1 ZINC000257198464 571318265 /nfs/dbraw/zinc/31/82/65/571318265.db2.gz PXQGJCAMNTXNSQ-LJHCUZDXSA-N 0 0 352.465 6.013 40 0 FKABRN O=C(Cc1ccccc1)N1CCCC[C@@H]1c1ccc(-c2cccc(F)c2)nc1 ZINC000257200302 223016240 /nfs/dbraw/zinc/01/62/40/223016240.db2.gz ACUQAFFALUGRON-HSZRJFAPSA-N 0 0 374.459 5.184 40 0 FKABRN O=C(Cc1ccccc1)N1CCCC[C@H]1c1ccc(-c2cccc(F)c2)nc1 ZINC000257200303 223015707 /nfs/dbraw/zinc/01/57/07/223015707.db2.gz ACUQAFFALUGRON-QHCPKHFHSA-N 0 0 374.459 5.184 40 0 FKABRN Cc1cc(-c2ccccc2)cc([C@H]2CCCN(C(=O)c3ccccc3)C2)n1 ZINC000257204749 223018590 /nfs/dbraw/zinc/01/85/90/223018590.db2.gz AWEFYHKUISEXOD-NRFANRHFSA-N 0 0 356.469 5.077 40 0 FKABRN Cc1cc(-c2ccccc2)cc([C@@H]2CCCN(C(=O)c3ccccc3)C2)n1 ZINC000257204750 223018983 /nfs/dbraw/zinc/01/89/83/223018983.db2.gz AWEFYHKUISEXOD-OAQYLSRUSA-N 0 0 356.469 5.077 40 0 FKABRN C[C@H]1CC[C@H]2[C@H](O1)c1cc(OCc3ccc(F)cc3)ccc1OC2(C)C ZINC000257209237 571318261 /nfs/dbraw/zinc/31/82/61/571318261.db2.gz BPNURZUTSVLSAC-ONTRVFCTSA-N 0 0 356.437 5.432 40 0 FKABRN CC(C)=CCC[C@]1(C)Oc2cc(C(C)(C)C)ccc2[C@@H]2O[C@H](C)CC[C@H]21 ZINC000257210630 527427566 /nfs/dbraw/zinc/42/75/66/527427566.db2.gz BVNICHGMSNERLH-OITMPTDNSA-N 0 0 356.550 6.738 40 0 FKABRN CC(C)CN1C(=O)N(c2ccccc2)[C@@H]2[C@H](c3cccc(F)c3)CC[C@@H]21 ZINC000257211403 571318280 /nfs/dbraw/zinc/31/82/80/571318280.db2.gz BYTCVNZPUKIRSY-PCCBWWKXSA-N 0 0 352.453 5.039 40 0 FKABRN C[C@H]1[C@H]2C[C@@H](C[C@@H]1O)C(C)(C)O[C@H]2c1ccc(-c2cccc(F)c2)cc1 ZINC000257212698 223021298 /nfs/dbraw/zinc/02/12/98/223021298.db2.gz CEPFIPUEUYSOAU-VLNSVQMVSA-N 0 0 354.465 5.366 40 0 FKABRN CC(C)c1ccc2c(c1)[C@H]1O[C@@H](CCc3ccccc3)CC[C@@H]1C(C)(C)O2 ZINC000257215054 528155877 /nfs/dbraw/zinc/15/58/77/528155877.db2.gz COLLLHLVLIJRJT-ODGPQVTHSA-N 0 0 364.529 6.450 40 0 FKABRN COC(=O)c1ccc2c(c1)[C@@H]1O[C@H](C)CC[C@H]1[C@](C)(CCC=C(C)C)O2 ZINC000257219815 209968648 /nfs/dbraw/zinc/96/86/48/209968648.db2.gz DIGLGNGYCPPMLZ-WOIRZILMSA-N 0 0 358.478 5.227 40 0 FKABRN CC(C)CN1C(=O)N(c2ccccc2F)[C@@H]2[C@H](c3ccccc3)CC[C@@H]21 ZINC000257224979 571318292 /nfs/dbraw/zinc/31/82/92/571318292.db2.gz FEGAYLFXLVYLDS-DZFGPLHGSA-N 0 0 352.453 5.039 40 0 FKABRN CC(C)C(=O)N[C@]1(C)C[C@H](c2ccc(F)cc2)O[C@H](c2ccc(F)cc2)C1 ZINC000257224999 527529031 /nfs/dbraw/zinc/52/90/31/527529031.db2.gz 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/nfs/dbraw/zinc/11/43/42/223114342.db2.gz WKTLAJLKBLZMBZ-UHFFFAOYSA-N 0 0 374.669 5.612 40 0 FKABRN Oc1ccc(CNc2ccc(Oc3ccccc3)cc2)cc1Br ZINC000321314794 571319065 /nfs/dbraw/zinc/31/90/65/571319065.db2.gz MWFSXUOAVQVQOK-UHFFFAOYSA-N 0 0 370.246 5.559 40 0 FKABRN CC(C)(C)c1nc(Cl)cc(Nc2ccc(C(F)(F)F)cc2Cl)n1 ZINC000321528942 210135403 /nfs/dbraw/zinc/13/54/03/210135403.db2.gz IUMVRHNWCRPJEJ-UHFFFAOYSA-N 0 0 364.198 5.843 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccn3)nc(NC(C)(C)C)n2)ccc1Cl ZINC000328957109 210123888 /nfs/dbraw/zinc/12/38/88/210123888.db2.gz AJDHWDQZXOHROM-UHFFFAOYSA-N 0 0 367.884 5.454 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(F)cc2Cl)cc(-c2ccccc2)n1 ZINC000328957960 526335467 /nfs/dbraw/zinc/33/54/67/526335467.db2.gz AMZXAPHVOSBCOO-UHFFFAOYSA-N 0 0 370.859 5.312 40 0 FKABRN CC(C)(C)Nc1nc(Nc2cccc(Cl)c2Cl)cc(C2CC2)n1 ZINC000328961602 526337996 /nfs/dbraw/zinc/33/79/96/526337996.db2.gz BELLZWBLWUDZGU-UHFFFAOYSA-N 0 0 351.281 5.037 40 0 FKABRN Clc1cccc(Nc2nccc(N3CCc4cc(Cl)ccc4C3)n2)c1 ZINC000328963008 571319186 /nfs/dbraw/zinc/31/91/86/571319186.db2.gz BLWWEVHSTVKEQU-UHFFFAOYSA-N 0 0 371.271 5.090 40 0 FKABRN Cc1c(Nc2cc(C3CC3)nc(NC(C)(C)C)n2)cccc1C(F)(F)F ZINC000328963481 571319148 /nfs/dbraw/zinc/31/91/48/571319148.db2.gz BOTCVVLCHZGXGI-UHFFFAOYSA-N 0 0 364.415 5.057 40 0 FKABRN Fc1ccc(Nc2cc(-c3ccccc3)nc(NC3CCCCC3)n2)cc1 ZINC000328964591 210128002 /nfs/dbraw/zinc/12/80/02/210128002.db2.gz BWOFPNNUUPYWDY-UHFFFAOYSA-N 0 0 362.452 5.193 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)ccc1F ZINC000328964899 223126813 /nfs/dbraw/zinc/12/68/13/223126813.db2.gz BXVONHGFJNTWJC-UHFFFAOYSA-N 0 0 350.441 5.545 40 0 FKABRN CC(C)(C)Nc1nc(Nc2cc(Cl)ccc2Cl)cc(C2CC2)n1 ZINC000328964947 571319192 /nfs/dbraw/zinc/31/91/92/571319192.db2.gz BZCKXOZFSMQBQB-UHFFFAOYSA-N 0 0 351.281 5.037 40 0 FKABRN Clc1cc(Nc2cccc(Cl)c2Cl)nc(-c2ccccc2)n1 ZINC000328964948 534628985 /nfs/dbraw/zinc/62/89/85/534628985.db2.gz BZCVMDFAITYJRQ-UHFFFAOYSA-N 0 0 350.636 5.269 40 0 FKABRN CC(C)(C)c1ccc(Nc2cc(-c3ccccc3)nc(NC3CC3)n2)cc1 ZINC000328965568 571319173 /nfs/dbraw/zinc/31/91/73/571319173.db2.gz CEFWUYVGXSOFHC-UHFFFAOYSA-N 0 0 358.489 5.181 40 0 FKABRN Cc1cc(C)c(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)c(C)c1 ZINC000328968097 206725419 /nfs/dbraw/zinc/72/54/19/206725419.db2.gz CXWLXRGPKQVPSD-UHFFFAOYSA-N 0 0 360.505 5.445 40 0 FKABRN CSc1ccccc1Nc1cc(-c2ccccc2)nc(NC(C)(C)C)n1 ZINC000328972202 533043055 /nfs/dbraw/zinc/04/30/55/533043055.db2.gz DVKLBNXVCIUUGQ-UHFFFAOYSA-N 0 0 364.518 5.241 40 0 FKABRN Cc1cc(Nc2cc(C3CC3)nc(NC3CCCC3)n2)ccc1C(C)C ZINC000328975696 210127306 /nfs/dbraw/zinc/12/73/06/210127306.db2.gz FLPOYPUHVDJVEH-UHFFFAOYSA-N 0 0 350.510 5.306 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccc3)nc(NC3CCCC3)n2)ccc1F ZINC000328976332 210127377 /nfs/dbraw/zinc/12/73/77/210127377.db2.gz FOEKJXCKRLTJDT-UHFFFAOYSA-N 0 0 362.452 5.111 40 0 FKABRN CCCC1CCC([C@H]2CC[C@H](c3ccc(OC)c(F)c3F)CC2)CC1 ZINC000328977113 571319237 /nfs/dbraw/zinc/31/92/37/571319237.db2.gz FRGPBGWMABUJNC-VNGAXPGBSA-N 0 0 350.493 6.854 40 0 FKABRN CC(C)c1cc(N2Cc3ccccc3C(C)(C)C2)nc(Nc2ccccc2)n1 ZINC000328977193 132372197 /nfs/dbraw/zinc/37/21/97/132372197.db2.gz FRWLUVWVBMFYFU-UHFFFAOYSA-N 0 0 372.516 5.063 40 0 FKABRN Fc1cccc(-c2nc(Cl)cc(Nc3cccc(Cl)c3Cl)n2)c1 ZINC000328977220 571319202 /nfs/dbraw/zinc/31/92/02/571319202.db2.gz FRYDOFGRLQFQFA-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN Cc1cccc(Nc2cc(-c3ccccc3)nc(NC3CCCCC3)n2)c1C ZINC000328977829 571319231 /nfs/dbraw/zinc/31/92/31/571319231.db2.gz FWIBZIAYMUQRCZ-UHFFFAOYSA-N 0 0 372.516 5.092 40 0 FKABRN Fc1ccc(-c2nc(Cl)cc(Nc3c(Cl)cccc3Cl)n2)cc1 ZINC000328979593 210129754 /nfs/dbraw/zinc/12/97/54/210129754.db2.gz GGWLRLMJJLHRRG-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN Fc1ccccc1Nc1cc(Cl)nc(-c2cccc(C(F)(F)F)c2)n1 ZINC000328979994 571319225 /nfs/dbraw/zinc/31/92/25/571319225.db2.gz GKASBLLPNXKGPX-UHFFFAOYSA-N 0 0 367.733 5.120 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccc3)nc(NC(C)C)n2)ccc1C(C)C ZINC000328981154 571319238 /nfs/dbraw/zinc/31/92/38/571319238.db2.gz GRHDIUKHPLYWAJ-UHFFFAOYSA-N 0 0 360.505 5.561 40 0 FKABRN CCc1cccc(C)c1Nc1cc(-c2ccccc2)nc(NC(C)(C)C)n1 ZINC000328981964 571319226 /nfs/dbraw/zinc/31/92/26/571319226.db2.gz GXHSZPGTGWLKKZ-UHFFFAOYSA-N 0 0 360.505 5.390 40 0 FKABRN Cc1cc(Nc2cc(Cl)nc(-c3cccc(F)c3)n2)c(C)cc1Cl ZINC000328983168 571319213 /nfs/dbraw/zinc/31/92/13/571319213.db2.gz HEMCPRXSAGNRHF-UHFFFAOYSA-N 0 0 362.235 5.950 40 0 FKABRN Cc1cccc(C)c1Nc1cc(-c2ccccc2)nc(NC2CCCCC2)n1 ZINC000328983581 203845889 /nfs/dbraw/zinc/84/58/89/203845889.db2.gz HHELMVFYEYWQLN-UHFFFAOYSA-N 0 0 372.516 5.092 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(Cl)cc2)cc(-c2ccccn2)n1 ZINC000328991970 210128426 /nfs/dbraw/zinc/12/84/26/210128426.db2.gz ITZGAPWHTRFZLE-UHFFFAOYSA-N 0 0 353.857 5.146 40 0 FKABRN Cc1cc(N2Cc3ccccc3C[C@@H]2C)nc(Nc2cccc(Cl)c2)n1 ZINC000328992493 132372418 /nfs/dbraw/zinc/37/24/18/132372418.db2.gz IVUGPPXMDQWGBE-HNNXBMFYSA-N 0 0 364.880 5.133 40 0 FKABRN Cc1cc(N2Cc3ccccc3C[C@H]2C)nc(Nc2cccc(Cl)c2)n1 ZINC000328992494 132372296 /nfs/dbraw/zinc/37/22/96/132372296.db2.gz IVUGPPXMDQWGBE-OAHLLOKOSA-N 0 0 364.880 5.133 40 0 FKABRN CC(C)c1nc(Nc2ccccc2)cc(N2Cc3ccccc3C(C)(C)C2)n1 ZINC000328992599 132372428 /nfs/dbraw/zinc/37/24/28/132372428.db2.gz IXPHHSUMEDQSGZ-UHFFFAOYSA-N 0 0 372.516 5.641 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(Cl)cc2Cl)cc(C2CC2)n1 ZINC000328993768 571319240 /nfs/dbraw/zinc/31/92/40/571319240.db2.gz JBIVMKHBKFJFNK-UHFFFAOYSA-N 0 0 351.281 5.037 40 0 FKABRN CC1(C)Cc2ccccc2CN1c1cc(NC2CCCC2)nc(C2CC2)n1 ZINC000328993769 132372347 /nfs/dbraw/zinc/37/23/47/132372347.db2.gz JBKMAPSABUSTJY-UHFFFAOYSA-N 0 0 362.521 5.050 40 0 FKABRN Cc1ccc(Nc2cc(-c3ccccc3)nc(NC3CCCCC3)n2)cc1 ZINC000328993797 223128402 /nfs/dbraw/zinc/12/84/02/223128402.db2.gz JCCQTMKGRUCMPS-UHFFFAOYSA-N 0 0 358.489 5.362 40 0 FKABRN CCCc1ccc(OC(=O)[C@H]2CC[C@H](C3CCC(CCC)CC3)CC2)cc1 ZINC000328995198 571319242 /nfs/dbraw/zinc/31/92/42/571319242.db2.gz JHDGZPSFHYZDNF-IBGPSGSDSA-N 0 0 370.577 6.957 40 0 FKABRN Cc1nc(Nc2cccc(Cl)c2)cc(N2Cc3ccccc3C[C@@H]2C)n1 ZINC000328996582 132372220 /nfs/dbraw/zinc/37/22/20/132372220.db2.gz JKJIRUMMOZARNH-AWEZNQCLSA-N 0 0 364.880 5.133 40 0 FKABRN Cc1nc(Nc2cccc(Cl)c2)cc(N2Cc3ccccc3C[C@H]2C)n1 ZINC000328996584 132372423 /nfs/dbraw/zinc/37/24/23/132372423.db2.gz JKJIRUMMOZARNH-CQSZACIVSA-N 0 0 364.880 5.133 40 0 FKABRN FC(F)(F)c1cc(Nc2ccc(Cl)cc2)nc(NC2CCCCC2)n1 ZINC000328996688 571319209 /nfs/dbraw/zinc/31/92/09/571319209.db2.gz JLRTVSNSXASMQE-UHFFFAOYSA-N 0 0 370.806 5.059 40 0 FKABRN Fc1ccc(-c2nc(Cl)cc(Nc3ccc(C(F)(F)F)cc3)n2)cc1 ZINC000328997860 571319235 /nfs/dbraw/zinc/31/92/35/571319235.db2.gz JPTXQMJRHHBZBC-UHFFFAOYSA-N 0 0 367.733 5.120 40 0 FKABRN Cc1ccc(Cl)c(C)c1Nc1cc(C(F)(F)F)nc(NC(C)(C)C)n1 ZINC000328999961 571319228 /nfs/dbraw/zinc/31/92/28/571319228.db2.gz JXPQSQMCXFXHHW-UHFFFAOYSA-N 0 0 372.822 5.142 40 0 FKABRN CC(C)c1nc(Nc2ccccc2)cc(N2Cc3ccccc3CC2(C)C)n1 ZINC000329001607 132372262 /nfs/dbraw/zinc/37/22/62/132372262.db2.gz KFHSLHDXXRLLIM-UHFFFAOYSA-N 0 0 372.516 5.685 40 0 FKABRN Cc1ccc(Cl)cc1Nc1cc(-c2ccccc2)nc(NC(C)(C)C)n1 ZINC000329001649 571319194 /nfs/dbraw/zinc/31/91/94/571319194.db2.gz KFOKOWHBQDTVJB-UHFFFAOYSA-N 0 0 366.896 5.481 40 0 FKABRN CC(C)(C)Nc1nc(Nc2cc(Cl)cc(Cl)c2)cc(C2CC2)n1 ZINC000329003952 526336108 /nfs/dbraw/zinc/33/61/08/526336108.db2.gz KPQAMDIFKPYWEL-UHFFFAOYSA-N 0 0 351.281 5.037 40 0 FKABRN Fc1cccc(-c2nc(Cl)cc(Nc3ccc(Cl)cc3Cl)n2)c1 ZINC000329003976 534513629 /nfs/dbraw/zinc/51/36/29/534513629.db2.gz KQDUCUFZMBAQJJ-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN CC(C)Nc1nc(Nc2ccc(C(C)(C)C)cc2)cc(-c2ccccc2)n1 ZINC000329005163 529115272 /nfs/dbraw/zinc/11/52/72/529115272.db2.gz KVPDDIQYFXPBFT-UHFFFAOYSA-N 0 0 360.505 5.427 40 0 FKABRN Cc1ccc(Nc2cc(C3CC3)nc(NC(C)(C)C)n2)cc1C(F)(F)F ZINC000329005329 571319199 /nfs/dbraw/zinc/31/91/99/571319199.db2.gz KXYJAILMKJAGSA-UHFFFAOYSA-N 0 0 364.415 5.057 40 0 FKABRN CCC[C@H]1CC[C@H](c2ccc(OC(=O)c3ccc(OC)cc3)cc2)CC1 ZINC000329008542 571319244 /nfs/dbraw/zinc/31/92/44/571319244.db2.gz LSVXFMRCYMRCNX-IYARVYRRSA-N 0 0 352.474 5.988 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(Cl)cc2)cc(-c2ccncc2)n1 ZINC000329009020 206726075 /nfs/dbraw/zinc/72/60/75/206726075.db2.gz LUSNURUMTDBZQR-UHFFFAOYSA-N 0 0 353.857 5.146 40 0 FKABRN CC1(C)CN(c2ccnc(Nc3cccc(Cl)c3)n2)Cc2ccccc21 ZINC000329010910 132372535 /nfs/dbraw/zinc/37/25/35/132372535.db2.gz MDJPWLXDGVJRGL-UHFFFAOYSA-N 0 0 364.880 5.171 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(C(F)(F)F)cc2)cc(C2CC2)n1 ZINC000329011534 210131739 /nfs/dbraw/zinc/13/17/39/210131739.db2.gz MGPFZCGEDKTKEC-UHFFFAOYSA-N 0 0 350.388 5.327 40 0 FKABRN Cc1ccccc1Nc1cc(Cl)nc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000329012520 210130164 /nfs/dbraw/zinc/13/01/64/210130164.db2.gz MJPVRKBBBOGTJF-UHFFFAOYSA-N 0 0 363.770 5.290 40 0 FKABRN Fc1cccc(-c2nc(Cl)cc(Nc3cc(Cl)ccc3Cl)n2)c1 ZINC000329012618 571319221 /nfs/dbraw/zinc/31/92/21/571319221.db2.gz MLDRCASHUQTELX-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN Cc1cc(F)ccc1Nc1cc(-c2ccccc2)nc(NC(C)(C)C)n1 ZINC000329013483 210131632 /nfs/dbraw/zinc/13/16/32/210131632.db2.gz MPTCSTSLKSCDOD-UHFFFAOYSA-N 0 0 350.441 5.545 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(C(C)C)c(C)c2)cc(C(F)(F)F)n1 ZINC000329013617 571319201 /nfs/dbraw/zinc/31/92/01/571319201.db2.gz MRNYLJFAHBEKFS-CYBMUJFWSA-N 0 0 366.431 5.303 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(C(C)C)c(C)c2)cc(C(F)(F)F)n1 ZINC000329013618 571319208 /nfs/dbraw/zinc/31/92/08/571319208.db2.gz MRNYLJFAHBEKFS-ZDUSSCGKSA-N 0 0 366.431 5.303 40 0 FKABRN Fc1ccc(-c2nc(Cl)cc(Nc3ccc(Cl)cc3Cl)n2)cc1 ZINC000329014763 571319217 /nfs/dbraw/zinc/31/92/17/571319217.db2.gz MXWHNOWGWTTZQQ-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN Fc1ccc(-c2nc(Cl)cc(Nc3cc(Cl)ccc3Cl)n2)cc1 ZINC000329016833 534454682 /nfs/dbraw/zinc/45/46/82/534454682.db2.gz NIGJVTVCQOKVSS-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(Cl)cc2)cc(-c2ccccc2)n1 ZINC000329016843 571319218 /nfs/dbraw/zinc/31/92/18/571319218.db2.gz NISGJTGKHJONJS-AWEZNQCLSA-N 0 0 352.869 5.173 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(Cl)cc2)cc(-c2ccccc2)n1 ZINC000329016844 210131388 /nfs/dbraw/zinc/13/13/88/210131388.db2.gz NISGJTGKHJONJS-CQSZACIVSA-N 0 0 352.869 5.173 40 0 FKABRN Cc1cc(Br)cc(C)c1Nc1cc(Cl)nc(CC2CC2)n1 ZINC000329017935 223129881 /nfs/dbraw/zinc/12/98/81/223129881.db2.gz NNWIBWBPUCDSQR-UHFFFAOYSA-N 0 0 366.690 5.205 40 0 FKABRN Cc1cccc(Cl)c1Nc1cc(-c2ccccc2)nc(NC(C)(C)C)n1 ZINC000329018882 210131453 /nfs/dbraw/zinc/13/14/53/210131453.db2.gz NTGUCAGEUATCKO-UHFFFAOYSA-N 0 0 366.896 5.481 40 0 FKABRN Cc1ccc(C(F)(F)F)cc1Nc1cc(C2CC2)nc(NC(C)(C)C)n1 ZINC000329022588 571319211 /nfs/dbraw/zinc/31/92/11/571319211.db2.gz ONHZGLUBDBOQQW-UHFFFAOYSA-N 0 0 364.415 5.057 40 0 FKABRN CC1(C)Cc2ccccc2CN1c1ccnc(Nc2cccc(Cl)c2)n1 ZINC000329024423 520583856 /nfs/dbraw/zinc/58/38/56/520583856.db2.gz OZVBPHAIGJROOU-UHFFFAOYSA-N 0 0 364.880 5.215 40 0 FKABRN Fc1cccc(-c2nc(Cl)cc(Nc3c(Cl)cccc3Cl)n2)c1 ZINC000329024487 526381703 /nfs/dbraw/zinc/38/17/03/526381703.db2.gz PAGMYDMHVDVDDY-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN Cc1cc(Nc2cc(-c3ccncc3)nc(NC(C)(C)C)n2)ccc1Cl ZINC000329024803 525305173 /nfs/dbraw/zinc/30/51/73/525305173.db2.gz PBICZUZZXSIUPU-UHFFFAOYSA-N 0 0 367.884 5.454 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(Cl)c(C)c2)cc(-c2ccccc2)n1 ZINC000329026264 210131502 /nfs/dbraw/zinc/13/15/02/210131502.db2.gz PLMFPXFHNLGIMO-HNNXBMFYSA-N 0 0 366.896 5.481 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(Cl)c(C)c2)cc(-c2ccccc2)n1 ZINC000329026265 529357509 /nfs/dbraw/zinc/35/75/09/529357509.db2.gz PLMFPXFHNLGIMO-OAHLLOKOSA-N 0 0 366.896 5.481 40 0 FKABRN Cc1cc(C)c(Nc2cc(-c3ccccc3)nc(NC3CCCC3)n2)c(C)c1 ZINC000329026523 223129429 /nfs/dbraw/zinc/12/94/29/223129429.db2.gz PMOBNMVGYBGNRB-UHFFFAOYSA-N 0 0 372.516 5.011 40 0 FKABRN Cc1cc(C)cc(Nc2cc(-c3ccccc3)nc(NC3CCCCC3)n2)c1 ZINC000329026907 571319197 /nfs/dbraw/zinc/31/91/97/571319197.db2.gz PPFNAIMRKFWDGE-UHFFFAOYSA-N 0 0 372.516 5.092 40 0 FKABRN Cc1ccc(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)cc1Cl ZINC000329027345 571319223 /nfs/dbraw/zinc/31/92/23/571319223.db2.gz PSBJYTIKCDLAMQ-UHFFFAOYSA-N 0 0 366.896 5.481 40 0 FKABRN Cc1cc(Nc2cc(C3CC3)nc(NC3CCCCC3)n2)ccc1C(C)C ZINC000329030357 223129568 /nfs/dbraw/zinc/12/95/68/223129568.db2.gz QDMDHFBRHZVYDP-UHFFFAOYSA-N 0 0 364.537 5.696 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(C(C)(C)C)cc2)cc(C(F)(F)F)n1 ZINC000329031732 529357660 /nfs/dbraw/zinc/35/76/60/529357660.db2.gz QKQKFXJAAUMIKX-GFCCVEGCSA-N 0 0 366.431 5.169 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(C(C)(C)C)cc2)cc(C(F)(F)F)n1 ZINC000329031733 571319196 /nfs/dbraw/zinc/31/91/96/571319196.db2.gz QKQKFXJAAUMIKX-LBPRGKRZSA-N 0 0 366.431 5.169 40 0 FKABRN CC1(C)Cc2ccccc2CN1c1cc(Nc2ccccc2)nc(C2CC2)n1 ZINC000329031765 132372890 /nfs/dbraw/zinc/37/28/90/132372890.db2.gz QLENMBUJYYCZAE-UHFFFAOYSA-N 0 0 370.500 5.439 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(C(C)(C)C)cc2)cc(C(F)(F)F)n1 ZINC000329031775 571319216 /nfs/dbraw/zinc/31/92/16/571319216.db2.gz QLJLXUMFRREJNZ-UHFFFAOYSA-N 0 0 366.431 5.747 40 0 FKABRN CC(C)(C)Nc1nc(Nc2cc(Cl)ccc2F)cc(-c2ccccc2)n1 ZINC000329031819 203846753 /nfs/dbraw/zinc/84/67/53/203846753.db2.gz QLUXMXOYDXXNOB-UHFFFAOYSA-N 0 0 370.859 5.312 40 0 FKABRN Fc1ccc(-c2nc(Cl)cc(Nc3cccc(Cl)c3Cl)n2)cc1 ZINC000329032891 571319247 /nfs/dbraw/zinc/31/92/47/571319247.db2.gz QRFSRLWBBYJRRW-UHFFFAOYSA-N 0 0 368.626 5.408 40 0 FKABRN Cc1cc(Nc2cc(-c3cccnc3)nc(NC(C)(C)C)n2)ccc1Cl ZINC000329033245 571319236 /nfs/dbraw/zinc/31/92/36/571319236.db2.gz QRVSJNYVLYBSEO-UHFFFAOYSA-N 0 0 367.884 5.454 40 0 FKABRN CC(C)(C)Nc1nc(NCc2cccc(Cl)c2)cc(-c2ccccc2)n1 ZINC000329033721 571319233 /nfs/dbraw/zinc/31/92/33/571319233.db2.gz QVFILJIMSQYPAW-UHFFFAOYSA-N 0 0 366.896 5.041 40 0 FKABRN CC(C)(C)c1ccc(Nc2cc(Cl)nc(-c3ccc(F)cc3)n2)cc1 ZINC000329033770 571319222 /nfs/dbraw/zinc/31/92/22/571319222.db2.gz QVXZSENANTVWFX-UHFFFAOYSA-N 0 0 355.844 5.399 40 0 FKABRN CC1(C)CN(c2cc(Nc3ccccc3)nc(C3CC3)n2)Cc2ccccc21 ZINC000329035434 132372931 /nfs/dbraw/zinc/37/29/31/132372931.db2.gz RETBARZIRZTOFS-UHFFFAOYSA-N 0 0 370.500 5.395 40 0 FKABRN CC(C)(C)c1ccc(Nc2cc(Cl)nc(-c3cccc(F)c3)n2)cc1 ZINC000329036403 210133656 /nfs/dbraw/zinc/13/36/56/210133656.db2.gz RIIFYFPQHKPRGO-UHFFFAOYSA-N 0 0 355.844 5.977 40 0 FKABRN Clc1ccc(Nc2cc(-c3ccccc3)nc(NC3CCCC3)n2)cc1 ZINC000329037055 203846517 /nfs/dbraw/zinc/84/65/17/203846517.db2.gz RLQUMIOONWRDRW-UHFFFAOYSA-N 0 0 364.880 5.317 40 0 FKABRN Clc1ccc(NNc2cc(Cl)nc(-c3ccccc3)n2)c(Cl)c1 ZINC000329039133 571319205 /nfs/dbraw/zinc/31/92/05/571319205.db2.gz RVWIRQQRBRVKNU-UHFFFAOYSA-N 0 0 365.651 5.543 40 0 FKABRN Cc1cc(Nc2cc(C3CC3)nc(NC3CCCCC3)n2)ccc1Cl ZINC000329040810 223130627 /nfs/dbraw/zinc/13/06/27/223130627.db2.gz SGAWTJJVYNAMPP-UHFFFAOYSA-N 0 0 356.901 5.226 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(Cl)cc2)cc(-c2cccnc2)n1 ZINC000329045467 571319243 /nfs/dbraw/zinc/31/92/43/571319243.db2.gz TVKGVOMIVBOZHU-UHFFFAOYSA-N 0 0 353.857 5.146 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)ccc1Cl ZINC000329045542 223130792 /nfs/dbraw/zinc/13/07/92/223130792.db2.gz TWLBSEPFHSVEEQ-UHFFFAOYSA-N 0 0 366.896 6.059 40 0 FKABRN Cc1ccc(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)c(Cl)c1 ZINC000329047654 223131396 /nfs/dbraw/zinc/13/13/96/223131396.db2.gz UFYFFWXPROYCAW-UHFFFAOYSA-N 0 0 366.896 5.481 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(Cl)c(Cl)c2)cc(C2CC2)n1 ZINC000329049064 571319229 /nfs/dbraw/zinc/31/92/29/571319229.db2.gz UNJWRMFUIBFPSD-UHFFFAOYSA-N 0 0 351.281 5.037 40 0 FKABRN CC(C)(C)Nc1nc(Nc2c(F)cccc2Cl)cc(-c2ccccc2)n1 ZINC000329049511 571319210 /nfs/dbraw/zinc/31/92/10/571319210.db2.gz UOUDXDLKPILDRU-UHFFFAOYSA-N 0 0 370.859 5.312 40 0 FKABRN CCc1cc(N2Cc3ccccc3CC2(C)C)nc(Nc2ccccc2)n1 ZINC000329050011 132373000 /nfs/dbraw/zinc/37/30/00/132373000.db2.gz URIUDDFFUJJQDD-UHFFFAOYSA-N 0 0 358.489 5.124 40 0 FKABRN CC1(C)CN(c2cc(NC3CCCC3)nc(C3CC3)n2)Cc2ccccc21 ZINC000329050865 132373087 /nfs/dbraw/zinc/37/30/87/132373087.db2.gz UVJGJVSPRQBEKU-UHFFFAOYSA-N 0 0 362.521 5.006 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(F)c(Cl)c2)cc(-c2ccccc2)n1 ZINC000329051475 571319214 /nfs/dbraw/zinc/31/92/14/571319214.db2.gz UYADGWYSLVAIRO-UHFFFAOYSA-N 0 0 370.859 5.312 40 0 FKABRN CCOc1ccc(Nc2cc(-c3ccccc3)nc(NC3CCCC3)n2)cc1 ZINC000329051890 571319203 /nfs/dbraw/zinc/31/92/03/571319203.db2.gz UYMDTYMUMVZHCG-UHFFFAOYSA-N 0 0 374.488 5.062 40 0 FKABRN CCC[C@H]1CC[C@H](C(=O)Oc2ccc([C@H]3CC[C@H](CCC)CC3)cc2)CC1 ZINC000329051919 528383955 /nfs/dbraw/zinc/38/39/55/528383955.db2.gz UZJWKZVGCKRFQL-CTOYOCAESA-N 0 0 370.577 7.272 40 0 FKABRN Fc1ccccc1Nc1cc(Cl)nc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000329051953 223130810 /nfs/dbraw/zinc/13/08/10/223130810.db2.gz VANOSMLOFMIFEY-UHFFFAOYSA-N 0 0 367.733 5.120 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccc3)nc(NC(C)C)n2)ccc1Cl ZINC000329052585 571319206 /nfs/dbraw/zinc/31/92/06/571319206.db2.gz VCOJSDJUUIACHC-UHFFFAOYSA-N 0 0 352.869 5.091 40 0 FKABRN Cc1cc(Nc2cc(Cl)nc(-c3ccc(F)cc3)n2)c(C)cc1Cl ZINC000329052634 210133184 /nfs/dbraw/zinc/13/31/84/210133184.db2.gz VDBNOEVTCGRGAD-UHFFFAOYSA-N 0 0 362.235 5.950 40 0 FKABRN CC(C)(C)Nc1nc(Nc2ccc(C(C)(C)C)cc2)cc(-c2ccccc2)n1 ZINC000329053973 526337458 /nfs/dbraw/zinc/33/74/58/526337458.db2.gz VIRZLUOLUSEJIO-UHFFFAOYSA-N 0 0 374.532 6.395 40 0 FKABRN Cc1ccccc1Nc1cc(Cl)nc(-c2cccc(C(F)(F)F)c2)n1 ZINC000329055328 571319220 /nfs/dbraw/zinc/31/92/20/571319220.db2.gz VMQLQUZUMWISGH-UHFFFAOYSA-N 0 0 363.770 5.290 40 0 FKABRN Cc1ccc(C)c(Nc2cc(-c3ccccc3)nc(NC3CCCCC3)n2)c1 ZINC000329056105 533675971 /nfs/dbraw/zinc/67/59/71/533675971.db2.gz VQWKHCLSHJAXCT-UHFFFAOYSA-N 0 0 372.516 5.092 40 0 FKABRN CC(C)c1cc(N2Cc3ccccc3CC2(C)C)nc(Nc2ccccc2)n1 ZINC000329058331 132372971 /nfs/dbraw/zinc/37/29/71/132372971.db2.gz WCCODRGJMHULEE-UHFFFAOYSA-N 0 0 372.516 5.107 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)ccc1C(C)C ZINC000329059164 210133157 /nfs/dbraw/zinc/13/31/57/210133157.db2.gz WGJKLLBAHSOZNF-UHFFFAOYSA-N 0 0 374.532 6.529 40 0 FKABRN CSc1cccc(Nc2cc(-c3ccccc3)nc(NC(C)(C)C)n2)c1 ZINC000329060252 533019168 /nfs/dbraw/zinc/01/91/68/533019168.db2.gz WKNNXUINHICQDC-UHFFFAOYSA-N 0 0 364.518 5.241 40 0 FKABRN CC(C)(C)Nc1nc(Nc2c(Cl)cccc2Cl)cc(C2CC2)n1 ZINC000329060304 571319245 /nfs/dbraw/zinc/31/92/45/571319245.db2.gz WLDWHMNKFIWCQV-UHFFFAOYSA-N 0 0 351.281 5.037 40 0 FKABRN C[C@H]1Cc2ccccc2CN1c1cc(Nc2ccccc2)nc(C2CC2)n1 ZINC000329060843 571319281 /nfs/dbraw/zinc/31/92/81/571319281.db2.gz WOTMGJYYSUOLAX-INIZCTEOSA-N 0 0 356.473 5.049 40 0 FKABRN C[C@@H]1Cc2ccccc2CN1c1cc(Nc2ccccc2)nc(C2CC2)n1 ZINC000329060845 571319262 /nfs/dbraw/zinc/31/92/62/571319262.db2.gz WOTMGJYYSUOLAX-MRXNPFEDSA-N 0 0 356.473 5.049 40 0 FKABRN Cc1cc(F)ccc1Nc1cc(-c2ccccc2)nc(NC2CCCC2)n1 ZINC000329061356 571319268 /nfs/dbraw/zinc/31/92/68/571319268.db2.gz WSGWTHKNXOYQRB-UHFFFAOYSA-N 0 0 362.452 5.111 40 0 FKABRN CC(C)(C)c1ccc(Nc2cc(C3CC3)nc(NC3CCCCC3)n2)cc1 ZINC000329062822 571319273 /nfs/dbraw/zinc/31/92/73/571319273.db2.gz WZKRJMADONKEQX-UHFFFAOYSA-N 0 0 364.537 5.562 40 0 FKABRN CC(C)(C)c1ccc(Nc2cc(C3CC3)nc(NC3CCCC3)n2)cc1 ZINC000329064681 526784368 /nfs/dbraw/zinc/78/43/68/526784368.db2.gz XLPDJODZPYHBNM-UHFFFAOYSA-N 0 0 350.510 5.172 40 0 FKABRN CCc1cc(N2Cc3ccccc3C(C)(C)C2)nc(Nc2ccccc2)n1 ZINC000329064710 132372988 /nfs/dbraw/zinc/37/29/88/132372988.db2.gz XMLHMTGYULUMIZ-UHFFFAOYSA-N 0 0 358.489 5.080 40 0 FKABRN C[C@H]1Cc2ccccc2CN1c1cc(NC2CCCCC2)nc(C2CC2)n1 ZINC000329065079 132372991 /nfs/dbraw/zinc/37/29/91/132372991.db2.gz XOWFYSCMMVASJM-INIZCTEOSA-N 0 0 362.521 5.050 40 0 FKABRN C[C@@H]1Cc2ccccc2CN1c1cc(NC2CCCCC2)nc(C2CC2)n1 ZINC000329065080 132373033 /nfs/dbraw/zinc/37/30/33/132373033.db2.gz XOWFYSCMMVASJM-MRXNPFEDSA-N 0 0 362.521 5.050 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(C(C)C)c(C)c2)cc(-c2ccccc2)n1 ZINC000329065369 529357490 /nfs/dbraw/zinc/35/74/90/529357490.db2.gz XQRTZGJTJKSIRN-GOSISDBHSA-N 0 0 374.532 5.951 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(C(C)C)c(C)c2)cc(-c2ccccc2)n1 ZINC000329065381 529702416 /nfs/dbraw/zinc/70/24/16/529702416.db2.gz XQRTZGJTJKSIRN-SFHVURJKSA-N 0 0 374.532 5.951 40 0 FKABRN Cc1cc(Nc2cc(C(F)(F)F)nc(NC(C)(C)C)n2)ccc1C(C)C ZINC000329066894 223132684 /nfs/dbraw/zinc/13/26/84/223132684.db2.gz YEBAEEMXJIJEKL-UHFFFAOYSA-N 0 0 366.431 5.881 40 0 FKABRN Cc1cc(Cl)cc(C)c1Nc1cc(C(F)(F)F)nc(NC(C)(C)C)n1 ZINC000329067957 210134874 /nfs/dbraw/zinc/13/48/74/210134874.db2.gz YKVZPOKPAMALFH-UHFFFAOYSA-N 0 0 372.822 5.142 40 0 FKABRN CC(C)c1nc(Nc2ccccc2)cc(N2Cc3ccccc3C[C@@H]2C)n1 ZINC000329068051 132373214 /nfs/dbraw/zinc/37/32/14/132373214.db2.gz YNMGPTPLIVXONK-KRWDZBQOSA-N 0 0 358.489 5.295 40 0 FKABRN CC(C)c1nc(Nc2ccccc2)cc(N2Cc3ccccc3C[C@H]2C)n1 ZINC000329068052 132373192 /nfs/dbraw/zinc/37/31/92/132373192.db2.gz YNMGPTPLIVXONK-QGZVFWFLSA-N 0 0 358.489 5.295 40 0 FKABRN Cc1cc(Nc2cc(-c3ccccc3)nc(NC3CC3)n2)ccc1C(C)C ZINC000329068630 571319288 /nfs/dbraw/zinc/31/92/88/571319288.db2.gz YRLFDPKGLBBPTC-UHFFFAOYSA-N 0 0 358.489 5.315 40 0 FKABRN Cc1cc(Nc2cc(C(F)(F)F)nc(NC(C)(C)C)n2)ccc1Cl ZINC000329070324 571319254 /nfs/dbraw/zinc/31/92/54/571319254.db2.gz ZGFBUNDWURBSBD-UHFFFAOYSA-N 0 0 358.795 5.411 40 0 FKABRN Fc1cccc(-c2nc(Cl)cc(Nc3ccc(C(F)(F)F)cc3)n2)c1 ZINC000329070938 571319278 /nfs/dbraw/zinc/31/92/78/571319278.db2.gz ZLQSHWDFCJFCQG-UHFFFAOYSA-N 0 0 367.733 5.699 40 0 FKABRN CC[C@H](C)Nc1nc(Nc2ccc(C(C)(C)C)cc2)cc(-c2ccccc2)n1 ZINC000329071945 571319257 /nfs/dbraw/zinc/31/92/57/571319257.db2.gz ZTXXJJCNGSAKSS-KRWDZBQOSA-N 0 0 374.532 5.817 40 0 FKABRN CC[C@@H](C)Nc1nc(Nc2ccc(C(C)(C)C)cc2)cc(-c2ccccc2)n1 ZINC000329071948 571319285 /nfs/dbraw/zinc/31/92/85/571319285.db2.gz ZTXXJJCNGSAKSS-QGZVFWFLSA-N 0 0 374.532 5.817 40 0 FKABRN Clc1ccc(-c2nnc(-c3ccc(Cl)cc3Cl)nn2)c(Cl)c1 ZINC000329788161 210149967 /nfs/dbraw/zinc/14/99/67/210149967.db2.gz UOICQSIWERGKBS-UHFFFAOYSA-N 0 0 372.042 5.214 40 0 FKABRN Cc1c(NC(=O)c2ccc(C(F)(F)F)nc2C)onc1C1CCCCC1 ZINC000332716027 571121157 /nfs/dbraw/zinc/12/11/57/571121157.db2.gz ZHDDEEDGCLZDET-UHFFFAOYSA-N 0 0 367.371 5.005 40 0 FKABRN CCOc1c(Br)cc(CNc2cc(C)ccc2C)cc1OC ZINC000386498195 571103515 /nfs/dbraw/zinc/10/35/15/571103515.db2.gz PTBVPTOOGNNCOZ-UHFFFAOYSA-N 0 0 364.283 5.085 40 0 FKABRN CCCOc1ccc(Br)cc1CNc1ccc(OCC)cc1 ZINC000387346414 571104229 /nfs/dbraw/zinc/10/42/29/571104229.db2.gz XFKAAWRGXZZXGV-UHFFFAOYSA-N 0 0 364.283 5.249 40 0 FKABRN CCc1c(NC(=O)OC(C)(C)C)cc(C(F)(F)F)cc1C(F)(F)F ZINC000390823079 523724627 /nfs/dbraw/zinc/72/46/27/523724627.db2.gz RYBFCXFMSYTORG-UHFFFAOYSA-N 0 0 357.294 5.634 40 0 FKABRN Cc1ccc(-c2ccc(OC(=O)c3ccc(Cl)cc3Cl)nn2)cc1C ZINC000408526870 570507994 /nfs/dbraw/zinc/50/79/94/570507994.db2.gz BXRNXMNASGQLDB-UHFFFAOYSA-N 0 0 373.239 5.286 40 0 FKABRN CCOc1ccccc1-c1nc(SCc2cccc3ccccc32)n[nH]1 ZINC000408527112 570939622 /nfs/dbraw/zinc/93/96/22/570939622.db2.gz KYJUOJPGEZHPHX-UHFFFAOYSA-N 0 0 361.470 5.316 40 0 FKABRN O=C(Oc1ccc(-c2ccc(-c3ccccc3)cc2)nn1)c1cccs1 ZINC000408527181 570939867 /nfs/dbraw/zinc/93/98/67/570939867.db2.gz BETXMCOYSVYVMS-UHFFFAOYSA-N 0 0 358.422 5.091 40 0 FKABRN Cc1ccc(C)c(-c2ccc(OC(=O)c3ccc(Cl)cc3Cl)nn2)c1 ZINC000408527711 570939859 /nfs/dbraw/zinc/93/98/59/570939859.db2.gz HEWVXCKKQQNDIG-UHFFFAOYSA-N 0 0 373.239 5.286 40 0 FKABRN O=C(Oc1ccc(-c2ccc(Oc3ccccc3)cc2)nn1)c1ccccc1 ZINC000408527753 570507422 /nfs/dbraw/zinc/50/74/22/570507422.db2.gz HOBXWLHUDZBCKD-UHFFFAOYSA-N 0 0 368.392 5.155 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2cccc3ccccc32)cc1OCC ZINC000408527756 570939786 /nfs/dbraw/zinc/93/97/86/570939786.db2.gz CNZIRZWGUDDAHI-UHFFFAOYSA-N 0 0 363.457 5.670 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2cc(Cl)ccc2C)cc1OCC ZINC000408527935 570940375 /nfs/dbraw/zinc/94/03/75/570940375.db2.gz DJGKGIXOFKISLN-UHFFFAOYSA-N 0 0 361.869 5.478 40 0 FKABRN Cc1ccc(-c2ccc(OC(=O)c3cccc4ccccc43)nn2)cc1C ZINC000408528559 570508631 /nfs/dbraw/zinc/50/86/31/570508631.db2.gz JDGDPQGHLKTRHR-UHFFFAOYSA-N 0 0 354.409 5.133 40 0 FKABRN Cc1ccccc1C(=O)Oc1ccc(-c2ccc(-c3ccccc3)cc2)nn1 ZINC000408528615 570940351 /nfs/dbraw/zinc/94/03/51/570940351.db2.gz FOAJDGVLCFZVGD-UHFFFAOYSA-N 0 0 366.420 5.338 40 0 FKABRN Cc1ccc(C)c(-c2ccc(OC(=O)c3cccc4ccccc43)nn2)c1 ZINC000408528856 570509039 /nfs/dbraw/zinc/50/90/39/570509039.db2.gz LNZATRMNSAJJBV-UHFFFAOYSA-N 0 0 354.409 5.133 40 0 FKABRN O=C(Oc1ccc(-c2ccc(Oc3ccccc3)cc2)nn1)c1cccs1 ZINC000408529787 570941041 /nfs/dbraw/zinc/94/10/41/570941041.db2.gz OQJLBEQIOZARHV-UHFFFAOYSA-N 0 0 374.421 5.217 40 0 FKABRN Cc1cccc(C(=O)Oc2ccc(-c3ccc(-c4ccccc4)cc3)nn2)c1 ZINC000408529948 570940741 /nfs/dbraw/zinc/94/07/41/570940741.db2.gz ICBUWBJSWRGYLZ-UHFFFAOYSA-N 0 0 366.420 5.338 40 0 FKABRN O=C(Oc1ccc(-c2ccc(-c3ccccc3)cc2)nn1)c1ccc(F)cc1 ZINC000408530514 570940225 /nfs/dbraw/zinc/94/02/25/570940225.db2.gz JODCLEYONKTDGP-UHFFFAOYSA-N 0 0 370.383 5.169 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1OCC ZINC000408530878 570941684 /nfs/dbraw/zinc/94/16/84/570941684.db2.gz KLXGBPNAIMSQDG-UHFFFAOYSA-N 0 0 363.457 5.670 40 0 FKABRN CCCCOc1ccc(Br)cc1/C=C1\C(=O)Nc2ccccc21 ZINC000408530899 570941774 /nfs/dbraw/zinc/94/17/74/570941774.db2.gz KONGDPBLBWNBCY-VBKFSLOCSA-N 0 0 372.262 5.121 40 0 FKABRN Cc1ccc(C)c(-c2ccc(OC(=O)c3ccc(C(C)(C)C)cc3)nn2)c1 ZINC000408530912 570941879 /nfs/dbraw/zinc/94/18/79/570941879.db2.gz SCMHHFZSTAJVSQ-UHFFFAOYSA-N 0 0 360.457 5.277 40 0 FKABRN Cc1ccc(C(=O)Oc2ccc(-c3ccc(-c4ccccc4)cc3)nn2)cc1 ZINC000408531153 570941830 /nfs/dbraw/zinc/94/18/30/570941830.db2.gz KYHJZTPDAFLDSC-UHFFFAOYSA-N 0 0 366.420 5.338 40 0 FKABRN Cc1ccc(-c2ccc(OC(=O)c3ccc(C(C)(C)C)cc3)nn2)cc1C ZINC000408532456 570940664 /nfs/dbraw/zinc/94/06/64/570940664.db2.gz YMXPRSKCZGXHQH-UHFFFAOYSA-N 0 0 360.457 5.277 40 0 FKABRN O=C(Oc1ccc(-c2ccc(-c3ccccc3)cc2)nn1)c1ccccc1 ZINC000408533293 570942412 /nfs/dbraw/zinc/94/24/12/570942412.db2.gz QGOFZYLFDSIQFC-UHFFFAOYSA-N 0 0 352.393 5.030 40 0 FKABRN O=C(Oc1ccc(-c2ccc(-c3ccccc3)cc2)nn1)c1cccc(F)c1 ZINC000408534662 570942927 /nfs/dbraw/zinc/94/29/27/570942927.db2.gz VVMIVAYBKZLICF-UHFFFAOYSA-N 0 0 370.383 5.169 40 0 FKABRN O=C(Oc1ccc(-c2ccc(-c3ccccc3)cc2)nn1)c1ccccc1F ZINC000408535015 570942610 /nfs/dbraw/zinc/94/26/10/570942610.db2.gz XEVCKZQKPPFYPQ-UHFFFAOYSA-N 0 0 370.383 5.169 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2ccc(C)c(Cl)c2)cc1OCC ZINC000408535166 570942919 /nfs/dbraw/zinc/94/29/19/570942919.db2.gz YEHRSWXHGSJTNQ-UHFFFAOYSA-N 0 0 361.869 5.478 40 0 FKABRN CCOc1cc(COc2ccccc2C=O)ccc1OCc1ccccc1 ZINC000408540411 570943815 /nfs/dbraw/zinc/94/38/15/570943815.db2.gz RJIQWLCLEXXNGN-UHFFFAOYSA-N 0 0 362.425 5.056 40 0 FKABRN COCc1nn2c(nc(C)cc2-c2ccc(Cl)cc2)c1-c1ccccc1 ZINC000408541163 570527974 /nfs/dbraw/zinc/52/79/74/570527974.db2.gz BTWXETUNGCXZNZ-UHFFFAOYSA-N 0 0 363.848 5.172 40 0 FKABRN O=C(CSc1cccc2ccccc21)NC12CC3CC(CC(C3)C1)C2 ZINC000408544202 570527129 /nfs/dbraw/zinc/52/71/29/570527129.db2.gz TYTCLXGJUAEVLO-UHFFFAOYSA-N 0 0 351.515 5.017 40 0 FKABRN CSc1ccccc1C(=O)Nc1cc(Cl)ccc1Oc1ccccc1 ZINC000408544571 570526962 /nfs/dbraw/zinc/52/69/62/570526962.db2.gz HTAFRNCGUVQXMW-UHFFFAOYSA-N 0 0 369.873 6.107 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NC3CCCCCC3)cc2)cc1 ZINC000408544643 570526989 /nfs/dbraw/zinc/52/69/89/570526989.db2.gz IFMOWRUSZWJUNV-UHFFFAOYSA-N 0 0 353.531 5.740 40 0 FKABRN Cc1ccc(/C=C/C(=O)Nc2ccc(CSc3ccccc3)cc2)cc1 ZINC000408544977 570943765 /nfs/dbraw/zinc/94/37/65/570943765.db2.gz KORXXJGAXZSFRF-DTQAZKPQSA-N 0 0 359.494 5.939 40 0 FKABRN O=C(NCCSCc1cccc(Cl)c1)Nc1cccc(Cl)c1 ZINC000408546808 570946422 /nfs/dbraw/zinc/94/64/22/570946422.db2.gz GNWMBGPZEAGXFZ-UHFFFAOYSA-N 0 0 355.290 5.048 40 0 FKABRN Cc1ccc(/C=C/C(=O)Nc2ccc(CSc3ccccc3)cc2C)cc1 ZINC000408546917 570946448 /nfs/dbraw/zinc/94/64/48/570946448.db2.gz HHCNVYZDJASDJN-FYWRMAATSA-N 0 0 373.521 6.248 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)Nc3ccccc3F)cc2)cc1 ZINC000408546988 570946336 /nfs/dbraw/zinc/94/63/36/570946336.db2.gz IBXOSMVZJVFOOQ-UHFFFAOYSA-N 0 0 351.446 5.679 40 0 FKABRN CCN(CC(=O)N1c2ccccc2Sc2ccccc21)c1ccccc1 ZINC000408547693 570944305 /nfs/dbraw/zinc/94/43/05/570944305.db2.gz LKPKYZXNZNFOCR-UHFFFAOYSA-N 0 0 360.482 5.342 40 0 FKABRN S=C(Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)NC1CCCCC1 ZINC000408547974 570528384 /nfs/dbraw/zinc/52/83/84/570528384.db2.gz BDQMPFNPABHQAQ-UHFFFAOYSA-N 0 0 368.590 5.774 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)Nc3cccc(F)c3)cc2)cc1 ZINC000408548471 570944482 /nfs/dbraw/zinc/94/44/82/570944482.db2.gz SHBMSVWVIVKUFU-UHFFFAOYSA-N 0 0 351.446 5.679 40 0 FKABRN S=C(Nc1ccc(Oc2ccccc2Cl)cc1)NC1CCCCC1 ZINC000408548668 570944924 /nfs/dbraw/zinc/94/49/24/570944924.db2.gz KWZJOTLICMRHRB-UHFFFAOYSA-N 0 0 360.910 5.751 40 0 FKABRN COc1ccc(Oc2ccc(NC(=S)NC3CCCCC3)cc2)cc1 ZINC000408549155 570945589 /nfs/dbraw/zinc/94/55/89/570945589.db2.gz PZHUGBNWAZGOSH-UHFFFAOYSA-N 0 0 356.491 5.107 40 0 FKABRN S=C(Nc1ccc(Oc2cccc(Cl)c2)cc1)NC1CCCCC1 ZINC000408549483 570945543 /nfs/dbraw/zinc/94/55/43/570945543.db2.gz UISDPUBZNLYNKN-UHFFFAOYSA-N 0 0 360.910 5.751 40 0 FKABRN COc1cc(C(=O)Nc2ccc(C)cc2)ccc1OCc1ccc(C)cc1 ZINC000408551024 570947051 /nfs/dbraw/zinc/94/70/51/570947051.db2.gz AERSKFZDOFOGCA-UHFFFAOYSA-N 0 0 361.441 5.143 40 0 FKABRN COc1cc(C(=O)Nc2cccc(C)c2)ccc1OCc1ccc(C)cc1 ZINC000408551455 570946846 /nfs/dbraw/zinc/94/68/46/570946846.db2.gz CUNVWOCJEKGJLB-UHFFFAOYSA-N 0 0 361.441 5.143 40 0 FKABRN O=C1CS[C@@H](c2c(Cl)cccc2Cl)N1c1ccc(Cl)cc1 ZINC000408553585 570546404 /nfs/dbraw/zinc/54/64/04/570546404.db2.gz AUUFGSPQRFMIJP-HNNXBMFYSA-N 0 0 358.677 5.425 40 0 FKABRN O=C1CS[C@H](c2c(Cl)cccc2Cl)N1c1ccc(Cl)cc1 ZINC000408553589 570546389 /nfs/dbraw/zinc/54/63/89/570546389.db2.gz AUUFGSPQRFMIJP-OAHLLOKOSA-N 0 0 358.677 5.425 40 0 FKABRN Cc1ccc(-c2cc(C(F)(F)F)nc(Sc3ccc(C=O)o3)n2)cc1 ZINC000408553603 570946907 /nfs/dbraw/zinc/94/69/07/570946907.db2.gz AXHMJKOWMQZCAA-UHFFFAOYSA-N 0 0 364.348 5.028 40 0 FKABRN CCOc1ccc([C@@H]2SCC(=O)N2c2ccc(Cl)cc2)cc1Cl ZINC000408555599 570947737 /nfs/dbraw/zinc/94/77/37/570947737.db2.gz GMANSUUFFHIWGI-KRWDZBQOSA-N 0 0 368.285 5.171 40 0 FKABRN CCOc1ccc([C@H]2SCC(=O)N2c2ccc(Cl)cc2)cc1Cl ZINC000408555604 570550787 /nfs/dbraw/zinc/55/07/87/570550787.db2.gz GMANSUUFFHIWGI-QGZVFWFLSA-N 0 0 368.285 5.171 40 0 FKABRN CCOc1cc(C(=O)Nc2cccc(F)c2)ccc1OCc1ccccc1 ZINC000408555637 570947841 /nfs/dbraw/zinc/94/78/41/570947841.db2.gz HMEPEXQWFKPDEY-UHFFFAOYSA-N 0 0 365.404 5.056 40 0 FKABRN COc1ccc2ccccc2c1[C@@H]1SCC(=O)N1c1ccc(Cl)cc1 ZINC000408557169 570554050 /nfs/dbraw/zinc/55/40/50/570554050.db2.gz NIOAYBGSNAAPHS-FQEVSTJZSA-N 0 0 369.873 5.280 40 0 FKABRN COc1ccc2ccccc2c1[C@H]1SCC(=O)N1c1ccc(Cl)cc1 ZINC000408557170 570553842 /nfs/dbraw/zinc/55/38/42/570553842.db2.gz NIOAYBGSNAAPHS-HXUWFJFHSA-N 0 0 369.873 5.280 40 0 FKABRN CCCOc1ccccc1CNc1ccc(Br)c(Cl)c1 ZINC000408557321 570553910 /nfs/dbraw/zinc/55/39/10/570553910.db2.gz MNKUHFNYVJSWCM-UHFFFAOYSA-N 0 0 354.675 5.503 40 0 FKABRN CCOc1ccc(Cl)cc1[C@@H]1SCC(=O)N1c1ccc(Cl)cc1 ZINC000408558869 570554299 /nfs/dbraw/zinc/55/42/99/570554299.db2.gz SVKCVLPSOWIDSG-KRWDZBQOSA-N 0 0 368.285 5.171 40 0 FKABRN CCOc1ccc(Cl)cc1[C@H]1SCC(=O)N1c1ccc(Cl)cc1 ZINC000408558873 570948154 /nfs/dbraw/zinc/94/81/54/570948154.db2.gz SVKCVLPSOWIDSG-QGZVFWFLSA-N 0 0 368.285 5.171 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)c(C)s/c1=N\C(=O)c1cccc(F)c1 ZINC000408559676 570948295 /nfs/dbraw/zinc/94/82/95/570948295.db2.gz AWEPGYMNIVRZHD-QOCHGBHMSA-N 0 0 374.868 5.079 40 0 FKABRN CCc1s/c(=N\C(=O)c2cccc(Cl)c2)n(CC)c1-c1ccccc1 ZINC000408559682 570554453 /nfs/dbraw/zinc/55/44/53/570554453.db2.gz AYRFRORDLGANRU-XDOYNYLZSA-N 0 0 370.905 5.193 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)c(C)s/c1=N\C(=O)c1cccs1 ZINC000408559688 570554296 /nfs/dbraw/zinc/55/42/96/570554296.db2.gz BDLSWVSGSGYWKE-ZPHPHTNESA-N 0 0 362.907 5.001 40 0 FKABRN CCn1c(-c2ccc(C)c(C)c2)c(C)s/c1=N\C(=O)c1cccc(C)c1 ZINC000408560513 570554649 /nfs/dbraw/zinc/55/46/49/570554649.db2.gz DAKVSLURZBODDW-FCQUAONHSA-N 0 0 364.514 5.211 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccccc2F)n(CC)c1-c1ccccc1 ZINC000408560641 570948120 /nfs/dbraw/zinc/94/81/20/570948120.db2.gz DRSWBAGEWHRZKN-LNVKXUELSA-N 0 0 368.477 5.069 40 0 FKABRN CCn1c(-c2ccc(F)cc2)c(C)s/c1=N\C(=O)c1ccc(Cl)cc1 ZINC000408560646 570554697 /nfs/dbraw/zinc/55/46/97/570554697.db2.gz DTECIUDKPMHSPB-QOCHGBHMSA-N 0 0 374.868 5.079 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccc(C)cc2)n(CC)c1-c1ccccc1 ZINC000408560741 570948286 /nfs/dbraw/zinc/94/82/86/570948286.db2.gz DZXCKQCQVJFZSM-FCQUAONHSA-N 0 0 364.514 5.239 40 0 FKABRN CCn1c(-c2ccc(C)c(C)c2)c(C)s/c1=N\C(=O)c1ccc(C)cc1 ZINC000408560959 570554632 /nfs/dbraw/zinc/55/46/32/570554632.db2.gz GDEGPCBCOZRCSC-FCQUAONHSA-N 0 0 364.514 5.211 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)c(C)s/c1=N\C(=O)c1ccc(F)cc1 ZINC000408561052 263471418 /nfs/dbraw/zinc/47/14/18/263471418.db2.gz GECAZSITLQTWSS-QOCHGBHMSA-N 0 0 374.868 5.079 40 0 FKABRN CCc1s/c(=N\C(=O)c2ccccc2Cl)n(CC)c1-c1ccccc1 ZINC000408561074 570948086 /nfs/dbraw/zinc/94/80/86/570948086.db2.gz GHOJVPVHZQWDKA-XDOYNYLZSA-N 0 0 370.905 5.193 40 0 FKABRN CCc1s/c(=N\C(=O)c2ccccc2)n(CC)c1-c1ccc(Cl)cc1 ZINC000408561103 570555321 /nfs/dbraw/zinc/55/53/21/570555321.db2.gz GOORWFWIDHVLJZ-XDOYNYLZSA-N 0 0 370.905 5.193 40 0 FKABRN CCc1s/c(=N\C(=O)c2cccs2)n(CC)c1-c1ccc(C)c(C)c1 ZINC000408561167 263471281 /nfs/dbraw/zinc/47/12/81/263471281.db2.gz GZBUZXNIOOEFAH-MRCUWXFGSA-N 0 0 370.543 5.218 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccco2)n(CC)c1-c1ccc(Cl)cc1 ZINC000408561299 263471443 /nfs/dbraw/zinc/47/14/43/263471443.db2.gz HLWYEURZZWBYME-VZCXRCSSSA-N 0 0 374.893 5.177 40 0 FKABRN CCn1c(-c2ccc(C)c(C)c2)c(C)s/c1=N\C(=O)c1ccccc1C ZINC000408561332 570948065 /nfs/dbraw/zinc/94/80/65/570948065.db2.gz HWXXCPPLHCWTCN-FCQUAONHSA-N 0 0 364.514 5.211 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccc(F)cc2)n(CC)c1-c1ccccc1 ZINC000408561396 570555071 /nfs/dbraw/zinc/55/50/71/570555071.db2.gz IVNPYSMISDRAFS-LNVKXUELSA-N 0 0 368.477 5.069 40 0 FKABRN CCn1c(-c2ccc(F)cc2)c(C)s/c1=N\C(=O)c1ccccc1Cl ZINC000408561545 570948146 /nfs/dbraw/zinc/94/81/46/570948146.db2.gz JKXDVNNGDNGSEA-QOCHGBHMSA-N 0 0 374.868 5.079 40 0 FKABRN CCn1c(-c2ccc(C)c(C)c2)c(C)s/c1=N\C(=O)c1cccc(F)c1 ZINC000408561561 570948077 /nfs/dbraw/zinc/94/80/77/570948077.db2.gz JRJFUXOCMQDQIE-LNVKXUELSA-N 0 0 368.477 5.042 40 0 FKABRN O=C(Nc1nc(C(F)(F)F)c(-c2ccccc2)s1)c1ccc(F)cc1 ZINC000408561568 263471649 /nfs/dbraw/zinc/47/16/49/263471649.db2.gz JTUIZVQLFRDWPH-UHFFFAOYSA-N 0 0 366.339 5.220 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccccc2C)n(CC)c1-c1ccccc1 ZINC000408561747 263471637 /nfs/dbraw/zinc/47/16/37/263471637.db2.gz KWIWYFAVBWINIR-FCQUAONHSA-N 0 0 364.514 5.239 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)c(C)s/c1=N\C(=O)c1ccccc1F ZINC000408561758 263471706 /nfs/dbraw/zinc/47/17/06/263471706.db2.gz KXRBGDUVAFPGOE-QOCHGBHMSA-N 0 0 374.868 5.079 40 0 FKABRN CCn1c(-c2ccc(C)cc2)c(C)s/c1=N\C(=O)c1ccccc1Cl ZINC000408561918 570948255 /nfs/dbraw/zinc/94/82/55/570948255.db2.gz LPMUCOJSKFODEK-XDOYNYLZSA-N 0 0 370.905 5.248 40 0 FKABRN CCCc1s/c(=N\C(=O)c2cccc(F)c2)n(CC)c1-c1ccccc1 ZINC000408561921 570555326 /nfs/dbraw/zinc/55/53/26/570555326.db2.gz LPUPFNZISMAMGE-LNVKXUELSA-N 0 0 368.477 5.069 40 0 FKABRN CCc1s/c(=N\C(=O)c2ccccc2C)n(CC)c1-c1ccc(C)cc1 ZINC000408561956 263471545 /nfs/dbraw/zinc/47/15/45/263471545.db2.gz MANRPXUDWIWZAC-FCQUAONHSA-N 0 0 364.514 5.157 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccco2)n(CC)c1-c1ccc(C)c(C)c1 ZINC000408561977 263471408 /nfs/dbraw/zinc/47/14/08/263471408.db2.gz MHJOBQFTUDMUPW-DQRAZIAOSA-N 0 0 368.502 5.140 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)c(C)s/c1=N\C(=O)c1ccc(C)cc1 ZINC000408562081 263471597 /nfs/dbraw/zinc/47/15/97/263471597.db2.gz MPYBRVRDRJJSET-XDOYNYLZSA-N 0 0 370.905 5.248 40 0 FKABRN Cc1ccc(C(=O)Nc2nc(C(F)(F)F)c(-c3ccccc3)s2)cc1 ZINC000408562142 570948760 /nfs/dbraw/zinc/94/87/60/570948760.db2.gz NFLORLWJJRCTRU-UHFFFAOYSA-N 0 0 362.376 5.390 40 0 FKABRN CCCc1s/c(=N\C(=O)c2cccs2)n(CC)c1-c1ccc(C)cc1 ZINC000408562236 570555125 /nfs/dbraw/zinc/55/51/25/570555125.db2.gz OGZILLJBBZKKAW-MRCUWXFGSA-N 0 0 370.543 5.300 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NC3CCCCCCC3)cc2)cc1 ZINC000408562536 570948597 /nfs/dbraw/zinc/94/85/97/570948597.db2.gz ABVOONBVONFGFB-UHFFFAOYSA-N 0 0 367.558 6.130 40 0 FKABRN O=C(CSCc1c(Cl)cccc1Cl)NC1CCCCCCC1 ZINC000408562563 570948904 /nfs/dbraw/zinc/94/89/04/570948904.db2.gz BGDGOQWDFVTKDN-UHFFFAOYSA-N 0 0 360.350 5.456 40 0 FKABRN CCn1c(-c2ccc(C)c(C)c2)c(C)s/c1=N\C(=O)c1ccc(F)cc1 ZINC000408562599 570555773 /nfs/dbraw/zinc/55/57/73/570555773.db2.gz QTQMLRBVOZHMND-LNVKXUELSA-N 0 0 368.477 5.042 40 0 FKABRN CCn1c(-c2ccc(C)cc2)c(C)s/c1=N\C(=O)c1cccc(Cl)c1 ZINC000408562627 570948876 /nfs/dbraw/zinc/94/88/76/570948876.db2.gz QZYFTUVMNZXTSQ-XDOYNYLZSA-N 0 0 370.905 5.248 40 0 FKABRN CCn1c(-c2ccc(C)cc2)c(C)s/c1=N\C(=O)c1ccc(Cl)cc1 ZINC000408562650 570555732 /nfs/dbraw/zinc/55/57/32/570555732.db2.gz REGXUAWMMUUQCT-XDOYNYLZSA-N 0 0 370.905 5.248 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)c(C)s/c1=N\C(=O)c1ccccc1C ZINC000408562738 570555625 /nfs/dbraw/zinc/55/56/25/570555625.db2.gz RVZSALWFJZRALY-XDOYNYLZSA-N 0 0 370.905 5.248 40 0 FKABRN CCn1c(-c2ccc(C)c(C)c2)c(C)s/c1=N\C(=O)c1ccccc1F ZINC000408562742 570555780 /nfs/dbraw/zinc/55/57/80/570555780.db2.gz RXDOOULLGPPDQS-LNVKXUELSA-N 0 0 368.477 5.042 40 0 FKABRN Cc1ccc(SCCC(=O)NC(c2ccccc2)c2ccccc2)cc1 ZINC000408562903 570948887 /nfs/dbraw/zinc/94/88/87/570948887.db2.gz GOAWFUBNGREONP-UHFFFAOYSA-N 0 0 361.510 5.383 40 0 FKABRN C[C@@H](SCc1ccccc1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000408562940 570948707 /nfs/dbraw/zinc/94/87/07/570948707.db2.gz GVHBZJLTVLLPIX-GOSISDBHSA-N 0 0 361.510 5.214 40 0 FKABRN C[C@H](SCc1ccccc1)C(=O)NC(c1ccccc1)c1ccccc1 ZINC000408562943 570555590 /nfs/dbraw/zinc/55/55/90/570555590.db2.gz GVHBZJLTVLLPIX-SFHVURJKSA-N 0 0 361.510 5.214 40 0 FKABRN Cc1cccc(C(=O)Nc2nc(C(F)(F)F)c(-c3ccccc3)s2)c1 ZINC000408563040 570555667 /nfs/dbraw/zinc/55/56/67/570555667.db2.gz TUNFUJOQDSQMDA-UHFFFAOYSA-N 0 0 362.376 5.390 40 0 FKABRN CCc1s/c(=N\C(=O)c2ccc(C)cc2)n(CC)c1-c1ccc(C)cc1 ZINC000408563053 570948776 /nfs/dbraw/zinc/94/87/76/570948776.db2.gz TWRJZOPTNOJNQN-FCQUAONHSA-N 0 0 364.514 5.157 40 0 FKABRN CC(C)Oc1cccc(NC(=O)CSCc2c(F)cccc2Cl)c1 ZINC000408563121 570555722 /nfs/dbraw/zinc/55/57/22/570555722.db2.gz IYPHEUBLJUKUHD-UHFFFAOYSA-N 0 0 367.873 5.138 40 0 FKABRN Cc1ccc(S[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1 ZINC000408563216 570555768 /nfs/dbraw/zinc/55/57/68/570555768.db2.gz ACZKYRWXDAJAKW-KRWDZBQOSA-N 0 0 363.482 5.907 40 0 FKABRN Cc1ccc(S[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1 ZINC000408563217 570948689 /nfs/dbraw/zinc/94/86/89/570948689.db2.gz ACZKYRWXDAJAKW-QGZVFWFLSA-N 0 0 363.482 5.907 40 0 FKABRN COc1ccccc1C(=O)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1 ZINC000408563318 570555531 /nfs/dbraw/zinc/55/55/31/570555531.db2.gz LIFOFVVJRALBSX-UHFFFAOYSA-N 0 0 361.485 5.415 40 0 FKABRN CCn1c(-c2ccc(F)cc2)c(C)s/c1=N\C(=O)c1cccc(Cl)c1 ZINC000408563402 570948511 /nfs/dbraw/zinc/94/85/11/570948511.db2.gz VRNFLUHRCKNMCE-QOCHGBHMSA-N 0 0 374.868 5.079 40 0 FKABRN CCc1s/c(=N\C(=O)c2ccc(Cl)cc2)n(CC)c1-c1ccccc1 ZINC000408563621 570948752 /nfs/dbraw/zinc/94/87/52/570948752.db2.gz VWTKNNSRFPCNJM-XDOYNYLZSA-N 0 0 370.905 5.193 40 0 FKABRN CCc1s/c(=N\C(=O)c2cccc(C)c2)n(CC)c1-c1ccc(C)cc1 ZINC000408563634 570948586 /nfs/dbraw/zinc/94/85/86/570948586.db2.gz VYQGSOCAOWJYSW-FCQUAONHSA-N 0 0 364.514 5.157 40 0 FKABRN Cc1ccccc1C(=O)Nc1nc(C(F)(F)F)c(-c2ccccc2)s1 ZINC000408563672 570948424 /nfs/dbraw/zinc/94/84/24/570948424.db2.gz WLAYLAOSNBPLJQ-UHFFFAOYSA-N 0 0 362.376 5.390 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)c(C)s/c1=N\C(=O)c1cccc(C)c1 ZINC000408563678 570948344 /nfs/dbraw/zinc/94/83/44/570948344.db2.gz WMCGBSKHXHYITC-XDOYNYLZSA-N 0 0 370.905 5.248 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccccc2)n(CC)c1-c1ccc(F)cc1 ZINC000408563758 570557535 /nfs/dbraw/zinc/55/75/35/570557535.db2.gz XBLYJCHIXBFRJD-LNVKXUELSA-N 0 0 368.477 5.069 40 0 FKABRN Cc1ccccc1CSCC(=O)NC(c1ccccc1)c1ccccc1 ZINC000408564003 263472177 /nfs/dbraw/zinc/47/21/77/263472177.db2.gz BYJOTSLVPZTFGT-UHFFFAOYSA-N 0 0 361.510 5.134 40 0 FKABRN CCn1c(-c2ccccc2)c(C)s/c1=N\C(=O)c1cccc2ccccc21 ZINC000408564075 570948338 /nfs/dbraw/zinc/94/83/38/570948338.db2.gz XLLSJNUASUQNOH-VHXPQNKSSA-N 0 0 372.493 5.439 40 0 FKABRN CCCc1s/c(=N\C(=O)c2ccccc2)n(CC)c1-c1ccc(C)cc1 ZINC000408564103 570557889 /nfs/dbraw/zinc/55/78/89/570557889.db2.gz XTJLWRAZUKKANT-FCQUAONHSA-N 0 0 364.514 5.239 40 0 FKABRN CCCc1s/c(=N\C(=O)c2cccc(C)c2)n(CC)c1-c1ccccc1 ZINC000408564124 263472361 /nfs/dbraw/zinc/47/23/61/263472361.db2.gz YADQKYJXOASQEC-FCQUAONHSA-N 0 0 364.514 5.239 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)CSc3ccc(C)cc3)ccc21 ZINC000408564167 570948358 /nfs/dbraw/zinc/94/83/58/570948358.db2.gz SDPDDAZCSJKRGT-UHFFFAOYSA-N 0 0 374.509 5.854 40 0 FKABRN CCCCOC(=O)c1ccc(NC(=O)CCSc2ccc(C)cc2)cc1 ZINC000408564206 570948044 /nfs/dbraw/zinc/94/80/44/570948044.db2.gz STQDAADYVMALKE-UHFFFAOYSA-N 0 0 371.502 5.073 40 0 FKABRN CCc1s/c(=N\C(=O)c2ccccc2)n(CC)c1-c1ccc(C)c(C)c1 ZINC000408564513 570558695 /nfs/dbraw/zinc/55/86/95/570558695.db2.gz ZASLGSSBDXWOLH-FCQUAONHSA-N 0 0 364.514 5.157 40 0 FKABRN CCCc1s/c(=N\C(=O)c2cccs2)n(CC)c1-c1ccc(F)cc1 ZINC000408564631 570559208 /nfs/dbraw/zinc/55/92/08/570559208.db2.gz ZZPARDSBLCXGDP-VZCXRCSSSA-N 0 0 374.506 5.131 40 0 FKABRN Cc1ccc(CSCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000408564640 263472704 /nfs/dbraw/zinc/47/27/04/263472704.db2.gz ZETJMUAAKFNYQE-UHFFFAOYSA-N 0 0 373.827 5.539 40 0 FKABRN CCCCOC(=O)c1ccc(NC(=O)[C@H](C)Sc2ccc(C)cc2)cc1 ZINC000408565315 570555628 /nfs/dbraw/zinc/55/56/28/570555628.db2.gz JQSYKUIUUHNNPQ-INIZCTEOSA-N 0 0 371.502 5.071 40 0 FKABRN CCCCOC(=O)c1ccc(NC(=O)[C@@H](C)Sc2ccc(C)cc2)cc1 ZINC000408565317 263473676 /nfs/dbraw/zinc/47/36/76/263473676.db2.gz JQSYKUIUUHNNPQ-MRXNPFEDSA-N 0 0 371.502 5.071 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3ccccc3SC)ccc21 ZINC000408565428 570555729 /nfs/dbraw/zinc/55/57/29/570555729.db2.gz KSKQLZILDNDMKM-UHFFFAOYSA-N 0 0 360.482 5.789 40 0 FKABRN O=C(Nc1ccc(Br)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000408565442 570555535 /nfs/dbraw/zinc/55/55/35/570555535.db2.gz KTHXOBAZPGLDGM-UHFFFAOYSA-N 0 0 366.214 5.601 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2cccc(Cl)c2)cc1OCC ZINC000408565827 570556188 /nfs/dbraw/zinc/55/61/88/570556188.db2.gz AWYLBZQSIPAXIV-PKNBQFBNSA-N 0 0 359.853 5.179 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2cc(C)ccc2C)cc1OCC ZINC000408565915 570556122 /nfs/dbraw/zinc/55/61/22/570556122.db2.gz CIUPLJRZTAAOJE-ZRDIBKRKSA-N 0 0 353.462 5.143 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2ccc(CC)cc2)cc1OCC ZINC000408566164 570556080 /nfs/dbraw/zinc/55/60/80/570556080.db2.gz DUEOMFFNBSJTIP-GXDHUFHOSA-N 0 0 353.462 5.088 40 0 FKABRN C[C@H](SCc1ccccc1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000408566413 570556229 /nfs/dbraw/zinc/55/62/29/570556229.db2.gz NVCGBSMWCVOJJS-KRWDZBQOSA-N 0 0 363.482 5.739 40 0 FKABRN C[C@@H](SCc1ccccc1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000408566415 263473570 /nfs/dbraw/zinc/47/35/70/263473570.db2.gz NVCGBSMWCVOJJS-QGZVFWFLSA-N 0 0 363.482 5.739 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2cc(Cl)ccc2C)cc1OCC ZINC000408566967 263473190 /nfs/dbraw/zinc/47/31/90/263473190.db2.gz JKNFZTUUJQKGDW-DHZHZOJOSA-N 0 0 373.880 5.488 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2ccc(C)cc2C)cc1OCC ZINC000408567333 570949291 /nfs/dbraw/zinc/94/92/91/570949291.db2.gz LVEODNPGSMVFOW-FMIVXFBMSA-N 0 0 353.462 5.143 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2cccc(Cl)c2C)cc1OCC ZINC000408567382 570949138 /nfs/dbraw/zinc/94/91/38/570949138.db2.gz MGFNGHBDBRJNIG-ZRDIBKRKSA-N 0 0 373.880 5.488 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2ccc(Cl)cc2)cc1OCC ZINC000408567657 570949189 /nfs/dbraw/zinc/94/91/89/570949189.db2.gz PEWYQSBJXWLPSF-WUXMJOGZSA-N 0 0 359.853 5.179 40 0 FKABRN CCCCOc1ccc(Br)cc1C(=O)Nc1ccccc1C ZINC000408567884 570949156 /nfs/dbraw/zinc/94/91/56/570949156.db2.gz QAXHIYYUYIOKQM-UHFFFAOYSA-N 0 0 362.267 5.189 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2ccc(C)c(Cl)c2)cc1OCC ZINC000408567904 570949126 /nfs/dbraw/zinc/94/91/26/570949126.db2.gz QGXZRSAYMFDTFV-DHZHZOJOSA-N 0 0 373.880 5.488 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2ccc(C)c(C)c2)cc1OCC ZINC000408568009 570949148 /nfs/dbraw/zinc/94/91/48/570949148.db2.gz RKLIZOZYMKRXLU-FMIVXFBMSA-N 0 0 353.462 5.143 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2ccccc2Cl)cc1OCC ZINC000408568060 570949261 /nfs/dbraw/zinc/94/92/61/570949261.db2.gz SBWXUGMPUXDKSQ-ZRDIBKRKSA-N 0 0 359.853 5.179 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2cccc(C)c2C)cc1OCC ZINC000408568389 570949177 /nfs/dbraw/zinc/94/91/77/570949177.db2.gz SZICPVRULNWUEK-ACCUITESSA-N 0 0 353.462 5.143 40 0 FKABRN CCCOc1ccc(/C=C/C(=O)Nc2ccccc2CC)cc1OCC ZINC000408568390 263473225 /nfs/dbraw/zinc/47/32/25/263473225.db2.gz SZIDAVHJEVXSDX-WYMLVPIESA-N 0 0 353.462 5.088 40 0 FKABRN COc1cccc2cc(C(=O)Nc3ccc(Oc4ccccc4C)cc3)oc21 ZINC000408569442 570556553 /nfs/dbraw/zinc/55/65/53/570556553.db2.gz NORLZTRZQRHFTM-UHFFFAOYSA-N 0 0 373.408 5.794 40 0 FKABRN O=C(Nc1cc(Cl)cc(Cl)c1)c1cc2c(ccc3ccccc23)o1 ZINC000408570046 570556540 /nfs/dbraw/zinc/55/65/40/570556540.db2.gz YFWCKNXDVXRTQN-UHFFFAOYSA-N 0 0 356.208 6.145 40 0 FKABRN COc1cccc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)oc21 ZINC000408570824 263473286 /nfs/dbraw/zinc/47/32/86/263473286.db2.gz YZSKUPWOKIZBFD-UHFFFAOYSA-N 0 0 359.381 5.486 40 0 FKABRN COc1cccc2cc(C(=O)Nc3ccc(Nc4ccccc4)cc3)oc21 ZINC000408570969 570949270 /nfs/dbraw/zinc/94/92/70/570949270.db2.gz ZXSJCEUVDRTBKY-UHFFFAOYSA-N 0 0 358.397 5.437 40 0 FKABRN COc1cccc2cc(C(=O)Nc3ccc(Oc4ccc(C)cc4)cc3)oc21 ZINC000408570982 570556571 /nfs/dbraw/zinc/55/65/71/570556571.db2.gz ZZZLCTPRHUPMRT-UHFFFAOYSA-N 0 0 373.408 5.794 40 0 FKABRN S=C(NCc1ccccc1)c1cccc(OCc2ccc(Cl)cc2)c1 ZINC000408571198 570949192 /nfs/dbraw/zinc/94/91/92/570949192.db2.gz AATQLYPDRUFSDJ-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN Fc1ccc(CNC(=S)c2cccc(OCc3ccc(F)cc3)c2)cc1 ZINC000408571203 570556969 /nfs/dbraw/zinc/55/69/69/570556969.db2.gz ACUXCPDPBWDHHM-UHFFFAOYSA-N 0 0 369.436 5.009 40 0 FKABRN S=C(c1ccccc1OCc1ccc(Cl)c(Cl)c1)N1CCCC1 ZINC000408571256 263473509 /nfs/dbraw/zinc/47/35/09/263473509.db2.gz ASTYWWZBSOJDDD-UHFFFAOYSA-N 0 0 366.313 5.344 40 0 FKABRN S=C(NCc1ccc(Cl)cc1)c1ccc(OCc2ccccc2)cc1 ZINC000408571417 570949625 /nfs/dbraw/zinc/94/96/25/570949625.db2.gz AUDZZZIMXGAEAT-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN S=C(NCc1ccccc1Cl)c1cccc(OCc2ccccc2)c1 ZINC000408571461 570556956 /nfs/dbraw/zinc/55/69/56/570556956.db2.gz BVGKLEVUVCKRAI-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN CC(C)C(=O)Nc1cccc(NC(=O)/C=C/c2ccc(-c3ccccc3)o2)c1 ZINC000408571467 263473762 /nfs/dbraw/zinc/47/37/62/263473762.db2.gz BZKGYKVCNSMGJF-WYMLVPIESA-N 0 0 374.440 5.193 40 0 FKABRN S=C(NCc1ccc(Cl)cc1)c1ccccc1OCc1ccccc1 ZINC000408571585 570948612 /nfs/dbraw/zinc/94/86/12/570948612.db2.gz BSQBADUERRMKDX-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN S=C(NCc1ccc(Cl)cc1)c1cccc(OCc2ccccc2)c1 ZINC000408571706 570557080 /nfs/dbraw/zinc/55/70/80/570557080.db2.gz CZNNBRJYFJTEEQ-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN S=C(NCc1ccccc1)c1cccc(OCc2ccccc2Cl)c1 ZINC000408571941 570948837 /nfs/dbraw/zinc/94/88/37/570948837.db2.gz DKRRJCVHFTXRRY-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN S=C(c1ccc(OCc2c(Cl)cccc2Cl)cc1)N1CCCC1 ZINC000408572010 570948880 /nfs/dbraw/zinc/94/88/80/570948880.db2.gz DTCUIBMDFCHHQP-UHFFFAOYSA-N 0 0 366.313 5.344 40 0 FKABRN Cc1cccc(CNC(=S)c2ccc(OCc3ccc(F)cc3)cc2)c1 ZINC000408572250 570948561 /nfs/dbraw/zinc/94/85/61/570948561.db2.gz FVTRVIRQVHEXNT-UHFFFAOYSA-N 0 0 365.473 5.178 40 0 FKABRN CCc1ccc(CNC(=S)c2ccc(OCc3ccccc3)cc2)cc1 ZINC000408572284 570557157 /nfs/dbraw/zinc/55/71/57/570557157.db2.gz IGEDWKZLQPZBPI-UHFFFAOYSA-N 0 0 361.510 5.293 40 0 FKABRN Cc1ccc(CNC(=S)c2ccc(OCc3ccc(F)cc3)cc2)cc1 ZINC000408572370 570948898 /nfs/dbraw/zinc/94/88/98/570948898.db2.gz GNMQUXZVMUGKEN-UHFFFAOYSA-N 0 0 365.473 5.178 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1ccccc1N1CCCCC1 ZINC000408572508 570557172 /nfs/dbraw/zinc/55/71/72/570557172.db2.gz IVOKHDFIHAVTHW-JQIJEIRASA-N 0 0 372.468 5.589 40 0 FKABRN CC(C)C(=O)Nc1ccc(NC(=O)/C=C/c2ccc(-c3ccccc3)o2)cc1 ZINC000408572548 570557533 /nfs/dbraw/zinc/55/75/33/570557533.db2.gz JUQXFQSBBJLOJV-FYWRMAATSA-N 0 0 374.440 5.193 40 0 FKABRN CC(C)Oc1cccc(NC(=O)/C=C/c2ccc(Cl)cc2Cl)c1 ZINC000408572881 570556405 /nfs/dbraw/zinc/55/64/05/570556405.db2.gz BKTHLULVGZPSSK-VQHVLOKHSA-N 0 0 350.245 5.433 40 0 FKABRN S=C(NCc1ccccc1Cl)c1ccc(OCc2ccccc2)cc1 ZINC000408573115 570560562 /nfs/dbraw/zinc/56/05/62/570560562.db2.gz MAONDIZFWKIQFU-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN S=C(c1cccc(OCc2ccc(Cl)c(Cl)c2)c1)N1CCCC1 ZINC000408573169 570949210 /nfs/dbraw/zinc/94/92/10/570949210.db2.gz IQQYTYRCBLQPIQ-UHFFFAOYSA-N 0 0 366.313 5.344 40 0 FKABRN Cc1ccccc1CNC(=S)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000408573176 570949196 /nfs/dbraw/zinc/94/91/96/570949196.db2.gz IRURBGDTAPCOBK-UHFFFAOYSA-N 0 0 365.473 5.178 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1cccc(Cl)c1Cl ZINC000408573856 570949654 /nfs/dbraw/zinc/94/96/54/570949654.db2.gz OYWXCLJBUUUMBA-ZRDIBKRKSA-N 0 0 358.224 5.905 40 0 FKABRN CCc1ccc(CNC(=S)c2cccc(OCc3ccccc3)c2)cc1 ZINC000408573874 263474221 /nfs/dbraw/zinc/47/42/21/263474221.db2.gz PLHPCKBAAZTVHU-UHFFFAOYSA-N 0 0 361.510 5.293 40 0 FKABRN COc1ccc(/C=C(/C(=O)NC2CCCCCCC2)c2ccccc2)cc1 ZINC000408573926 263474271 /nfs/dbraw/zinc/47/42/71/263474271.db2.gz FPFSDVMVZYFHQQ-PTGBLXJZSA-N 0 0 363.501 5.465 40 0 FKABRN Cc1ccc(/C=C/C(=O)Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2)cc1 ZINC000408573957 570949670 /nfs/dbraw/zinc/94/96/70/570949670.db2.gz GDUMGBYCCKIWLA-IZZDOVSWSA-N 0 0 371.524 6.115 40 0 FKABRN Cc1ccc(SCCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1 ZINC000408574021 570560894 /nfs/dbraw/zinc/56/08/94/570560894.db2.gz HJXYKVLFKSIOSW-UHFFFAOYSA-N 0 0 373.827 5.788 40 0 FKABRN CCOC(=O)c1ccc(NC(=O)c2cc3c(ccc4ccccc34)o2)cc1 ZINC000408574036 263474292 /nfs/dbraw/zinc/47/42/92/263474292.db2.gz HOKYTMNBEZXTTA-UHFFFAOYSA-N 0 0 359.381 5.015 40 0 FKABRN CCOC(=O)c1ccccc1NC(=O)c1cc2c(ccc3ccccc23)o1 ZINC000408574046 263474289 /nfs/dbraw/zinc/47/42/89/263474289.db2.gz HRUGQACTOHTMDA-UHFFFAOYSA-N 0 0 359.381 5.015 40 0 FKABRN S=C(NCc1ccccc1)c1ccc(OCc2ccc(Cl)cc2)cc1 ZINC000408574335 263474201 /nfs/dbraw/zinc/47/42/01/263474201.db2.gz LWOVFYWFISYWHO-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN Cc1ccc(C)c2sc(NC(=O)/C=C/c3ccc(-c4ccccc4)o3)nc21 ZINC000408574444 570561308 /nfs/dbraw/zinc/56/13/08/570561308.db2.gz QRKUIIKENFIOFS-ACCUITESSA-N 0 0 374.465 5.825 40 0 FKABRN O=C(NC1CCCCCCC1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408574674 570950165 /nfs/dbraw/zinc/95/01/65/570950165.db2.gz KACMJWLDGRCAMC-HEHNFIMWSA-N 0 0 367.920 6.110 40 0 FKABRN Cc1ccccc1CSCC(=O)Nc1ccccc1Oc1ccccc1 ZINC000408574758 570950081 /nfs/dbraw/zinc/95/00/81/570950081.db2.gz CTHLCZUGLJGYIT-UHFFFAOYSA-N 0 0 363.482 5.659 40 0 FKABRN S=C(NCc1ccccc1Cl)c1ccccc1OCc1ccccc1 ZINC000408574792 570950160 /nfs/dbraw/zinc/95/01/60/570950160.db2.gz MSZKWTGLSWJPPX-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1ccccc1N1CCCC1 ZINC000408575228 570949704 /nfs/dbraw/zinc/94/97/04/570949704.db2.gz TVZGRFZXLKRSRL-FYWRMAATSA-N 0 0 358.441 5.199 40 0 FKABRN CC1CCN(C(=S)c2cccc(OCc3ccccc3Cl)c2)CC1 ZINC000408575235 570949622 /nfs/dbraw/zinc/94/96/22/570949622.db2.gz NIJWIHCEMZLREJ-UHFFFAOYSA-N 0 0 359.922 5.326 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccccc2)o1)Nc1ccccc1Br ZINC000408575250 570949588 /nfs/dbraw/zinc/94/95/88/570949588.db2.gz TYNUBRFWYGLLQT-ACCUITESSA-N 0 0 368.230 5.361 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)/C=C/c1ccc(-c2ccccc2)o1 ZINC000408575334 570561363 /nfs/dbraw/zinc/56/13/63/570561363.db2.gz ULKVNWRDZYKVIF-FMIVXFBMSA-N 0 0 353.805 5.261 40 0 FKABRN O=C(CCc1ccccc1)Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1 ZINC000408575704 570561326 /nfs/dbraw/zinc/56/13/26/570561326.db2.gz PPKMGGKGWIBWEE-UHFFFAOYSA-N 0 0 359.513 5.726 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)CSCc3ccccc3)ccc21 ZINC000408575721 570561366 /nfs/dbraw/zinc/56/13/66/570561366.db2.gz PUYDEIWCMVBSOZ-UHFFFAOYSA-N 0 0 374.509 5.686 40 0 FKABRN O=C(Nc1cccc(Br)c1)c1cc2c(ccc3ccccc23)o1 ZINC000408575737 570561335 /nfs/dbraw/zinc/56/13/35/570561335.db2.gz QAQRSZXLDHQPMM-UHFFFAOYSA-N 0 0 366.214 5.601 40 0 FKABRN S=C(NCc1ccccc1)c1ccccc1OCc1ccccc1Cl ZINC000408575988 570951475 /nfs/dbraw/zinc/95/14/75/570951475.db2.gz PDLKVZHGPHYKSS-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN CCc1ccc(CNC(=S)c2ccccc2OCc2ccccc2)cc1 ZINC000408576111 570951806 /nfs/dbraw/zinc/95/18/06/570951806.db2.gz PTGCICDPHQQOAL-UHFFFAOYSA-N 0 0 361.510 5.293 40 0 FKABRN O=C(NC12CC3CC(CC(C3)C1)C2)/C(=C/c1ccccc1)c1ccccc1 ZINC000408576478 570949949 /nfs/dbraw/zinc/94/99/49/570949949.db2.gz VWWDCIAGFSTFGO-OEAKJJBVSA-N 0 0 357.497 5.312 40 0 FKABRN Cc1cc(CSc2ccccc2)ccc1NC(=O)c1ccccc1F ZINC000408576489 570949935 /nfs/dbraw/zinc/94/99/35/570949935.db2.gz WENYFUUOPNWZOU-UHFFFAOYSA-N 0 0 351.446 5.679 40 0 FKABRN Cc1ccc(CSCC(=O)Nc2ccccc2Oc2ccccc2)cc1 ZINC000408576490 570950152 /nfs/dbraw/zinc/95/01/52/570950152.db2.gz WEXIXNUIRITDPL-UHFFFAOYSA-N 0 0 363.482 5.659 40 0 FKABRN S=C(NCc1ccccc1)c1ccccc1OCc1ccc(Cl)cc1 ZINC000408577224 570950537 /nfs/dbraw/zinc/95/05/37/570950537.db2.gz RXWHBISLLPUZDH-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN CC1CCN(C(=S)c2cccc(OCc3ccc(Cl)cc3)c2)CC1 ZINC000408577281 570950501 /nfs/dbraw/zinc/95/05/01/570950501.db2.gz SEUFXNJQEBBNQN-UHFFFAOYSA-N 0 0 359.922 5.326 40 0 FKABRN O=C(NC1CCCCCCC1)c1ccc(CSc2ccccc2)cc1 ZINC000408577324 570561640 /nfs/dbraw/zinc/56/16/40/570561640.db2.gz YNVNTZLDLRJNLK-UHFFFAOYSA-N 0 0 353.531 5.822 40 0 FKABRN Cc1ccccc1CNC(=S)c1cccc(OCc2ccc(F)cc2)c1 ZINC000408577863 570950724 /nfs/dbraw/zinc/95/07/24/570950724.db2.gz VAPVTTIXZDFYFO-UHFFFAOYSA-N 0 0 365.473 5.178 40 0 FKABRN Cc1cccc(CNC(=S)c2cccc(OCc3ccc(F)cc3)c2)c1 ZINC000408577871 570950509 /nfs/dbraw/zinc/95/05/09/570950509.db2.gz VCTTUYURLILPND-UHFFFAOYSA-N 0 0 365.473 5.178 40 0 FKABRN Cc1ccc(CNC(=S)c2cccc(OCc3ccc(F)cc3)c2)cc1 ZINC000408578143 570950831 /nfs/dbraw/zinc/95/08/31/570950831.db2.gz WANCJKJDOGJAEZ-UHFFFAOYSA-N 0 0 365.473 5.178 40 0 FKABRN S=C(NCc1ccccc1)c1ccc(OCc2ccccc2Cl)cc1 ZINC000408578182 570562500 /nfs/dbraw/zinc/56/25/00/570562500.db2.gz WNUWKCRSZOVLBG-UHFFFAOYSA-N 0 0 367.901 5.384 40 0 FKABRN S=C(c1cccc(OCc2c(Cl)cccc2Cl)c1)N1CCCC1 ZINC000408578289 570950674 /nfs/dbraw/zinc/95/06/74/570950674.db2.gz XGDOSJVNSDGUCT-UHFFFAOYSA-N 0 0 366.313 5.344 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccc(Cl)cc2)cc1 ZINC000408578586 263475379 /nfs/dbraw/zinc/47/53/79/263475379.db2.gz AAEKWVPBZCTBNB-UHFFFAOYSA-N 0 0 356.878 5.587 40 0 FKABRN Fc1ccc(CNC(=S)c2ccc(OCc3ccc(F)cc3)cc2)cc1 ZINC000408578621 570950566 /nfs/dbraw/zinc/95/05/66/570950566.db2.gz ZHJLAXORUBKDAP-UHFFFAOYSA-N 0 0 369.436 5.009 40 0 FKABRN Cc1nc(-c2ccc(C(=O)Nc3ccc4ccccc4c3)cc2)c(C)s1 ZINC000408578669 263475482 /nfs/dbraw/zinc/47/54/82/263475482.db2.gz AHKNLOCHXMALLS-UHFFFAOYSA-N 0 0 358.466 5.832 40 0 FKABRN Cc1nc(-c2ccc(C(=O)Nc3cc(Cl)ccc3C)cc2)c(C)s1 ZINC000408578899 263475491 /nfs/dbraw/zinc/47/54/91/263475491.db2.gz BPHMRQPHWCBYDJ-UHFFFAOYSA-N 0 0 356.878 5.641 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2cc(C)ccc2C)cc1 ZINC000408579218 570950754 /nfs/dbraw/zinc/95/07/54/570950754.db2.gz DVBVRLUHHZPEEY-UHFFFAOYSA-N 0 0 350.487 5.550 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2cccc(Cl)c2)cc1 ZINC000408579357 570559700 /nfs/dbraw/zinc/55/97/00/570559700.db2.gz GDGCRXUHBDCOFY-UHFFFAOYSA-N 0 0 356.878 5.587 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2cc(Cl)ccc2C)cc1 ZINC000408579622 263475382 /nfs/dbraw/zinc/47/53/82/263475382.db2.gz ITBMODHFYJHGRF-UHFFFAOYSA-N 0 0 370.905 5.895 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccc(C)cc2C)cc1 ZINC000408579631 570950845 /nfs/dbraw/zinc/95/08/45/570950845.db2.gz IVVJJWZZDZAVNY-UHFFFAOYSA-N 0 0 350.487 5.550 40 0 FKABRN CCc1sc(Nc2ccccc2)nc1-c1ccc(Br)cc1 ZINC000408579633 570950461 /nfs/dbraw/zinc/95/04/61/570950461.db2.gz IWKWXEHIRLFMGV-UHFFFAOYSA-N 0 0 359.292 5.301 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2cccc(C)c2C)cc1 ZINC000408579903 570950634 /nfs/dbraw/zinc/95/06/34/570950634.db2.gz LGNRYITXDHMNJP-UHFFFAOYSA-N 0 0 350.487 5.550 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccc(CC)cc2)cc1 ZINC000408580219 570950658 /nfs/dbraw/zinc/95/06/58/570950658.db2.gz NCHIFZNUDNLFBX-UHFFFAOYSA-N 0 0 350.487 5.496 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2cccc3ccccc32)cc1 ZINC000408580244 570950521 /nfs/dbraw/zinc/95/05/21/570950521.db2.gz NGKHKVGEWOJQAA-UHFFFAOYSA-N 0 0 372.493 6.086 40 0 FKABRN Cc1nc(-c2ccc(C(=O)Nc3ccc(C)c(Cl)c3)cc2)c(C)s1 ZINC000408580279 570950946 /nfs/dbraw/zinc/95/09/46/570950946.db2.gz NUXJURQHFWTTBM-UHFFFAOYSA-N 0 0 356.878 5.641 40 0 FKABRN CCOc1ccc(NC(=O)c2ccc(-c3nc(C)sc3C)cc2)cc1 ZINC000408580454 570561850 /nfs/dbraw/zinc/56/18/50/570561850.db2.gz PRLSQPCMGKAWHC-UHFFFAOYSA-N 0 0 352.459 5.078 40 0 FKABRN O=C(Nc1c(Cl)cccc1Cl)/C(=C/c1ccco1)c1ccccc1 ZINC000408580511 570951099 /nfs/dbraw/zinc/95/10/99/570951099.db2.gz RCTZQUKEMMUGAR-NTCAYCPXSA-N 0 0 358.224 5.766 40 0 FKABRN CCc1sc(Nc2ccc(C)cc2)nc1-c1ccc(Br)cc1 ZINC000408580611 263474985 /nfs/dbraw/zinc/47/49/85/263474985.db2.gz PYDXLAROWBSDHA-UHFFFAOYSA-N 0 0 373.319 6.187 40 0 FKABRN CCOc1ccc(NC(=O)c2ccc(-c3nc(C)sc3CC)cc2)cc1 ZINC000408580676 263475383 /nfs/dbraw/zinc/47/53/83/263475383.db2.gz QPQIFZYLZFBZTL-UHFFFAOYSA-N 0 0 366.486 5.332 40 0 FKABRN O=C(Nc1c(Cl)cccc1Cl)/C(=C/c1ccccc1)c1ccccc1 ZINC000408580880 570951037 /nfs/dbraw/zinc/95/10/37/570951037.db2.gz RTMNESGKMXWYRK-SAPNQHFASA-N 0 0 368.263 6.173 40 0 FKABRN Cc1nc(-c2ccc(C(=O)Nc3cccc(Cl)c3C)cc2)c(C)s1 ZINC000408581031 570950928 /nfs/dbraw/zinc/95/09/28/570950928.db2.gz SUIDTANIIWYBFH-UHFFFAOYSA-N 0 0 356.878 5.641 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccc(C)c(Cl)c2)cc1 ZINC000408581101 570950950 /nfs/dbraw/zinc/95/09/50/570950950.db2.gz ULILMBKQWKBWDC-UHFFFAOYSA-N 0 0 370.905 5.895 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1 ZINC000408581119 570951334 /nfs/dbraw/zinc/95/13/34/570951334.db2.gz UUYCAKNUNDKJJH-UHFFFAOYSA-N 0 0 350.487 5.550 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccccc2Cl)cc1 ZINC000408581214 570951251 /nfs/dbraw/zinc/95/12/51/570951251.db2.gz VCNXTEIRUVXYHN-UHFFFAOYSA-N 0 0 356.878 5.587 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccc3ccccc3c2)cc1 ZINC000408581316 570951138 /nfs/dbraw/zinc/95/11/38/570951138.db2.gz WCQBHBGLDGLPOU-UHFFFAOYSA-N 0 0 372.493 6.086 40 0 FKABRN Cc1nc(-c2ccc(C(=O)Nc3cccc4ccccc43)cc2)c(C)s1 ZINC000408581427 570951131 /nfs/dbraw/zinc/95/11/31/570951131.db2.gz WMINWXMTNURGTC-UHFFFAOYSA-N 0 0 358.466 5.832 40 0 FKABRN Cc1nc(-c2ccc(C(=O)NCc3cccc4ccccc43)cc2)c(C)s1 ZINC000408581442 570951256 /nfs/dbraw/zinc/95/12/56/570951256.db2.gz WUFGDDDRWFDMQR-UHFFFAOYSA-N 0 0 372.493 5.510 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2cccc(Cl)c2C)cc1 ZINC000408581549 570951109 /nfs/dbraw/zinc/95/11/09/570951109.db2.gz XVGYGRNVQJJOTE-UHFFFAOYSA-N 0 0 370.905 5.895 40 0 FKABRN CCc1sc(C)nc1-c1ccc(C(=O)Nc2ccccc2CC)cc1 ZINC000408581787 570951297 /nfs/dbraw/zinc/95/12/97/570951297.db2.gz ZIQKEBRRTQBUFW-UHFFFAOYSA-N 0 0 350.487 5.496 40 0 FKABRN CCSc1nc(-c2ccc(Br)cc2)cc(C(F)(F)F)n1 ZINC000408583895 263475358 /nfs/dbraw/zinc/47/53/58/263475358.db2.gz YJKVSPFRVJCMPC-UHFFFAOYSA-N 0 0 363.202 5.037 40 0 FKABRN COc1ccccc1NC(=O)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408585103 570952060 /nfs/dbraw/zinc/95/20/60/570952060.db2.gz ACBLHCDILYOKAR-UHFFFAOYSA-N 0 0 367.832 5.180 40 0 FKABRN CCOc1ccc(Cl)cc1C(=O)Nc1ccccc1Oc1ccccc1 ZINC000408585162 570565226 /nfs/dbraw/zinc/56/52/26/570565226.db2.gz BTZRMJCZNYBTBP-UHFFFAOYSA-N 0 0 367.832 5.783 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1ccc(Br)cc1 ZINC000408585195 570952234 /nfs/dbraw/zinc/95/22/34/570952234.db2.gz CRCVRCPLHLFVKA-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1ccccc1C(F)(F)F ZINC000408585428 570952083 /nfs/dbraw/zinc/95/20/83/570952083.db2.gz DMCNJXMDNHUDCP-UHFFFAOYSA-N 0 0 357.759 5.400 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408585440 570952068 /nfs/dbraw/zinc/95/20/68/570952068.db2.gz DTGNVTFOJHADDW-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN O=C(Nc1ccccc1Cl)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408585444 570952273 /nfs/dbraw/zinc/95/22/73/570952273.db2.gz DUFIPBZHGIIWFH-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1cc(Cl)ccc1Cl ZINC000408585449 263475456 /nfs/dbraw/zinc/47/54/56/263475456.db2.gz DWXMXFWFXPZHIL-UHFFFAOYSA-N 0 0 358.652 5.688 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1ccc(CC)cc1 ZINC000408585452 570952278 /nfs/dbraw/zinc/95/22/78/570952278.db2.gz DXHSNOBWNUOBLS-UHFFFAOYSA-N 0 0 362.267 5.053 40 0 FKABRN CCCOc1ccccc1C(=O)OCC(=O)c1ccc(-c2ccccc2)cc1 ZINC000408585459 263475301 /nfs/dbraw/zinc/47/53/01/263475301.db2.gz FCFPHKPHBAMTAM-UHFFFAOYSA-N 0 0 374.436 5.182 40 0 FKABRN O=C(Sc1nnc(-c2ccccc2Cl)o1)c1ccc2ccccc2c1 ZINC000408585464 570952093 /nfs/dbraw/zinc/95/20/93/570952093.db2.gz FELMKMPIKYGNTJ-UHFFFAOYSA-N 0 0 366.829 5.476 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1cccc(Br)c1 ZINC000408585467 263475830 /nfs/dbraw/zinc/47/58/30/263475830.db2.gz FGAANYDOHIIQOQ-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN Cc1cccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)c1C ZINC000408585482 570952169 /nfs/dbraw/zinc/95/21/69/570952169.db2.gz FQWJEIINZNBVBV-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000408585500 570952160 /nfs/dbraw/zinc/95/21/60/570952160.db2.gz GDTMXRRAVVGTBS-UHFFFAOYSA-N 0 0 358.652 5.688 40 0 FKABRN CCOc1ccc(Cl)cc1C(=O)Nc1ccc(Br)cc1C ZINC000408585609 570952005 /nfs/dbraw/zinc/95/20/05/570952005.db2.gz GKAKAHYPLUQIKQ-UHFFFAOYSA-N 0 0 368.658 5.062 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1cccc(Cl)c1C ZINC000408585639 570952164 /nfs/dbraw/zinc/95/21/64/570952164.db2.gz GTONTFKCOYWQQI-UHFFFAOYSA-N 0 0 352.261 5.733 40 0 FKABRN COc1ccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000408585674 263475980 /nfs/dbraw/zinc/47/59/80/263475980.db2.gz HCICTGWMOYKBQH-UHFFFAOYSA-N 0 0 367.832 5.180 40 0 FKABRN Cc1ccccc1NC(=O)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408585696 570952185 /nfs/dbraw/zinc/95/21/85/570952185.db2.gz HIWFKMFQMXJXLP-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000408585721 570952189 /nfs/dbraw/zinc/95/21/89/570952189.db2.gz HOLRJCOPURFFBZ-UHFFFAOYSA-N 0 0 371.786 5.790 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1ccc(C)c(Cl)c1 ZINC000408585771 570952032 /nfs/dbraw/zinc/95/20/32/570952032.db2.gz IGLISSSDXUCLMJ-UHFFFAOYSA-N 0 0 352.261 5.733 40 0 FKABRN CCCOc1ccccc1C(=O)Nc1ccc(Br)c(Cl)c1 ZINC000408585772 263475753 /nfs/dbraw/zinc/47/57/53/263475753.db2.gz IHASNZYNGSZVJG-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000408585782 570952113 /nfs/dbraw/zinc/95/21/13/570952113.db2.gz IMSSVBXVGACFFQ-UHFFFAOYSA-N 0 0 372.679 6.078 40 0 FKABRN CCCOc1ccc(Br)cc1C(=O)Nc1ccccc1CC ZINC000408585822 570952098 /nfs/dbraw/zinc/95/20/98/570952098.db2.gz JBMDQSFLKILUSD-UHFFFAOYSA-N 0 0 362.267 5.053 40 0 FKABRN O=C(Sc1nnc(-c2ccccc2Cl)o1)c1cccc2ccccc21 ZINC000408585827 570952193 /nfs/dbraw/zinc/95/21/93/570952193.db2.gz JBXAVVUOJPNFLM-UHFFFAOYSA-N 0 0 366.829 5.476 40 0 FKABRN Cc1ccc(C)c(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)c1 ZINC000408585833 570952275 /nfs/dbraw/zinc/95/22/75/570952275.db2.gz JEBCXLGZIQDCGZ-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN O=C(Nc1cccc(Cl)c1)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408585837 570952259 /nfs/dbraw/zinc/95/22/59/570952259.db2.gz JEWUUILUZFAPPB-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1cccc(C(F)(F)F)c1 ZINC000408585855 570952180 /nfs/dbraw/zinc/95/21/80/570952180.db2.gz JKAWQVDHGOFDSL-UHFFFAOYSA-N 0 0 357.759 5.400 40 0 FKABRN Cc1ccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)cc1C ZINC000408585930 570952251 /nfs/dbraw/zinc/95/22/51/570952251.db2.gz KIEVCNPFKFSMIZ-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cc1Cl ZINC000408585958 570565479 /nfs/dbraw/zinc/56/54/79/570565479.db2.gz KMULFMPLGYQANS-UHFFFAOYSA-N 0 0 372.679 6.078 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1cccc(Cl)c1Cl ZINC000408586081 570952173 /nfs/dbraw/zinc/95/21/73/570952173.db2.gz KZOFJGKJLBTUSY-UHFFFAOYSA-N 0 0 372.679 6.078 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1cc(Cl)ccc1Cl ZINC000408586097 263475888 /nfs/dbraw/zinc/47/58/88/263475888.db2.gz LBROUWBUGNZVIR-UHFFFAOYSA-N 0 0 372.679 6.078 40 0 FKABRN Cc1cccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)c1 ZINC000408586207 263476380 /nfs/dbraw/zinc/47/63/80/263476380.db2.gz LWNZBRXHZIPFPO-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN O=C(Nc1ccccc1C(F)(F)F)c1ccccc1OCc1ccccc1 ZINC000408586491 570566504 /nfs/dbraw/zinc/56/65/04/570566504.db2.gz NFXIHSFSVFQTGL-UHFFFAOYSA-N 0 0 371.358 5.537 40 0 FKABRN O=C(Nc1cccc(F)c1)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408586510 263475739 /nfs/dbraw/zinc/47/57/39/263475739.db2.gz NLVWMSQGTJFACM-UHFFFAOYSA-N 0 0 355.796 5.310 40 0 FKABRN O=C(Nc1ccc(F)cc1)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408586538 570952089 /nfs/dbraw/zinc/95/20/89/570952089.db2.gz NPGCNNMZXYWDHD-UHFFFAOYSA-N 0 0 355.796 5.310 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(Oc3ccccc3OC)cc2)cc1 ZINC000408586571 570566250 /nfs/dbraw/zinc/56/62/50/570566250.db2.gz NZCPSQXXSXTZKO-UHFFFAOYSA-N 0 0 363.413 5.139 40 0 FKABRN COc1cccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)c1 ZINC000408586637 570952177 /nfs/dbraw/zinc/95/21/77/570952177.db2.gz OJGBMEYTNHBAKR-UHFFFAOYSA-N 0 0 367.832 5.180 40 0 FKABRN O=C(Nc1ccccc1F)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408587082 570566207 /nfs/dbraw/zinc/56/62/07/570566207.db2.gz PWJRNFPIJKBQGP-UHFFFAOYSA-N 0 0 355.796 5.310 40 0 FKABRN CCc1ccccc1NC(=O)c1cc(Cl)ccc1OCc1ccccc1 ZINC000408587084 570952396 /nfs/dbraw/zinc/95/23/96/570952396.db2.gz PXFAPUYMJBQEBB-UHFFFAOYSA-N 0 0 365.860 5.734 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1ccccc1Br ZINC000408587112 263475900 /nfs/dbraw/zinc/47/59/00/263475900.db2.gz QGYCZCVJYGHEDN-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1cccc2ccccc21 ZINC000408587115 570952559 /nfs/dbraw/zinc/95/25/59/570952559.db2.gz QHQFJSNUJDBGMM-UHFFFAOYSA-N 0 0 353.849 5.924 40 0 FKABRN CCCOc1ccc(C(=O)OCC(=O)c2ccc(-c3ccccc3)cc2)cc1 ZINC000408587139 570952536 /nfs/dbraw/zinc/95/25/36/570952536.db2.gz QYNNYSCFMNKCPG-UHFFFAOYSA-N 0 0 374.436 5.182 40 0 FKABRN CCCCOc1ccccc1C(=O)Nc1ccccc1Oc1ccccc1 ZINC000408587145 570952755 /nfs/dbraw/zinc/95/27/55/570952755.db2.gz RBIVYMUBWPYCPF-UHFFFAOYSA-N 0 0 361.441 5.910 40 0 FKABRN O=C(Nc1ccc2ccccc2c1)c1ccccc1OCc1ccccc1 ZINC000408587576 570952647 /nfs/dbraw/zinc/95/26/47/570952647.db2.gz SBGIAWSNWMCLRA-UHFFFAOYSA-N 0 0 353.421 5.671 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1ccccc1C(F)(F)F ZINC000408587675 570952790 /nfs/dbraw/zinc/95/27/90/570952790.db2.gz SZRMLWXRBNBJFS-UHFFFAOYSA-N 0 0 371.786 5.790 40 0 FKABRN CCOc1ccc(Cl)cc1C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000408587788 570952707 /nfs/dbraw/zinc/95/27/07/570952707.db2.gz UPFRNDXLGTZSNF-UHFFFAOYSA-N 0 0 367.832 5.783 40 0 FKABRN CCCOc1ccc(C(=O)Nc2ccc(Br)c(Cl)c2)cc1 ZINC000408587819 570952640 /nfs/dbraw/zinc/95/26/40/570952640.db2.gz UVKFYOYTUIVLBZ-UHFFFAOYSA-N 0 0 368.658 5.144 40 0 FKABRN S=C(NCc1ccccc1)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000408587977 570952773 /nfs/dbraw/zinc/95/27/73/570952773.db2.gz VKSUONZYAQDNJT-UHFFFAOYSA-N 0 0 368.889 5.619 40 0 FKABRN CCc1ccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000408588335 570566013 /nfs/dbraw/zinc/56/60/13/570566013.db2.gz VOSMTSDJLIDOQY-UHFFFAOYSA-N 0 0 365.860 5.734 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1cccc(Cl)c1Cl ZINC000408588383 263475988 /nfs/dbraw/zinc/47/59/88/263475988.db2.gz VUFIPHRWUARFPM-UHFFFAOYSA-N 0 0 358.652 5.688 40 0 FKABRN CCCOc1ccc(Cl)cc1C(=O)Nc1ccc(Cl)cc1Cl ZINC000408588397 570566462 /nfs/dbraw/zinc/56/64/62/570566462.db2.gz VXTOEXZYCUYSGR-UHFFFAOYSA-N 0 0 358.652 5.688 40 0 FKABRN Cc1ccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000408588461 570952545 /nfs/dbraw/zinc/95/25/45/570952545.db2.gz WHXNVVZSMAXNCZ-UHFFFAOYSA-N 0 0 351.833 5.480 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1cc(Cl)ccc1C ZINC000408588466 570952762 /nfs/dbraw/zinc/95/27/62/570952762.db2.gz WIAAIUFOTZDPKD-UHFFFAOYSA-N 0 0 352.261 5.733 40 0 FKABRN COc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C)cc2)cc1 ZINC000408588612 570952432 /nfs/dbraw/zinc/95/24/32/570952432.db2.gz XJITUTCKLPIKTG-UHFFFAOYSA-N 0 0 364.470 5.605 40 0 FKABRN S=C(NCc1ccccc1)Nc1ccc(Oc2ccccc2Cl)cc1 ZINC000408588858 570953221 /nfs/dbraw/zinc/95/32/21/570953221.db2.gz ZTGYZRONRNVPOB-UHFFFAOYSA-N 0 0 368.889 5.619 40 0 FKABRN O=C(Nc1ccc2ccccc2c1)c1ccc(OCc2ccccc2)cc1 ZINC000408588916 570953202 /nfs/dbraw/zinc/95/32/02/570953202.db2.gz XEOFKWSTERUEBH-UHFFFAOYSA-N 0 0 353.421 5.671 40 0 FKABRN CCCCOc1ccccc1C(=O)Nc1ccc(Br)cc1C ZINC000408588976 570952955 /nfs/dbraw/zinc/95/29/55/570952955.db2.gz XPGGOPQLBCUZLS-UHFFFAOYSA-N 0 0 362.267 5.189 40 0 FKABRN O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1OCc1ccccc1 ZINC000408589216 570953234 /nfs/dbraw/zinc/95/32/34/570953234.db2.gz ZCPKTLIJVZBREY-UHFFFAOYSA-N 0 0 371.358 5.537 40 0 FKABRN CCCCOc1ccc(Cl)cc1C(=O)Nc1ccc2ccccc2c1 ZINC000408589256 570953262 /nfs/dbraw/zinc/95/32/62/570953262.db2.gz ZOEUPDUWKXRWFI-UHFFFAOYSA-N 0 0 353.849 5.924 40 0 FKABRN Cc1ccc(NC(=O)c2cc(Cl)ccc2OCc2ccccc2)c(C)c1 ZINC000408589270 570566591 /nfs/dbraw/zinc/56/65/91/570566591.db2.gz ZWSPLOWFXBMJJI-UHFFFAOYSA-N 0 0 365.860 5.788 40 0 FKABRN Cc1c(Cl)cccc1NC(=S)NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000408594627 570575578 /nfs/dbraw/zinc/57/55/78/570575578.db2.gz IVPYTEUDZHVMEJ-UHFFFAOYSA-N 0 0 373.692 5.082 40 0 FKABRN Cc1cc(Cl)ccc1NC(=S)NC(=O)c1ccc(Cl)cc1Cl ZINC000408594703 570955352 /nfs/dbraw/zinc/95/53/52/570955352.db2.gz JUYXNAZLORTDRK-UHFFFAOYSA-N 0 0 373.692 5.082 40 0 FKABRN Cc1ccc(Cl)cc1NC(=S)NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000408596221 263478461 /nfs/dbraw/zinc/47/84/61/263478461.db2.gz QIWKLWPBRSWYGK-UHFFFAOYSA-N 0 0 373.692 5.082 40 0 FKABRN CC(C)c1ccccc1NC(=S)NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000408596318 570955198 /nfs/dbraw/zinc/95/51/98/570955198.db2.gz RMUCPCIZVSGOCG-UHFFFAOYSA-N 0 0 367.301 5.244 40 0 FKABRN Cc1cc(Cl)ccc1NC(=S)NC(=O)c1ccc(Cl)c(Cl)c1 ZINC000408596675 570576858 /nfs/dbraw/zinc/57/68/58/570576858.db2.gz SSBLQNMURXAQJU-UHFFFAOYSA-N 0 0 373.692 5.082 40 0 FKABRN Cc1ccc(NC(=S)NC(=O)c2ccc(Cl)c(Cl)c2)cc1Cl ZINC000408597399 570577187 /nfs/dbraw/zinc/57/71/87/570577187.db2.gz YVHISOIADYGZFT-UHFFFAOYSA-N 0 0 373.692 5.082 40 0 FKABRN Cc1csc2[nH]c(SCc3c(Cl)cccc3Cl)nc(=O)c12 ZINC000408597834 570574362 /nfs/dbraw/zinc/57/43/62/570574362.db2.gz CHQUNUQKBHHOOK-UHFFFAOYSA-N 0 0 357.287 5.304 40 0 FKABRN Cc1csc2[nH]c(SCc3ccc(Cl)c(Cl)c3)nc(=O)c12 ZINC000408597848 570574246 /nfs/dbraw/zinc/57/42/46/570574246.db2.gz KIRBZTWMLPMBJN-UHFFFAOYSA-N 0 0 357.287 5.304 40 0 FKABRN Cc1csc2[nH]c(SCc3ccc(Cl)cc3Cl)nc(=O)c12 ZINC000408597863 570574351 /nfs/dbraw/zinc/57/43/51/570574351.db2.gz SHGSDLSVQARUOV-UHFFFAOYSA-N 0 0 357.287 5.304 40 0 FKABRN Cc1ccc(-c2nnc(SC(=O)c3ccc(C(C)(C)C)cc3)o2)cc1 ZINC000408599694 263478559 /nfs/dbraw/zinc/47/85/59/263478559.db2.gz JFYUZBHRVRZYIZ-UHFFFAOYSA-N 0 0 352.459 5.275 40 0 FKABRN CCCOc1ccccc1/C=C1\SC(=O)N(Cc2ccc(C)cc2)C1=O ZINC000408600160 263478966 /nfs/dbraw/zinc/47/89/66/263478966.db2.gz WBQMJHJBZPHTCX-UYRXBGFRSA-N 0 0 367.470 5.020 40 0 FKABRN COc1cccc(Oc2ccc(C(=O)c3cc(Cl)cc(Cl)c3)cc2)c1 ZINC000408600251 570956417 /nfs/dbraw/zinc/95/64/17/570956417.db2.gz ASPUSJDCAIDWAQ-UHFFFAOYSA-N 0 0 373.235 6.025 40 0 FKABRN CCCOc1ccccc1/C=C1\SC(=O)N(c2cccc(Cl)c2)C1=O ZINC000408600300 570956459 /nfs/dbraw/zinc/95/64/59/570956459.db2.gz BIPWOJYATBIZPA-BOPFTXTBSA-N 0 0 373.861 5.370 40 0 FKABRN COc1cccc(Oc2ccc(NC(=O)/C=C/c3ccc(F)cc3)cc2)c1 ZINC000408600513 570956457 /nfs/dbraw/zinc/95/64/57/570956457.db2.gz CGMVTHPJAAFMFJ-VGOFMYFVSA-N 0 0 363.388 5.279 40 0 FKABRN O=C(/C=C/c1ccc(F)cc1)Nc1ccc(Oc2cccc(Cl)c2)cc1 ZINC000408600564 570578567 /nfs/dbraw/zinc/57/85/67/570578567.db2.gz DKHYNZGHPWBSDP-AWNIVKPZSA-N 0 0 367.807 5.923 40 0 FKABRN O=C(Nc1ccccc1Oc1ccccc1)c1cc(Cl)cc(Cl)c1 ZINC000408600596 570578656 /nfs/dbraw/zinc/57/86/56/570578656.db2.gz DUJQUCLTZZFYSG-UHFFFAOYSA-N 0 0 358.224 6.038 40 0 FKABRN COc1ccc(Oc2ccc(NC(=O)/C=C/c3ccc(F)cc3)cc2)cc1 ZINC000408600735 570955773 /nfs/dbraw/zinc/95/57/73/570955773.db2.gz FSSLYMOWNDVBEP-SYZQJQIISA-N 0 0 363.388 5.279 40 0 FKABRN CCCCc1ccc(NC(=O)/C=C/c2ccc(OC)c(OCC)c2)cc1 ZINC000408600792 570955727 /nfs/dbraw/zinc/95/57/27/570955727.db2.gz GEJYGMMDSCTDIM-RVDMUPIBSA-N 0 0 353.462 5.088 40 0 FKABRN Cc1ccc(NC(=O)CSCc2ccc(Cl)cc2Cl)c(C)c1 ZINC000408600936 570957415 /nfs/dbraw/zinc/95/74/15/570957415.db2.gz HLEAGZQHSSNMHH-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN CCOc1cc(/C=C/C(=O)Nc2ccc([C@H](C)CC)cc2)ccc1OC ZINC000408600972 570579085 /nfs/dbraw/zinc/57/90/85/570579085.db2.gz HYKSAZANZZTRBP-FCONWMNKSA-N 0 0 353.462 5.259 40 0 FKABRN CCOc1cc(/C=C/C(=O)Nc2ccc([C@@H](C)CC)cc2)ccc1OC ZINC000408600973 263478664 /nfs/dbraw/zinc/47/86/64/263478664.db2.gz HYKSAZANZZTRBP-SBNBMVPLSA-N 0 0 353.462 5.259 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)CSCc1ccc(Cl)cc1Cl ZINC000408601244 570957453 /nfs/dbraw/zinc/95/74/53/570957453.db2.gz JHKIHHKMDKXBFB-UHFFFAOYSA-N 0 0 374.720 5.827 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)CSCc1cccc2ccccc21 ZINC000408601640 263478656 /nfs/dbraw/zinc/47/86/56/263478656.db2.gz LCQPYVLCUHEQBP-UHFFFAOYSA-N 0 0 355.890 5.674 40 0 FKABRN CCCOc1ccccc1/C=C1\SC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000408601643 570957344 /nfs/dbraw/zinc/95/73/44/570957344.db2.gz LCTQYAMKTMXVCS-ATVHPVEESA-N 0 0 373.861 5.370 40 0 FKABRN COc1ccc(Oc2ccc(C(=O)c3cc(Cl)cc(Cl)c3)cc2)cc1 ZINC000408601910 263478628 /nfs/dbraw/zinc/47/86/28/263478628.db2.gz MCKYNRMBVUBGEF-UHFFFAOYSA-N 0 0 373.235 6.025 40 0 FKABRN CCOc1cc(/C=C/C(=O)Nc2ccc(Cl)c(Cl)c2)ccc1OC ZINC000408602057 570957518 /nfs/dbraw/zinc/95/75/18/570957518.db2.gz CAYKXHDSBMGCSC-WEVVVXLNSA-N 0 0 366.244 5.053 40 0 FKABRN O=C(Nc1ccc(Nc2ccccc2)cc1)c1cc2cc(Cl)ccc2o1 ZINC000408602094 570957464 /nfs/dbraw/zinc/95/74/64/570957464.db2.gz CIEQTFFXJBUTEP-UHFFFAOYSA-N 0 0 362.816 6.082 40 0 FKABRN CC(C)c1cc(Br)ccc1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000408602387 263479963 /nfs/dbraw/zinc/47/99/63/263479963.db2.gz NCWUYACHRKNIOG-UHFFFAOYSA-N 0 0 372.089 6.110 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2)cc1)c1cc2cc(Cl)ccc2o1 ZINC000408602878 570957331 /nfs/dbraw/zinc/95/73/31/570957331.db2.gz DBWODDGTPRKXFF-UHFFFAOYSA-N 0 0 363.800 6.131 40 0 FKABRN Cc1ccc(NC(=O)CSCc2ccc(Cl)cc2Cl)cc1Cl ZINC000408602912 570957394 /nfs/dbraw/zinc/95/73/94/570957394.db2.gz OXJNUSIZNLBMQX-UHFFFAOYSA-N 0 0 374.720 5.827 40 0 FKABRN Cc1ccc(NC(=O)CSCc2cccc3ccccc32)cc1Cl ZINC000408602918 263479640 /nfs/dbraw/zinc/47/96/40/263479640.db2.gz OZQXAKSDHMMAEJ-UHFFFAOYSA-N 0 0 355.890 5.674 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)CSCc1cccc2ccccc21 ZINC000408603093 263479857 /nfs/dbraw/zinc/47/98/57/263479857.db2.gz QCKYIOUGEKBDRT-UHFFFAOYSA-N 0 0 355.890 5.674 40 0 FKABRN COc1ccccc1Oc1ccc(C(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000408603610 263480007 /nfs/dbraw/zinc/48/00/07/263480007.db2.gz SAEDKYBQRYAZDP-UHFFFAOYSA-N 0 0 373.235 6.025 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)CSCc1ccc(Cl)cc1Cl ZINC000408604127 570957958 /nfs/dbraw/zinc/95/79/58/570957958.db2.gz SSYDQPZLFJVFPB-UHFFFAOYSA-N 0 0 374.720 5.827 40 0 FKABRN O=C(/C=C/c1ccc(F)cc1)Nc1ccc(Oc2ccccc2Cl)cc1 ZINC000408604298 570958044 /nfs/dbraw/zinc/95/80/44/570958044.db2.gz URSZRZXYXXJCGY-VGOFMYFVSA-N 0 0 367.807 5.923 40 0 FKABRN Cc1cccc(Oc2ccc(C(=O)c3cc(Cl)cc(Cl)c3)cc2)c1 ZINC000408604571 570957900 /nfs/dbraw/zinc/95/79/00/570957900.db2.gz VKGUJGDRZGWQBM-UHFFFAOYSA-N 0 0 357.236 6.325 40 0 FKABRN Cc1ccc(C)c(NC(=O)CSCc2ccc(Cl)cc2Cl)c1 ZINC000408604622 263480063 /nfs/dbraw/zinc/48/00/63/263480063.db2.gz VTEZPYDDQQXWDI-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN CCCOc1ccc(Cl)cc1CNc1ccc(Br)cc1C ZINC000408604629 263480195 /nfs/dbraw/zinc/48/01/95/263480195.db2.gz FDPCNQOCMOUIQG-UHFFFAOYSA-N 0 0 368.702 5.812 40 0 FKABRN Cc1cccc(NC(=O)CSCc2ccc(Cl)cc2Cl)c1C ZINC000408604635 570580814 /nfs/dbraw/zinc/58/08/14/570580814.db2.gz VUOWFRFJYZJQMH-UHFFFAOYSA-N 0 0 354.302 5.482 40 0 FKABRN Fc1ccc(COc2ccc(CNc3ccc(F)c(Cl)c3)cc2)cc1 ZINC000408604682 570580881 /nfs/dbraw/zinc/58/08/81/570580881.db2.gz DTRFAJSVZDXKBH-UHFFFAOYSA-N 0 0 359.803 5.809 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2)nc1)c1cc2cc(Cl)ccc2o1 ZINC000408604706 570580834 /nfs/dbraw/zinc/58/08/34/570580834.db2.gz HVBISGYJEISSPT-UHFFFAOYSA-N 0 0 364.788 5.526 40 0 FKABRN Fc1cccc(COc2cccc(CNc3ccc(F)c(Cl)c3)c2)c1 ZINC000408604892 570581246 /nfs/dbraw/zinc/58/12/46/570581246.db2.gz FQHILBWQQIQYBE-UHFFFAOYSA-N 0 0 359.803 5.809 40 0 FKABRN Cc1ccccc1Oc1ccc(C(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000408605044 570958029 /nfs/dbraw/zinc/95/80/29/570958029.db2.gz WNYDXXYJASRETA-UHFFFAOYSA-N 0 0 357.236 6.325 40 0 FKABRN Cc1ccc(Oc2ccc(C(=O)c3cc(Cl)cc(Cl)c3)cc2)cc1 ZINC000408605056 570957845 /nfs/dbraw/zinc/95/78/45/570957845.db2.gz WRAOBXPINMVCJH-UHFFFAOYSA-N 0 0 357.236 6.325 40 0 FKABRN COc1ccccc1Oc1ccc(NC(=O)/C=C/c2ccc(F)cc2)cc1 ZINC000408605094 570577499 /nfs/dbraw/zinc/57/74/99/570577499.db2.gz WTKQAEXEOVNSSU-OVCLIPMQSA-N 0 0 363.388 5.279 40 0 FKABRN CCOc1ccc2ccccc2c1CNc1ccc(Br)cc1C ZINC000408605416 570957839 /nfs/dbraw/zinc/95/78/39/570957839.db2.gz HDQWIVLWJGVVKC-UHFFFAOYSA-N 0 0 370.290 5.922 40 0 FKABRN CCCOc1ccc(CNc2ccc(Br)cc2C)cc1Cl ZINC000408605507 570957857 /nfs/dbraw/zinc/95/78/57/570957857.db2.gz HKTCDKKUNIZKPU-UHFFFAOYSA-N 0 0 368.702 5.812 40 0 FKABRN O=C(Nc1ccc(Oc2cccc(Cl)c2)cc1)c1ccc2c(c1)OCO2 ZINC000408605570 570957929 /nfs/dbraw/zinc/95/79/29/570957929.db2.gz JMZRPHDYLKXVPH-UHFFFAOYSA-N 0 0 367.788 5.113 40 0 FKABRN O=C(Nc1ccc(Oc2ccccc2Cl)cc1)c1ccc2c(c1)OCO2 ZINC000408605738 570957912 /nfs/dbraw/zinc/95/79/12/570957912.db2.gz JYTUYOBVBNNCQK-UHFFFAOYSA-N 0 0 367.788 5.113 40 0 FKABRN CCOc1cc(CNc2ccc(Br)cc2C)cc(Cl)c1O ZINC000408606206 570957872 /nfs/dbraw/zinc/95/78/72/570957872.db2.gz HOYMIGZTUGCYIT-UHFFFAOYSA-N 0 0 370.674 5.127 40 0 FKABRN O=C(Nc1cc(Cl)ccc1Oc1ccccc1)c1cc2ccccc2o1 ZINC000408606711 570957896 /nfs/dbraw/zinc/95/78/96/570957896.db2.gz LPZOZAGYORZQBX-UHFFFAOYSA-N 0 0 363.800 6.131 40 0 FKABRN CCOc1ccc(CNc2ccc(Br)cc2C)cc1Cl ZINC000408607231 263481009 /nfs/dbraw/zinc/48/10/09/263481009.db2.gz JESXOIMCAUOYPJ-UHFFFAOYSA-N 0 0 354.675 5.422 40 0 FKABRN Fc1cccc(COc2ccc(CNc3ccc(F)c(Cl)c3)cc2)c1 ZINC000408607250 570957934 /nfs/dbraw/zinc/95/79/34/570957934.db2.gz KGJUWIPVOKZPGL-UHFFFAOYSA-N 0 0 359.803 5.809 40 0 FKABRN CCOc1ccc(CNc2ccc(Br)cc2C)cc1OCC ZINC000408609334 570958439 /nfs/dbraw/zinc/95/84/39/570958439.db2.gz MZSPVDDFRUPIQO-UHFFFAOYSA-N 0 0 364.283 5.167 40 0 FKABRN Fc1cccc(COc2ccccc2CNc2ccc(F)c(Cl)c2)c1 ZINC000408609855 570956435 /nfs/dbraw/zinc/95/64/35/570956435.db2.gz PDRJTTMSWGURGE-UHFFFAOYSA-N 0 0 359.803 5.809 40 0 FKABRN CCOc1ccc(Cl)cc1CNc1ccc(Br)cc1C ZINC000408612579 570956971 /nfs/dbraw/zinc/95/69/71/570956971.db2.gz STFZPLYSESRIOL-UHFFFAOYSA-N 0 0 354.675 5.422 40 0 FKABRN Fc1ccc(NCc2ccc(OCc3ccccc3F)cc2)cc1Cl ZINC000408613080 570957389 /nfs/dbraw/zinc/95/73/89/570957389.db2.gz XIXRGVHJNSRRPN-UHFFFAOYSA-N 0 0 359.803 5.809 40 0 FKABRN Cc1cc(NC(=O)c2cc3cc(Cl)ccc3o2)ccc1Br ZINC000408613224 570957483 /nfs/dbraw/zinc/95/74/83/570957483.db2.gz VWTZAVLXKGTSMK-UHFFFAOYSA-N 0 0 364.626 5.409 40 0 FKABRN CCCOc1ccc(CNc2ccc(Br)cc2C)cc1OC ZINC000408613838 570957357 /nfs/dbraw/zinc/95/73/57/570957357.db2.gz WINGTWRPKAZURC-UHFFFAOYSA-N 0 0 364.283 5.167 40 0 FKABRN O=C(NCCSC1CCCCC1)c1cc2c(ccc3ccccc23)o1 ZINC000408614671 570584842 /nfs/dbraw/zinc/58/48/42/570584842.db2.gz GCHGVXCNXACOIL-UHFFFAOYSA-N 0 0 353.487 5.382 40 0 FKABRN O=C(Nc1ccccc1-c1ccccc1)c1cc2c(ccc3ccccc23)o1 ZINC000408615149 570584867 /nfs/dbraw/zinc/58/48/67/570584867.db2.gz MQFCTDHIHXJDFN-UHFFFAOYSA-N 0 0 363.416 6.505 40 0 FKABRN O=C(c1cc2c(ccc3ccccc23)o1)N1CCC(Cc2ccccc2)CC1 ZINC000408615522 263482168 /nfs/dbraw/zinc/48/21/68/263482168.db2.gz BIWFBBRILJAWAV-UHFFFAOYSA-N 0 0 369.464 5.681 40 0 FKABRN O=C(Nc1ccccc1C(F)(F)F)c1cc2c(ccc3ccccc23)o1 ZINC000408616293 570585216 /nfs/dbraw/zinc/58/52/16/570585216.db2.gz FWSNGPZHRVHWBY-UHFFFAOYSA-N 0 0 355.315 5.857 40 0 FKABRN COc1ccc(Cl)cc1NC(=O)c1cc2c(ccc3ccccc23)o1 ZINC000408616869 570585819 /nfs/dbraw/zinc/58/58/19/570585819.db2.gz COVQKEJUQWXNLD-UHFFFAOYSA-N 0 0 351.789 5.500 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408617081 570959632 /nfs/dbraw/zinc/95/96/32/570959632.db2.gz BJZXLBMYVAXLDL-UHFFFAOYSA-N 0 0 350.176 5.645 40 0 FKABRN Cc1cc(F)ccc1C(=O)Nc1ccc(Br)cc1C(C)C ZINC000408617093 570585678 /nfs/dbraw/zinc/58/56/78/570585678.db2.gz BOJQHHMAJLCKKP-UHFFFAOYSA-N 0 0 350.231 5.272 40 0 FKABRN Cc1cccc(Cl)c1NC(=O)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408617144 570959602 /nfs/dbraw/zinc/95/96/02/570959602.db2.gz BVCKDCMWZNHFDK-UHFFFAOYSA-N 0 0 364.203 5.953 40 0 FKABRN O=C(Nc1ccc(C(F)(F)F)cc1)c1cc2c(ccc3ccccc23)o1 ZINC000408617159 263481865 /nfs/dbraw/zinc/48/18/65/263481865.db2.gz IAPPKJKDMXQJLY-UHFFFAOYSA-N 0 0 355.315 5.857 40 0 FKABRN Cc1ccc(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)cc1C ZINC000408617348 570959503 /nfs/dbraw/zinc/95/95/03/570959503.db2.gz AGTRSYWACWBNPR-UHFFFAOYSA-N 0 0 368.889 5.237 40 0 FKABRN O=C(Nc1cccc(Cl)c1)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408617695 570959512 /nfs/dbraw/zinc/95/95/12/570959512.db2.gz DJDGCMUYQRQWAP-UHFFFAOYSA-N 0 0 350.176 5.645 40 0 FKABRN COc1ccc(Oc2ccc(NC(=O)c3ccc(F)cc3C)cc2)cc1 ZINC000408618288 570959622 /nfs/dbraw/zinc/95/96/22/570959622.db2.gz FVRILHJCBMYAPH-UHFFFAOYSA-N 0 0 351.377 5.187 40 0 FKABRN COc1ccc(C(=O)Nc2ccc(Oc3ccccc3C)cc2)cc1OC ZINC000408618792 570960154 /nfs/dbraw/zinc/96/01/54/570960154.db2.gz GQEJWSNTWACPMJ-UHFFFAOYSA-N 0 0 363.413 5.057 40 0 FKABRN Cc1c(Cl)cccc1NC(=O)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408618875 570582985 /nfs/dbraw/zinc/58/29/85/570582985.db2.gz HMMGUWYLGRMLBW-UHFFFAOYSA-N 0 0 364.203 5.953 40 0 FKABRN CCc1ccccc1NC(=S)NC(=O)c1cccc2c(Cl)cccc12 ZINC000408619051 570959985 /nfs/dbraw/zinc/95/99/85/570959985.db2.gz FRVVSUBGCOHWEH-UHFFFAOYSA-N 0 0 368.889 5.182 40 0 FKABRN Cc1ccc(C)c(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)c1 ZINC000408619067 570959942 /nfs/dbraw/zinc/95/99/42/570959942.db2.gz FUXVLIIIJMOZAS-UHFFFAOYSA-N 0 0 368.889 5.237 40 0 FKABRN COc1cccc(C(=O)Nc2ccc3oc(-c4cc(C)cc(C)c4)nc3c2)c1 ZINC000408619224 570583480 /nfs/dbraw/zinc/58/34/80/570583480.db2.gz ACZCMVOCSYFXRY-UHFFFAOYSA-N 0 0 372.424 5.373 40 0 FKABRN CCCCOc1cccc(C(=O)Nc2cc(NC(=O)CC)ccc2Cl)c1 ZINC000408619237 570583398 /nfs/dbraw/zinc/58/33/98/570583398.db2.gz AMYADJBZSSQFLQ-UHFFFAOYSA-N 0 0 374.868 5.120 40 0 FKABRN COc1c(Br)c2ccccc2cc1C(=O)Nc1ccccc1C ZINC000408619244 570583400 /nfs/dbraw/zinc/58/34/00/570583400.db2.gz AOVPOWKZAHTYET-UHFFFAOYSA-N 0 0 370.246 5.172 40 0 FKABRN COc1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)cc1Cl ZINC000408619257 570960108 /nfs/dbraw/zinc/96/01/08/570960108.db2.gz ATRGPCZHNCLJHU-UHFFFAOYSA-N 0 0 364.150 5.273 40 0 FKABRN COc1c(Br)c2ccccc2cc1C(=O)Nc1ccccc1F ZINC000408619281 570960206 /nfs/dbraw/zinc/96/02/06/570960206.db2.gz AXVISPSFKGGMCF-UHFFFAOYSA-N 0 0 374.209 5.002 40 0 FKABRN CC(C)COc1ccc(C(=O)Nc2ccccc2N2CCC(C)CC2)cc1 ZINC000408619290 570960201 /nfs/dbraw/zinc/96/02/01/570960201.db2.gz AZDUHWUHWISNRO-UHFFFAOYSA-N 0 0 366.505 5.210 40 0 FKABRN O=C(Nc1nc2ccc(F)cc2s1)c1ccc(-c2ccc(Cl)cc2)o1 ZINC000408619294 570583490 /nfs/dbraw/zinc/58/34/90/570583490.db2.gz AZEBNPUBTBLBDV-UHFFFAOYSA-N 0 0 372.808 5.601 40 0 FKABRN Cc1ccccc1NC(=O)COc1c(Cl)c(C)c(Cl)c(C)c1Cl ZINC000408619347 570960141 /nfs/dbraw/zinc/96/01/41/570960141.db2.gz BGYWMIMHJIZORO-UHFFFAOYSA-N 0 0 372.679 5.590 40 0 FKABRN Cc1ccc(-c2nc3cc(NC(=O)c4cccs4)ccc3o2)cc1Cl ZINC000408619428 570959998 /nfs/dbraw/zinc/95/99/98/570959998.db2.gz CAFGQKUNEVZTEU-UHFFFAOYSA-N 0 0 368.845 5.770 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1ccc2oc(-c3ccccc3C)nc2c1 ZINC000408619444 570960000 /nfs/dbraw/zinc/96/00/00/570960000.db2.gz CCDYSUPYTCXPRZ-UHFFFAOYSA-N 0 0 372.424 5.373 40 0 FKABRN O=C(Nc1ccc2oc(-c3ccc(Cl)cc3)nc2c1)c1cccc(F)c1 ZINC000408619453 570960024 /nfs/dbraw/zinc/96/00/24/570960024.db2.gz CDWDLLSZKTZLKU-UHFFFAOYSA-N 0 0 366.779 5.540 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1ccc2oc(-c3ccc(C)cc3)nc2c1 ZINC000408619474 570960164 /nfs/dbraw/zinc/96/01/64/570960164.db2.gz CHBJQPSLCLRIRM-UHFFFAOYSA-N 0 0 372.424 5.373 40 0 FKABRN COc1ccc(C(=O)Nc2ccc3oc(-c4cc(C)cc(C)c4)nc3c2)cc1 ZINC000408619488 570583532 /nfs/dbraw/zinc/58/35/32/570583532.db2.gz CJSQOZVXQDAVQS-UHFFFAOYSA-N 0 0 372.424 5.373 40 0 FKABRN CC(C)COc1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000408619551 570960115 /nfs/dbraw/zinc/96/01/15/570960115.db2.gz CSKWMHYKMWIUSY-UHFFFAOYSA-N 0 0 371.786 5.646 40 0 FKABRN COc1c(Cl)cc(Cl)cc1C(=O)Nc1cc(Cl)ccc1Cl ZINC000408619556 570584001 /nfs/dbraw/zinc/58/40/01/570584001.db2.gz CTQBGNJNGWPVOP-UHFFFAOYSA-N 0 0 365.043 5.561 40 0 FKABRN Cc1cccc(C)c1NC(=O)C(=O)c1c(-c2ccccc2)cc2ccccn21 ZINC000408619570 570959980 /nfs/dbraw/zinc/95/99/80/570959980.db2.gz JHJRIBZIZSYUEU-UHFFFAOYSA-N 0 0 368.436 5.045 40 0 FKABRN COc1cccc(Oc2ccc(NC(=O)c3ccc(F)cc3C)cc2)c1 ZINC000408619581 570960212 /nfs/dbraw/zinc/96/02/12/570960212.db2.gz JLSCXVIIPQGZSH-UHFFFAOYSA-N 0 0 351.377 5.187 40 0 FKABRN CCCCOc1cccc(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)c1 ZINC000408619878 570960138 /nfs/dbraw/zinc/96/01/38/570960138.db2.gz CVIPNKNUPXFCEW-UHFFFAOYSA-N 0 0 371.786 5.790 40 0 FKABRN CCCC(=O)Nc1ccc(NC(=O)c2cccc3c(Cl)cccc23)cc1 ZINC000408619906 570585239 /nfs/dbraw/zinc/58/52/39/570585239.db2.gz DAXJOHKPUOPEMY-UHFFFAOYSA-N 0 0 366.848 5.484 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 ZINC000408619909 570585397 /nfs/dbraw/zinc/58/53/97/570585397.db2.gz DDRCQSTWPWQGBH-UHFFFAOYSA-N 0 0 367.832 5.702 40 0 FKABRN Cc1ccccc1-c1nc2cc(NC(=O)c3cccnc3Cl)ccc2o1 ZINC000408619936 570960183 /nfs/dbraw/zinc/96/01/83/570960183.db2.gz DNDWHJNCSROANY-UHFFFAOYSA-N 0 0 363.804 5.104 40 0 FKABRN Cc1cccc(NC(=O)COc2c(Cl)c(C)c(Cl)c(C)c2Cl)c1 ZINC000408619959 570960122 /nfs/dbraw/zinc/96/01/22/570960122.db2.gz DYPJHSRYHMCCDH-UHFFFAOYSA-N 0 0 372.679 5.590 40 0 FKABRN CC(C)c1ccc(/C=C/C(=O)Nc2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000408619962 570960210 /nfs/dbraw/zinc/96/02/10/570960210.db2.gz FAFNQVNXMMHYQK-BJMVGYQFSA-N 0 0 367.798 6.134 40 0 FKABRN CCCCCC(=O)Nc1ccc(NC(=O)c2ccccc2Cl)c(OC)c1 ZINC000408619988 570583563 /nfs/dbraw/zinc/58/35/63/570583563.db2.gz FUTCOSCXETYGTQ-UHFFFAOYSA-N 0 0 374.868 5.120 40 0 FKABRN O=C(/C=C/c1ccc(-c2ccc(Cl)cc2Cl)o1)Nc1nccs1 ZINC000408619990 570959990 /nfs/dbraw/zinc/95/99/90/570959990.db2.gz FWTNNZUFGUCMPQ-ZZXKWVIFSA-N 0 0 365.241 5.362 40 0 FKABRN CCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C/c2ccc(C(C)C)cc2)c1 ZINC000408619995 570959925 /nfs/dbraw/zinc/95/99/25/570959925.db2.gz GCEUPSOAQBNVIS-KPKJPENVSA-N 0 0 370.880 5.464 40 0 FKABRN O=C(Nc1nc(-c2ccccc2)cs1)c1cccc2c(Cl)cccc12 ZINC000408620014 570959939 /nfs/dbraw/zinc/95/99/39/570959939.db2.gz GMTRQEIPEPYAIK-UHFFFAOYSA-N 0 0 364.857 5.869 40 0 FKABRN Cc1ccc(NC(=O)COc2c(Cl)c(C)c(Cl)c(C)c2Cl)cc1 ZINC000408620016 570960019 /nfs/dbraw/zinc/96/00/19/570960019.db2.gz GNSHKMIFFOQAGC-UHFFFAOYSA-N 0 0 372.679 5.590 40 0 FKABRN O=C(Nc1ccccc1Cl)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408620354 570960030 /nfs/dbraw/zinc/96/00/30/570960030.db2.gz LZPQVAJCKGWSTH-UHFFFAOYSA-N 0 0 350.176 5.645 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000408620517 570960198 /nfs/dbraw/zinc/96/01/98/570960198.db2.gz GXXMYPMSVXKJAG-UHFFFAOYSA-N 0 0 371.786 5.790 40 0 FKABRN Cc1ccc(C)c2sc(NC(=O)c3cccc4c(Cl)cccc34)nc21 ZINC000408620548 570584811 /nfs/dbraw/zinc/58/48/11/570584811.db2.gz HGRCBSSNILKTKE-UHFFFAOYSA-N 0 0 366.873 5.972 40 0 FKABRN COc1c(Cl)cc(Cl)cc1C(=O)Nc1cccc(Cl)c1Cl ZINC000408620563 570959956 /nfs/dbraw/zinc/95/99/56/570959956.db2.gz HIEALUKERPERAZ-UHFFFAOYSA-N 0 0 365.043 5.561 40 0 FKABRN CC[C@@H](C)c1ccc(OCC(=O)Nc2nc3c(s2)c(C)ccc3C)cc1 ZINC000408620602 570959965 /nfs/dbraw/zinc/95/99/65/570959965.db2.gz HQXDFTOCIREGFQ-CYBMUJFWSA-N 0 0 368.502 5.444 40 0 FKABRN CC[C@H](C)c1ccc(OCC(=O)Nc2nc3c(s2)c(C)ccc3C)cc1 ZINC000408620606 570960585 /nfs/dbraw/zinc/96/05/85/570960585.db2.gz HQXDFTOCIREGFQ-ZDUSSCGKSA-N 0 0 368.502 5.444 40 0 FKABRN O=C(Nc1ccc(NC(=O)c2ccc(F)cc2)cc1)c1cc2ccccc2o1 ZINC000408620697 570960533 /nfs/dbraw/zinc/96/05/33/570960533.db2.gz IWAYHCTXCCUBHW-UHFFFAOYSA-N 0 0 374.371 5.077 40 0 FKABRN CCc1ccc(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)cc1 ZINC000408620783 570960662 /nfs/dbraw/zinc/96/06/62/570960662.db2.gz KABVAVZTEBTNMO-UHFFFAOYSA-N 0 0 368.889 5.182 40 0 FKABRN Cc1ccc(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)c(C)c1 ZINC000408620819 570960375 /nfs/dbraw/zinc/96/03/75/570960375.db2.gz KFMDVSLDBRNJSX-UHFFFAOYSA-N 0 0 368.889 5.237 40 0 FKABRN O=C(Nc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)c1cc2ccccc2o1 ZINC000408621057 570960365 /nfs/dbraw/zinc/96/03/65/570960365.db2.gz NZKPIBFGGUBXNJ-UHFFFAOYSA-N 0 0 371.480 6.153 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4cc(C)cc(C)c4)nc3c2)cc1 ZINC000408621129 570960564 /nfs/dbraw/zinc/96/05/64/570960564.db2.gz JUTYGKSIEUSNDT-UHFFFAOYSA-N 0 0 370.452 5.926 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1nc(-c2cccc3ccccc32)cs1 ZINC000408621145 570960632 /nfs/dbraw/zinc/96/06/32/570960632.db2.gz JXRBMPAHAKNDQM-UHFFFAOYSA-N 0 0 374.465 5.533 40 0 FKABRN Cc1cccc(OCC(=O)Nc2nc(-c3cccc4ccccc43)cs2)c1 ZINC000408621151 570960574 /nfs/dbraw/zinc/96/05/74/570960574.db2.gz JYDKJNQJAKQJEO-UHFFFAOYSA-N 0 0 374.465 5.289 40 0 FKABRN Cc1cc(Br)ccc1NC(=O)c1cccc2c(Cl)cccc12 ZINC000408621284 570587086 /nfs/dbraw/zinc/58/70/86/570587086.db2.gz LFTGYAIGNHOTBS-UHFFFAOYSA-N 0 0 374.665 5.816 40 0 FKABRN Cc1ccc(C(=O)Nc2ccc(NC(=O)c3cc4ccccc4o3)cc2)cc1 ZINC000408621349 570960411 /nfs/dbraw/zinc/96/04/11/570960411.db2.gz MAECLCGUQWUCCT-UHFFFAOYSA-N 0 0 370.408 5.246 40 0 FKABRN CCOc1cc(C(=O)Nc2c(C)cccc2Cl)cc(Cl)c1OCC ZINC000408621668 570587551 /nfs/dbraw/zinc/58/75/51/570587551.db2.gz PCNOOKCJPMOAAX-UHFFFAOYSA-N 0 0 368.260 5.352 40 0 FKABRN Cc1cc(C)cc(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)c1 ZINC000408621703 570587589 /nfs/dbraw/zinc/58/75/89/570587589.db2.gz NHXUAWOMJXYYON-UHFFFAOYSA-N 0 0 368.889 5.237 40 0 FKABRN Cc1cc(NC(=O)c2cccc3c(Cl)cccc23)ccc1Br ZINC000408621924 570587953 /nfs/dbraw/zinc/58/79/53/570587953.db2.gz MMEJGHCGVPNUBL-UHFFFAOYSA-N 0 0 374.665 5.816 40 0 FKABRN O=C(Nc1ccc(C(F)(F)F)cc1Cl)c1ccc(Cl)c(Cl)c1 ZINC000408621925 570588024 /nfs/dbraw/zinc/58/80/24/570588024.db2.gz MNANQHHNIKKLFB-UHFFFAOYSA-N 0 0 368.569 5.918 40 0 FKABRN CCN(CC)c1ccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c(C)c1 ZINC000408621950 570588029 /nfs/dbraw/zinc/58/80/29/570588029.db2.gz NJNYYKGBAMNFFI-UHFFFAOYSA-N 0 0 374.912 5.291 40 0 FKABRN CCCCC(=O)Nc1cccc(NC(=O)c2ccc(OCC(C)C)cc2)c1 ZINC000408621955 570587877 /nfs/dbraw/zinc/58/78/77/570587877.db2.gz NPQLCBKJZBENSX-UHFFFAOYSA-N 0 0 368.477 5.102 40 0 FKABRN O=C(/C=C/c1ccc(-c2cc(Cl)cc(Cl)c2)o1)Nc1nccs1 ZINC000408621959 570960484 /nfs/dbraw/zinc/96/04/84/570960484.db2.gz NSGYKZABEYJVBJ-DUXPYHPUSA-N 0 0 365.241 5.362 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc2oc(-c3ccc(Br)cc3)nc2c1 ZINC000408621960 570960630 /nfs/dbraw/zinc/96/06/30/570960630.db2.gz NSHVZFZZWRHQMV-UHFFFAOYSA-N 0 0 373.250 5.242 40 0 FKABRN COc1c(Br)c2ccccc2cc1C(=O)Nc1ccc(F)cc1 ZINC000408621972 570960380 /nfs/dbraw/zinc/96/03/80/570960380.db2.gz OBQVKCBCFRVSLW-UHFFFAOYSA-N 0 0 374.209 5.002 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1ccc2oc(-c3cccc(C)c3)nc2c1 ZINC000408621975 570587884 /nfs/dbraw/zinc/58/78/84/570587884.db2.gz OCPIXPPSNAKZKB-UHFFFAOYSA-N 0 0 372.424 5.373 40 0 FKABRN Cc1ccc(C)c2sc(NC(=O)COc3ccc(C(C)(C)C)cc3)nc21 ZINC000408621989 570960635 /nfs/dbraw/zinc/96/06/35/570960635.db2.gz OLMRGQYEGLDKGT-UHFFFAOYSA-N 0 0 368.502 5.228 40 0 FKABRN COc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Cl)cc1Cl ZINC000408621993 570587972 /nfs/dbraw/zinc/58/79/72/570587972.db2.gz OQHPXKVJDFHBST-UHFFFAOYSA-N 0 0 365.043 5.561 40 0 FKABRN O=C(NCc1ccc(Cl)cc1Cl)c1cc2c(ccc3ccccc23)o1 ZINC000408622296 570960558 /nfs/dbraw/zinc/96/05/58/570960558.db2.gz VPBPHYNKSGEGEL-UHFFFAOYSA-N 0 0 370.235 5.823 40 0 FKABRN O=C(Nc1ccc2ccccc2c1)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408622354 570960516 /nfs/dbraw/zinc/96/05/16/570960516.db2.gz PTPCTJJNXLQKNF-UHFFFAOYSA-N 0 0 365.791 6.145 40 0 FKABRN Cc1cc2sc(NC(=O)c3cccc4c(Cl)cccc34)nc2c(C)c1 ZINC000408622603 570587949 /nfs/dbraw/zinc/58/79/49/570587949.db2.gz PJPONMQAIYJQMX-UHFFFAOYSA-N 0 0 366.873 5.972 40 0 FKABRN Cc1ccccc1NC(=O)/C=C/c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000408622605 570587992 /nfs/dbraw/zinc/58/79/92/570587992.db2.gz PKEJZBKMTMTFEK-DHZHZOJOSA-N 0 0 372.251 6.214 40 0 FKABRN O=C(Nc1ccc2oc(-c3cccc4ccccc43)nc2c1)c1cccs1 ZINC000408622623 570588035 /nfs/dbraw/zinc/58/80/35/570588035.db2.gz PSKMFUDZHDTRJT-UHFFFAOYSA-N 0 0 370.433 5.962 40 0 FKABRN Cc1cc(C)cc(-c2nc3cc(NC(=O)COc4ccccc4)ccc3o2)c1 ZINC000408622626 570588004 /nfs/dbraw/zinc/58/80/04/570588004.db2.gz PSMYMUIAXFOHMO-UHFFFAOYSA-N 0 0 372.424 5.129 40 0 FKABRN O=C(Nc1ccccc1N1CCCCC1)c1cccc2c(Cl)cccc12 ZINC000408622634 570588033 /nfs/dbraw/zinc/58/80/33/570588033.db2.gz PWHGLDZYWZBRTL-UHFFFAOYSA-N 0 0 364.876 5.736 40 0 FKABRN O=C(COc1ccc(C2CCCCC2)cc1)Nc1nc2ccccc2s1 ZINC000408622643 570958345 /nfs/dbraw/zinc/95/83/45/570958345.db2.gz QFHYRGWGGBCYCL-UHFFFAOYSA-N 0 0 366.486 5.362 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(NC(=O)Cc3ccccc3)cc2)cc1 ZINC000408622650 570587890 /nfs/dbraw/zinc/58/78/90/570587890.db2.gz QHTRBWCMQXMOAT-UHFFFAOYSA-N 0 0 372.468 5.244 40 0 FKABRN CC[C@@H](C)c1ccccc1NC(=O)COc1ccc(C2CCCCC2)cc1 ZINC000408622687 570958447 /nfs/dbraw/zinc/95/84/47/570958447.db2.gz QOKDXLRTCMTEEX-GOSISDBHSA-N 0 0 365.517 6.265 40 0 FKABRN CC[C@H](C)c1ccccc1NC(=O)COc1ccc(C2CCCCC2)cc1 ZINC000408622690 570958383 /nfs/dbraw/zinc/95/83/83/570958383.db2.gz QOKDXLRTCMTEEX-SFHVURJKSA-N 0 0 365.517 6.265 40 0 FKABRN Cc1ccc(-c2nc3cc(NC(=O)c4cccs4)ccc3o2)c(Cl)c1 ZINC000408622691 570958421 /nfs/dbraw/zinc/95/84/21/570958421.db2.gz QOYKPBDVWUKWGO-UHFFFAOYSA-N 0 0 368.845 5.770 40 0 FKABRN Cc1ccc(C(C)C)c(OCC(=O)Nc2nc3c(s2)c(C)ccc3C)c1 ZINC000408622721 570588315 /nfs/dbraw/zinc/58/83/15/570588315.db2.gz RCRWIAKFJHDLMB-UHFFFAOYSA-N 0 0 368.502 5.362 40 0 FKABRN Cc1cccc(NC(=O)/C=C/c2ccc(-c3cc(Cl)cc(Cl)c3)o2)c1 ZINC000408622727 570958425 /nfs/dbraw/zinc/95/84/25/570958425.db2.gz RDMBKMGITHSOLO-SOFGYWHQSA-N 0 0 372.251 6.214 40 0 FKABRN O=C(Nc1ccc(N2CCCCC2)cc1)c1cccc2c(Cl)cccc12 ZINC000408622739 570588553 /nfs/dbraw/zinc/58/85/53/570588553.db2.gz RGSOFDUQYKVSJF-UHFFFAOYSA-N 0 0 364.876 5.736 40 0 FKABRN COc1c(Br)c2ccccc2cc1C(=O)Nc1cccc(F)c1 ZINC000408622741 570588482 /nfs/dbraw/zinc/58/84/82/570588482.db2.gz RHBUMZIEUIXXJG-UHFFFAOYSA-N 0 0 374.209 5.002 40 0 FKABRN O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1cccc2c(Cl)cccc12 ZINC000408622753 570958434 /nfs/dbraw/zinc/95/84/34/570958434.db2.gz RHYAUYTYWLOTNJ-UHFFFAOYSA-N 0 0 369.851 6.317 40 0 FKABRN CC(C)(C)C(=O)Nc1ccc2oc(-c3ccccc3Br)nc2c1 ZINC000408622759 570958496 /nfs/dbraw/zinc/95/84/96/570958496.db2.gz RJJDUCCTPFJRQF-UHFFFAOYSA-N 0 0 373.250 5.242 40 0 FKABRN Cc1cccc(C)c1NC(=S)NC(=O)c1cccc2c(Cl)cccc12 ZINC000408622880 570588383 /nfs/dbraw/zinc/58/83/83/570588383.db2.gz QAFDLTDXHGMPRF-UHFFFAOYSA-N 0 0 368.889 5.237 40 0 FKABRN Cc1cccc(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)c1C ZINC000408622910 570588275 /nfs/dbraw/zinc/58/82/75/570588275.db2.gz QGFVDMHHQCPGCH-UHFFFAOYSA-N 0 0 368.889 5.237 40 0 FKABRN CC[C@@H](C)c1ccc(NC(=O)COc2ccc(C3CCCCC3)cc2)cc1 ZINC000408623173 570588746 /nfs/dbraw/zinc/58/87/46/570588746.db2.gz RUDJNZCDUOOQTB-GOSISDBHSA-N 0 0 365.517 6.265 40 0 FKABRN CC[C@H](C)c1ccc(NC(=O)COc2ccc(C3CCCCC3)cc2)cc1 ZINC000408623174 570588836 /nfs/dbraw/zinc/58/88/36/570588836.db2.gz RUDJNZCDUOOQTB-SFHVURJKSA-N 0 0 365.517 6.265 40 0 FKABRN O=C(Nc1cccc2ccccc21)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408623217 570588974 /nfs/dbraw/zinc/58/89/74/570588974.db2.gz RQLDMAINODIENH-UHFFFAOYSA-N 0 0 365.791 6.145 40 0 FKABRN CCOc1ccc(NC(=O)c2ccc(-c3ccc(F)c(Cl)c3)o2)cc1 ZINC000408623282 570588978 /nfs/dbraw/zinc/58/89/78/570588978.db2.gz SBNLVLGIENKZGD-UHFFFAOYSA-N 0 0 359.784 5.390 40 0 FKABRN Cc1ccccc1Oc1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1 ZINC000408623285 570589370 /nfs/dbraw/zinc/58/93/70/570589370.db2.gz SBQBFQHEARKBGO-UHFFFAOYSA-N 0 0 371.358 6.058 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408623288 570589273 /nfs/dbraw/zinc/58/92/73/570589273.db2.gz SCQQTYMKAPEQNW-UHFFFAOYSA-N 0 0 364.203 5.953 40 0 FKABRN COc1ccc(Cl)cc1C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC000408623289 570589230 /nfs/dbraw/zinc/58/92/30/570589230.db2.gz SLTZCUUKFVLDMN-UHFFFAOYSA-N 0 0 364.150 5.273 40 0 FKABRN Cc1ccc(NC(=O)/C=C/c2ccc(-c3cc(Cl)cc(Cl)c3)o2)cc1 ZINC000408623319 570589201 /nfs/dbraw/zinc/58/92/01/570589201.db2.gz SSUOKKODYKFQMH-VQHVLOKHSA-N 0 0 372.251 6.214 40 0 FKABRN CCc1cccc(C)c1NC(=O)c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408623332 570958268 /nfs/dbraw/zinc/95/82/68/570958268.db2.gz SMDLZCMNAIVNKC-UHFFFAOYSA-N 0 0 357.812 5.862 40 0 FKABRN CC(C)C(=O)Nc1ccc(NC(=O)c2cccc3c(Cl)cccc23)cc1 ZINC000408623348 570958261 /nfs/dbraw/zinc/95/82/61/570958261.db2.gz SVSMUFNVXQRUDT-UHFFFAOYSA-N 0 0 366.848 5.340 40 0 FKABRN CC(C)Oc1cccc(C(=O)Nc2ccc(Br)cc2Cl)c1 ZINC000408623394 570589259 /nfs/dbraw/zinc/58/92/59/570589259.db2.gz TUWRVXACCNXIPD-UHFFFAOYSA-N 0 0 368.658 5.142 40 0 FKABRN Cc1cc(C)cc(-c2nc3cc(NC(=O)c4ccc(C)c(C)c4)ccc3o2)c1 ZINC000408623410 570958500 /nfs/dbraw/zinc/95/85/00/570958500.db2.gz TYUUEZOPOQOTRS-UHFFFAOYSA-N 0 0 370.452 5.981 40 0 FKABRN Cc1ccccc1NC(=O)/C=C/c1ccc(-c2cc(Cl)cc(Cl)c2)o1 ZINC000408623413 570958508 /nfs/dbraw/zinc/95/85/08/570958508.db2.gz TZGYJYOMMMPCQY-VQHVLOKHSA-N 0 0 372.251 6.214 40 0 FKABRN COc1c(Cl)cc(Cl)cc1C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000408623426 570589249 /nfs/dbraw/zinc/58/92/49/570589249.db2.gz UBTLDCICHRDEPE-UHFFFAOYSA-N 0 0 365.043 5.561 40 0 FKABRN CCCC(=O)Nc1cccc(NC(=O)c2cccc3c(Cl)cccc23)c1 ZINC000408623436 570589336 /nfs/dbraw/zinc/58/93/36/570589336.db2.gz UFKZINUQORSTFA-UHFFFAOYSA-N 0 0 366.848 5.484 40 0 FKABRN CCCOC(=O)c1ccc(NC(=O)c2cccc3c(Cl)cccc23)cc1 ZINC000408623480 570958374 /nfs/dbraw/zinc/95/83/74/570958374.db2.gz UTCMMNTURKZAFX-UHFFFAOYSA-N 0 0 367.832 5.312 40 0 FKABRN O=C(Nc1ccc2c(c1)oc1ccccc12)c1cccc2c(Cl)cccc12 ZINC000408623485 570958257 /nfs/dbraw/zinc/95/82/57/570958257.db2.gz UUUFIZDMFXBPTR-UHFFFAOYSA-N 0 0 371.823 6.645 40 0 FKABRN COc1ccc(NC(=O)c2cc3c(ccc4ccccc34)o2)cc1Cl ZINC000408623641 570958490 /nfs/dbraw/zinc/95/84/90/570958490.db2.gz SHVWZPMDGXLDRB-UHFFFAOYSA-N 0 0 351.789 5.500 40 0 FKABRN O=C(Nc1ccc(CSc2ccccc2)cc1)c1cc2ccccc2o1 ZINC000408623655 570958461 /nfs/dbraw/zinc/95/84/61/570958461.db2.gz YMXJJPTZXKUYLH-UHFFFAOYSA-N 0 0 359.450 5.977 40 0 FKABRN CC(C)c1ccc(OCC(=O)Nc2ccc(C(F)(F)F)cc2Cl)cc1 ZINC000408623888 570589782 /nfs/dbraw/zinc/58/97/82/570589782.db2.gz UUWFLOLGQYQIKP-UHFFFAOYSA-N 0 0 371.786 5.500 40 0 FKABRN Cc1cc(C)cc(-c2nc3cc(NC(=O)/C=C/c4ccccc4)ccc3o2)c1 ZINC000408623909 570958472 /nfs/dbraw/zinc/95/84/72/570958472.db2.gz VBTXRZAEIWRQQB-DHZHZOJOSA-N 0 0 368.436 5.764 40 0 FKABRN COc1c(Br)c2ccccc2cc1C(=O)Nc1ccc(C)cc1 ZINC000408623923 570958379 /nfs/dbraw/zinc/95/83/79/570958379.db2.gz VFSRENOMODCTTL-UHFFFAOYSA-N 0 0 370.246 5.172 40 0 FKABRN COc1c(Br)c2ccccc2cc1C(=O)Nc1cccc(C)c1 ZINC000408623937 570958410 /nfs/dbraw/zinc/95/84/10/570958410.db2.gz VKLKDWAEFKAODV-UHFFFAOYSA-N 0 0 370.246 5.172 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccc(C)cc4C)nc3c2)cc1 ZINC000408623939 570589764 /nfs/dbraw/zinc/58/97/64/570589764.db2.gz VMOHCMKWCRHORP-UHFFFAOYSA-N 0 0 370.452 5.926 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1nc(-c2ccc3ccccc3c2)cs1 ZINC000408623943 570958246 /nfs/dbraw/zinc/95/82/46/570958246.db2.gz VNVSPIYTVIXHAF-UHFFFAOYSA-N 0 0 374.465 5.533 40 0 FKABRN O=C(/C=C/c1ccc(-c2cc(Cl)cc(Cl)c2)o1)NCc1ccccc1 ZINC000408623953 570589743 /nfs/dbraw/zinc/58/97/43/570589743.db2.gz VQZCJEDXVVTJCO-VQHVLOKHSA-N 0 0 372.251 5.583 40 0 FKABRN Cc1nc(NC(=O)c2ccc(-c3ccccc3)cc2)ccc1Br ZINC000408623962 570958849 /nfs/dbraw/zinc/95/88/49/570958849.db2.gz VUYHWUUACRVWCJ-UHFFFAOYSA-N 0 0 367.246 5.072 40 0 FKABRN CCN(CC)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2OC)cc1 ZINC000408623970 570958771 /nfs/dbraw/zinc/95/87/71/570958771.db2.gz VXPDKYQNLQRKPN-UHFFFAOYSA-N 0 0 367.276 5.101 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc3oc(-c4ccc(C)c(C)c4)nc3c2)cc1 ZINC000408623972 570958865 /nfs/dbraw/zinc/95/88/65/570958865.db2.gz VZFWKRJHMFYWSJ-UHFFFAOYSA-N 0 0 370.452 5.926 40 0 FKABRN O=C(Nc1cc(-c2nc3ccccc3[nH]2)ccc1Cl)c1ccc(F)cc1 ZINC000408623982 570589698 /nfs/dbraw/zinc/58/96/98/570589698.db2.gz ACBKHIHGKQUHIL-UHFFFAOYSA-N 0 0 365.795 5.275 40 0 FKABRN O=C(Nc1nc2ccc(F)cc2s1)c1ccc(-c2cccc(Cl)c2)o1 ZINC000408624003 570958747 /nfs/dbraw/zinc/95/87/47/570958747.db2.gz WHQRWIUKUVUGNB-UHFFFAOYSA-N 0 0 372.808 5.601 40 0 FKABRN O=C(Nc1ccccc1OC(F)F)c1ccc(-c2cccc(Cl)c2)o1 ZINC000408624034 570958857 /nfs/dbraw/zinc/95/88/57/570958857.db2.gz WSNHWLTYYGKNPN-UHFFFAOYSA-N 0 0 363.747 5.454 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3nc4cc(C)c(C)cc4o3)cc2)cc1 ZINC000408624205 570958851 /nfs/dbraw/zinc/95/88/51/570958851.db2.gz BNWWZJHYYZQYBT-UHFFFAOYSA-N 0 0 370.452 5.926 40 0 FKABRN CCCOc1c(Cl)cc(C(=O)Nc2ccc(F)c(C)c2)cc1OCC ZINC000408624221 570958833 /nfs/dbraw/zinc/95/88/33/570958833.db2.gz VAAVTDRTXGJTGV-UHFFFAOYSA-N 0 0 365.832 5.227 40 0 FKABRN COc1ccc2nc(NC(=O)c3cccc4c(Cl)cccc34)sc2c1 ZINC000408624517 570590622 /nfs/dbraw/zinc/59/06/22/570590622.db2.gz XOEHCTKACOXGSJ-UHFFFAOYSA-N 0 0 368.845 5.364 40 0 FKABRN O=C(Nc1cccc(Cl)c1Cl)c1ccc(-c2ccc(Cl)cc2)o1 ZINC000408624519 570590605 /nfs/dbraw/zinc/59/06/05/570590605.db2.gz XOGVHAFWQYPCFA-UHFFFAOYSA-N 0 0 366.631 6.159 40 0 FKABRN O=C(Nc1cccc(Cl)c1Cl)c1cccc(OCc2ccccc2)c1 ZINC000408624523 570958797 /nfs/dbraw/zinc/95/87/97/570958797.db2.gz XPIBTLSLPUUUMF-UHFFFAOYSA-N 0 0 372.251 5.825 40 0 FKABRN O=C(Nc1ccc(C(F)(F)F)cc1Cl)c1cc(Cl)ccc1Cl ZINC000408624564 570590632 /nfs/dbraw/zinc/59/06/32/570590632.db2.gz XSYZDDKXFPXGBZ-UHFFFAOYSA-N 0 0 368.569 5.918 40 0 FKABRN O=C(Nc1ccc2oc(-c3cccc4ccccc43)nc2c1)c1ccccc1 ZINC000408624577 570958713 /nfs/dbraw/zinc/95/87/13/570958713.db2.gz XWPNPRGYSOODLE-UHFFFAOYSA-N 0 0 364.404 5.900 40 0 FKABRN Cc1ccc(C)c2sc(NC(=O)COc3cc(C)c(Cl)c(C)c3)nc21 ZINC000408624595 570590661 /nfs/dbraw/zinc/59/06/61/570590661.db2.gz YCKKENIVMPMWSH-UHFFFAOYSA-N 0 0 374.893 5.201 40 0 FKABRN O=C(Nc1ccc2oc(-c3ccc(F)cc3Cl)nc2c1)c1cccs1 ZINC000408624621 570590603 /nfs/dbraw/zinc/59/06/03/570590603.db2.gz YFUAXOFVABTVOQ-UHFFFAOYSA-N 0 0 372.808 5.601 40 0 FKABRN O=C(CC12CC3CC(CC(C3)C1)C2)Nc1ccc(C(F)(F)F)cc1Cl ZINC000408624662 570590647 /nfs/dbraw/zinc/59/06/47/570590647.db2.gz YSTHJSQREDCRKY-UHFFFAOYSA-N 0 0 371.830 5.904 40 0 FKABRN COc1c(Cl)cc(Cl)cc1C(=O)Nc1ccccc1C(F)(F)F ZINC000408624692 570958738 /nfs/dbraw/zinc/95/87/38/570958738.db2.gz ZAHBCDKDQVHZDJ-UHFFFAOYSA-N 0 0 364.150 5.273 40 0 FKABRN O=C(Nc1nc2ccc(Cl)cc2s1)c1cccc2c(Cl)cccc12 ZINC000408624743 570958750 /nfs/dbraw/zinc/95/87/50/570958750.db2.gz ZNYSQHXXMIXYAF-UHFFFAOYSA-N 0 0 373.264 6.009 40 0 FKABRN CCCC(=O)Nc1c(Cl)cc(Cl)cc1-c1nc2ccccc2s1 ZINC000408624866 570958730 /nfs/dbraw/zinc/95/87/30/570958730.db2.gz CUOJNMQIRCSDMO-UHFFFAOYSA-N 0 0 365.285 6.009 40 0 FKABRN Cc1cc(-c2nc3ncccc3o2)ccc1NC(=O)c1ccc(C(C)C)cc1 ZINC000408624894 570958707 /nfs/dbraw/zinc/95/87/07/570958707.db2.gz DGPGJULEAVTHFP-UHFFFAOYSA-N 0 0 371.440 5.574 40 0 FKABRN CCOc1cc(C(=O)Nc2c(C)cccc2CC)cc(Cl)c1OCC ZINC000408624922 570958815 /nfs/dbraw/zinc/95/88/15/570958815.db2.gz VWWDCLSNZOFDRI-UHFFFAOYSA-N 0 0 361.869 5.261 40 0 FKABRN Cc1ccc(F)cc1NC(=O)c1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000408625029 570958844 /nfs/dbraw/zinc/95/88/44/570958844.db2.gz WNXLOHRLTJEDQR-UHFFFAOYSA-N 0 0 364.203 5.953 40 0 FKABRN COc1ccc(C(=O)Nc2ccc(Oc3cccc(C)c3)cc2)cc1OC ZINC000408625577 263483357 /nfs/dbraw/zinc/48/33/57/263483357.db2.gz XNTAQXVETQGTKD-UHFFFAOYSA-N 0 0 363.413 5.057 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2c(C)cccc2Cl)cc1OCC ZINC000408625622 570958725 /nfs/dbraw/zinc/95/87/25/570958725.db2.gz XRSZCCSWJGPTMN-UHFFFAOYSA-N 0 0 361.869 5.478 40 0 FKABRN Cc1cc(C)cc(NC(=O)C(=O)c2c(-c3ccccc3)cc3ccccn32)c1 ZINC000408625733 570591954 /nfs/dbraw/zinc/59/19/54/570591954.db2.gz XXOYKHILXBBKMH-UHFFFAOYSA-N 0 0 368.436 5.045 40 0 FKABRN O=C(NC1CCCCCCC1)C(=O)c1c(-c2ccccc2)cc2ccccn21 ZINC000408625934 570958753 /nfs/dbraw/zinc/95/87/53/570958753.db2.gz YRFZYCCYCWUKKI-UHFFFAOYSA-N 0 0 374.484 5.018 40 0 FKABRN Cc1ccc(NC(=O)c2ccc(-c3ccc(F)c(Cl)c3)o2)cc1Cl ZINC000408626013 570958867 /nfs/dbraw/zinc/95/88/67/570958867.db2.gz ZAJYTHCLSMPRFU-UHFFFAOYSA-N 0 0 364.203 5.953 40 0 FKABRN Cc1cc(NC(=O)c2ccc(-c3cc(Cl)ccc3Cl)o2)ccc1F ZINC000408626154 570958824 /nfs/dbraw/zinc/95/88/24/570958824.db2.gz ZNKGOQFYALALIX-UHFFFAOYSA-N 0 0 364.203 5.953 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1ccc(-c2nc3ccc(C)cc3o2)cc1 ZINC000408626381 570958860 /nfs/dbraw/zinc/95/88/60/570958860.db2.gz GWWVIJPTZHLWRA-UHFFFAOYSA-N 0 0 372.424 5.373 40 0 FKABRN CC(C)c1ccc2oc(-c3ccc(NC(=O)c4cccc(F)c4)cc3)nc2c1 ZINC000408626861 570592992 /nfs/dbraw/zinc/59/29/92/570592992.db2.gz IYXGJCFAGCTWAT-UHFFFAOYSA-N 0 0 374.415 6.010 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3nc4cc(CC)ccc4o3)cc2)cc1 ZINC000408626966 263483701 /nfs/dbraw/zinc/48/37/01/263483701.db2.gz JSXYQJZOHCEBLT-UHFFFAOYSA-N 0 0 370.452 5.872 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000408627120 570592975 /nfs/dbraw/zinc/59/29/75/570592975.db2.gz KJUUKOVDVSZEKP-VGOFMYFVSA-N 0 0 373.843 5.535 40 0 FKABRN O=C(NCCSCc1ccccc1)c1cc2c(ccc3ccccc23)o1 ZINC000408627332 570958734 /nfs/dbraw/zinc/95/87/34/570958734.db2.gz ZGPKSNSVRNFHIU-UHFFFAOYSA-N 0 0 361.466 5.249 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3cc4ccccc4o3)ccc21 ZINC000408627497 570593269 /nfs/dbraw/zinc/59/32/69/570593269.db2.gz NAYPUJFHORZPMF-UHFFFAOYSA-N 0 0 354.409 5.813 40 0 FKABRN COc1cccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2C)c1 ZINC000408627719 570958810 /nfs/dbraw/zinc/95/88/10/570958810.db2.gz NFTPPZIQMOTAIZ-UHFFFAOYSA-N 0 0 374.465 5.533 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3nc4cc(C)cc(C)c4o3)cc2)cc1 ZINC000408627840 570593389 /nfs/dbraw/zinc/59/33/89/570593389.db2.gz OHTXOHYQVGBGCT-UHFFFAOYSA-N 0 0 370.452 5.926 40 0 FKABRN CC(C)C(=O)Nc1c(Cl)cc(Cl)cc1-c1nc2ccccc2s1 ZINC000408627985 570593355 /nfs/dbraw/zinc/59/33/55/570593355.db2.gz PBHBDELFGXDTQM-UHFFFAOYSA-N 0 0 365.285 5.865 40 0 FKABRN Cc1ccc2nc(-c3ccc(NC(=O)c4cccnc4Cl)cc3)oc2c1 ZINC000408628169 570593816 /nfs/dbraw/zinc/59/38/16/570593816.db2.gz QFEURDAZYFVONS-UHFFFAOYSA-N 0 0 363.804 5.104 40 0 FKABRN CC(C)c1ccc(C(=O)NCc2ccc(-c3nc4ccccc4o3)cc2)cc1 ZINC000408628381 570958744 /nfs/dbraw/zinc/95/87/44/570958744.db2.gz SDJKWKZQKYFHGC-UHFFFAOYSA-N 0 0 370.452 5.548 40 0 FKABRN O=C(NCc1ccc(-c2nc3ccccc3o2)cc1)c1cc2ccccc2o1 ZINC000408628428 570958787 /nfs/dbraw/zinc/95/87/87/570958787.db2.gz SXQSRXIPLRSSKH-UHFFFAOYSA-N 0 0 368.392 5.171 40 0 FKABRN CCOc1ccc(C(=O)Nc2cc(-c3nc4ccccc4[nH]3)ccc2C)cc1 ZINC000408628755 570594140 /nfs/dbraw/zinc/59/41/40/570594140.db2.gz XBGPYORRGWVRBE-UHFFFAOYSA-N 0 0 371.440 5.189 40 0 FKABRN CC(C)c1ccc(C(=O)Nc2ccc(N3CCC(C)CC3)c(Cl)c2)cc1 ZINC000408628790 570958830 /nfs/dbraw/zinc/95/88/30/570958830.db2.gz AHPWOEDGFPCDEH-UHFFFAOYSA-N 0 0 370.924 5.952 40 0 FKABRN CC(C)COc1ccc(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)cc1 ZINC000408628791 570594505 /nfs/dbraw/zinc/59/45/05/570594505.db2.gz AIOJSQUIWRWXME-GOSISDBHSA-N 0 0 366.505 5.353 40 0 FKABRN CC(C)COc1ccc(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)cc1 ZINC000408628792 570594489 /nfs/dbraw/zinc/59/44/89/570594489.db2.gz AIOJSQUIWRWXME-SFHVURJKSA-N 0 0 366.505 5.353 40 0 FKABRN CC1CCN(c2ccc(NC(=O)c3cc4ccccc4o3)cc2Cl)CC1 ZINC000408628797 570594604 /nfs/dbraw/zinc/59/46/04/570594604.db2.gz AMQGSBDEQIFLEZ-UHFFFAOYSA-N 0 0 368.864 5.575 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1 ZINC000408628833 570594555 /nfs/dbraw/zinc/59/45/55/570594555.db2.gz CQERFIMWGLGXFE-IBGZPJMESA-N 0 0 370.496 5.985 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1 ZINC000408628834 570958819 /nfs/dbraw/zinc/95/88/19/570958819.db2.gz CQERFIMWGLGXFE-LJQANCHMSA-N 0 0 370.496 5.985 40 0 FKABRN Cc1cc(OCC(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)ccc1Cl ZINC000408628837 570958766 /nfs/dbraw/zinc/95/87/66/570958766.db2.gz DEZXAHXSBYCELM-INIZCTEOSA-N 0 0 372.896 5.045 40 0 FKABRN Cc1cc(OCC(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)ccc1Cl ZINC000408628838 570958802 /nfs/dbraw/zinc/95/88/02/570958802.db2.gz DEZXAHXSBYCELM-MRXNPFEDSA-N 0 0 372.896 5.045 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)c2ccc(Br)cc2)cc1 ZINC000408628839 570594752 /nfs/dbraw/zinc/59/47/52/570594752.db2.gz DFFBWUURVQLWNI-AWEZNQCLSA-N 0 0 373.294 5.080 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)c2ccc(Br)cc2)cc1 ZINC000408628840 570958838 /nfs/dbraw/zinc/95/88/38/570958838.db2.gz DFFBWUURVQLWNI-CQSZACIVSA-N 0 0 373.294 5.080 40 0 FKABRN CC(C)c1ccc(OCC(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)cc1 ZINC000408628844 570958821 /nfs/dbraw/zinc/95/88/21/570958821.db2.gz DHZNMCRBERUHRK-GOSISDBHSA-N 0 0 366.505 5.206 40 0 FKABRN CC(C)c1ccc(OCC(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)cc1 ZINC000408628845 570959062 /nfs/dbraw/zinc/95/90/62/570959062.db2.gz DHZNMCRBERUHRK-SFHVURJKSA-N 0 0 366.505 5.206 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)cc1Cl ZINC000408628871 570594486 /nfs/dbraw/zinc/59/44/86/570594486.db2.gz FPIMUFVQOHZNIR-HNNXBMFYSA-N 0 0 372.896 5.370 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)cc1Cl ZINC000408628872 570959039 /nfs/dbraw/zinc/95/90/39/570959039.db2.gz FPIMUFVQOHZNIR-OAHLLOKOSA-N 0 0 372.896 5.370 40 0 FKABRN COc1c(C)cccc1C(=O)Nc1ccc(N2CCC(C)CC2)c(Cl)c1 ZINC000408628874 570959320 /nfs/dbraw/zinc/95/93/20/570959320.db2.gz GASALYFQIBCFRP-UHFFFAOYSA-N 0 0 372.896 5.146 40 0 FKABRN Cc1cc(-c2nc3ccccc3s2)ccc1NC(=O)COc1ccccc1 ZINC000408628918 570594687 /nfs/dbraw/zinc/59/46/87/570594687.db2.gz YDQVUNQXCOMMDI-UHFFFAOYSA-N 0 0 374.465 5.289 40 0 FKABRN Cc1ccc2oc(-c3ccc(NC(=O)c4cccnc4Cl)cc3)nc2c1 ZINC000408628919 570594508 /nfs/dbraw/zinc/59/45/08/570594508.db2.gz YDRMIPVBNQNRQJ-UHFFFAOYSA-N 0 0 363.804 5.104 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)COc2ccc3ccccc3c2)cc1 ZINC000408629003 570594647 /nfs/dbraw/zinc/59/46/47/570594647.db2.gz HIUXUOPJQBKMRK-GOSISDBHSA-N 0 0 374.484 5.236 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)COc2ccc3ccccc3c2)cc1 ZINC000408629004 570594623 /nfs/dbraw/zinc/59/46/23/570594623.db2.gz HIUXUOPJQBKMRK-SFHVURJKSA-N 0 0 374.484 5.236 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)CSc2ccc(Cl)cc2)cc1 ZINC000408629016 570959266 /nfs/dbraw/zinc/95/92/66/570959266.db2.gz HZHGPDBAKUNESR-HNNXBMFYSA-N 0 0 374.937 5.450 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)CSc2ccc(Cl)cc2)cc1 ZINC000408629017 570959314 /nfs/dbraw/zinc/95/93/14/570959314.db2.gz HZHGPDBAKUNESR-OAHLLOKOSA-N 0 0 374.937 5.450 40 0 FKABRN CCOc1ccc(C(=O)Nc2ccc(N3CCC(C)CC3)c(Cl)c2)cc1 ZINC000408629035 570594494 /nfs/dbraw/zinc/59/44/94/570594494.db2.gz IXCWEYSXMPSVIG-UHFFFAOYSA-N 0 0 372.896 5.227 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)c2cccc(Br)c2)cc1 ZINC000408629059 570959193 /nfs/dbraw/zinc/95/91/93/570959193.db2.gz KMNIHRLSTHQSCV-AWEZNQCLSA-N 0 0 373.294 5.080 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)c2cccc(Br)c2)cc1 ZINC000408629060 570959258 /nfs/dbraw/zinc/95/92/58/570959258.db2.gz KMNIHRLSTHQSCV-CQSZACIVSA-N 0 0 373.294 5.080 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)cc1 ZINC000408629064 570594617 /nfs/dbraw/zinc/59/46/17/570594617.db2.gz KQLXQVJJELIXFC-GOSISDBHSA-N 0 0 366.505 5.497 40 0 FKABRN CCCCOc1ccc(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)cc1 ZINC000408629065 570594550 /nfs/dbraw/zinc/59/45/50/570594550.db2.gz KQLXQVJJELIXFC-SFHVURJKSA-N 0 0 366.505 5.497 40 0 FKABRN COc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc2c3c(cccc31)CC2 ZINC000408629151 570595078 /nfs/dbraw/zinc/59/50/78/570595078.db2.gz MJWFPWBQGPIJFJ-UHFFFAOYSA-N 0 0 372.251 5.506 40 0 FKABRN O=C(Nc1ccc(Cc2ccncc2)cc1)c1cccc2c(Cl)cccc12 ZINC000408629168 570595047 /nfs/dbraw/zinc/59/50/47/570595047.db2.gz NKPGDDFUKJJNMY-UHFFFAOYSA-N 0 0 372.855 5.731 40 0 FKABRN CCc1ccc(C(=O)Nc2ccc(-c3cc4ccccc4oc3=O)cc2)cc1 ZINC000408629212 570595163 /nfs/dbraw/zinc/59/51/63/570595163.db2.gz QAFKNCBCFAHVCS-UHFFFAOYSA-N 0 0 369.420 5.275 40 0 FKABRN O=C(COc1ccc(C2CCCCC2)cc1)NC12CC3CC(CC(C3)C1)C2 ZINC000408629266 570959334 /nfs/dbraw/zinc/95/93/34/570959334.db2.gz TVELDMNCSQSLHW-UHFFFAOYSA-N 0 0 367.533 5.198 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)COc2cccc3ccccc32)cc1 ZINC000408629277 570959076 /nfs/dbraw/zinc/95/90/76/570959076.db2.gz UPHGWCIUMHNZET-GOSISDBHSA-N 0 0 374.484 5.236 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)COc2cccc3ccccc32)cc1 ZINC000408629278 570959156 /nfs/dbraw/zinc/95/91/56/570959156.db2.gz UPHGWCIUMHNZET-SFHVURJKSA-N 0 0 374.484 5.236 40 0 FKABRN CCCCOc1cccc(C(=O)Nc2ccc(N3CCCC[C@H]3C)cc2)c1 ZINC000408629327 570591282 /nfs/dbraw/zinc/59/12/82/570591282.db2.gz XBQWWZFMPKMNOG-GOSISDBHSA-N 0 0 366.505 5.497 40 0 FKABRN CCCCOc1cccc(C(=O)Nc2ccc(N3CCCC[C@@H]3C)cc2)c1 ZINC000408629328 570591021 /nfs/dbraw/zinc/59/10/21/570591021.db2.gz XBQWWZFMPKMNOG-SFHVURJKSA-N 0 0 366.505 5.497 40 0 FKABRN CCOc1cccc(C(=O)Nc2ccc(N3CCC(C)CC3)c(Cl)c2)c1 ZINC000408629329 570591270 /nfs/dbraw/zinc/59/12/70/570591270.db2.gz XDDFUZSREZAKDC-UHFFFAOYSA-N 0 0 372.896 5.227 40 0 FKABRN Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCCC[C@@H]2C)cc1 ZINC000408629332 570959044 /nfs/dbraw/zinc/95/90/44/570959044.db2.gz XKBIEKCEYPTSIK-INIZCTEOSA-N 0 0 372.896 5.045 40 0 FKABRN Cc1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCCC[C@H]2C)cc1 ZINC000408629333 570959148 /nfs/dbraw/zinc/95/91/48/570959148.db2.gz XKBIEKCEYPTSIK-MRXNPFEDSA-N 0 0 372.896 5.045 40 0 FKABRN COc1cc2ccccc2cc1C(=O)Nc1ccc(N2CCCC[C@@H]2C)cc1 ZINC000408629347 570959142 /nfs/dbraw/zinc/95/91/42/570959142.db2.gz XYBYCIJZCDFVCG-KRWDZBQOSA-N 0 0 374.484 5.480 40 0 FKABRN COc1cc2ccccc2cc1C(=O)Nc1ccc(N2CCCC[C@H]2C)cc1 ZINC000408629348 570959181 /nfs/dbraw/zinc/95/91/81/570959181.db2.gz XYBYCIJZCDFVCG-QGZVFWFLSA-N 0 0 374.484 5.480 40 0 FKABRN C[C@@H]1CCCCN1c1ccc(NC(=O)CC23CC4CC(CC(C4)C2)C3)cc1 ZINC000408629352 570959311 /nfs/dbraw/zinc/95/93/11/570959311.db2.gz YCMZJQQZMONBMB-OQOKOFKUSA-N 0 0 366.549 5.610 40 0 FKABRN C[C@H]1CCCCN1c1ccc(NC(=O)CC23CC4CC(CC(C4)C2)C3)cc1 ZINC000408629353 570959348 /nfs/dbraw/zinc/95/93/48/570959348.db2.gz YCMZJQQZMONBMB-QZGUCNERSA-N 0 0 366.549 5.610 40 0 FKABRN CCc1ccc(C(=O)Nc2cccc(-c3cc4ccccc4oc3=O)c2)cc1 ZINC000408629354 570959331 /nfs/dbraw/zinc/95/93/31/570959331.db2.gz YEGQVDGNGKUGRC-UHFFFAOYSA-N 0 0 369.420 5.275 40 0 FKABRN C[C@@H](NC(=O)c1cccc2c(Cl)cccc12)C12CC3CC(CC(C3)C1)C2 ZINC000408629364 570959187 /nfs/dbraw/zinc/95/91/87/570959187.db2.gz ZAZJUSHWPDVSQK-KWJFTMPMSA-N 0 0 367.920 5.828 40 0 FKABRN C[C@H](NC(=O)c1cccc2c(Cl)cccc12)C12CC3CC(CC(C3)C1)C2 ZINC000408629365 570959171 /nfs/dbraw/zinc/95/91/71/570959171.db2.gz ZAZJUSHWPDVSQK-NSDYXAQKSA-N 0 0 367.920 5.828 40 0 FKABRN O=C(Nc1ccc(Cl)c(Cl)c1)c1cc2c(ccc3ccccc23)o1 ZINC000408630008 570959085 /nfs/dbraw/zinc/95/90/85/570959085.db2.gz MCHBHJFSYGQBED-UHFFFAOYSA-N 0 0 356.208 6.145 40 0 FKABRN Cc1ccc(SCCNC(=O)c2cc3c(ccc4ccccc34)o2)cc1 ZINC000408630222 570595895 /nfs/dbraw/zinc/59/58/95/570595895.db2.gz PQEOJRUUHANMIH-UHFFFAOYSA-N 0 0 361.466 5.417 40 0 FKABRN Cc1ccc(NC(=O)C(=O)c2c(-c3ccc(C)cc3)cc3ccccn32)cc1 ZINC000408674887 570964818 /nfs/dbraw/zinc/96/48/18/570964818.db2.gz DRTXVSPLRIJRDC-UHFFFAOYSA-N 0 0 368.436 5.045 40 0 FKABRN Cc1cc(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)c(C)n1C ZINC000408675804 570964796 /nfs/dbraw/zinc/96/47/96/570964796.db2.gz BBJNECUCHNKEGG-UHFFFAOYSA-N 0 0 354.837 5.340 40 0 FKABRN O=C(Nc1ccc(Oc2cccc(Cl)c2)cc1)c1cccnc1Cl ZINC000408676159 570965108 /nfs/dbraw/zinc/96/51/08/570965108.db2.gz GILWWBBIHUCVNE-UHFFFAOYSA-N 0 0 359.212 5.433 40 0 FKABRN O=C(Nc1ccc(OCc2ccccc2)cc1)c1ccc(N2CCCC2)cc1 ZINC000408676547 570965036 /nfs/dbraw/zinc/96/50/36/570965036.db2.gz KJXMSDMUGCTEET-UHFFFAOYSA-N 0 0 372.468 5.118 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000408677374 570638926 /nfs/dbraw/zinc/63/89/26/570638926.db2.gz DDYFAUAJFRFWBZ-INIZCTEOSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000408677378 570964883 /nfs/dbraw/zinc/96/48/83/570964883.db2.gz DDYFAUAJFRFWBZ-MRXNPFEDSA-N 0 0 371.786 5.463 40 0 FKABRN Cc1ccc(Oc2ccc(NC(=O)c3ccc(N4CCCC4)cc3)cc2)cc1 ZINC000408677538 570964905 /nfs/dbraw/zinc/96/49/05/570964905.db2.gz RKWMAEWKPYKSGX-UHFFFAOYSA-N 0 0 372.468 5.640 40 0 FKABRN O=C(Nc1ccc(Nc2ccccc2)cc1)c1ccc(N2CCCC2)cc1 ZINC000408677791 570639733 /nfs/dbraw/zinc/63/97/33/570639733.db2.gz UWJADSCDMWQJKN-UHFFFAOYSA-N 0 0 357.457 5.283 40 0 FKABRN COc1ccc(S(=O)(=O)Nc2c(C)cccc2C(C)C)cc1C(C)C ZINC000408678093 570964809 /nfs/dbraw/zinc/96/48/09/570964809.db2.gz FPPDMENORAEIDN-UHFFFAOYSA-N 0 0 361.507 5.051 40 0 FKABRN Cc1ccc(-c2cc3ccccn3c2C(=O)C(=O)Nc2cccc(C)c2)cc1 ZINC000408678678 570641494 /nfs/dbraw/zinc/64/14/94/570641494.db2.gz UPOLQQHYCUZUCF-UHFFFAOYSA-N 0 0 368.436 5.045 40 0 FKABRN Cc1cccc(CSCCNC(=O)c2ccccc2SC(C)C)c1 ZINC000408678980 570965061 /nfs/dbraw/zinc/96/50/61/570965061.db2.gz LRONUJMKVWGUSQ-UHFFFAOYSA-N 0 0 359.560 5.159 40 0 FKABRN Cc1cc(C)cc(O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 ZINC000408679501 570965122 /nfs/dbraw/zinc/96/51/22/570965122.db2.gz MTGRKIYHRSPCFI-GFCCVEGCSA-N 0 0 371.786 5.382 40 0 FKABRN Cc1cc(C)cc(O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 ZINC000408679502 570965296 /nfs/dbraw/zinc/96/52/96/570965296.db2.gz MTGRKIYHRSPCFI-LBPRGKRZSA-N 0 0 371.786 5.382 40 0 FKABRN CC(C)Sc1ccccc1C(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000408679515 570965268 /nfs/dbraw/zinc/96/52/68/570965268.db2.gz NBLNUUGRHXTIJA-UHFFFAOYSA-N 0 0 363.482 6.232 40 0 FKABRN Cc1ccc(-c2cc3ccccn3c2C(=O)C(=O)Nc2ccccc2C)cc1 ZINC000408680064 570965467 /nfs/dbraw/zinc/96/54/67/570965467.db2.gz YIIVVGODLAHUJH-UHFFFAOYSA-N 0 0 368.436 5.045 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000408680571 570965343 /nfs/dbraw/zinc/96/53/43/570965343.db2.gz NPGMOXUCONPUGI-INIZCTEOSA-N 0 0 371.786 5.463 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000408680572 570965413 /nfs/dbraw/zinc/96/54/13/570965413.db2.gz NPGMOXUCONPUGI-MRXNPFEDSA-N 0 0 371.786 5.463 40 0 FKABRN CC(C)Oc1ccc(C(=O)Nc2ccc(Br)c(Cl)c2)cc1 ZINC000408680611 570640999 /nfs/dbraw/zinc/64/09/99/570640999.db2.gz OCGWXPGFHDPJEV-UHFFFAOYSA-N 0 0 368.658 5.142 40 0 FKABRN CC(C)Oc1ccc(C(=O)Nc2ccccc2Sc2ccccc2)cc1 ZINC000408681137 570965207 /nfs/dbraw/zinc/96/52/07/570965207.db2.gz PDALWEOAMKJXCT-UHFFFAOYSA-N 0 0 363.482 5.877 40 0 FKABRN CC[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000408681186 570965422 /nfs/dbraw/zinc/96/54/22/570965422.db2.gz PVPOEDSNXSJWGM-AWEZNQCLSA-N 0 0 358.652 5.443 40 0 FKABRN CC[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1c(Cl)cccc1Cl ZINC000408681189 570965508 /nfs/dbraw/zinc/96/55/08/570965508.db2.gz PVPOEDSNXSJWGM-CQSZACIVSA-N 0 0 358.652 5.443 40 0 FKABRN CCn1c2ccccc2c2cc(NC(=O)c3ccc(COC)cc3)ccc21 ZINC000408681201 570965527 /nfs/dbraw/zinc/96/55/27/570965527.db2.gz PZVGAUWRYSYBIB-UHFFFAOYSA-N 0 0 358.441 5.213 40 0 FKABRN CC[C@H](Oc1ccc(C)cc1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000408681599 570965459 /nfs/dbraw/zinc/96/54/59/570965459.db2.gz YLNXLXSZLJQNSN-NRFANRHFSA-N 0 0 361.441 5.583 40 0 FKABRN CC[C@@H](Oc1ccc(C)cc1)C(=O)Nc1ccccc1Oc1ccccc1 ZINC000408681601 570641248 /nfs/dbraw/zinc/64/12/48/570641248.db2.gz YLNXLXSZLJQNSN-OAQYLSRUSA-N 0 0 361.441 5.583 40 0 FKABRN CCSc1ccccc1C(=O)NCCSCc1ccccc1Cl ZINC000408681811 570965536 /nfs/dbraw/zinc/96/55/36/570965536.db2.gz ZJMXHGLYODOQCC-UHFFFAOYSA-N 0 0 365.951 5.115 40 0 FKABRN Cc1ccc(O[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1C ZINC000408681818 570965361 /nfs/dbraw/zinc/96/53/61/570965361.db2.gz TXDCDUARGLYLLO-GOSISDBHSA-N 0 0 361.441 5.502 40 0 FKABRN Cc1ccc(O[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1C ZINC000408681820 570965328 /nfs/dbraw/zinc/96/53/28/570965328.db2.gz TXDCDUARGLYLLO-SFHVURJKSA-N 0 0 361.441 5.502 40 0 FKABRN CC[C@H](Oc1ccccc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000408681842 570965290 /nfs/dbraw/zinc/96/52/90/570965290.db2.gz ZSXTXURBCDQXEY-HNNXBMFYSA-N 0 0 357.759 5.155 40 0 FKABRN CC[C@@H](Oc1ccccc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000408681844 570643955 /nfs/dbraw/zinc/64/39/55/570643955.db2.gz ZSXTXURBCDQXEY-OAHLLOKOSA-N 0 0 357.759 5.155 40 0 FKABRN Cc1cccc(O[C@@H](C)C(=O)Nc2ccccc2Sc2ccccc2)c1 ZINC000408702078 263485730 /nfs/dbraw/zinc/48/57/30/263485730.db2.gz BLXNMSGSBOXXRI-KRWDZBQOSA-N 0 0 363.482 5.552 40 0 FKABRN Cc1cccc(O[C@H](C)C(=O)Nc2ccccc2Sc2ccccc2)c1 ZINC000408702079 570967847 /nfs/dbraw/zinc/96/78/47/570967847.db2.gz BLXNMSGSBOXXRI-QGZVFWFLSA-N 0 0 363.482 5.552 40 0 FKABRN COc1cccc2cc(C(=O)Nc3cc(Cl)c(Cl)cc3Cl)oc21 ZINC000408702275 570967753 /nfs/dbraw/zinc/96/77/53/570967753.db2.gz MLVNWZIGPFGUEQ-UHFFFAOYSA-N 0 0 370.619 5.654 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2ccc3ccccc3c2)cc(C)c1Cl ZINC000408702460 570968814 /nfs/dbraw/zinc/96/88/14/570968814.db2.gz GIOQUJYHZDXIEJ-HNNXBMFYSA-N 0 0 353.849 5.516 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2ccc3ccccc3c2)cc(C)c1Cl ZINC000408702463 570968869 /nfs/dbraw/zinc/96/88/69/570968869.db2.gz GIOQUJYHZDXIEJ-OAHLLOKOSA-N 0 0 353.849 5.516 40 0 FKABRN O=C(CCCOc1ccc(Cl)cc1)Nc1ccc(C(F)(F)F)cc1 ZINC000408703067 263485636 /nfs/dbraw/zinc/48/56/36/263485636.db2.gz MLBOAAJEHVXBSE-UHFFFAOYSA-N 0 0 357.759 5.157 40 0 FKABRN CC[C@@H](Oc1ccc(OC)cc1)C(=O)Nc1ccccc1-c1ccccc1 ZINC000408703643 570968459 /nfs/dbraw/zinc/96/84/59/570968459.db2.gz VLZNXYYGHKZIGL-JOCHJYFZSA-N 0 0 361.441 5.158 40 0 FKABRN CC[C@H](Oc1ccc(OC)cc1)C(=O)Nc1ccccc1-c1ccccc1 ZINC000408703644 570968229 /nfs/dbraw/zinc/96/82/29/570968229.db2.gz VLZNXYYGHKZIGL-QFIPXVFZSA-N 0 0 361.441 5.158 40 0 FKABRN O=C(CCCOc1ccc(Cl)cc1)Nc1cccc(Cl)c1Cl ZINC000408705604 570969461 /nfs/dbraw/zinc/96/94/61/570969461.db2.gz JNOULAXPDNAPKX-UHFFFAOYSA-N 0 0 358.652 5.445 40 0 FKABRN O=C(CCCOc1ccc(Cl)cc1)Nc1c(Cl)cccc1Cl ZINC000408705631 570969402 /nfs/dbraw/zinc/96/94/02/570969402.db2.gz KGGOZYYPENXCLP-UHFFFAOYSA-N 0 0 358.652 5.445 40 0 FKABRN O=C(CCCOc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl ZINC000408705935 570969512 /nfs/dbraw/zinc/96/95/12/570969512.db2.gz QPECPXJDPFRTKS-UHFFFAOYSA-N 0 0 358.652 5.445 40 0 FKABRN Cc1cc(O[C@H](C)C(=O)Nc2c(Cl)cccc2Cl)cc(C)c1Cl ZINC000408706087 570969514 /nfs/dbraw/zinc/96/95/14/570969514.db2.gz VBATZYJBHYGLSR-LLVKDONJSA-N 0 0 372.679 5.670 40 0 FKABRN Cc1cc(O[C@@H](C)C(=O)Nc2c(Cl)cccc2Cl)cc(C)c1Cl ZINC000408706088 570969368 /nfs/dbraw/zinc/96/93/68/570969368.db2.gz VBATZYJBHYGLSR-NSHDSACASA-N 0 0 372.679 5.670 40 0 FKABRN O=C(CCCOc1ccc(Cl)cc1)NCc1ccc(Cl)cc1Cl ZINC000408706175 570657904 /nfs/dbraw/zinc/65/79/04/570657904.db2.gz WQZGEGSVRAVWNV-UHFFFAOYSA-N 0 0 372.679 5.122 40 0 FKABRN CCCOc1ccc(NC(=O)c2cc3cc(Br)ccc3o2)cc1 ZINC000408707652 263487325 /nfs/dbraw/zinc/48/73/25/263487325.db2.gz LJXCNFXSRDCMHI-UHFFFAOYSA-N 0 0 374.234 5.236 40 0 FKABRN CCCCc1ccc(NC(=O)C(=O)NC2CCC(C(C)(C)CC)CC2)cc1 ZINC000408708504 570969493 /nfs/dbraw/zinc/96/94/93/570969493.db2.gz JDLPBNMFWANIJQ-UHFFFAOYSA-N 0 0 372.553 5.079 40 0 FKABRN CC(C)(C)c1ccc(NC(=O)c2cc3cc(Br)ccc3o2)cc1 ZINC000408708620 570969343 /nfs/dbraw/zinc/96/93/43/570969343.db2.gz RLPLMHGJOKNSNP-UHFFFAOYSA-N 0 0 372.262 5.745 40 0 FKABRN COc1cccc2cc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)oc21 ZINC000408708826 263488259 /nfs/dbraw/zinc/48/82/59/263488259.db2.gz UCRMVFSOLQWMTN-UHFFFAOYSA-N 0 0 369.726 5.366 40 0 FKABRN CCC(C)(C)C1CCC(NC(=O)C(=O)Nc2ccccc2C(C)(C)C)CC1 ZINC000408709887 570969358 /nfs/dbraw/zinc/96/93/58/570969358.db2.gz YXOVKJRAFYEEIA-UHFFFAOYSA-N 0 0 372.553 5.034 40 0 FKABRN COc1ccc2cc(C(=O)Nc3cccc(Cl)c3Cl)c(C)nc2c1 ZINC000408712937 570970332 /nfs/dbraw/zinc/97/03/32/570970332.db2.gz CFBAYSWDYMKWIL-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN COc1ccc2cc(C(=O)Nc3ccc(Cl)c(Cl)c3)c(C)nc2c1 ZINC000408713146 570970568 /nfs/dbraw/zinc/97/05/68/570970568.db2.gz LVFIPTVARGPHBU-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN COc1ccc2cc(C(=O)Nc3ccc(Cl)cc3Cl)c(C)nc2c1 ZINC000408713194 570970357 /nfs/dbraw/zinc/97/03/57/570970357.db2.gz NOWREPTXRNPYRD-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN COc1ccc2cc(C(=O)Nc3cc(Cl)cc(Cl)c3)c(C)nc2c1 ZINC000408713210 570970362 /nfs/dbraw/zinc/97/03/62/570970362.db2.gz OEROZNKYQRUAAH-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN CCn1cc(C(=O)Nc2ccc(C(C)C)cc2)c(=O)c2cc(Cl)ccc21 ZINC000408713214 570970268 /nfs/dbraw/zinc/97/02/68/570970268.db2.gz OIKLXQMDMFIDQU-UHFFFAOYSA-N 0 0 368.864 5.051 40 0 FKABRN COc1ccc2nc(C)c(C(=O)Nc3ccc(Cl)c(Cl)c3)cc2c1 ZINC000408713485 570668063 /nfs/dbraw/zinc/66/80/63/570668063.db2.gz BHPXBLWBSNXIPS-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN COc1ccc2nc(C)c(C(=O)Nc3cc(Cl)cc(Cl)c3)cc2c1 ZINC000408713520 570970508 /nfs/dbraw/zinc/97/05/08/570970508.db2.gz FQCRRIPFCZYYOW-UHFFFAOYSA-N 0 0 361.228 5.111 40 0 FKABRN COc1ccccc1C(=O)Nc1ccc(OCc2ccccc2Cl)cc1 ZINC000408718606 570970532 /nfs/dbraw/zinc/97/05/32/570970532.db2.gz IQRAVIRFNQGTPL-UHFFFAOYSA-N 0 0 367.832 5.180 40 0 FKABRN Cc1ccc(NCN2C(=O)S/C(=C/c3ccccc3Cl)C2=O)c(C)c1 ZINC000408719085 570673420 /nfs/dbraw/zinc/67/34/20/570673420.db2.gz CKLMOWLOPDXCPI-LICLKQGHSA-N 0 0 372.877 5.063 40 0 FKABRN Cc1ccccc1NCN1C(=O)S/C(=C/c2ccc(C(C)C)cc2)C1=O ZINC000408719180 570970561 /nfs/dbraw/zinc/97/05/61/570970561.db2.gz KETZGRRJIYQSPT-XDHOZWIPSA-N 0 0 366.486 5.224 40 0 FKABRN O=C(Nc1ccccc1F)c1cnc(-c2ccccc2)c(-c2ccccc2)n1 ZINC000408721108 570971364 /nfs/dbraw/zinc/97/13/64/570971364.db2.gz CWMVCVKSEQLNPW-UHFFFAOYSA-N 0 0 369.399 5.202 40 0 FKABRN Cc1cccc(OC(=O)c2cnc(-c3ccccc3)c(-c3ccccc3)n2)c1 ZINC000408721880 263489928 /nfs/dbraw/zinc/48/99/28/263489928.db2.gz MIPHGJHDJISLNM-UHFFFAOYSA-N 0 0 366.420 5.338 40 0 FKABRN Cc1ccc(NC(=O)c2cnc(-c3ccccc3)c(-c3ccccc3)n2)cc1 ZINC000408721924 570971092 /nfs/dbraw/zinc/97/10/92/570971092.db2.gz MYKLJVHXOMVOGN-UHFFFAOYSA-N 0 0 365.436 5.371 40 0 FKABRN O=C(Nc1ccc(F)cc1)c1cnc(-c2ccccc2)c(-c2ccccc2)n1 ZINC000408722685 263491581 /nfs/dbraw/zinc/49/15/81/263491581.db2.gz VWAPDTBANSRWQU-UHFFFAOYSA-N 0 0 369.399 5.202 40 0 FKABRN CCCCOc1ccc(NCC(=O)c2ccc3c(c2)Cc2ccccc2-3)cc1 ZINC000408723860 570970657 /nfs/dbraw/zinc/97/06/57/570970657.db2.gz WILAIMAFVXDPBK-UHFFFAOYSA-N 0 0 371.480 5.732 40 0 FKABRN CCOC(=O)c1cc(-c2cccc3ccccc32)n(-c2ccccc2C)n1 ZINC000408723944 263491046 /nfs/dbraw/zinc/49/10/46/263491046.db2.gz AUPULCNJUGTZOQ-UHFFFAOYSA-N 0 0 356.425 5.178 40 0 FKABRN Cc1ccc(NC(=O)c2cc(-c3ccc(C)cc3)n(-c3ccccc3)n2)cc1 ZINC000408723958 570970854 /nfs/dbraw/zinc/97/08/54/570970854.db2.gz BEIFKARLGDVGAT-UHFFFAOYSA-N 0 0 367.452 5.408 40 0 FKABRN Cc1ccc(-c2cc(C(=O)Nc3ccc(F)cc3)nn2-c2ccccc2)cc1 ZINC000408723971 570970654 /nfs/dbraw/zinc/97/06/54/570970654.db2.gz BIQNPQKLKCOANL-UHFFFAOYSA-N 0 0 371.415 5.239 40 0 FKABRN Cc1ccc(-c2cc(C(=O)Nc3ccccc3)nn2-c2ccc(C)cc2)cc1 ZINC000408723994 570970747 /nfs/dbraw/zinc/97/07/47/570970747.db2.gz BVLBLWQXDQAPNR-UHFFFAOYSA-N 0 0 367.452 5.408 40 0 FKABRN CCOC(=O)c1cc(-c2ccc3ccccc3c2)n(-c2ccccc2C)n1 ZINC000408724041 570970821 /nfs/dbraw/zinc/97/08/21/570970821.db2.gz CWQSITHSHGXLKZ-UHFFFAOYSA-N 0 0 356.425 5.178 40 0 FKABRN CCOC(=O)c1cc(-c2cccc3ccccc32)n(-c2cccc(C)c2)n1 ZINC000408724042 570970832 /nfs/dbraw/zinc/97/08/32/570970832.db2.gz CXGKIYUYIMLWMN-UHFFFAOYSA-N 0 0 356.425 5.178 40 0 FKABRN CCOC(=O)c1cc(-c2ccc3ccccc3c2)n(-c2ccc(C)cc2)n1 ZINC000408724053 570970792 /nfs/dbraw/zinc/97/07/92/570970792.db2.gz DFAJBGQWYVUBLB-UHFFFAOYSA-N 0 0 356.425 5.178 40 0 FKABRN Cc1ccc(-c2cc(C(=O)Nc3ccccc3)nn2-c2cccc(C)c2)cc1 ZINC000408724145 570970664 /nfs/dbraw/zinc/97/06/64/570970664.db2.gz GIZHHHJUXDFAMV-UHFFFAOYSA-N 0 0 367.452 5.408 40 0 FKABRN Cc1ccc(-c2cc(C(=O)Nc3ccccc3C)nn2-c2ccccc2)cc1 ZINC000408724262 570970668 /nfs/dbraw/zinc/97/06/68/570970668.db2.gz JEKNRFUBTVDJTF-UHFFFAOYSA-N 0 0 367.452 5.408 40 0 FKABRN CCOC(=O)c1cc(-c2ccc(-c3ccccc3)cc2)n(-c2ccccc2)n1 ZINC000408724274 263491322 /nfs/dbraw/zinc/49/13/22/263491322.db2.gz JJOJCUQYDFCJSU-UHFFFAOYSA-N 0 0 368.436 5.383 40 0 FKABRN Cc1ccc(-c2cc(C(=O)Nc3cccc(C)c3)nn2-c2ccccc2)cc1 ZINC000408724400 263491635 /nfs/dbraw/zinc/49/16/35/263491635.db2.gz JSTBVXDDJRZCMS-UHFFFAOYSA-N 0 0 367.452 5.408 40 0 FKABRN Cc1ccc(-c2cc(C(=O)Nc3ccccc3)nn2-c2ccccc2C)cc1 ZINC000408724466 263491015 /nfs/dbraw/zinc/49/10/15/263491015.db2.gz KWGGSOKYQONDBS-UHFFFAOYSA-N 0 0 367.452 5.408 40 0 FKABRN Cc1ccc(-c2cc(C(=O)NC3CCCCC3)nn2-c2ccccc2C)cc1 ZINC000408724540 263491447 /nfs/dbraw/zinc/49/14/47/263491447.db2.gz LRCJCOZNVOUHST-UHFFFAOYSA-N 0 0 373.500 5.219 40 0 FKABRN Cc1ccc(-c2cc(C(=O)NC3CCCCC3)nn2-c2ccc(C)cc2)cc1 ZINC000408725328 570972338 /nfs/dbraw/zinc/97/23/38/570972338.db2.gz OATRSXNPCKQQOY-UHFFFAOYSA-N 0 0 373.500 5.219 40 0 FKABRN Cc1ccc(-c2cc(C(=O)NC3CCCCC3)nn2-c2cccc(C)c2)cc1 ZINC000408726080 570972110 /nfs/dbraw/zinc/97/21/10/570972110.db2.gz RWVZPQRDWPJITA-UHFFFAOYSA-N 0 0 373.500 5.219 40 0 FKABRN CCOC(=O)c1cc(-c2cccc3ccccc32)n(-c2ccc(C)cc2)n1 ZINC000408726755 570679817 /nfs/dbraw/zinc/67/98/17/570679817.db2.gz UAXRWVNPOZMHFG-UHFFFAOYSA-N 0 0 356.425 5.178 40 0 FKABRN Cc1ccc(/C=C2/SC(=O)N(CNc3cccc(Cl)c3C)C2=O)cc1 ZINC000408727494 263492514 /nfs/dbraw/zinc/49/25/14/263492514.db2.gz PVOLQPYOJRPMOO-LICLKQGHSA-N 0 0 372.877 5.063 40 0 FKABRN CCOC(=O)c1cc(-c2ccc3ccccc3c2)n(-c2cccc(C)c2)n1 ZINC000408727765 570972982 /nfs/dbraw/zinc/97/29/82/570972982.db2.gz XMLVGABHMFFAGH-UHFFFAOYSA-N 0 0 356.425 5.178 40 0 FKABRN Cc1ccc(-c2cc(C(=O)Nc3ccccc3)nn2-c2ccccc2)cc1 ZINC000408727879 263492257 /nfs/dbraw/zinc/49/22/57/263492257.db2.gz YNHKKFDMDGNEKT-UHFFFAOYSA-N 0 0 353.425 5.100 40 0 FKABRN COC(=O)c1ccc(-n2c(-c3ccccc3)ccc2-c2ccccc2)cc1 ZINC000408731025 570972498 /nfs/dbraw/zinc/97/24/98/570972498.db2.gz IKPJAKDNXALKIT-UHFFFAOYSA-N 0 0 353.421 5.598 40 0 FKABRN CN(C(=O)NC(=S)c1cccc2ccccc21)c1ccc2ccccc2c1 ZINC000408732051 570972764 /nfs/dbraw/zinc/97/27/64/570972764.db2.gz OPTWCDYIIXKWCB-UHFFFAOYSA-N 0 0 370.477 5.515 40 0 FKABRN CC(C)(C)c1ccc(OC(=O)NC(=S)c2cccc3ccccc32)cc1 ZINC000408733072 570973198 /nfs/dbraw/zinc/97/31/98/570973198.db2.gz VRJSHKQUJQGNGN-UHFFFAOYSA-N 0 0 363.482 5.601 40 0 FKABRN CCCN(Cc1ccccc1)C(=O)NC(=S)c1cccc2ccccc21 ZINC000408733094 570973160 /nfs/dbraw/zinc/97/31/60/570973160.db2.gz WBDPWSXVLIBXPQ-UHFFFAOYSA-N 0 0 362.498 5.137 40 0 FKABRN CCc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(C(C)C)cc2)cc1 ZINC000408733166 570683718 /nfs/dbraw/zinc/68/37/18/570683718.db2.gz FOCDWBJVCUUYKB-DEOSSOPVSA-N 0 0 370.496 6.144 40 0 FKABRN CCc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(C(C)C)cc2)cc1 ZINC000408733168 263492358 /nfs/dbraw/zinc/49/23/58/263492358.db2.gz FOCDWBJVCUUYKB-XMMPIXPASA-N 0 0 370.496 6.144 40 0 FKABRN CC[C@@H](C)c1ccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C)cc2)cc1 ZINC000408733188 570973730 /nfs/dbraw/zinc/97/37/30/570973730.db2.gz FVMHFAPEBIYZFV-HOYKHHGWSA-N 0 0 370.496 6.280 40 0 FKABRN CC[C@@H](C)c1ccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(C)cc2)cc1 ZINC000408733189 263492109 /nfs/dbraw/zinc/49/21/09/263492109.db2.gz FVMHFAPEBIYZFV-KOSHJBKYSA-N 0 0 370.496 6.280 40 0 FKABRN CC[C@H](C)c1ccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C)cc2)cc1 ZINC000408733190 263492355 /nfs/dbraw/zinc/49/23/55/263492355.db2.gz FVMHFAPEBIYZFV-MHECFPHRSA-N 0 0 370.496 6.280 40 0 FKABRN CC[C@H](C)c1ccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(C)cc2)cc1 ZINC000408733191 570973662 /nfs/dbraw/zinc/97/36/62/570973662.db2.gz FVMHFAPEBIYZFV-UUOWRZLLSA-N 0 0 370.496 6.280 40 0 FKABRN CCc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(CC)cc2)cc1 ZINC000408733361 570973867 /nfs/dbraw/zinc/97/38/67/570973867.db2.gz HKJPZJSYIWHZOA-HSZRJFAPSA-N 0 0 356.469 5.583 40 0 FKABRN CCc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(CC)cc2)cc1 ZINC000408733362 570973833 /nfs/dbraw/zinc/97/38/33/570973833.db2.gz HKJPZJSYIWHZOA-QHCPKHFHSA-N 0 0 356.469 5.583 40 0 FKABRN CCOc1ccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(CC)cc2)cc1 ZINC000408733612 570683925 /nfs/dbraw/zinc/68/39/25/570683925.db2.gz MFSQPMPJIYYJLZ-HSZRJFAPSA-N 0 0 372.468 5.419 40 0 FKABRN CCOc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(CC)cc2)cc1 ZINC000408733613 570683844 /nfs/dbraw/zinc/68/38/44/570683844.db2.gz MFSQPMPJIYYJLZ-QHCPKHFHSA-N 0 0 372.468 5.419 40 0 FKABRN CCc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(C)c(C)c2)cc1 ZINC000408733781 570974108 /nfs/dbraw/zinc/97/41/08/570974108.db2.gz QPQUMLAAOUBLNN-HSZRJFAPSA-N 0 0 356.469 5.637 40 0 FKABRN CCc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(C)c(C)c2)cc1 ZINC000408733782 570973846 /nfs/dbraw/zinc/97/38/46/570973846.db2.gz QPQUMLAAOUBLNN-QHCPKHFHSA-N 0 0 356.469 5.637 40 0 FKABRN CCOc1ccc2ccccc2c1-c1nc(=O)c2c(C)c(C)sc2[nH]1 ZINC000408734505 263493059 /nfs/dbraw/zinc/49/30/59/263493059.db2.gz HDSPWJKGWXVRBU-UHFFFAOYSA-N 0 0 350.443 5.233 40 0 FKABRN Cc1sc2[nH]c(-c3ccccc3OCc3ccccc3)nc(=O)c2c1C ZINC000408734519 570685350 /nfs/dbraw/zinc/68/53/50/570685350.db2.gz HIULPOWMLJNSGZ-UHFFFAOYSA-N 0 0 362.454 5.260 40 0 FKABRN CCCOc1ccc2ccccc2c1-c1nc(=O)c2c(C)c(C)sc2[nH]1 ZINC000408734757 570973452 /nfs/dbraw/zinc/97/34/52/570973452.db2.gz JFCOHTYJYBQYFL-UHFFFAOYSA-N 0 0 364.470 5.623 40 0 FKABRN Cc1nc2ccc(OC(=S)N(C)c3ccc4ccccc4c3)cc2nc1C ZINC000408734801 570973366 /nfs/dbraw/zinc/97/33/66/570973366.db2.gz DYNHIAUOEUPRBY-UHFFFAOYSA-N 0 0 373.481 5.200 40 0 FKABRN COc1cc(C)c(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)cc1C(C)C ZINC000408735266 570973485 /nfs/dbraw/zinc/97/34/85/570973485.db2.gz PFILDTUWLALAFM-UHFFFAOYSA-N 0 0 368.502 5.383 40 0 FKABRN Cc1sc2nc(-c3ccc(OCc4ccccc4)cc3)[nH]c(=O)c2c1C ZINC000408735924 570974076 /nfs/dbraw/zinc/97/40/76/570974076.db2.gz ZJMRMLMETHDNAO-UHFFFAOYSA-N 0 0 362.454 5.260 40 0 FKABRN CC(C)(C)OC(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)s1 ZINC000408736918 570974610 /nfs/dbraw/zinc/97/46/10/570974610.db2.gz JSDHQHJRKWAHJX-UHFFFAOYSA-N 0 0 352.459 5.824 40 0 FKABRN CCCCCOc1ccccc1/C=C1\N=C(c2ccccc2Cl)OC1=O ZINC000408737107 570974616 /nfs/dbraw/zinc/97/46/16/570974616.db2.gz JEOFZBCEEQHAFR-JXAWBTAJSA-N 0 0 369.848 5.254 40 0 FKABRN CCCSc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2s1 ZINC000408749833 570980435 /nfs/dbraw/zinc/98/04/35/570980435.db2.gz JHDQOVZAOYBYOG-UHFFFAOYSA-N 0 0 362.907 5.704 40 0 FKABRN CC(C)Sc1nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2s1 ZINC000408751338 570980024 /nfs/dbraw/zinc/98/00/24/570980024.db2.gz ZDVSQWOKSCQKJI-UHFFFAOYSA-N 0 0 362.907 5.703 40 0 FKABRN CCCc1sc(Nc2cccc(C)c2C)nc1-c1ccc(OC)cc1 ZINC000408754646 570982225 /nfs/dbraw/zinc/98/22/25/570982225.db2.gz GNUPIYNRVSOECA-UHFFFAOYSA-N 0 0 352.503 5.554 40 0 FKABRN CCCc1sc(Nc2ccc(C)cc2)nc1-c1ccc(OC)c(OC)c1 ZINC000408755243 570982590 /nfs/dbraw/zinc/98/25/90/570982590.db2.gz IURPHMMOCCQXKS-UHFFFAOYSA-N 0 0 368.502 5.832 40 0 FKABRN CCCc1sc(Nc2cccc(C)c2)nc1-c1ccc(OC)c(OC)c1 ZINC000408755351 570982578 /nfs/dbraw/zinc/98/25/78/570982578.db2.gz KQQGZHMBYGIRHW-UHFFFAOYSA-N 0 0 368.502 5.254 40 0 FKABRN CCCc1sc(Nc2ccc(OCC)cc2)nc1-c1ccc(OC)cc1 ZINC000408757157 570690501 /nfs/dbraw/zinc/69/05/01/570690501.db2.gz VBENFHFPDWAECW-UHFFFAOYSA-N 0 0 368.502 5.914 40 0 FKABRN CCCc1sc(Nc2ccc(F)cc2)nc1-c1ccc(OC)c(OC)c1 ZINC000408757474 570982925 /nfs/dbraw/zinc/98/29/25/570982925.db2.gz XQBNFLFXDWIPQT-UHFFFAOYSA-N 0 0 372.465 5.663 40 0 FKABRN CCCc1sc(Nc2ccccc2OCC)nc1-c1ccc(OC)cc1 ZINC000408757506 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Cc1sc(NC(=O)c2ccccc2)nc1-c1ccc(Cl)c(Cl)c1 ZINC000408821231 571002893 /nfs/dbraw/zinc/00/28/93/571002893.db2.gz FAIPJNXWKBCTJG-UHFFFAOYSA-N 0 0 363.269 5.678 40 0 FKABRN Cc1ccc(-c2sc(NC(=O)c3cccnc3)nc2-c2ccccc2)cc1 ZINC000408822417 263498481 /nfs/dbraw/zinc/49/84/81/263498481.db2.gz BNZSNXOMRBTYLJ-UHFFFAOYSA-N 0 0 371.465 5.433 40 0 FKABRN Cc1sc(NC(=O)c2cccnc2)nc1-c1ccc(Cl)cc1Cl ZINC000408822424 570690017 /nfs/dbraw/zinc/69/00/17/570690017.db2.gz BPMKLUKIBRVIIA-UHFFFAOYSA-N 0 0 364.257 5.073 40 0 FKABRN CCCc1sc(NC(=O)c2ccc(F)cc2)nc1-c1ccc(C)cc1 ZINC000408823123 570689951 /nfs/dbraw/zinc/68/99/51/570689951.db2.gz DRVLMTHYIFYCGF-UHFFFAOYSA-N 0 0 354.450 5.462 40 0 FKABRN CC(C)c1ccc(C(=O)CCC(=O)Nc2ccc(Br)cc2)cc1 ZINC000408823270 571003521 /nfs/dbraw/zinc/00/35/21/571003521.db2.gz DPGBLTWLXGLLJX-UHFFFAOYSA-N 0 0 374.278 5.174 40 0 FKABRN Cc1cccc(NC(=O)CCC(=O)c2ccc(Oc3ccccc3)cc2)c1 ZINC000408823515 571003436 /nfs/dbraw/zinc/00/34/36/571003436.db2.gz FRXXKELDPVFDTQ-UHFFFAOYSA-N 0 0 359.425 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LHBVNIOOIFHZPJ-UHFFFAOYSA-N 0 0 361.441 5.149 40 0 FKABRN CCCc1sc(NC(=O)c2ccc(Cl)cc2)nc1-c1ccccc1 ZINC000408826762 570690430 /nfs/dbraw/zinc/69/04/30/570690430.db2.gz KSJKCJTWHQZUIP-UHFFFAOYSA-N 0 0 356.878 5.668 40 0 FKABRN CCCc1sc(NC(=O)c2ccncc2)nc1-c1ccc(C)c(C)c1 ZINC000408826922 570690462 /nfs/dbraw/zinc/69/04/62/570690462.db2.gz LHENGRMEONQBNA-UHFFFAOYSA-N 0 0 351.475 5.027 40 0 FKABRN CCCc1sc(NC(=O)c2cccc(C)c2)nc1-c1ccc(Cl)cc1 ZINC000408826943 570690472 /nfs/dbraw/zinc/69/04/72/570690472.db2.gz UHSSHCALTUQEAE-UHFFFAOYSA-N 0 0 370.905 5.977 40 0 FKABRN O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)Nc1ccc(Cl)cc1 ZINC000408826990 570690510 /nfs/dbraw/zinc/69/05/10/570690510.db2.gz JZLPDJNXXRLKCT-UHFFFAOYSA-N 0 0 363.844 5.609 40 0 FKABRN CCCc1sc(NC(=O)c2ccccc2Cl)nc1-c1ccc(C)cc1 ZINC000408827816 571006760 /nfs/dbraw/zinc/00/67/60/571006760.db2.gz VAIXRQCKUOMMFU-UHFFFAOYSA-N 0 0 370.905 5.977 40 0 FKABRN CCCc1sc(NC(=O)c2ccc(C)cc2)nc1-c1ccc(F)cc1 ZINC000408828052 263499979 /nfs/dbraw/zinc/49/99/79/263499979.db2.gz NETMVHSJJURBLK-UHFFFAOYSA-N 0 0 354.450 5.462 40 0 FKABRN Cc1sc(NC(=O)c2ccncc2)nc1-c1ccc(Cl)cc1Cl ZINC000408828926 571007299 /nfs/dbraw/zinc/00/72/99/571007299.db2.gz WPBGVWAMGXTEAI-UHFFFAOYSA-N 0 0 364.257 5.073 40 0 FKABRN Cc1sc(NC(=O)c2ccco2)nc1-c1ccc(Cl)cc1Cl ZINC000408828957 570690358 /nfs/dbraw/zinc/69/03/58/570690358.db2.gz MOOPXSASIFNIIM-UHFFFAOYSA-N 0 0 353.230 5.271 40 0 FKABRN Cc1ccc(-c2sc(NC(=O)c3ccccn3)nc2-c2ccccc2)cc1 ZINC000408829214 570690439 /nfs/dbraw/zinc/69/04/39/570690439.db2.gz FCRNMXNAHJXYKZ-UHFFFAOYSA-N 0 0 371.465 5.433 40 0 FKABRN CCCc1sc(NC(=O)c2cccc(C)c2)nc1-c1ccc(F)cc1 ZINC000408829453 570690400 /nfs/dbraw/zinc/69/04/00/570690400.db2.gz XFHNMRNCMPUSSA-UHFFFAOYSA-N 0 0 354.450 5.462 40 0 FKABRN Cc1ccc2cc(C(=O)CCC(=O)Nc3ccc(C)c(Cl)c3)ccc2c1 ZINC000408830295 570690392 /nfs/dbraw/zinc/69/03/92/570690392.db2.gz PGFJRPNXXSYHQC-UHFFFAOYSA-N 0 0 365.860 5.712 40 0 FKABRN Cc1ccc(-c2sc(NC(=O)c3ccncc3)nc2-c2ccccc2)cc1 ZINC000408830311 571007250 /nfs/dbraw/zinc/00/72/50/571007250.db2.gz PCIBAJLXVLISCZ-UHFFFAOYSA-N 0 0 371.465 5.433 40 0 FKABRN Cc1ccc(C(=O)CCC(=O)Nc2cc(Cl)cc(Cl)c2)c(C)c1 ZINC000408831156 263499890 /nfs/dbraw/zinc/49/98/90/263499890.db2.gz OUTGBNJMWRMGOV-UHFFFAOYSA-N 0 0 350.245 5.212 40 0 FKABRN CCCc1sc(NC(=O)c2cccc(Cl)c2)nc1-c1ccccc1 ZINC000408831289 263500011 /nfs/dbraw/zinc/50/00/11/263500011.db2.gz QNIIMZHAZDEXRF-UHFFFAOYSA-N 0 0 356.878 5.668 40 0 FKABRN Cc1ccc(NC(=O)CCC(=O)c2ccc(C(C)(C)C)cc2)cc1Cl ZINC000408831303 571007830 /nfs/dbraw/zinc/00/78/30/571007830.db2.gz PDVVYHVLLPGKCT-UHFFFAOYSA-N 0 0 357.881 5.548 40 0 FKABRN CC(C)c1ccc(C(=O)CCC(=O)Nc2cc(Cl)cc(Cl)c2)cc1 ZINC000408831357 571007806 /nfs/dbraw/zinc/00/78/06/571007806.db2.gz PGIIVFDEEKQFFH-UHFFFAOYSA-N 0 0 364.272 5.718 40 0 FKABRN CCCc1sc(NC(=O)c2ccccc2)nc1-c1ccc(OCC)cc1 ZINC000408831761 570690491 /nfs/dbraw/zinc/69/04/91/570690491.db2.gz HHCJRNXRIJZCLV-UHFFFAOYSA-N 0 0 366.486 5.414 40 0 FKABRN CCCc1sc(NC(=O)c2ccc(F)cc2)nc1-c1ccc(OC)cc1 ZINC000408832134 571007710 /nfs/dbraw/zinc/00/77/10/571007710.db2.gz RIEPQVTYWONNIV-UHFFFAOYSA-N 0 0 370.449 5.163 40 0 FKABRN Cc1sc(NC(=O)c2ccncc2)nc1-c1ccc(Cl)c(Cl)c1 ZINC000408832195 570690373 /nfs/dbraw/zinc/69/03/73/570690373.db2.gz QGTDYWLTOXJITA-UHFFFAOYSA-N 0 0 364.257 5.073 40 0 FKABRN CCCc1sc(NC(=O)c2ccccc2)nc1-c1ccc(Cl)cc1 ZINC000408832295 570690388 /nfs/dbraw/zinc/69/03/88/570690388.db2.gz RVDJJARTLMZEPX-UHFFFAOYSA-N 0 0 356.878 5.668 40 0 FKABRN CCCc1sc(NC(=O)c2cccc(C)c2)nc1-c1cc(C)ccc1C ZINC000408832893 570690481 /nfs/dbraw/zinc/69/04/81/570690481.db2.gz QWJABSJHKAYLPM-UHFFFAOYSA-N 0 0 364.514 5.940 40 0 FKABRN Cc1sc(NC(=O)c2ccccn2)nc1-c1ccc(Cl)c(Cl)c1 ZINC000408832972 570690475 /nfs/dbraw/zinc/69/04/75/570690475.db2.gz RCFJLUVYXBVZKC-UHFFFAOYSA-N 0 0 364.257 5.073 40 0 FKABRN CC(C)(C)c1ccc(C(=O)CCC(=O)Nc2cccc3ccccc32)cc1 ZINC000408833069 570690432 /nfs/dbraw/zinc/69/04/32/570690432.db2.gz RKUSEVMAWDMMQD-UHFFFAOYSA-N 0 0 359.469 5.739 40 0 FKABRN CCCc1sc(NC(=O)c2ccc(OC)cc2)nc1-c1ccccc1 ZINC000408833634 263499981 /nfs/dbraw/zinc/49/99/81/263499981.db2.gz RYTFXAMSTYFSTE-UHFFFAOYSA-N 0 0 352.459 5.024 40 0 FKABRN Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccc(Cl)c(Cl)c2)c1 ZINC000408833697 570690751 /nfs/dbraw/zinc/69/07/51/570690751.db2.gz SEEBEILXDMFUMM-UHFFFAOYSA-N 0 0 350.245 5.212 40 0 FKABRN CC(C)c1ccc(C(=O)CCC(=O)Nc2cccc(C(F)(F)F)c2)cc1 ZINC000408834219 570690733 /nfs/dbraw/zinc/69/07/33/570690733.db2.gz LEJFJYCQUUHMCG-UHFFFAOYSA-N 0 0 363.379 5.430 40 0 FKABRN Cc1ccc2cc(C(=O)CCC(=O)Nc3ccc(Cl)cc3)ccc2c1 ZINC000408834300 570690914 /nfs/dbraw/zinc/69/09/14/570690914.db2.gz VQDAYZZCSTZFNR-UHFFFAOYSA-N 0 0 351.833 5.403 40 0 FKABRN CCCc1sc(NC(=O)c2ccccn2)nc1-c1ccc(C)c(C)c1 ZINC000408834323 571008822 /nfs/dbraw/zinc/00/88/22/571008822.db2.gz VUZLFVFMMIHIRB-UHFFFAOYSA-N 0 0 351.475 5.027 40 0 FKABRN CCCc1sc(NC(=O)c2cccc(C)c2)nc1-c1ccc(C)c(C)c1 ZINC000408834641 571009034 /nfs/dbraw/zinc/00/90/34/571009034.db2.gz LMTLBNUJZXIMNM-UHFFFAOYSA-N 0 0 364.514 5.940 40 0 FKABRN CCCc1sc(NC(=O)c2ccc(C)cc2)nc1-c1ccc(C)c(C)c1 ZINC000408834729 263499792 /nfs/dbraw/zinc/49/97/92/263499792.db2.gz VAVUWOTXBJSBOE-UHFFFAOYSA-N 0 0 364.514 5.940 40 0 FKABRN CC(C)c1ccc(C(=O)CCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1 ZINC000408834731 570690879 /nfs/dbraw/zinc/69/08/79/570690879.db2.gz VBDZZVNOKSSMHH-UHFFFAOYSA-N 0 0 364.272 5.718 40 0 FKABRN CCCc1sc(NC(=O)c2ccccc2OC)nc1-c1ccc(C)cc1 ZINC000408834785 570690793 /nfs/dbraw/zinc/69/07/93/570690793.db2.gz LWQABAICTVAYSF-UHFFFAOYSA-N 0 0 366.486 5.332 40 0 FKABRN Cc1ccc2cc(C(=O)CCC(=O)Nc3cccc4ccccc43)ccc2c1 ZINC000408834990 571009219 /nfs/dbraw/zinc/00/92/19/571009219.db2.gz VSPMNYZKVNCFBX-UHFFFAOYSA-N 0 0 367.448 5.903 40 0 FKABRN CCCc1sc(NC(=O)c2cccc(C)c2)nc1-c1ccc(OC)cc1 ZINC000408835637 263499936 /nfs/dbraw/zinc/49/99/36/263499936.db2.gz YWOSYBZPXWWVCP-UHFFFAOYSA-N 0 0 366.486 5.332 40 0 FKABRN CCCc1sc(NC(=O)c2ccccc2Cl)nc1-c1ccccc1 ZINC000408835659 571009763 /nfs/dbraw/zinc/00/97/63/571009763.db2.gz YYOVFCTUZFDLCY-UHFFFAOYSA-N 0 0 356.878 5.668 40 0 FKABRN CCCc1sc(NC(=O)c2ccc(OC)cc2)nc1-c1ccc(C)cc1 ZINC000408835844 570690736 /nfs/dbraw/zinc/69/07/36/570690736.db2.gz YLHUSQFHXAICPL-UHFFFAOYSA-N 0 0 366.486 5.332 40 0 FKABRN Cc1ccc(C(=O)CCC(=O)Nc2ccc(Cl)c(Cl)c2)c(C)c1 ZINC000408836004 570690888 /nfs/dbraw/zinc/69/08/88/570690888.db2.gz PCBFSBIUOCPZQG-UHFFFAOYSA-N 0 0 350.245 5.212 40 0 FKABRN O=C1OC(c2sc3cc(Cl)ccc3c2Cl)=N/C1=C/c1ccccc1 ZINC000408837877 263499774 /nfs/dbraw/zinc/49/97/74/263499774.db2.gz AIXZRXANBDPWPT-MDWZMJQESA-N 0 0 374.248 5.553 40 0 FKABRN Cc1ccc(/C=C2/N=C(c3sc4cc(C)ccc4c3Cl)OC2=O)cc1 ZINC000408838403 570691297 /nfs/dbraw/zinc/69/12/97/570691297.db2.gz FGKMEQBFHYUHCM-XNTDXEJSSA-N 0 0 367.857 5.516 40 0 FKABRN O=C1OC(c2sc3ccccc3c2Cl)=N/C1=C/C=C/c1ccccc1 ZINC000408839150 571011451 /nfs/dbraw/zinc/01/14/51/571011451.db2.gz NVTPIIHCBHBBBJ-AOLDMILESA-N 0 0 365.841 5.455 40 0 FKABRN Cc1ccc2c(Cl)c(C3=N/C(=C/c4ccccc4)C(=O)O3)sc2c1 ZINC000408841657 263499944 /nfs/dbraw/zinc/49/99/44/263499944.db2.gz GIODACXSCGTZSD-GXDHUFHOSA-N 0 0 353.830 5.208 40 0 FKABRN O=C1OC(c2sc3cc(Cl)ccc3c2Cl)=N/C1=C/c1ccco1 ZINC000408843531 570691316 /nfs/dbraw/zinc/69/13/16/570691316.db2.gz LWUKFKOOQXTUGN-YRNVUSSQSA-N 0 0 364.209 5.146 40 0 FKABRN COc1ccc(/C=C2\SC(=O)N(c3ccccc3)C2=O)c2ccccc12 ZINC000408843843 570691247 /nfs/dbraw/zinc/69/12/47/570691247.db2.gz SOUGNTOUDWVEFV-UYRXBGFRSA-N 0 0 361.422 5.089 40 0 FKABRN Cc1ccc2c(Cl)c(C3=N/C(=C/c4cccs4)C(=O)O3)sc2c1 ZINC000408848925 263501060 /nfs/dbraw/zinc/50/10/60/263501060.db2.gz XGTYNSDZTZTELK-XYOKQWHBSA-N 0 0 359.859 5.269 40 0 FKABRN Cc1ccc(N2C(=N)S/C(=C\c3c[nH]c4ccccc34)C2=O)cc1Cl ZINC000408849431 263501242 /nfs/dbraw/zinc/50/12/42/263501242.db2.gz ZZXDZUGRMRBYEZ-NSUDZLJRSA-N 0 0 367.861 5.185 40 0 FKABRN Cc1ccc2c(Cl)c(C3=N/C(=C/c4ccc(F)cc4)C(=O)O3)sc2c1 ZINC000408849468 263501091 /nfs/dbraw/zinc/50/10/91/263501091.db2.gz YYYSMIOZWGMRHB-NTEUORMPSA-N 0 0 371.820 5.347 40 0 FKABRN COc1cc(C=O)c(Br)cc1OCc1ccc2ccccc2c1 ZINC000408854175 570692786 /nfs/dbraw/zinc/69/27/86/570692786.db2.gz ZAYPFRBWDAVBRD-UHFFFAOYSA-N 0 0 371.230 5.002 40 0 FKABRN O=C(NCCSCc1ccccc1Cl)c1ccc(Cl)cc1Cl ZINC000408866412 570693844 /nfs/dbraw/zinc/69/38/44/570693844.db2.gz FQBGTVHGAREJED-UHFFFAOYSA-N 0 0 374.720 5.310 40 0 FKABRN Cc1ccc(SCCNC(=O)/C=C/c2ccc(Cl)cc2Cl)cc1 ZINC000408867019 263502564 /nfs/dbraw/zinc/50/25/64/263502564.db2.gz IVDSQNYUYAJLAI-WEVVVXLNSA-N 0 0 366.313 5.224 40 0 FKABRN COc1cc2c(cc1C)-c1nc(Nc3cccc(Cl)c3)sc1CC2 ZINC000408879497 570694408 /nfs/dbraw/zinc/69/44/08/570694408.db2.gz DTSKCKHDOXSSRY-UHFFFAOYSA-N 0 0 356.878 5.045 40 0 FKABRN C[C@H](Sc1ccccc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000408880826 570695234 /nfs/dbraw/zinc/69/52/34/570695234.db2.gz HOQRNVKUJKDBMV-KRWDZBQOSA-N 0 0 363.482 5.385 40 0 FKABRN C[C@@H](Sc1ccccc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000408880828 263504468 /nfs/dbraw/zinc/50/44/68/263504468.db2.gz HOQRNVKUJKDBMV-QGZVFWFLSA-N 0 0 363.482 5.385 40 0 FKABRN COc1ccc2c(c1)Cc1sc(Nc3cc(Cl)cc(Cl)c3)nc1-2 ZINC000408881780 263504046 /nfs/dbraw/zinc/50/40/46/263504046.db2.gz OMVPPKAKPRNVIM-UHFFFAOYSA-N 0 0 363.269 5.195 40 0 FKABRN COc1ccc2c(c1)CCc1sc(Nc3ccc(C)c(Cl)c3)nc1-2 ZINC000408884326 570694804 /nfs/dbraw/zinc/69/48/04/570694804.db2.gz YHMZMLJISGASHE-UHFFFAOYSA-N 0 0 356.878 5.045 40 0 FKABRN COc1ccc2c(c1)Cc1sc(Nc3ccc(Cl)cc3Cl)nc1-2 ZINC000408884328 570694629 /nfs/dbraw/zinc/69/46/29/570694629.db2.gz YHTHXJZCEYROEJ-UHFFFAOYSA-N 0 0 363.269 5.195 40 0 FKABRN Brc1ccc(Nc2nc3c(s2)CCc2ccccc2-3)cc1 ZINC000408887437 571039220 /nfs/dbraw/zinc/03/92/20/571039220.db2.gz QQFPBFDPXBBXRT-UHFFFAOYSA-N 0 0 357.276 5.415 40 0 FKABRN COc1cc2c(cc1C)-c1nc(Nc3ccc(Cl)cc3)sc1CC2 ZINC000408888531 570695195 /nfs/dbraw/zinc/69/51/95/570695195.db2.gz WTEPJXSDPXVXSP-UHFFFAOYSA-N 0 0 356.878 5.623 40 0 FKABRN COc1cc2c(cc1C)-c1nc(Nc3ccccc3Cl)sc1CC2 ZINC000408889109 570695228 /nfs/dbraw/zinc/69/52/28/570695228.db2.gz DRKAISJFVSMBCE-UHFFFAOYSA-N 0 0 356.878 5.045 40 0 FKABRN COc1ccc2c(c1)CCc1sc(Nc3cccc4ccccc43)nc1-2 ZINC000408891264 571041484 /nfs/dbraw/zinc/04/14/84/571041484.db2.gz NSYOAFDAYJQWMA-UHFFFAOYSA-N 0 0 358.466 5.236 40 0 FKABRN COc1ccc2c(c1)Cc1sc(Nc3ccc(Cl)c(Cl)c3)nc1-2 ZINC000408891520 570695400 /nfs/dbraw/zinc/69/54/00/570695400.db2.gz RVMDXOUGVMKAAA-UHFFFAOYSA-N 0 0 363.269 5.195 40 0 FKABRN COc1ccc2c(c1)Cc1sc(Nc3ccc(Br)cc3)nc1-2 ZINC000408891537 570695166 /nfs/dbraw/zinc/69/51/66/570695166.db2.gz SDNBQJFJENDOAW-UHFFFAOYSA-N 0 0 373.275 5.229 40 0 FKABRN CCOc1ccc(Nc2nc3c(s2)CCc2cc(OC)ccc2-3)cc1 ZINC000408892053 570695567 /nfs/dbraw/zinc/69/55/67/570695567.db2.gz AIFGMAOTRUMQKM-UHFFFAOYSA-N 0 0 352.459 5.060 40 0 FKABRN CCOc1ccc(Nc2nc3c(s2)CCc2cc(OC)c(C)cc2-3)cc1 ZINC000408894123 263504595 /nfs/dbraw/zinc/50/45/95/263504595.db2.gz JGGOIQXLKWNDQN-UHFFFAOYSA-N 0 0 366.486 5.368 40 0 FKABRN COc1ccc2c(c1)Cc1sc(Nc3cccc(Cl)c3Cl)nc1-2 ZINC000408897096 570696699 /nfs/dbraw/zinc/69/66/99/570696699.db2.gz VPJFYHCSUMNYNQ-UHFFFAOYSA-N 0 0 363.269 5.195 40 0 FKABRN COc1cc2c(cc1C)-c1nc(Nc3cccc4ccccc43)sc1CC2 ZINC000408898900 571044532 /nfs/dbraw/zinc/04/45/32/571044532.db2.gz YFQPWGXUDAQIQV-UHFFFAOYSA-N 0 0 372.493 5.544 40 0 FKABRN COc1cc2c(cc1C)-c1nc(Nc3ccc(C)c(Cl)c3)sc1CC2 ZINC000408899909 571045022 /nfs/dbraw/zinc/04/50/22/571045022.db2.gz RUSPEUFUFYROMH-UHFFFAOYSA-N 0 0 370.905 5.353 40 0 FKABRN CC[C@@H](C)Oc1ccccc1/C=C1/SC(=O)N(c2ccccc2)C1=O ZINC000408901207 570696043 /nfs/dbraw/zinc/69/60/43/570696043.db2.gz CBOSAGUHQHHIMW-QFGUUYLXSA-N 0 0 353.443 5.105 40 0 FKABRN CC[C@H](C)Oc1ccccc1/C=C1/SC(=O)N(c2ccccc2)C1=O ZINC000408901208 571045099 /nfs/dbraw/zinc/04/50/99/571045099.db2.gz CBOSAGUHQHHIMW-RAOBZKRQSA-N 0 0 353.443 5.105 40 0 FKABRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=O)N(c3ccccc3)C2=O)cc1 ZINC000408901258 263505835 /nfs/dbraw/zinc/50/58/35/263505835.db2.gz CRROJMGDXUHGPZ-QFGUUYLXSA-N 0 0 353.443 5.105 40 0 FKABRN CC[C@H](C)Oc1ccc(/C=C2/SC(=O)N(c3ccccc3)C2=O)cc1 ZINC000408901259 570695984 /nfs/dbraw/zinc/69/59/84/570695984.db2.gz CRROJMGDXUHGPZ-RAOBZKRQSA-N 0 0 353.443 5.105 40 0 FKABRN CC(C)n1cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c2ccccc21 ZINC000408901942 571045928 /nfs/dbraw/zinc/04/59/28/571045928.db2.gz JFJZTHDBGOJQEJ-XDHOZWIPSA-N 0 0 362.454 5.463 40 0 FKABRN CC(C)Oc1ccc(/C=C2/SC(=O)N(c3ccccc3)C2=O)cc1Cl ZINC000408902450 263505888 /nfs/dbraw/zinc/50/58/88/263505888.db2.gz NUSUEQOPOKAHBO-GZTJUZNOSA-N 0 0 373.861 5.368 40 0 FKABRN O=C1S/C(=C/c2ccc3[nH]c4ccccc4c3c2)C(=O)N1c1ccccc1 ZINC000408903225 571046010 /nfs/dbraw/zinc/04/60/10/571046010.db2.gz VYLFQQKWUOEAAQ-DEDYPNTBSA-N 0 0 370.433 5.562 40 0 FKABRN Cc1cc(CSc2ccccc2)ccc1NC(=O)/C=C/c1ccccc1 ZINC000408906288 263506378 /nfs/dbraw/zinc/50/63/78/263506378.db2.gz FNDPXDSHUUCJNS-FYWRMAATSA-N 0 0 359.494 5.939 40 0 FKABRN CN(Cc1ccccc1)C(=O)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408906290 570697026 /nfs/dbraw/zinc/69/70/26/570697026.db2.gz FOQLFCPTZWIQHN-LTGZKZEYSA-N 0 0 361.872 5.539 40 0 FKABRN COc1ccc(C(=O)Nc2ccc(CSc3ccccc3)cc2C)cc1 ZINC000408906569 570697056 /nfs/dbraw/zinc/69/70/56/570697056.db2.gz HPABVTVHAZATSF-UHFFFAOYSA-N 0 0 363.482 5.548 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408907441 570696919 /nfs/dbraw/zinc/69/69/19/570696919.db2.gz OAKVWLFPJAMTMB-XMHGGMMESA-N 0 0 368.263 6.173 40 0 FKABRN Cc1ccc(NC(=O)/C(=C/c2ccccc2Cl)c2ccccc2)c(C)c1 ZINC000408908102 571046975 /nfs/dbraw/zinc/04/69/75/571046975.db2.gz TXJKZIQPNWPWHZ-HMMYKYKNSA-N 0 0 361.872 6.136 40 0 FKABRN O=C(/C=C/c1ccc(F)cc1)Nc1ccc(CSc2ccccc2)cc1 ZINC000408908164 570697997 /nfs/dbraw/zinc/69/79/97/570697997.db2.gz UKQGJKXMMQDQLF-XNTDXEJSSA-N 0 0 363.457 5.770 40 0 FKABRN O=C(Nc1cccc(Cl)c1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408908208 263506886 /nfs/dbraw/zinc/50/68/86/263506886.db2.gz VLHCNLRIOLOBLO-CPNJWEJPSA-N 0 0 368.263 6.173 40 0 FKABRN COc1ccc(/C=C(/C(=O)NC(C(C)C)C(C)C)c2ccccc2)cc1 ZINC000408908706 263506472 /nfs/dbraw/zinc/50/64/72/263506472.db2.gz YBHVWQQGMLNZGG-RCCKNPSSSA-N 0 0 351.490 5.033 40 0 FKABRN Cc1ccc(NC(=O)/C(=C/c2ccccc2Cl)c2ccccc2)cc1C ZINC000408909002 571047344 /nfs/dbraw/zinc/04/73/44/571047344.db2.gz ZXYKFWLCMWTJEE-RCCKNPSSSA-N 0 0 361.872 6.136 40 0 FKABRN O=C(Nc1ccccc1Cl)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408911246 570698359 /nfs/dbraw/zinc/69/83/59/570698359.db2.gz MLBXRPWXQWPHAE-SAPNQHFASA-N 0 0 368.263 6.173 40 0 FKABRN O=C(NCCSCc1ccc(Cl)cc1Cl)c1cccc(Cl)c1 ZINC000408911674 263506636 /nfs/dbraw/zinc/50/66/36/263506636.db2.gz NQDJLCWOZSLOLZ-UHFFFAOYSA-N 0 0 374.720 5.310 40 0 FKABRN O=C(/C=C/c1ccc(Cl)cc1Cl)NCCSCc1cccs1 ZINC000408912780 571048080 /nfs/dbraw/zinc/04/80/80/571048080.db2.gz RKZUCRJIMXOTEY-GQCTYLIASA-N 0 0 372.342 5.118 40 0 FKABRN O=C(Nc1ccc(CSc2ccccc2)cc1)c1cccc(Cl)c1 ZINC000408913730 571048429 /nfs/dbraw/zinc/04/84/29/571048429.db2.gz UBWCPRSPRLEYEC-UHFFFAOYSA-N 0 0 353.874 5.885 40 0 FKABRN O=C(/C=C/c1ccccc1)NCCSCc1ccc(Cl)cc1Cl ZINC000408914447 570698853 /nfs/dbraw/zinc/69/88/53/570698853.db2.gz WVBQVTMHJBSPBZ-RMKNXTFCSA-N 0 0 366.313 5.056 40 0 FKABRN Cc1c(F)cccc1NC(=O)CCCOc1ccc(Cl)cc1Cl ZINC000408916124 570699227 /nfs/dbraw/zinc/69/92/27/570699227.db2.gz UZHDVHIPEOZBKZ-UHFFFAOYSA-N 0 0 356.224 5.239 40 0 FKABRN CC(C)(C)SCCNC(=O)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408921170 570699153 /nfs/dbraw/zinc/69/91/53/570699153.db2.gz UGCFAXBPXCTCLL-OBGWFSINSA-N 0 0 373.949 5.529 40 0 FKABRN O=C(Nc1ccc(F)cc1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408921352 570699259 /nfs/dbraw/zinc/69/92/59/570699259.db2.gz GQUWBVYYKMMTBF-XMHGGMMESA-N 0 0 351.808 5.658 40 0 FKABRN Cc1cc(C)cc(NC(=O)/C(=C/c2ccccc2Cl)c2ccccc2)c1 ZINC000408922564 570699392 /nfs/dbraw/zinc/69/93/92/570699392.db2.gz CFHRVTGZKHBYOC-RCCKNPSSSA-N 0 0 361.872 6.136 40 0 FKABRN O=C(NCCSCc1ccc(Cl)cc1Cl)c1ccccc1Cl ZINC000408922643 570699984 /nfs/dbraw/zinc/69/99/84/570699984.db2.gz DARFGVRNDOPUBH-UHFFFAOYSA-N 0 0 374.720 5.310 40 0 FKABRN O=C(NCCSCc1ccc(Cl)c(Cl)c1)c1cccc(Cl)c1 ZINC000408923446 571054239 /nfs/dbraw/zinc/05/42/39/571054239.db2.gz XVZZQWXQYBLIPE-UHFFFAOYSA-N 0 0 374.720 5.310 40 0 FKABRN COc1cc2c(cc1NC(=O)c1ccccc1-c1ccccc1)CCCC2 ZINC000408923555 571054177 /nfs/dbraw/zinc/05/41/77/571054177.db2.gz FZBIFFMWPLNZIZ-UHFFFAOYSA-N 0 0 357.453 5.493 40 0 FKABRN Cc1cc(CSc2ccccc2)ccc1NC(=O)c1cccc(Cl)c1 ZINC000408923648 571054281 /nfs/dbraw/zinc/05/42/81/571054281.db2.gz ZFMXLQKDHIIIFT-UHFFFAOYSA-N 0 0 367.901 6.193 40 0 FKABRN COc1ccc(/C=C(/C(=O)N[C@H](C)c2ccccc2)c2ccccc2)cc1 ZINC000408923657 571054172 /nfs/dbraw/zinc/05/41/72/571054172.db2.gz ZGZCCOCBYICYLY-KIJZHVTOSA-N 0 0 357.453 5.113 40 0 FKABRN O=C(NCCc1ccccc1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408923814 570699949 /nfs/dbraw/zinc/69/99/49/570699949.db2.gz GWAGWKNTFKKODS-HEHNFIMWSA-N 0 0 361.872 5.240 40 0 FKABRN Cc1cc(CSc2ccccc2)ccc1NC(=S)Nc1ccccc1 ZINC000408923840 570700028 /nfs/dbraw/zinc/70/00/28/570700028.db2.gz HGERGDQSSWZJPO-UHFFFAOYSA-N 0 0 364.539 6.096 40 0 FKABRN O=C(/C(=C/c1ccccc1Cl)c1ccccc1)N1CCc2ccccc2C1 ZINC000408923910 570700043 /nfs/dbraw/zinc/70/00/43/570700043.db2.gz HZDDSZFXAWDXGF-CJLVFECKSA-N 0 0 373.883 5.466 40 0 FKABRN COc1cc2c(cc1NC(=O)c1ccc(Cl)cc1Cl)CCCC2 ZINC000408924316 571054127 /nfs/dbraw/zinc/05/41/27/571054127.db2.gz HOKKNNPAJOEXBS-UHFFFAOYSA-N 0 0 350.245 5.133 40 0 FKABRN COc1cc2c(cc1NC(=O)c1ccc(-c3ccccc3)cc1)CCCC2 ZINC000408925427 570699399 /nfs/dbraw/zinc/69/93/99/570699399.db2.gz KURKNFXNVAKRJX-UHFFFAOYSA-N 0 0 357.453 5.493 40 0 FKABRN COc1ccc(/C=C(/C(=O)Nc2ccc(C)cc2C)c2ccccc2)cc1 ZINC000408925786 571054585 /nfs/dbraw/zinc/05/45/85/571054585.db2.gz PVKDVSXLIQMYCF-CJLVFECKSA-N 0 0 357.453 5.491 40 0 FKABRN Cc1ccc(CNC(=O)/C(=C/c2ccccc2Cl)c2ccccc2)cc1 ZINC000408925810 570699462 /nfs/dbraw/zinc/69/94/62/570699462.db2.gz QOLJFZXPMMMNAQ-RCCKNPSSSA-N 0 0 361.872 5.505 40 0 FKABRN Cc1cccc(C)c1NC(=O)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408925825 571054622 /nfs/dbraw/zinc/05/46/22/571054622.db2.gz QTMLTEZGEVEXRK-HMMYKYKNSA-N 0 0 361.872 6.136 40 0 FKABRN CC(C)(C)SCCNC(=O)c1ccc(CSCc2ccccc2)cc1 ZINC000408927329 571054582 /nfs/dbraw/zinc/05/45/82/571054582.db2.gz ZAYOPSAOYDWFHQ-UHFFFAOYSA-N 0 0 373.587 5.382 40 0 FKABRN CCc1ccccc1NC(=O)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000408927348 571054558 /nfs/dbraw/zinc/05/45/58/571054558.db2.gz ZROVNUDOBZJHAJ-CAPFRKAQSA-N 0 0 361.872 6.082 40 0 FKABRN Nc1c(-c2ccc(Cl)cc2)cnn1-c1c(Cl)cc(Cl)cc1Cl ZINC000408947719 570702409 /nfs/dbraw/zinc/70/24/09/570702409.db2.gz DALNTONEJJQCKI-UHFFFAOYSA-N 0 0 373.070 5.735 40 0 FKABRN Cc1ccc(-c2cc(N)n(-c3c(Cl)cc(Cl)cc3Cl)n2)cc1 ZINC000408948356 570702395 /nfs/dbraw/zinc/70/23/95/570702395.db2.gz FRXIRDBRGRSJQU-UHFFFAOYSA-N 0 0 352.652 5.390 40 0 FKABRN Cc1nn(-c2c(Cl)cc(Cl)cc2Cl)c(N)c1-c1ccccc1 ZINC000408948832 263509283 /nfs/dbraw/zinc/50/92/83/263509283.db2.gz HBZQHIZGJWXOPS-UHFFFAOYSA-N 0 0 352.652 5.390 40 0 FKABRN Nc1cc(-c2ccc(Cl)cc2)nn1-c1c(Cl)cc(Cl)cc1Cl ZINC000408950425 570702018 /nfs/dbraw/zinc/70/20/18/570702018.db2.gz KBVWLQYHBIWQPA-UHFFFAOYSA-N 0 0 373.070 5.735 40 0 FKABRN COc1ccc(-c2cc(N)n(-c3c(Cl)cc(Cl)cc3Cl)n2)cc1 ZINC000408952600 571060734 /nfs/dbraw/zinc/06/07/34/571060734.db2.gz OLIRLCYUWIDLQV-UHFFFAOYSA-N 0 0 368.651 5.090 40 0 FKABRN Cc1cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c(C)n1C(C)(C)C ZINC000408960750 571065075 /nfs/dbraw/zinc/06/50/75/571065075.db2.gz INAGCTGVNOVJJD-SFQUDFHCSA-N 0 0 354.475 5.101 40 0 FKABRN Cc1cccc(-n2cccc2/C=C2/SC(=O)N(c3ccccc3)C2=O)c1C ZINC000408961138 570703402 /nfs/dbraw/zinc/70/34/02/570703402.db2.gz ALMKATFSZIXLFU-XSFVSMFZSA-N 0 0 374.465 5.335 40 0 FKABRN Cc1ccc(-n2cccc2/C=C2/SC(=O)N(c3ccccc3)C2=O)c(C)c1 ZINC000408961200 571065396 /nfs/dbraw/zinc/06/53/96/571065396.db2.gz BHQKPQJDBAXRQX-XSFVSMFZSA-N 0 0 374.465 5.335 40 0 FKABRN Cc1ccc(-n2cccc2/C=C2/SC(=O)N(c3ccccc3)C2=O)cc1 ZINC000408962179 570703669 /nfs/dbraw/zinc/70/36/69/570703669.db2.gz QSYJZMKNGURXSQ-XMHGGMMESA-N 0 0 360.438 5.027 40 0 FKABRN Cc1cccc(-n2cccc2/C=C2/SC(=O)N(c3ccccc3)C2=O)c1 ZINC000408964015 570704256 /nfs/dbraw/zinc/70/42/56/570704256.db2.gz FEQCLHLFKWUVJS-XMHGGMMESA-N 0 0 360.438 5.027 40 0 FKABRN O=C(Nc1ccc(F)cc1)c1sc2cc(Cl)cc(Cl)c2c1Cl ZINC000408964501 570704152 /nfs/dbraw/zinc/70/41/52/570704152.db2.gz SFIAITGPHSAYMU-UHFFFAOYSA-N 0 0 374.651 6.253 40 0 FKABRN Cc1ccc(-n2cccc2/C=C2/SC(=O)N(c3ccccc3)C2=O)cc1C ZINC000408964879 570704095 /nfs/dbraw/zinc/70/40/95/570704095.db2.gz SYRNMNRDTNVNID-XSFVSMFZSA-N 0 0 374.465 5.335 40 0 FKABRN Cc1ccccc1-n1cccc1/C=C1/SC(=O)N(c2ccccc2)C1=O ZINC000408966570 263510652 /nfs/dbraw/zinc/51/06/52/263510652.db2.gz PFGVOUQTIFRILE-XMHGGMMESA-N 0 0 360.438 5.027 40 0 FKABRN O=C(NC1CCCCC1)c1sc2cc(Cl)cc(Cl)c2c1Cl ZINC000408968646 570705101 /nfs/dbraw/zinc/70/51/01/570705101.db2.gz ANIBRIHSFSSOOQ-UHFFFAOYSA-N 0 0 362.709 5.924 40 0 FKABRN Cc1ccc2c(c1)sc(C(=O)Nc1ccc(Cl)cc1C)c2Cl ZINC000408969258 571073261 /nfs/dbraw/zinc/07/32/61/571073261.db2.gz KEUIJIXQSGKDJG-UHFFFAOYSA-N 0 0 350.270 6.077 40 0 FKABRN Cc1cc(Cl)ccc1NC(=O)c1sc2cc(Cl)ccc2c1Cl ZINC000408970096 570705111 /nfs/dbraw/zinc/70/51/11/570705111.db2.gz APGQGHOQXWFVGJ-UHFFFAOYSA-N 0 0 370.688 6.422 40 0 FKABRN COc1ccc2c(Cl)c(C(=O)Nc3ccc(C)cc3)sc2c1Cl ZINC000408971111 570705446 /nfs/dbraw/zinc/70/54/46/570705446.db2.gz MGSCDTWJINYKOQ-UHFFFAOYSA-N 0 0 366.269 5.777 40 0 FKABRN COc1ccc2c(Cl)c(C(=O)Nc3cccc(C)c3)sc2c1Cl ZINC000408971454 263511650 /nfs/dbraw/zinc/51/16/50/263511650.db2.gz OPMROCLSVNCTBR-UHFFFAOYSA-N 0 0 366.269 5.777 40 0 FKABRN Cc1ccc(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)cc1 ZINC000408971491 263511988 /nfs/dbraw/zinc/51/19/88/263511988.db2.gz GIRHVTYRQMLGSR-UHFFFAOYSA-N 0 0 370.688 6.422 40 0 FKABRN Cc1ccccc1NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl ZINC000408971974 570704629 /nfs/dbraw/zinc/70/46/29/570704629.db2.gz NAGBTTCTNVELMU-UHFFFAOYSA-N 0 0 370.688 6.422 40 0 FKABRN O=C(NCc1ccccc1)c1sc2cc(Cl)cc(Cl)c2c1Cl ZINC000408972717 570707000 /nfs/dbraw/zinc/70/70/00/570707000.db2.gz VKQVIKJIMLKYBN-UHFFFAOYSA-N 0 0 370.688 5.792 40 0 FKABRN COc1ccc2c(Cl)c(C(=O)NC3CCCCC3)sc2c1Cl ZINC000408972756 570707035 /nfs/dbraw/zinc/70/70/35/570707035.db2.gz WLZJGMOGLMRSLF-UHFFFAOYSA-N 0 0 358.290 5.279 40 0 FKABRN Cc1ccc2c(Cl)c(C3=N/C(=C\c4cccc(C)c4)C(=O)O3)sc2c1 ZINC000408973452 263511894 /nfs/dbraw/zinc/51/18/94/263511894.db2.gz SJHOFNYRHYNULE-GDNBJRDFSA-N 0 0 367.857 5.516 40 0 FKABRN Nc1ncnc2oc(-c3ccccc3)c(-c3ccc(-c4ccccc4)cc3)c21 ZINC000408973454 570705496 /nfs/dbraw/zinc/70/54/96/570705496.db2.gz AXOFMIMIGNHRGJ-UHFFFAOYSA-N 0 0 363.420 5.806 40 0 FKABRN CC(C)c1ccc(/C=C2/SC(=O)N(CNc3ccc(F)cc3)C2=O)cc1 ZINC000408974147 571085445 /nfs/dbraw/zinc/08/54/45/571085445.db2.gz VUTAXAMHLUUXOJ-WOJGMQOQSA-N 0 0 370.449 5.055 40 0 FKABRN CCCCCCOc1ccccc1/C=C1\N=C(c2cccc(C)c2)OC1=O ZINC000408974769 570705796 /nfs/dbraw/zinc/70/57/96/570705796.db2.gz DSWSFJSOWGZDFX-SILNSSARSA-N 0 0 363.457 5.299 40 0 FKABRN N=C1S/C(=C\c2ccc(Cl)cc2Cl)C(=O)N1c1ccc(F)cc1 ZINC000408975920 571087609 /nfs/dbraw/zinc/08/76/09/571087609.db2.gz CTQIZNQFDSGOFS-UPCQICKVSA-N 0 0 367.232 5.188 40 0 FKABRN Cc1cccc(Nc2nc(-c3ccc(Br)cc3)cs2)c1C ZINC000408976847 570706539 /nfs/dbraw/zinc/70/65/39/570706539.db2.gz GTTBBAYIDHXTKZ-UHFFFAOYSA-N 0 0 359.292 5.355 40 0 FKABRN Cc1cccc(-c2c3c(nc4c2C(=O)CC(C)(C)C4)-c2ccccc2[C@@H]3O)c1 ZINC000408979896 570707925 /nfs/dbraw/zinc/70/79/25/570707925.db2.gz DHMJUVDIUWTHHY-DEOSSOPVSA-N 0 0 369.464 5.274 40 0 FKABRN Cc1cccc(-c2c3c(nc4c2C(=O)CC(C)(C)C4)-c2ccccc2[C@H]3O)c1 ZINC000408979900 571097218 /nfs/dbraw/zinc/09/72/18/571097218.db2.gz DHMJUVDIUWTHHY-XMMPIXPASA-N 0 0 369.464 5.274 40 0 FKABRN CCCN(Cc1ccccc1)C(=S)Nc1ccc2nc(C)sc2c1 ZINC000408980076 571097375 /nfs/dbraw/zinc/09/73/75/571097375.db2.gz ULQNSMJHTBARSL-UHFFFAOYSA-N 0 0 355.532 5.214 40 0 FKABRN COc1cc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCCC4)ccc1C ZINC000408985289 570707868 /nfs/dbraw/zinc/70/78/68/570707868.db2.gz ANUDJRLWWHTARF-UHFFFAOYSA-N 0 0 354.475 5.040 40 0 FKABRN CC(C)Oc1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCC4)cc1 ZINC000408985908 571106909 /nfs/dbraw/zinc/10/69/09/571106909.db2.gz BKBXOLWPZNJWGV-UHFFFAOYSA-N 0 0 354.475 5.120 40 0 FKABRN CC1(C)CC(=O)c2c(nc3c(c2-c2cccc(F)c2)[C@H](O)c2ccccc2-3)C1 ZINC000408986203 570707966 /nfs/dbraw/zinc/70/79/66/570707966.db2.gz ONOZREVGLOSAQA-HSZRJFAPSA-N 0 0 373.427 5.105 40 0 FKABRN CC1(C)CC(=O)c2c(nc3c(c2-c2cccc(F)c2)[C@@H](O)c2ccccc2-3)C1 ZINC000408986204 570707989 /nfs/dbraw/zinc/70/79/89/570707989.db2.gz ONOZREVGLOSAQA-QHCPKHFHSA-N 0 0 373.427 5.105 40 0 FKABRN O=c1nc(-c2ccc(Cl)cc2Cl)[nH]c2sc3c(c21)CCCCC3 ZINC000408986421 570707974 /nfs/dbraw/zinc/70/79/74/570707974.db2.gz CFYBFVQQKPPSNV-UHFFFAOYSA-N 0 0 365.285 5.640 40 0 FKABRN CC(C)(C)c1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCCC4)cc1 ZINC000408986698 570708196 /nfs/dbraw/zinc/70/81/96/570708196.db2.gz DAABSKKYVWSDRC-UHFFFAOYSA-N 0 0 366.530 6.020 40 0 FKABRN CC(C)(C)c1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCC4)cc1 ZINC000408986711 570708150 /nfs/dbraw/zinc/70/81/50/570708150.db2.gz DBKZZZQVTQXCLC-UHFFFAOYSA-N 0 0 352.503 5.630 40 0 FKABRN CCOc1cccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCCC4)c1 ZINC000408987658 263513961 /nfs/dbraw/zinc/51/39/61/263513961.db2.gz GFDPOMAXLFGCDH-UHFFFAOYSA-N 0 0 354.475 5.122 40 0 FKABRN O=c1nc(-c2cccc3ccccc32)[nH]c2sc3c(c21)CCCCCC3 ZINC000408988076 263514534 /nfs/dbraw/zinc/51/45/34/263514534.db2.gz GUKKAKAPNSHQDE-UHFFFAOYSA-N 0 0 360.482 5.876 40 0 FKABRN O=c1nc(-c2c(F)cccc2Cl)[nH]c2sc3c(c21)CCCCCC3 ZINC000408988079 570708183 /nfs/dbraw/zinc/70/81/83/570708183.db2.gz GUTVIEFCCHZNMH-UHFFFAOYSA-N 0 0 362.857 5.515 40 0 FKABRN COc1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCCC4)cc1C ZINC000408988165 263514352 /nfs/dbraw/zinc/51/43/52/263514352.db2.gz HHVYRKZPWGQSJO-UHFFFAOYSA-N 0 0 354.475 5.040 40 0 FKABRN CCCOc1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCC4)cc1 ZINC000408988508 570708429 /nfs/dbraw/zinc/70/84/29/570708429.db2.gz IEIYUKPBPYMVHJ-UHFFFAOYSA-N 0 0 354.475 5.122 40 0 FKABRN CC(C)c1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCCC4)cc1 ZINC000408988595 571107488 /nfs/dbraw/zinc/10/74/88/571107488.db2.gz ILSKJHJKIQIEFF-UHFFFAOYSA-N 0 0 352.503 5.846 40 0 FKABRN CC(C)COc1ccc(-c2nc3sc4c(c3c(=O)[nH]2)CCCCC4)cc1 ZINC000408989704 570708218 /nfs/dbraw/zinc/70/82/18/570708218.db2.gz LLVRXGOXDBQQQV-UHFFFAOYSA-N 0 0 368.502 5.368 40 0 FKABRN CCCOc1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCCC4)cc1 ZINC000408989795 570708389 /nfs/dbraw/zinc/70/83/89/570708389.db2.gz MCTSUHBCZVYSNO-UHFFFAOYSA-N 0 0 368.502 5.512 40 0 FKABRN Cc1ccc(-c2c3c(nc4c2C(=O)CC(C)(C)C4)-c2ccccc2[C@@H]3O)cc1 ZINC000408990054 570708329 /nfs/dbraw/zinc/70/83/29/570708329.db2.gz VBZGLCYYRWVNOM-DEOSSOPVSA-N 0 0 369.464 5.274 40 0 FKABRN Cc1ccc(-c2c3c(nc4c2C(=O)CC(C)(C)C4)-c2ccccc2[C@H]3O)cc1 ZINC000408990056 571107659 /nfs/dbraw/zinc/10/76/59/571107659.db2.gz VBZGLCYYRWVNOM-XMMPIXPASA-N 0 0 369.464 5.274 40 0 FKABRN O=c1nc(-c2cccc(Cl)c2Cl)[nH]c2sc3c(c21)CCCCC3 ZINC000408990854 263514763 /nfs/dbraw/zinc/51/47/63/263514763.db2.gz OOFDRRAEFUVKJY-UHFFFAOYSA-N 0 0 365.285 5.640 40 0 FKABRN CC(C)Oc1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCCCC4)cc1 ZINC000408991933 571110068 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CC(C)(C)c1ccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(F)cc2)cc1 ZINC000408999441 570710134 /nfs/dbraw/zinc/71/01/34/570710134.db2.gz CVGHIAPTFJXXSN-QFIPXVFZSA-N 0 0 374.459 5.894 40 0 FKABRN CSc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(C)c(C)c2)cc1 ZINC000409000481 571110806 /nfs/dbraw/zinc/11/08/06/571110806.db2.gz YJIBNGPWMZCUFV-JOCHJYFZSA-N 0 0 374.509 5.796 40 0 FKABRN CSc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(C)c(C)c2)cc1 ZINC000409000485 571110700 /nfs/dbraw/zinc/11/07/00/571110700.db2.gz YJIBNGPWMZCUFV-QFIPXVFZSA-N 0 0 374.509 5.796 40 0 FKABRN CCc1ccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(SC)cc2)cc1 ZINC000409000680 570710583 /nfs/dbraw/zinc/71/05/83/570710583.db2.gz ZMYNQYGJWRDLCY-JOCHJYFZSA-N 0 0 374.509 5.742 40 0 FKABRN CCc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(SC)cc2)cc1 ZINC000409000682 263515703 /nfs/dbraw/zinc/51/57/03/263515703.db2.gz ZMYNQYGJWRDLCY-QFIPXVFZSA-N 0 0 374.509 5.742 40 0 FKABRN COc1ccc(CCCC(=O)Nc2ccc3c(c2)oc2ccccc23)cc1C ZINC000409001795 263516682 /nfs/dbraw/zinc/51/66/82/263516682.db2.gz 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CC[C@H](C)N1C(=O)S/C(=C/c2ccc(Sc3ccc(C)cc3)o2)C1=O ZINC000409010432 570712170 /nfs/dbraw/zinc/71/21/70/570712170.db2.gz DXKYJFLNLCQAHB-XDUBLRSXSA-N 0 0 373.499 5.574 40 0 FKABRN CC[C@@H](C)N1C(=O)S/C(=C/c2ccccc2OCc2ccccc2)C1=O ZINC000409011072 570712576 /nfs/dbraw/zinc/71/25/76/570712576.db2.gz LXGFHEWAWWXXQE-DQPIFXJKSA-N 0 0 367.470 5.100 40 0 FKABRN CC[C@H](C)N1C(=O)S/C(=C/c2ccccc2OCc2ccccc2)C1=O ZINC000409011074 570712667 /nfs/dbraw/zinc/71/26/67/570712667.db2.gz LXGFHEWAWWXXQE-SJPXOZHESA-N 0 0 367.470 5.100 40 0 FKABRN Clc1ccccc1CSc1nnc(COc2ccccc2Cl)o1 ZINC000409011591 571111330 /nfs/dbraw/zinc/11/13/30/571111330.db2.gz GNIAGMPZJTWAJU-UHFFFAOYSA-N 0 0 367.257 5.248 40 0 FKABRN COc1ccc(CCCc2nnc(SCc3ccc(C)cc3)o2)cc1C ZINC000409013990 570712972 /nfs/dbraw/zinc/71/29/72/570712972.db2.gz LMRIBHPUZLMRJD-UHFFFAOYSA-N 0 0 368.502 5.163 40 0 FKABRN CC[C@@H](C)N1C(=O)S/C(=C/c2cn([C@@H](C)CC)c3ccccc23)C1=O ZINC000409014087 570713123 /nfs/dbraw/zinc/71/31/23/570713123.db2.gz FAFXVZDNFYJTES-NRWOIDKPSA-N 0 0 356.491 5.447 40 0 FKABRN CC[C@H](C)n1cc(/C=C2/SC(=O)N([C@@H](C)CC)C2=O)c2ccccc21 ZINC000409014093 570713135 /nfs/dbraw/zinc/71/31/35/570713135.db2.gz FAFXVZDNFYJTES-UQVNSJMISA-N 0 0 356.491 5.447 40 0 FKABRN COc1ccc(CCCc2nnc(SCc3ccccc3Cl)o2)cc1 ZINC000409014568 570713022 /nfs/dbraw/zinc/71/30/22/570713022.db2.gz NATNFIDRRUIVGB-UHFFFAOYSA-N 0 0 374.893 5.199 40 0 FKABRN CC[C@@H](C)N1C(=O)S/C(=C/c2ccc(-c3ccc(Cl)cc3)o2)C1=O ZINC000409015604 570713583 /nfs/dbraw/zinc/71/35/83/570713583.db2.gz SQSPUGXIXMMFSE-HPUUJOOBSA-N 0 0 361.850 5.435 40 0 FKABRN CC[C@H](C)N1C(=O)S/C(=C/c2ccc(-c3ccc(Cl)cc3)o2)C1=O ZINC000409015607 570713412 /nfs/dbraw/zinc/71/34/12/570713412.db2.gz SQSPUGXIXMMFSE-YAFRSCOQSA-N 0 0 361.850 5.435 40 0 FKABRN Clc1ccc(CSc2nnc(COc3ccccc3Cl)o2)cc1 ZINC000409015952 570713544 /nfs/dbraw/zinc/71/35/44/570713544.db2.gz PWUHGIHQTCPTRD-UHFFFAOYSA-N 0 0 367.257 5.248 40 0 FKABRN COc1ccc(CCCc2nnc(SCc3cccc(C)c3)o2)cc1C ZINC000409016557 570713376 /nfs/dbraw/zinc/71/33/76/570713376.db2.gz QGNXMLKLEXTAIS-UHFFFAOYSA-N 0 0 368.502 5.163 40 0 FKABRN CC[C@H](C)Oc1ccc(/C=C2/SC(=O)N([C@@H](C)CC)C2=O)cc1Cl ZINC000409018071 570713102 /nfs/dbraw/zinc/71/31/02/570713102.db2.gz XFUCINUCEZLCCB-ATARQRRYSA-N 0 0 367.898 5.352 40 0 FKABRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=O)N([C@@H](C)CC)C2=O)cc1Cl ZINC000409018073 570713059 /nfs/dbraw/zinc/71/30/59/570713059.db2.gz XFUCINUCEZLCCB-AWOYWQDDSA-N 0 0 367.898 5.352 40 0 FKABRN CC[C@@H](C)Oc1ccc(/C=C2/SC(=O)N([C@H](C)CC)C2=O)cc1Cl ZINC000409018074 571111749 /nfs/dbraw/zinc/11/17/49/571111749.db2.gz XFUCINUCEZLCCB-DYBVGFEPSA-N 0 0 367.898 5.352 40 0 FKABRN CC[C@@H](C)N1C(=O)S/C(=C/c2ccc(O[C@@H](C)CC)c(Cl)c2)C1=O ZINC000409018075 571111857 /nfs/dbraw/zinc/11/18/57/571111857.db2.gz XFUCINUCEZLCCB-GIBJHAEVSA-N 0 0 367.898 5.352 40 0 FKABRN COc1ccc(CCCc2nnc(SCc3ccc(Cl)cc3)o2)cc1 ZINC000409020009 570713855 /nfs/dbraw/zinc/71/38/55/570713855.db2.gz YPRKXNBMSOLCLX-UHFFFAOYSA-N 0 0 374.893 5.199 40 0 FKABRN O=C1S/C(=C\c2ccc(-c3cccc(F)c3)o2)C(=O)N1c1ccccc1 ZINC000409020606 570713405 /nfs/dbraw/zinc/71/34/05/570713405.db2.gz QZDSGSORRKOQNB-PDGQHHTCSA-N 0 0 365.385 5.327 40 0 FKABRN CC(C)Oc1ccc2ccccc2c1/C=C1/SC(=O)N(C(C)C)C1=O ZINC000409021527 570713542 /nfs/dbraw/zinc/71/35/42/570713542.db2.gz LTSMBJLMZHMFCY-WOJGMQOQSA-N 0 0 355.459 5.072 40 0 FKABRN Cc1cccc(COc2ccc(/C=C3/SC(=O)N(C(C)C)C3=O)cc2)c1 ZINC000409021834 263517951 /nfs/dbraw/zinc/51/79/51/263517951.db2.gz BEROBRHJBYELIM-XDHOZWIPSA-N 0 0 367.470 5.019 40 0 FKABRN Cc1cccc(COc2ccccc2/C=C2/SC(=O)N(C(C)C)C2=O)c1 ZINC000409022438 571112567 /nfs/dbraw/zinc/11/25/67/571112567.db2.gz NWFBOYQXJNYSDX-XDHOZWIPSA-N 0 0 367.470 5.019 40 0 FKABRN O=C(NCCSCc1c(Cl)cccc1Cl)c1ccccc1Cl ZINC000409022970 263518140 /nfs/dbraw/zinc/51/81/40/263518140.db2.gz AUGIEUHWKJLNDL-UHFFFAOYSA-N 0 0 374.720 5.310 40 0 FKABRN O=C(NC1CCCCCC1)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000409025310 571112582 /nfs/dbraw/zinc/11/25/82/571112582.db2.gz SXYKXBHZMBNBPP-CAPFRKAQSA-N 0 0 353.893 5.720 40 0 FKABRN O=C(/C=C/c1ccccc1)NCCSCc1c(Cl)cccc1Cl ZINC000409025433 571112885 /nfs/dbraw/zinc/11/28/85/571112885.db2.gz RDTGPDBDMWQNHO-MDZDMXLPSA-N 0 0 366.313 5.056 40 0 FKABRN Cc1ccccc1CSCCNC(=O)/C=C/c1ccc(C(C)(C)C)cc1 ZINC000409025908 570714354 /nfs/dbraw/zinc/71/43/54/570714354.db2.gz ABOABCYBUYUKLB-SDNWHVSQSA-N 0 0 367.558 5.355 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)NCc2ccc(Cl)cc2Cl)cc1 ZINC000409025962 571112422 /nfs/dbraw/zinc/11/24/22/571112422.db2.gz BXUIRQMRSNRHLH-IZZDOVSWSA-N 0 0 362.300 5.621 40 0 FKABRN C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCCSC1CCCCC1 ZINC000409026757 570714775 /nfs/dbraw/zinc/71/47/75/570714775.db2.gz XDKWBPOUSBWLLF-CYBMUJFWSA-N 0 0 357.972 5.003 40 0 FKABRN C[C@H](Sc1ccc(Cl)cc1)C(=O)NCCSC1CCCCC1 ZINC000409026758 570714831 /nfs/dbraw/zinc/71/48/31/570714831.db2.gz XDKWBPOUSBWLLF-ZDUSSCGKSA-N 0 0 357.972 5.003 40 0 FKABRN CC(C)(C)c1ccc(/C=C/C(=O)NCCSc2ccc(Cl)cc2)cc1 ZINC000409026781 570714700 /nfs/dbraw/zinc/71/47/00/570714700.db2.gz 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5.196 40 0 FKABRN CCCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(OC)cc1 ZINC000409094696 571133661 /nfs/dbraw/zinc/13/36/61/571133661.db2.gz FIDPFQRFSZCUPL-UHFFFAOYSA-N 0 0 373.909 5.489 40 0 FKABRN Cc1nnc(SCc2cccc(Cl)c2)n1-c1ccc(Cl)cc1 ZINC000409094734 571134066 /nfs/dbraw/zinc/13/40/66/571134066.db2.gz FSMOCFUYCMJRSG-UHFFFAOYSA-N 0 0 350.274 5.175 40 0 FKABRN CCn1c(SCCOc2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 ZINC000409095208 570721774 /nfs/dbraw/zinc/72/17/74/570721774.db2.gz AAUYSTPPEJHNRU-UHFFFAOYSA-N 0 0 373.909 5.098 40 0 FKABRN CCCCSc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1 ZINC000409095390 263525706 /nfs/dbraw/zinc/52/57/06/263525706.db2.gz HKCFUEVFRHRGGP-UHFFFAOYSA-N 0 0 357.910 5.404 40 0 FKABRN CC(C)Cn1c(Cc2ccccc2)nnc1SCc1cccc(Cl)c1 ZINC000409095499 570721622 /nfs/dbraw/zinc/72/16/22/570721622.db2.gz IBGOJIUNLCJCOD-UHFFFAOYSA-N 0 0 371.937 5.471 40 0 FKABRN Cc1cccc(-n2c(SCCc3ccccc3)nnc2-c2ccccc2)c1 ZINC000409095754 263525946 /nfs/dbraw/zinc/52/59/46/263525946.db2.gz IRTHIPDTYPECHY-UHFFFAOYSA-N 0 0 371.509 5.578 40 0 FKABRN Cc1ccc(COc2ccc(/C=C3\Sc4ccccc4NC3=O)cc2)cc1 ZINC000409095796 263525817 /nfs/dbraw/zinc/52/58/17/263525817.db2.gz ICYCDAMXBHRNAT-HMAPJEAMSA-N 0 0 373.477 5.659 40 0 FKABRN CCCn1c(SCc2cccc(F)c2)nnc1-c1ccc(Cl)cc1 ZINC000409095958 263525896 /nfs/dbraw/zinc/52/58/96/263525896.db2.gz JFBJBBVCKFABOP-UHFFFAOYSA-N 0 0 361.873 5.440 40 0 FKABRN CCCn1c(Cc2ccccc2)nnc1SCc1cccc(Cl)c1 ZINC000409095966 571134010 /nfs/dbraw/zinc/13/40/10/571134010.db2.gz IXNCQQGZDAWXGH-UHFFFAOYSA-N 0 0 357.910 5.225 40 0 FKABRN CCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(OCC)cc1 ZINC000409096007 263525645 /nfs/dbraw/zinc/52/56/45/263525645.db2.gz FDXSTDKNKYLBOF-UHFFFAOYSA-N 0 0 373.909 5.489 40 0 FKABRN CCCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(F)cc1 ZINC000409096232 263525314 /nfs/dbraw/zinc/52/53/14/263525314.db2.gz CVNUOQBNSBCULK-UHFFFAOYSA-N 0 0 361.873 5.619 40 0 FKABRN COc1ccc(-n2c(C)nnc2SCc2ccc3ccccc3c2)cc1 ZINC000409096317 263525902 /nfs/dbraw/zinc/52/59/02/263525902.db2.gz JNZUSFLIBHZLRJ-UHFFFAOYSA-N 0 0 361.470 5.030 40 0 FKABRN O=C1Nc2ccccc2S/C1=C\c1ccc(OCc2ccccc2)cc1 ZINC000409096662 571134025 /nfs/dbraw/zinc/13/40/25/571134025.db2.gz KVAQWADAYKEPIY-STZFKDTASA-N 0 0 359.450 5.351 40 0 FKABRN CCCCSc1nnc(Cc2ccccc2)n1-c1ccc(OCC)cc1 ZINC000409096727 571134001 /nfs/dbraw/zinc/13/40/01/571134001.db2.gz GLTFXTLBHNAAIV-UHFFFAOYSA-N 0 0 367.518 5.149 40 0 FKABRN Clc1ccc(-n2c(Sc3ccccn3)nnc2-c2ccccc2)cc1 ZINC000409096769 570723044 /nfs/dbraw/zinc/72/30/44/570723044.db2.gz LAHPTJMHXCAWCB-UHFFFAOYSA-N 0 0 364.861 5.134 40 0 FKABRN CCc1ccc(-n2c(SCc3ccccc3)nnc2-c2ccncc2)cc1 ZINC000409096797 570723190 /nfs/dbraw/zinc/72/31/90/570723190.db2.gz LBHBHKUKRBDGTC-UHFFFAOYSA-N 0 0 372.497 5.184 40 0 FKABRN CCCn1c(SCc2cccc3ccccc32)nnc1-c1ccccc1 ZINC000409097268 571133927 /nfs/dbraw/zinc/13/39/27/571133927.db2.gz LUWRPAKKOWEKMV-UHFFFAOYSA-N 0 0 359.498 5.801 40 0 FKABRN CCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(C)c(C)c1 ZINC000409097425 570722967 /nfs/dbraw/zinc/72/29/67/570722967.db2.gz NREQPPDSJYCBPM-UHFFFAOYSA-N 0 0 357.910 5.707 40 0 FKABRN O=C1Nc2ccccc2S/C1=C\c1ccccc1OCc1ccccc1 ZINC000409097749 570723689 /nfs/dbraw/zinc/72/36/89/570723689.db2.gz HFFKPUYBEKSXCV-STZFKDTASA-N 0 0 359.450 5.351 40 0 FKABRN CC(C)Cn1c(SCc2ccccc2Cl)nnc1-c1ccccc1 ZINC000409097991 570723552 /nfs/dbraw/zinc/72/35/52/570723552.db2.gz JTDXCZJKQBYLTL-UHFFFAOYSA-N 0 0 357.910 5.547 40 0 FKABRN Cc1nnc(SCc2ccc(Cl)c(Cl)c2)n1-c1cccc(C)c1 ZINC000409098385 571134019 /nfs/dbraw/zinc/13/40/19/571134019.db2.gz PTPDVAKFOLCLLM-UHFFFAOYSA-N 0 0 364.301 5.483 40 0 FKABRN CCCn1c(Cc2ccccc2)nnc1SCCCc1ccccc1 ZINC000409098421 571133988 /nfs/dbraw/zinc/13/39/88/571133988.db2.gz OSUHEVZAMBGYSB-UHFFFAOYSA-N 0 0 351.519 5.004 40 0 FKABRN CCCn1c(SCc2cccc(C)c2)nnc1-c1ccc(Cl)cc1 ZINC000409098581 570723463 /nfs/dbraw/zinc/72/34/63/570723463.db2.gz PIEVJSLYJOUVMP-UHFFFAOYSA-N 0 0 357.910 5.609 40 0 FKABRN Cc1nnc(SCc2ccc(Cl)cc2)n1-c1ccc(Cl)cc1 ZINC000409098599 571134305 /nfs/dbraw/zinc/13/43/05/571134305.db2.gz QTUOMCUDRWVEKO-UHFFFAOYSA-N 0 0 350.274 5.175 40 0 FKABRN Cc1cccc(CSc2nnc(-c3ccncc3)n2-c2cccc(C)c2)c1 ZINC000409098896 571134259 /nfs/dbraw/zinc/13/42/59/571134259.db2.gz MOICBMLOSSDFOW-UHFFFAOYSA-N 0 0 372.497 5.238 40 0 FKABRN CC(=O)c1ccc(-c2ccc(C=C3Sc4ccccc4NC3=O)o2)cc1 ZINC000409098964 571134214 /nfs/dbraw/zinc/13/42/14/571134214.db2.gz NADHIKZNWZBYEZ-NDENLUEZSA-N 0 0 361.422 5.235 40 0 FKABRN CCc1ccc(-n2c(C)nnc2SCc2ccc3ccccc3c2)cc1 ZINC000409098973 571134271 /nfs/dbraw/zinc/13/42/71/571134271.db2.gz NBTHSVSDAGBSGS-UHFFFAOYSA-N 0 0 359.498 5.584 40 0 FKABRN CCCn1c(SCCCc2ccccc2)nnc1-c1ccc(Cl)cc1 ZINC000409099525 571134237 /nfs/dbraw/zinc/13/42/37/571134237.db2.gz TYTWGWMSGBKEJR-UHFFFAOYSA-N 0 0 371.937 5.733 40 0 FKABRN Cc1nnc(SCc2cccc3ccccc32)n1-c1ccc(Cl)cc1 ZINC000409099608 570724055 /nfs/dbraw/zinc/72/40/55/570724055.db2.gz OTMVGKSKFJYDGT-UHFFFAOYSA-N 0 0 365.889 5.675 40 0 FKABRN CCCn1c(SCc2ccc(F)cc2)nnc1-c1ccc(Cl)cc1 ZINC000409099644 570723896 /nfs/dbraw/zinc/72/38/96/570723896.db2.gz RPORWBSQYHNLHK-UHFFFAOYSA-N 0 0 361.873 5.440 40 0 FKABRN Cc1ccc(CSc2nnc(-c3ccccc3)n2-c2cccc(C)c2)cc1 ZINC000409099682 571134292 /nfs/dbraw/zinc/13/42/92/571134292.db2.gz SAABYXAHJBFJEQ-UHFFFAOYSA-N 0 0 371.509 5.843 40 0 FKABRN c1ccc(CCSc2nnc(-c3ccccc3)n2-c2ccccc2)cc1 ZINC000409099988 570724095 /nfs/dbraw/zinc/72/40/95/570724095.db2.gz SPRZSHNJGDSCLM-UHFFFAOYSA-N 0 0 357.482 5.269 40 0 FKABRN O=C1Nc2ccccc2S/C1=C\c1cccn1-c1ccc(Cl)cc1 ZINC000409100379 570723957 /nfs/dbraw/zinc/72/39/57/570723957.db2.gz UVMPESLWFJKOTO-PDGQHHTCSA-N 0 0 352.846 5.216 40 0 FKABRN CC(C)Cn1c(SCc2cccc3ccccc32)nnc1-c1ccccc1 ZINC000409100782 570724070 /nfs/dbraw/zinc/72/40/70/570724070.db2.gz WQVSNDSUZJVDRE-UHFFFAOYSA-N 0 0 373.525 6.047 40 0 FKABRN O=C1Nc2ccccc2S/C1=C\c1ccc(-c2ccc(Cl)cc2)o1 ZINC000409100872 570724005 /nfs/dbraw/zinc/72/40/05/570724005.db2.gz VQPBSNFFAHXIDQ-WQRHYEAKSA-N 0 0 353.830 5.685 40 0 FKABRN CCCn1c(Cc2ccccc2)nnc1SCc1ccc(Cl)cc1 ZINC000409101113 570724392 /nfs/dbraw/zinc/72/43/92/570724392.db2.gz VLQNNNHAHJCVFU-UHFFFAOYSA-N 0 0 357.910 5.225 40 0 FKABRN CCCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(C)c(C)c1 ZINC000409101315 571134326 /nfs/dbraw/zinc/13/43/26/571134326.db2.gz SOSINIAXSCPBBV-UHFFFAOYSA-N 0 0 371.937 6.097 40 0 FKABRN Cc1ccc(CSc2nnc(-c3ccc(Cl)cc3)n2CC(C)C)cc1 ZINC000409101710 571134287 /nfs/dbraw/zinc/13/42/87/571134287.db2.gz QQQCGAXLCPLDCR-UHFFFAOYSA-N 0 0 371.937 5.855 40 0 FKABRN CCCn1c(SCc2ccccc2F)nnc1-c1ccc(Cl)cc1 ZINC000409101751 570724267 /nfs/dbraw/zinc/72/42/67/570724267.db2.gz QYVLAMBSEMLDPW-UHFFFAOYSA-N 0 0 361.873 5.440 40 0 FKABRN CC(C)Cn1c(SCCc2ccccc2)nnc1-c1ccc(Cl)cc1 ZINC000409102055 570724503 /nfs/dbraw/zinc/72/45/03/570724503.db2.gz ZRPDQSPLNGOMER-UHFFFAOYSA-N 0 0 371.937 5.589 40 0 FKABRN Cc1ccc(CSc2nnc(Cc3ccccc3)n2-c2ccccc2)cc1 ZINC000409102128 571134203 /nfs/dbraw/zinc/13/42/03/571134203.db2.gz YARPNNMYTXOFGL-UHFFFAOYSA-N 0 0 371.509 5.459 40 0 FKABRN CC(C)Cn1c(SCCCc2ccccc2)nnc1-c1ccccc1 ZINC000409102217 571134294 /nfs/dbraw/zinc/13/42/94/571134294.db2.gz VHXGHRQKGYZBFT-UHFFFAOYSA-N 0 0 351.519 5.326 40 0 FKABRN CCn1c2ccccc2c2cc(/C=C3\Sc4ccccc4NC3=O)ccc21 ZINC000409102673 571134281 /nfs/dbraw/zinc/13/42/81/571134281.db2.gz VVHXRYOFMGNBDE-HMAPJEAMSA-N 0 0 370.477 5.900 40 0 FKABRN CC(C)Cn1c(SCc2ccc(Cl)cc2)nnc1-c1ccccc1 ZINC000409102715 570724825 /nfs/dbraw/zinc/72/48/25/570724825.db2.gz ZKNUPEPGCLBGPX-UHFFFAOYSA-N 0 0 357.910 5.547 40 0 FKABRN CCCn1c(SCCc2ccccc2)nnc1-c1ccc(Cl)cc1 ZINC000409102895 570724684 /nfs/dbraw/zinc/72/46/84/570724684.db2.gz WMHYMQYTNRYZFN-UHFFFAOYSA-N 0 0 357.910 5.343 40 0 FKABRN c1ccc(CCSc2nnc(Cc3ccccc3)n2-c2ccccc2)cc1 ZINC000409102946 570724859 /nfs/dbraw/zinc/72/48/59/570724859.db2.gz WVAMXGUGJYECEA-UHFFFAOYSA-N 0 0 371.509 5.193 40 0 FKABRN Cc1cccc(CSc2nnc(-c3ccccc3)n2-c2cccc(C)c2)c1 ZINC000409103134 570724900 /nfs/dbraw/zinc/72/49/00/570724900.db2.gz AXVFEEYOGLTQKW-UHFFFAOYSA-N 0 0 371.509 5.843 40 0 FKABRN CCCn1c(Cc2ccccc2)nnc1SCc1ccccc1Cl ZINC000409103228 570724852 /nfs/dbraw/zinc/72/48/52/570724852.db2.gz FZBHQCCXDJNKSE-UHFFFAOYSA-N 0 0 357.910 5.225 40 0 FKABRN O=C1Nc2ccccc2S/C1=C\c1ccc(-c2cccc(Cl)c2)o1 ZINC000409103372 571134296 /nfs/dbraw/zinc/13/42/96/571134296.db2.gz BGECOJOILCDOAC-WQRHYEAKSA-N 0 0 353.830 5.685 40 0 FKABRN Cc1ccc(OCCSc2nnc(-c3ccccc3)n2CC(C)C)cc1 ZINC000409103665 570722483 /nfs/dbraw/zinc/72/24/83/570722483.db2.gz AZISHNJVJWREQI-UHFFFAOYSA-N 0 0 367.518 5.081 40 0 FKABRN CC(C)Cn1c(Cc2ccccc2)nnc1SCc1ccc(Cl)cc1 ZINC000409103928 570722410 /nfs/dbraw/zinc/72/24/10/570722410.db2.gz ZUPMYTBCTNIMRH-UHFFFAOYSA-N 0 0 371.937 5.471 40 0 FKABRN CCN1C(=O)S/C(=C/c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C1=O ZINC000409103984 570722522 /nfs/dbraw/zinc/72/25/22/570722522.db2.gz XURJPCJKPDIILH-RVDMUPIBSA-N 0 0 361.507 5.043 40 0 FKABRN Clc1ccc(-c2nnc(Sc3ccccn3)n2-c2ccccc2)cc1 ZINC000409104798 570722533 /nfs/dbraw/zinc/72/25/33/570722533.db2.gz FNABKPLRMKMBEQ-UHFFFAOYSA-N 0 0 364.861 5.134 40 0 FKABRN Cc1ccc(Sc2ccc(/C=C3\Sc4ccccc4NC3=O)o2)cc1 ZINC000409104884 571134522 /nfs/dbraw/zinc/13/45/22/571134522.db2.gz KRLJUSWCQOSVAW-PDGQHHTCSA-N 0 0 365.479 5.825 40 0 FKABRN O=C1Nc2ccccc2S/C1=C\c1cccc(OCc2ccccc2)c1 ZINC000409105177 571134574 /nfs/dbraw/zinc/13/45/74/571134574.db2.gz HBTMCZMBWKOWOX-STZFKDTASA-N 0 0 359.450 5.351 40 0 FKABRN CC(C)Cn1c(Cc2ccccc2)nnc1SCCCc1ccccc1 ZINC000409105657 571134516 /nfs/dbraw/zinc/13/45/16/571134516.db2.gz JZPVAYXYCZOIQP-UHFFFAOYSA-N 0 0 365.546 5.250 40 0 FKABRN CCCCSc1nnc(-c2ccc(Cl)cc2)n1-c1cccc(C)c1 ZINC000409105748 263526579 /nfs/dbraw/zinc/52/65/79/263526579.db2.gz KHQHILPNDWHTHO-UHFFFAOYSA-N 0 0 357.910 5.788 40 0 FKABRN CCCCSc1nnc(Cc2ccccc2)n1-c1ccc(CC)cc1 ZINC000409105874 570726513 /nfs/dbraw/zinc/72/65/13/570726513.db2.gz JMVDUCYYPPLCPL-UHFFFAOYSA-N 0 0 351.519 5.313 40 0 FKABRN CCCn1c(SCCOc2ccccc2Cl)nnc1-c1ccccc1 ZINC000409105889 570726468 /nfs/dbraw/zinc/72/64/68/570726468.db2.gz PBPUOQXUZUIDJO-UHFFFAOYSA-N 0 0 373.909 5.180 40 0 FKABRN CCOc1ccc(-n2c(SCC)nnc2-c2ccc(Cl)cc2)cc1 ZINC000409106004 263526834 /nfs/dbraw/zinc/52/68/34/263526834.db2.gz LRLCAIBHHOPLTB-UHFFFAOYSA-N 0 0 359.882 5.098 40 0 FKABRN Cc1cccc(CSc2nnc(-c3ccc(Cl)cc3)n2CC(C)C)c1 ZINC000409106107 571134612 /nfs/dbraw/zinc/13/46/12/571134612.db2.gz MIXYUYVAQJYJGV-UHFFFAOYSA-N 0 0 371.937 5.855 40 0 FKABRN Cc1ccc(Cl)cc1-c1ccc(/C=C2\Sc3ccccc3NC2=O)o1 ZINC000409106429 571134810 /nfs/dbraw/zinc/13/48/10/571134810.db2.gz NEHMVAAIRSVGCK-ODLFYWEKSA-N 0 0 367.857 5.994 40 0 FKABRN CCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(CC)cc1 ZINC000409106572 570726592 /nfs/dbraw/zinc/72/65/92/570726592.db2.gz OCGBZPKTCXNPAZ-UHFFFAOYSA-N 0 0 357.910 5.652 40 0 FKABRN CCCCSc1nnc(-c2ccccc2)n1-c1ccc(OCC)cc1 ZINC000409106599 571134772 /nfs/dbraw/zinc/13/47/72/571134772.db2.gz OEDOEVIJNUQVPB-UHFFFAOYSA-N 0 0 353.491 5.225 40 0 FKABRN O=C1Nc2ccccc2S/C1=C\c1ccc(Sc2ccccc2)o1 ZINC000409106661 571134815 /nfs/dbraw/zinc/13/48/15/571134815.db2.gz OPWYUBYBPCMNOA-ATVHPVEESA-N 0 0 351.452 5.516 40 0 FKABRN COc1ccc(-n2c(C)nnc2SCc2cccc3ccccc32)cc1 ZINC000409106764 263527061 /nfs/dbraw/zinc/52/70/61/263527061.db2.gz UEPZPTALYGWAHU-UHFFFAOYSA-N 0 0 361.470 5.030 40 0 FKABRN CC(C)Cn1c(SCc2ccc3ccccc3c2)nnc1-c1ccncc1 ZINC000409106803 571134768 /nfs/dbraw/zinc/13/47/68/571134768.db2.gz MVFURPHJRJUBOX-UHFFFAOYSA-N 0 0 374.513 5.442 40 0 FKABRN Cc1ccc(CSc2nnc(Cc3ccccc3)n2CC(C)C)cc1 ZINC000409106834 570726624 /nfs/dbraw/zinc/72/66/24/570726624.db2.gz OSHXAHXQROMZPZ-UHFFFAOYSA-N 0 0 351.519 5.126 40 0 FKABRN Cc1ccc(-n2c(Sc3ccccn3)nnc2-c2ccccc2)cc1C ZINC000409107123 263527074 /nfs/dbraw/zinc/52/70/74/263527074.db2.gz VDXNFYDCKXBVDD-UHFFFAOYSA-N 0 0 358.470 5.097 40 0 FKABRN Cc1cccc(-n2c(SCc3ccccc3)nnc2-c2ccccc2)c1 ZINC000409107779 571134569 /nfs/dbraw/zinc/13/45/69/571134569.db2.gz QKZBPDUPRORLHS-UHFFFAOYSA-N 0 0 357.482 5.535 40 0 FKABRN Cc1cccc(CSc2nnc(Cc3ccccc3)n2-c2ccccc2)c1 ZINC000409108214 571134634 /nfs/dbraw/zinc/13/46/34/571134634.db2.gz VTFVWAZRAHBQAT-UHFFFAOYSA-N 0 0 371.509 5.459 40 0 FKABRN Cc1nnc(SCc2ccc3ccccc3c2)n1-c1ccc(C)c(C)c1 ZINC000409108255 263526401 /nfs/dbraw/zinc/52/64/01/263526401.db2.gz SVELWGCRGKTHGE-UHFFFAOYSA-N 0 0 359.498 5.638 40 0 FKABRN CCCCSc1nnc(Cc2ccccc2)n1-c1ccc(C)c(C)c1 ZINC000409108353 570727100 /nfs/dbraw/zinc/72/71/00/570727100.db2.gz WITYAHKEDMEKKE-UHFFFAOYSA-N 0 0 351.519 5.367 40 0 FKABRN CCc1ccc(-n2c(C)nnc2SCc2cccc3ccccc32)cc1 ZINC000409108359 570726923 /nfs/dbraw/zinc/72/69/23/570726923.db2.gz WORWBPCGZSVBRF-UHFFFAOYSA-N 0 0 359.498 5.584 40 0 FKABRN CCCn1c(Cc2ccccc2)nnc1SCc1cccc2ccccc21 ZINC000409108854 570727279 /nfs/dbraw/zinc/72/72/79/570727279.db2.gz YGUIBFFDGFPCIY-UHFFFAOYSA-N 0 0 373.525 5.724 40 0 FKABRN CC(C)Cn1c(SCc2cccc3ccccc32)nnc1-c1ccncc1 ZINC000409109087 570724743 /nfs/dbraw/zinc/72/47/43/570724743.db2.gz XOVBJQANCJEHCL-UHFFFAOYSA-N 0 0 374.513 5.442 40 0 FKABRN CC(C)Cn1c(SCc2ccc3ccccc3c2)nnc1-c1ccccc1 ZINC000409109170 571134841 /nfs/dbraw/zinc/13/48/41/571134841.db2.gz ZBUIXPZZCMOUOS-UHFFFAOYSA-N 0 0 373.525 6.047 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3cccc(Cl)c3)cc2)c(C)c1 ZINC000409109265 570724774 /nfs/dbraw/zinc/72/47/74/570724774.db2.gz AREOIRDVOWJKEH-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCOc1cc(CNc2cc(Cl)ccc2C)cc(Br)c1O ZINC000409109318 571134830 /nfs/dbraw/zinc/13/48/30/571134830.db2.gz BPNDGVRCHNBPPD-UHFFFAOYSA-N 0 0 370.674 5.127 40 0 FKABRN CCOc1ccc(CNc2cccc(Cl)c2C)cc1Br ZINC000409109440 570725208 /nfs/dbraw/zinc/72/52/08/570725208.db2.gz DXPFGMCHNAVLGY-UHFFFAOYSA-N 0 0 354.675 5.422 40 0 FKABRN CCc1ccccc1NCc1cc(Cl)ccc1OCc1ccc(C)cc1 ZINC000409109484 570725184 /nfs/dbraw/zinc/72/51/84/570725184.db2.gz FXEXIYSXCUXHQK-UHFFFAOYSA-N 0 0 365.904 6.402 40 0 FKABRN Cc1ccc(COc2ccccc2CNc2cccc(Cl)c2C)cc1 ZINC000409109547 571134825 /nfs/dbraw/zinc/13/48/25/571134825.db2.gz HBVBYXNKVQJTMT-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCCN1c2ccccc2/C(=C/c2ccc(OC)c3cccc(OC)c23)C1=O ZINC000409109573 571134744 /nfs/dbraw/zinc/13/47/44/571134744.db2.gz HLQNWCOLHLLASV-CYVLTUHYSA-N 0 0 373.452 5.154 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3Cl)cc2)c(C)c1 ZINC000409109589 263526395 /nfs/dbraw/zinc/52/63/95/263526395.db2.gz HUAPTNLMPYNCHK-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3cccc(Cl)c3)c2)c(C)c1 ZINC000409109600 571134860 /nfs/dbraw/zinc/13/48/60/571134860.db2.gz IAVUWYFCODBMSR-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCCN1C(=O)/C(=C\c2cc(Cl)cc(Cl)c2OC)c2ccccc21 ZINC000409109608 263527057 /nfs/dbraw/zinc/52/70/57/263527057.db2.gz IBWOGEZLKUVMEJ-GDNBJRDFSA-N 0 0 362.256 5.299 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3cccc4ccccc43)cc2)cc1 ZINC000409109636 570725149 /nfs/dbraw/zinc/72/51/49/570725149.db2.gz IMLXCPKLSBGGKT-UHFFFAOYSA-N 0 0 367.492 6.593 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2cccc(F)c2)c(OC)c1 ZINC000409109650 571134877 /nfs/dbraw/zinc/13/48/77/571134877.db2.gz ITADGZVTAZOBHQ-UHFFFAOYSA-N 0 0 365.448 5.588 40 0 FKABRN CCOc1cc(CNc2cccc(C)c2C)ccc1OCc1ccccc1 ZINC000409109724 263526588 /nfs/dbraw/zinc/52/65/88/263526588.db2.gz JWUQRBDIUGOEFM-UHFFFAOYSA-N 0 0 361.485 5.893 40 0 FKABRN CCc1ccc(NCc2ccccc2OCc2ccccc2Cl)cc1 ZINC000409109777 571135093 /nfs/dbraw/zinc/13/50/93/571135093.db2.gz LFEVZAOKZYDHFQ-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3cccc4ccccc43)cc2)c(C)c1 ZINC000409109831 570725317 /nfs/dbraw/zinc/72/53/17/570725317.db2.gz MGYAWOSSLCERAK-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN COc1cc(CNc2cc(C)ccc2C)ccc1OCc1ccc(F)cc1 ZINC000409109857 263527440 /nfs/dbraw/zinc/52/74/40/263527440.db2.gz MVEAELWVRZCUGW-UHFFFAOYSA-N 0 0 365.448 5.642 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3F)cc2)cc1Cl ZINC000409109873 263528281 /nfs/dbraw/zinc/52/82/81/263528281.db2.gz NBBGMXSRQUKHHO-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccc(OCc2cccc(F)c2)cc1 ZINC000409109912 570725204 /nfs/dbraw/zinc/72/52/04/570725204.db2.gz NTGWZKAKAQXLNN-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccccc1OCc1cccc(Cl)c1 ZINC000409109985 571135063 /nfs/dbraw/zinc/13/50/63/571135063.db2.gz OZNRXHGNSBQLKZ-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2cccc(F)c2)c(C)c1 ZINC000409109989 570725263 /nfs/dbraw/zinc/72/52/63/570725263.db2.gz PAYUMXMVWUHAFW-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2ccc(Cl)cc2)c(C)c1 ZINC000409109997 571135056 /nfs/dbraw/zinc/13/50/56/571135056.db2.gz PDYFNJSSUFYEOL-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccccc1NCc1c(OCc2ccc(F)cc2)ccc2ccccc21 ZINC000409109998 263528030 /nfs/dbraw/zinc/52/80/30/263528030.db2.gz PEPNTSSXBPZYBW-UHFFFAOYSA-N 0 0 371.455 6.478 40 0 FKABRN Cc1ccc(C)c(NCc2ccccc2OCc2ccc(Cl)cc2)c1 ZINC000409110025 571135079 /nfs/dbraw/zinc/13/50/79/571135079.db2.gz PTFYGUMWZQZBCE-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Brc1ccc(COc2cccc(CNc3ccccc3)c2)cc1 ZINC000409110048 263527754 /nfs/dbraw/zinc/52/77/54/263527754.db2.gz QHMZZKASLRECCB-UHFFFAOYSA-N 0 0 368.274 5.640 40 0 FKABRN Cc1ccc(C)c(NCc2ccc(OCc3cccc(Cl)c3)cc2)c1 ZINC000409110051 571135036 /nfs/dbraw/zinc/13/50/36/571135036.db2.gz QIKMNXLDZBGPPM-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3ccc(Cl)cc3)c(Cl)c2)c1 ZINC000409110065 571135026 /nfs/dbraw/zinc/13/50/26/571135026.db2.gz QPCAHEAPLNWDQY-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCCN1c2ccccc2/C(=C/c2ccccc2OCc2ccccc2)C1=O ZINC000409110104 571135031 /nfs/dbraw/zinc/13/50/31/571135031.db2.gz RIGWNUIFUMETHN-XLNRJJMWSA-N 0 0 369.464 5.563 40 0 FKABRN COc1cc(CNc2ccccc2C)ccc1OCc1ccc(F)cc1 ZINC000409110114 263527609 /nfs/dbraw/zinc/52/76/09/263527609.db2.gz RLHNWVOOPQJEFJ-UHFFFAOYSA-N 0 0 351.421 5.334 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3ccccc3F)c(Cl)c2)c1 ZINC000409110123 571135117 /nfs/dbraw/zinc/13/51/17/571135117.db2.gz RRJHLSKKCPCDAY-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Fc1cccc(COc2ccc3ccccc3c2CNc2ccccc2)c1 ZINC000409110136 570725223 /nfs/dbraw/zinc/72/52/23/570725223.db2.gz SDZYLSUWTVEYKX-UHFFFAOYSA-N 0 0 357.428 6.170 40 0 FKABRN CCOc1ccc(NCc2ccc(OCc3ccc(Cl)cc3)cc2)cc1 ZINC000409110194 570725253 /nfs/dbraw/zinc/72/52/53/570725253.db2.gz UDAMNFPZIADHFS-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN CCc1ccc(NCc2ccccc2OCc2ccc(Cl)cc2)cc1 ZINC000409110201 263527758 /nfs/dbraw/zinc/52/77/58/263527758.db2.gz UETOYFBMKMGBPF-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3ccc(C)cc3)c(Cl)c2)cc1 ZINC000409110224 263528155 /nfs/dbraw/zinc/52/81/55/263528155.db2.gz UNENVPPLSJNDNF-UHFFFAOYSA-N 0 0 365.904 6.402 40 0 FKABRN Cc1c(Cl)cccc1NCc1cccc(OCc2ccccc2Cl)c1 ZINC000409110260 570725179 /nfs/dbraw/zinc/72/51/79/570725179.db2.gz ALDQUZUYYQCNAJ-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3ccccc3Cl)cc2)c1C ZINC000409110279 571135040 /nfs/dbraw/zinc/13/50/40/571135040.db2.gz AVJZHLIYKMLQKM-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCOc1cc(CNc2cccc(C)c2)ccc1OCc1ccc(F)cc1 ZINC000409110288 263528203 /nfs/dbraw/zinc/52/82/03/263528203.db2.gz BAFOUKZHPDXJQK-UHFFFAOYSA-N 0 0 365.448 5.724 40 0 FKABRN CCCN1c2ccccc2/C(=C/c2cc(C(C)C)c(OCC)cc2C)C1=O ZINC000409110316 571135071 /nfs/dbraw/zinc/13/50/71/571135071.db2.gz BNWQVPMJDLHJAL-QNGOZBTKSA-N 0 0 363.501 5.814 40 0 FKABRN CCc1ccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)cc1 ZINC000409110415 571135035 /nfs/dbraw/zinc/13/50/35/571135035.db2.gz BVCYXFSBNXKDIO-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN Cc1ccccc1NCc1ccc(OCc2cccc3ccccc32)cc1 ZINC000409110428 571135057 /nfs/dbraw/zinc/13/50/57/571135057.db2.gz VZKGOSGYPXZTEL-UHFFFAOYSA-N 0 0 353.465 6.339 40 0 FKABRN CCc1ccc(NCc2cc(Cl)ccc2OCc2cccc(F)c2)cc1 ZINC000409110451 571135042 /nfs/dbraw/zinc/13/50/42/571135042.db2.gz CERURVFUCQNJIL-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN Cc1ccc(Cl)cc1NCc1cccc(OCc2ccc(F)cc2)c1 ZINC000409110472 570725257 /nfs/dbraw/zinc/72/52/57/570725257.db2.gz WHPJPBONRCDWDP-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCOc1cc(CNc2ccc(CC)cc2)ccc1OCc1ccccc1 ZINC000409110476 571135107 /nfs/dbraw/zinc/13/51/07/571135107.db2.gz CJVOEHTWTHAWKY-UHFFFAOYSA-N 0 0 361.485 5.839 40 0 FKABRN COc1cc(CNc2cccc(C)c2)ccc1OCc1cccc(F)c1 ZINC000409110534 571135039 /nfs/dbraw/zinc/13/50/39/571135039.db2.gz DRAXLLMIMGYSHT-UHFFFAOYSA-N 0 0 351.421 5.334 40 0 FKABRN Cc1ccc(Cl)cc1NCc1cccc(OCc2ccc(Cl)cc2)c1 ZINC000409110551 263528014 /nfs/dbraw/zinc/52/80/14/263528014.db2.gz WJTRFKRSHIORPR-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2ccc(C)cc2)c(OC)c1 ZINC000409110585 571135045 /nfs/dbraw/zinc/13/50/45/571135045.db2.gz FFVZLIZLWRSEEQ-UHFFFAOYSA-N 0 0 361.485 5.757 40 0 FKABRN Cc1ccc(COc2ccc3ccccc3c2CNc2cccc(C)c2)cc1 ZINC000409110639 571135072 /nfs/dbraw/zinc/13/50/72/571135072.db2.gz FOSTVNCMDNWNAR-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN Cc1ccc(Cl)cc1NCc1ccc(OCc2ccccc2)c(Cl)c1 ZINC000409110669 571135068 /nfs/dbraw/zinc/13/50/68/571135068.db2.gz XPTODPDLOGMIJN-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2ccccc2F)c(OC)c1 ZINC000409110675 570725146 /nfs/dbraw/zinc/72/51/46/570725146.db2.gz FVLOYRDEQCNPDT-UHFFFAOYSA-N 0 0 365.448 5.588 40 0 FKABRN Cc1ccccc1NCc1c(OCc2ccccc2)ccc2ccccc21 ZINC000409110695 570725152 /nfs/dbraw/zinc/72/51/52/570725152.db2.gz FYISREXVOKTSCH-UHFFFAOYSA-N 0 0 353.465 6.339 40 0 FKABRN CCCN1c2ccccc2/C(=C/c2ccc(OCc3ccccc3)cc2)C1=O ZINC000409110703 571135109 /nfs/dbraw/zinc/13/51/09/571135109.db2.gz FZQJZBGMJLTCOD-QJOMJCCJSA-N 0 0 369.464 5.563 40 0 FKABRN CCCOc1ccc(Cl)cc1CNc1ccc(Oc2ccccc2)cc1 ZINC000409110712 570725219 /nfs/dbraw/zinc/72/52/19/570725219.db2.gz GCCJMZDKAHYACQ-UHFFFAOYSA-N 0 0 367.876 6.533 40 0 FKABRN CCCSc1nc2sc(CCC)c(C)c2c(=O)n1-c1ccccc1 ZINC000409110713 570725270 /nfs/dbraw/zinc/72/52/70/570725270.db2.gz YBGGSDWARYSXBF-UHFFFAOYSA-N 0 0 358.532 5.210 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3cccc(Cl)c3)cc2)cc1 ZINC000409110764 263527880 /nfs/dbraw/zinc/52/78/80/263527880.db2.gz GOJDXZNCFVCWTF-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccccc1OCc1ccccc1Cl ZINC000409110816 571135046 /nfs/dbraw/zinc/13/50/46/571135046.db2.gz AFKBMLNPMIQRSO-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(C)c(NCc2cc(Cl)ccc2OCc2ccccc2)c1 ZINC000409110820 263527821 /nfs/dbraw/zinc/52/78/21/263527821.db2.gz AGNKHOZMYJIDFU-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(COc2ccc(CNc3ccccc3C)cc2Cl)cc1 ZINC000409110833 571135082 /nfs/dbraw/zinc/13/50/82/571135082.db2.gz YYPKMIUIACACHH-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1cccc(NCc2cc(Cl)ccc2OCc2ccc(Cl)cc2)c1 ZINC000409110862 570725307 /nfs/dbraw/zinc/72/53/07/570725307.db2.gz HHYKHMJYBXMUJJ-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccc(CNc3cc(Cl)ccc3C)cc2)cc1 ZINC000409110895 570725321 /nfs/dbraw/zinc/72/53/21/570725321.db2.gz ZKIFUFBYERNWBU-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccccc1NCc1cc(Cl)ccc1OCc1ccccc1F ZINC000409110951 263527889 /nfs/dbraw/zinc/52/78/89/263527889.db2.gz HNEDGDUDVBIXDK-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccccc1OCc1ccc(Cl)cc1 ZINC000409110956 571134887 /nfs/dbraw/zinc/13/48/87/571134887.db2.gz ZUURTPYESIOQFD-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCOc1ccc(NCc2ccccc2OCc2cccc(Cl)c2)cc1 ZINC000409110973 570725131 /nfs/dbraw/zinc/72/51/31/570725131.db2.gz HQAOZICGCHRJPN-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN COc1cc(CNc2ccc(C)cc2C)ccc1OCc1ccccc1F ZINC000409110992 263528065 /nfs/dbraw/zinc/52/80/65/263528065.db2.gz ADHSWPMLXRUQSF-UHFFFAOYSA-N 0 0 365.448 5.642 40 0 FKABRN CCCCSc1nc2sc(CCC)c(C)c2c(=O)n1-c1ccccc1 ZINC000409111008 571135065 /nfs/dbraw/zinc/13/50/65/571135065.db2.gz AFSFSRSDDLNHAH-UHFFFAOYSA-N 0 0 372.559 5.600 40 0 FKABRN CCOc1cc(CNc2cc(C)ccc2C)cc(Br)c1OC ZINC000409111015 571135032 /nfs/dbraw/zinc/13/50/32/571135032.db2.gz ZZHDVSMJXVUMLW-UHFFFAOYSA-N 0 0 364.283 5.085 40 0 FKABRN Clc1ccc(OCc2cccc3ccccc32)c(CNc2ccccc2)c1 ZINC000409111022 263527870 /nfs/dbraw/zinc/52/78/70/263527870.db2.gz AODWSBGKDHVJLT-UHFFFAOYSA-N 0 0 373.883 6.684 40 0 FKABRN CCOc1cc(CNc2ccc(CC)cc2)cc(Br)c1OC ZINC000409111082 263527618 /nfs/dbraw/zinc/52/76/18/263527618.db2.gz BNZSBHKSRJKUIU-UHFFFAOYSA-N 0 0 364.283 5.031 40 0 FKABRN Cc1cccc(NCc2c(OCc3ccc(F)cc3)ccc3ccccc32)c1 ZINC000409111173 571135334 /nfs/dbraw/zinc/13/53/34/571135334.db2.gz BJAQEMZYILHSHG-UHFFFAOYSA-N 0 0 371.455 6.478 40 0 FKABRN CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)Nc4ccccc43)c2c1 ZINC000409111174 571135363 /nfs/dbraw/zinc/13/53/63/571135363.db2.gz ARGUUGDAFAGYLQ-ZHZULCJRSA-N 0 0 359.425 5.130 40 0 FKABRN CCc1ccccc1NCc1ccccc1OCc1ccc(Cl)cc1 ZINC000409111185 571135274 /nfs/dbraw/zinc/13/52/74/571135274.db2.gz ARVSXSWHKYEFKG-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1cccc(NCc2c(OCc3cccc(F)c3)ccc3ccccc32)c1 ZINC000409111203 571135352 /nfs/dbraw/zinc/13/53/52/571135352.db2.gz BMGGTBLABGWKEN-UHFFFAOYSA-N 0 0 371.455 6.478 40 0 FKABRN CCOc1cc(CNc2ccccc2CC)cc(Br)c1OC ZINC000409111208 263528285 /nfs/dbraw/zinc/52/82/85/263528285.db2.gz BMJGZZMURXGBAJ-UHFFFAOYSA-N 0 0 364.283 5.031 40 0 FKABRN CCc1ccccc1NCc1cc(Cl)ccc1OCc1cccc(F)c1 ZINC000409111230 570725698 /nfs/dbraw/zinc/72/56/98/570725698.db2.gz BNCPOOYJXODQNT-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN COc1cc(CNc2ccccc2C)ccc1OCc1cccc(F)c1 ZINC000409111319 571135325 /nfs/dbraw/zinc/13/53/25/571135325.db2.gz HWGVHCIIFILXEB-UHFFFAOYSA-N 0 0 351.421 5.334 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccc(F)cc3)cc2)cc1Cl ZINC000409111322 571135317 /nfs/dbraw/zinc/13/53/17/571135317.db2.gz HXDFVTAQBBNJTJ-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCc1ccccc1NCc1ccccc1OCc1ccccc1Cl ZINC000409111345 571135291 /nfs/dbraw/zinc/13/52/91/571135291.db2.gz IIEPYKHZFHDFRN-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1ccccc1NCc1cc(Cl)ccc1OCc1ccccc1Cl ZINC000409111347 571135369 /nfs/dbraw/zinc/13/53/69/571135369.db2.gz IJSGQBVCZHNGEO-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCOc1cc(/C=C2\C(=O)Nc3ccccc32)ccc1OCc1ccccc1 ZINC000409111392 570725746 /nfs/dbraw/zinc/72/57/46/570725746.db2.gz CLCNSKKZRIIQTN-ZHZULCJRSA-N 0 0 371.436 5.157 40 0 FKABRN CCOc1ccc(Br)cc1CNc1cccc(Cl)c1C ZINC000409111440 570725694 /nfs/dbraw/zinc/72/56/94/570725694.db2.gz IRLGROYMDNOCTJ-UHFFFAOYSA-N 0 0 354.675 5.422 40 0 FKABRN CCCOc1c(Cl)cc(CNc2cccc(Cl)c2C)cc1OC ZINC000409111453 263527389 /nfs/dbraw/zinc/52/73/89/263527389.db2.gz CUSVYAPMBIMYCB-UHFFFAOYSA-N 0 0 354.277 5.711 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2ccccc2Cl)cc1 ZINC000409111479 570725784 /nfs/dbraw/zinc/72/57/84/570725784.db2.gz IXVRMVMTWYGKMU-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN CCOc1ccc(CNc2cc(Cl)ccc2C)cc1Br ZINC000409111482 570725787 /nfs/dbraw/zinc/72/57/87/570725787.db2.gz CYTQMWBBAFVKRA-UHFFFAOYSA-N 0 0 354.675 5.422 40 0 FKABRN CCc1ccccc1NCc1cccc(OCc2cccc(Cl)c2)c1 ZINC000409111493 570725763 /nfs/dbraw/zinc/72/57/63/570725763.db2.gz CLYKJICKVCVPKJ-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2ccccc2F)c(Cl)c1 ZINC000409111515 263527512 /nfs/dbraw/zinc/52/75/12/263527512.db2.gz JEHIICXRAWMWED-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3cccc4ccccc43)c2)cc1C ZINC000409111548 263528274 /nfs/dbraw/zinc/52/82/74/263528274.db2.gz JGXGWGJHGDWWKW-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN CCc1ccccc1NCc1cc(Cl)ccc1OCc1ccccc1 ZINC000409111577 263527423 /nfs/dbraw/zinc/52/74/23/263527423.db2.gz CUQMDFJZXDTTSY-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1ccccc1NCc1ccccc1OCc1ccc(Cl)cc1Cl ZINC000409111699 571135285 /nfs/dbraw/zinc/13/52/85/571135285.db2.gz BZYPYBHSCSMEQD-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(C)c(NCc2cccc(OCc3ccccc3Cl)c2)c1 ZINC000409111779 263528207 /nfs/dbraw/zinc/52/82/07/263528207.db2.gz CPMAAGQOJVGANJ-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccccc1NCc1ccc(OCc2cccc(F)c2)c(Cl)c1 ZINC000409111830 571135329 /nfs/dbraw/zinc/13/53/29/571135329.db2.gz DAEYMVLXLOKVHL-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN COc1cc(CNc2ccc(Oc3ccccc3)cc2)cc(Cl)c1O ZINC000409111934 571135359 /nfs/dbraw/zinc/13/53/59/571135359.db2.gz ALNYGSRKSWGKHL-UHFFFAOYSA-N 0 0 355.821 5.459 40 0 FKABRN Cc1ccc(Cl)cc1NCc1ccccc1OCc1ccccc1Cl ZINC000409111936 571135367 /nfs/dbraw/zinc/13/53/67/571135367.db2.gz ALTWATNLYLEPHW-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccc(OCc2cccc(Cl)c2)cc1 ZINC000409111968 263527740 /nfs/dbraw/zinc/52/77/40/263527740.db2.gz BBHJEBBWUPSSDU-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2ccc(F)cc2)c(Cl)c1 ZINC000409112060 263528109 /nfs/dbraw/zinc/52/81/09/263528109.db2.gz JWBKRGCRBRCYRZ-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN COc1cc(CNc2ccccc2)ccc1OCc1cccc2ccccc21 ZINC000409112063 263527715 /nfs/dbraw/zinc/52/77/15/263527715.db2.gz ATVYYWQYJPRDQA-UHFFFAOYSA-N 0 0 369.464 6.040 40 0 FKABRN CCCSc1nc2sc(CCC)c(C)c2c(=O)n1-c1cccc(C)c1 ZINC000409112132 571135273 /nfs/dbraw/zinc/13/52/73/571135273.db2.gz FBNOYIKKVHDJMR-UHFFFAOYSA-N 0 0 372.559 5.519 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3cccc(Cl)c3)cc2)c1C ZINC000409112147 570725605 /nfs/dbraw/zinc/72/56/05/570725605.db2.gz FFAJEFMMZJMTSR-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1cccc(NCc2ccccc2OCc2cccc(Cl)c2)c1C ZINC000409112186 571135281 /nfs/dbraw/zinc/13/52/81/571135281.db2.gz KRMQVBVKUSDJLK-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccccc1NCc1c(OCc2cccc(F)c2)ccc2ccccc21 ZINC000409112229 570725691 /nfs/dbraw/zinc/72/56/91/570725691.db2.gz CAOZYJDBXYNZDX-UHFFFAOYSA-N 0 0 371.455 6.478 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3ccc(F)cc3)c(OC)c2)cc1 ZINC000409112364 570725684 /nfs/dbraw/zinc/72/56/84/570725684.db2.gz CGDOQSUENYBRGA-UHFFFAOYSA-N 0 0 365.448 5.588 40 0 FKABRN CCOc1ccc2ccccc2c1CNc1ccc(Oc2ccccc2)cc1 ZINC000409112408 571135279 /nfs/dbraw/zinc/13/52/79/571135279.db2.gz CMUDTJINAHXNBF-UHFFFAOYSA-N 0 0 369.464 6.643 40 0 FKABRN CCOc1cc(CNc2cc(Cl)ccc2C)cc(Cl)c1OCC ZINC000409112416 571135315 /nfs/dbraw/zinc/13/53/15/571135315.db2.gz GDPAQDOHHHPZEH-UHFFFAOYSA-N 0 0 354.277 5.711 40 0 FKABRN Cc1ccc(C)c(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)c1 ZINC000409112449 571135296 /nfs/dbraw/zinc/13/52/96/571135296.db2.gz DGIWGCIRBMQIMJ-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3Cl)c(Cl)c2)cc1 ZINC000409112469 570725766 /nfs/dbraw/zinc/72/57/66/570725766.db2.gz GKFKPTYYLHIBJT-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1c(Cl)cccc1NCc1cccc(OCc2ccc(Cl)cc2)c1 ZINC000409112480 571135278 /nfs/dbraw/zinc/13/52/78/571135278.db2.gz CYYGTIIKRNVSGO-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCOc1cc(CNc2ccccc2C)ccc1OCc1ccc(F)cc1 ZINC000409112527 571135327 /nfs/dbraw/zinc/13/53/27/571135327.db2.gz GQYNKECDWSZLPZ-UHFFFAOYSA-N 0 0 365.448 5.724 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3cccc(F)c3)c(Cl)c2)cc1 ZINC000409112564 570725724 /nfs/dbraw/zinc/72/57/24/570725724.db2.gz DYABHQYHUKKQPX-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCCOc1c(Cl)cc(CNc2cc(Cl)ccc2C)cc1Cl ZINC000409112570 571135341 /nfs/dbraw/zinc/13/53/41/571135341.db2.gz FAULNLPTJCEEOW-UHFFFAOYSA-N 0 0 358.696 6.356 40 0 FKABRN CCN1c2ccccc2/C(=C/c2ccc(OCc3ccccc3)cc2)C1=O ZINC000409112602 263527972 /nfs/dbraw/zinc/52/79/72/263527972.db2.gz FCSVLOPGMCURPI-JWGURIENSA-N 0 0 355.437 5.173 40 0 FKABRN COc1cc(CNc2cccc(C)c2C)ccc1OCc1cccc(F)c1 ZINC000409112684 571135319 /nfs/dbraw/zinc/13/53/19/571135319.db2.gz FUSSFDJBGVTFFX-UHFFFAOYSA-N 0 0 365.448 5.642 40 0 FKABRN Cc1ccc(C)c(NCc2ccc(OCc3ccc(F)cc3)c(Cl)c2)c1 ZINC000409112736 571135377 /nfs/dbraw/zinc/13/53/77/571135377.db2.gz CIXGVMUDDZUGIR-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN Cc1ccc(Cl)cc1NCc1ccc(OCc2ccccc2F)cc1 ZINC000409112807 570726140 /nfs/dbraw/zinc/72/61/40/570726140.db2.gz LPJMJLVQDHYVFE-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCc1ccccc1NCc1cccc(OCc2ccccc2Cl)c1 ZINC000409112824 263528079 /nfs/dbraw/zinc/52/80/79/263528079.db2.gz LTWFPDPKSPNMLP-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1cccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)c1 ZINC000409112841 570726200 /nfs/dbraw/zinc/72/62/00/570726200.db2.gz CGCWQPKSDVCCCH-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(Cl)cc1NCc1ccccc1OCc1cccc(F)c1 ZINC000409112863 570726124 /nfs/dbraw/zinc/72/61/24/570726124.db2.gz CJXIOIIVZLUVDF-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCOc1cc(CNc2cc(C)ccc2C)ccc1OCc1ccccc1 ZINC000409112899 571135299 /nfs/dbraw/zinc/13/52/99/571135299.db2.gz GXSUSRLNBVXMKC-UHFFFAOYSA-N 0 0 361.485 5.893 40 0 FKABRN Cc1ccc(COc2ccc(CNc3cccc(Cl)c3C)cc2)cc1 ZINC000409112905 263527968 /nfs/dbraw/zinc/52/79/68/263527968.db2.gz DOJUFEBJQNPJBB-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN O=C1Nc2ccccc2/C1=C/c1ccccc1OCc1ccccc1Cl ZINC000409112960 570726105 /nfs/dbraw/zinc/72/61/05/570726105.db2.gz HHQPYEKOPNETAA-AQTBWJFISA-N 0 0 361.828 5.412 40 0 FKABRN Cc1cccc(NCc2ccccc2OCc2ccc(Cl)cc2Cl)c1 ZINC000409112963 571135596 /nfs/dbraw/zinc/13/55/96/571135596.db2.gz HKRKDBCJMKXDMP-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCCN1c2ccccc2/C(=C/c2c(OC)ccc3ccc(OC)cc32)C1=O ZINC000409112975 571135598 /nfs/dbraw/zinc/13/55/98/571135598.db2.gz MVTWQARFYRUSLN-QNGOZBTKSA-N 0 0 373.452 5.154 40 0 FKABRN Cc1cccc(NCc2cc(Cl)ccc2OCc2ccc(F)cc2)c1C ZINC000409112985 263527788 /nfs/dbraw/zinc/52/77/88/263527788.db2.gz MWIAVYSRECIIAW-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN CCCOc1c(Cl)cc(CNc2cccc(Cl)c2C)cc1OCC ZINC000409113013 571135338 /nfs/dbraw/zinc/13/53/38/571135338.db2.gz HRGGLUPRCUFZPT-UHFFFAOYSA-N 0 0 368.304 6.101 40 0 FKABRN COc1ccc(NCc2ccc(OCc3cccc(F)c3)c(Cl)c2)cc1 ZINC000409113020 570726196 /nfs/dbraw/zinc/72/61/96/570726196.db2.gz DEFGZEVJXWSSNR-UHFFFAOYSA-N 0 0 371.839 5.679 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3ccc(Cl)cc3)cc2)c1C ZINC000409113110 571135588 /nfs/dbraw/zinc/13/55/88/571135588.db2.gz DNRJLVQJJXARKG-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN COc1cc(CNc2cc(Cl)ccc2C)ccc1OCc1ccccc1 ZINC000409113145 571135590 /nfs/dbraw/zinc/13/55/90/571135590.db2.gz GRYZBAGHGUFPJY-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN Cc1c(Cl)cccc1NCc1cccc(OCc2cccc(F)c2)c1 ZINC000409113160 570726213 /nfs/dbraw/zinc/72/62/13/570726213.db2.gz GXWPVZHEHQCGHX-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3cccc4ccccc43)cc2)c1C ZINC000409113169 571135618 /nfs/dbraw/zinc/13/56/18/571135618.db2.gz GYMVLCQXPJCIFA-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN CCOc1cc(CNc2ccc(C)cc2)ccc1OCc1ccccc1F ZINC000409113241 571135625 /nfs/dbraw/zinc/13/56/25/571135625.db2.gz ACNRFHMQFLARKY-UHFFFAOYSA-N 0 0 365.448 5.724 40 0 FKABRN Cc1cccc(NCc2cc(Cl)c(OCc3ccccc3)c(Cl)c2)c1 ZINC000409113265 570726074 /nfs/dbraw/zinc/72/60/74/570726074.db2.gz HJJBMAVWVJXCKP-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN CCCN1C(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)c2ccccc21 ZINC000409113370 571135593 /nfs/dbraw/zinc/13/55/93/571135593.db2.gz HOUOKIGMEPWGFL-RGEXLXHISA-N 0 0 363.844 5.897 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccccc1OCc1ccc(F)cc1 ZINC000409113421 571135654 /nfs/dbraw/zinc/13/56/54/571135654.db2.gz FXQJUPORVSVVHQ-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1cccc(NCc2cccc(OCc3cccc4ccccc43)c2)c1C ZINC000409113430 570726069 /nfs/dbraw/zinc/72/60/69/570726069.db2.gz FYZAZIVQURQKRT-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN CCCOc1c(Cl)cc(CNc2ccc(OCC)cc2)cc1OCC ZINC000409113477 570726193 /nfs/dbraw/zinc/72/61/93/570726193.db2.gz GFNMYHNWHOJYQD-UHFFFAOYSA-N 0 0 363.885 5.538 40 0 FKABRN CCc1ccccc1NCc1ccccc1OCc1cccc2ccccc21 ZINC000409113482 570726058 /nfs/dbraw/zinc/72/60/58/570726058.db2.gz IJPDBQRRVXCIOG-UHFFFAOYSA-N 0 0 367.492 6.593 40 0 FKABRN CCc1ccccc1NCc1cc(Cl)ccc1OCc1ccc(F)cc1 ZINC000409113500 571135652 /nfs/dbraw/zinc/13/56/52/571135652.db2.gz GLLLPUDEKVQKNN-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3cccc(F)c3)c2)cc1Cl ZINC000409113505 571135608 /nfs/dbraw/zinc/13/56/08/571135608.db2.gz GMTZYMBJFVGWFJ-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3ccccc3F)c(Cl)c2)cc1 ZINC000409113537 570726112 /nfs/dbraw/zinc/72/61/12/570726112.db2.gz GSJPJRMVAMZPDY-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN Cc1ccc(C)c(NCc2ccc(OCc3ccccc3)c(Cl)c2)c1 ZINC000409113541 571135606 /nfs/dbraw/zinc/13/56/06/571135606.db2.gz GUFROMAOPCKJNJ-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2cccc(F)c2)cc1C ZINC000409113548 571135600 /nfs/dbraw/zinc/13/56/00/571135600.db2.gz HAAHBOHAJOMTEH-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN CCOc1ccc(NCc2cccc(OCc3ccccc3Cl)c2)cc1 ZINC000409113564 570726117 /nfs/dbraw/zinc/72/61/17/570726117.db2.gz HHISPXMAXXVEGZ-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3)c(Cl)c2)c(C)c1 ZINC000409113596 570726210 /nfs/dbraw/zinc/72/62/10/570726210.db2.gz HTCJCOSMWNTQTD-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 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CCN1C(=O)/C(=C\c2ccc(OCc3ccc(F)cc3)cc2)c2ccccc21 ZINC000409117923 571137213 /nfs/dbraw/zinc/13/72/13/571137213.db2.gz YDFVMZLFBPGZIZ-JCMHNJIXSA-N 0 0 373.427 5.312 40 0 FKABRN Cc1ccc(C)c(NCc2ccc(OCc3ccccc3F)c(Cl)c2)c1 ZINC000409117936 263529217 /nfs/dbraw/zinc/52/92/17/263529217.db2.gz RRUKPVXHLYDKOS-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN Cc1ccc(C)c(NCc2cc(Cl)ccc2OCc2ccccc2F)c1 ZINC000409117937 570727470 /nfs/dbraw/zinc/72/74/70/570727470.db2.gz MDUHWJWUIRVGHK-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccc(OCc2ccccc2Cl)cc1 ZINC000409117990 570727436 /nfs/dbraw/zinc/72/74/36/570727436.db2.gz MMIFSZCHFHWJNB-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccccc1NCc1ccc(OCc2ccc(Cl)cc2Cl)cc1 ZINC000409118072 571137688 /nfs/dbraw/zinc/13/76/88/571137688.db2.gz MXQAAPHRRQVYTD-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2ccccc2Cl)c(C)c1 ZINC000409118155 571137629 /nfs/dbraw/zinc/13/76/29/571137629.db2.gz SPJSSVQUUYWARC-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(COc2ccc(Cl)cc2CNc2cc(C)ccc2C)cc1 ZINC000409118164 570727830 /nfs/dbraw/zinc/72/78/30/570727830.db2.gz ZBXOBNZQDFDYIV-UHFFFAOYSA-N 0 0 365.904 6.456 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccccc3F)c(Cl)c2)cc1 ZINC000409118167 570727313 /nfs/dbraw/zinc/72/73/13/570727313.db2.gz SRGVCIKAPTYGAV-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccc(Cl)cc3)cc2)c(C)c1 ZINC000409118188 570727835 /nfs/dbraw/zinc/72/78/35/570727835.db2.gz PCEPVLKTKCXCGB-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3ccccc3F)c(OC)c2)cc1 ZINC000409118194 263528561 /nfs/dbraw/zinc/52/85/61/263528561.db2.gz SUVGHQJJWOHBCR-UHFFFAOYSA-N 0 0 365.448 5.588 40 0 FKABRN COc1cc(CNc2cccc(C)c2)ccc1OCc1ccc(Cl)cc1 ZINC000409118195 570727642 /nfs/dbraw/zinc/72/76/42/570727642.db2.gz ZGECAUAIGLIRSU-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN O=C1Nc2ccccc2/C1=C/c1ccc(OCc2ccc(Cl)cc2)cc1 ZINC000409118199 570727639 /nfs/dbraw/zinc/72/76/39/570727639.db2.gz ZGKQAKPIXPTGTO-MOSHPQCFSA-N 0 0 361.828 5.412 40 0 FKABRN COc1cc(CNc2cccc(C)c2)cc(Cl)c1OCc1ccccc1 ZINC000409118237 570727769 /nfs/dbraw/zinc/72/77/69/570727769.db2.gz PIBGLFLCUVSWMX-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN COc1cc(CNc2ccc(Oc3ccccc3)cc2)cc(Cl)c1OC ZINC000409118244 571137542 /nfs/dbraw/zinc/13/75/42/571137542.db2.gz ZHZXMQUYHXBQAD-UHFFFAOYSA-N 0 0 369.848 5.762 40 0 FKABRN COc1cc(CNc2ccc(C)cc2C)ccc1OCc1cccc(F)c1 ZINC000409118255 570727656 /nfs/dbraw/zinc/72/76/56/570727656.db2.gz NNRCQHTZIKPGQC-UHFFFAOYSA-N 0 0 365.448 5.642 40 0 FKABRN Cc1cccc(NCc2ccccc2OCc2ccccc2Cl)c1C ZINC000409118277 570727728 /nfs/dbraw/zinc/72/77/28/570727728.db2.gz ZJOWDCMJLCUSAG-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCOc1ccc(CNc2ccc(Oc3ccccc3)cc2)cc1Cl ZINC000409118281 571137513 /nfs/dbraw/zinc/13/75/13/571137513.db2.gz OSPXBZOVVGPRLY-UHFFFAOYSA-N 0 0 353.849 6.143 40 0 FKABRN Clc1cc(Cl)c(OCc2ccccc2)c(CNc2ccccc2)c1 ZINC000409118288 570727797 /nfs/dbraw/zinc/72/77/97/570727797.db2.gz POJUCVSDBZAFDT-UHFFFAOYSA-N 0 0 358.268 6.185 40 0 FKABRN CCc1ccccc1NCc1c(OCc2ccccc2)ccc2ccccc21 ZINC000409118310 570727690 /nfs/dbraw/zinc/72/76/90/570727690.db2.gz OWTDMJSZVBJWAO-UHFFFAOYSA-N 0 0 367.492 6.593 40 0 FKABRN CCc1ccc(NCc2ccccc2OCc2cccc(Cl)c2)cc1 ZINC000409118334 571137639 /nfs/dbraw/zinc/13/76/39/571137639.db2.gz PDGUOWYKLUUHOJ-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN COc1ccc(NCc2cc(Cl)ccc2OCc2cccc(F)c2)cc1 ZINC000409118347 570727764 /nfs/dbraw/zinc/72/77/64/570727764.db2.gz PEYFWIOIBVJFBO-UHFFFAOYSA-N 0 0 371.839 5.679 40 0 FKABRN CCOc1cc(CNc2ccc(C)cc2)ccc1OCc1cccc(F)c1 ZINC000409118370 263528348 /nfs/dbraw/zinc/52/83/48/263528348.db2.gz PKYFIODSSNAHTQ-UHFFFAOYSA-N 0 0 365.448 5.724 40 0 FKABRN Cc1ccc(COc2ccc3ccccc3c2CNc2ccccc2C)cc1 ZINC000409118373 570727845 /nfs/dbraw/zinc/72/78/45/570727845.db2.gz PNHYXZNHDFZKBY-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN CCc1ccccc1NCc1cccc(OCc2cccc3ccccc32)c1 ZINC000409118410 570727820 /nfs/dbraw/zinc/72/78/20/570727820.db2.gz ZMHCDYMWWJGSHC-UHFFFAOYSA-N 0 0 367.492 6.593 40 0 FKABRN CCCOc1ccc(CNc2ccc(Oc3ccccc3)cc2)cc1OC ZINC000409118422 570727666 /nfs/dbraw/zinc/72/76/66/570727666.db2.gz QILLREOCZCATJR-UHFFFAOYSA-N 0 0 363.457 5.888 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccccc1OCc1cccc(F)c1 ZINC000409118425 570727752 /nfs/dbraw/zinc/72/77/52/570727752.db2.gz ZQPLDJIUXJIAKJ-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccccc1NCc1ccc(OCc2ccccc2F)c(Cl)c1 ZINC000409118427 570727676 /nfs/dbraw/zinc/72/76/76/570727676.db2.gz ZRJRVOQSAZDZTR-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3ccc(F)cc3)c(Cl)c2)cc1C ZINC000409118443 263529225 /nfs/dbraw/zinc/52/92/25/263529225.db2.gz ZYTSGDZJUIOXPE-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN CCc1ccccc1NCc1ccccc1OCc1cccc(Cl)c1 ZINC000409118450 263528709 /nfs/dbraw/zinc/52/87/09/263528709.db2.gz QFMIJEKFACPANR-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN CCc1ccc(NCc2cccc(OCc3cccc(Cl)c3)c2)cc1 ZINC000409118477 571137657 /nfs/dbraw/zinc/13/76/57/571137657.db2.gz NIZRQCNQKPMZBH-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1cccc(NCc2cc(Cl)ccc2OCc2ccccc2F)c1 ZINC000409118588 570727786 /nfs/dbraw/zinc/72/77/86/570727786.db2.gz OLFKOBUIGCZFEG-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2ccccc2)c(Cl)c1 ZINC000409118589 571137575 /nfs/dbraw/zinc/13/75/75/571137575.db2.gz RNWRQHNALLDVTJ-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1ccc(C)c(NCc2ccc(OCc3ccc(Cl)cc3)cc2)c1 ZINC000409118615 571137607 /nfs/dbraw/zinc/13/76/07/571137607.db2.gz OQQUGQWISIYOBB-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN COc1c(Cl)cc(CNc2ccc(Oc3ccccc3)cc2)cc1Cl ZINC000409118691 263528895 /nfs/dbraw/zinc/52/88/95/263528895.db2.gz PRURJOHTBLAPOQ-UHFFFAOYSA-N 0 0 374.267 6.406 40 0 FKABRN Cc1ccc(NCc2cccc(OCc3ccccc3Cl)c2)c(C)c1 ZINC000409118696 571137696 /nfs/dbraw/zinc/13/76/96/571137696.db2.gz TWLHEQZNZPISNL-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCOc1cc(CNc2ccccc2)ccc1OCc1cccc(F)c1 ZINC000409118822 570727733 /nfs/dbraw/zinc/72/77/33/570727733.db2.gz RDLYVZHRADCXLV-UHFFFAOYSA-N 0 0 351.421 5.416 40 0 FKABRN Cc1ccc(C)c(NCc2ccc(OCc3cccc4ccccc43)cc2)c1 ZINC000409118948 263528573 /nfs/dbraw/zinc/52/85/73/263528573.db2.gz RKCUJMDFTYWMOL-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN CCc1ccccc1NCc1ccc(OCc2cccc(F)c2)c(Cl)c1 ZINC000409118956 263528921 /nfs/dbraw/zinc/52/89/21/263528921.db2.gz QSSUBPKHEOEXST-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN Cc1ccc(Cl)cc1NCc1cccc(OCc2cccc(Cl)c2)c1 ZINC000409118962 571137610 /nfs/dbraw/zinc/13/76/10/571137610.db2.gz QQPWTYRHDMOUCB-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3cccc4ccccc43)cc2)c1 ZINC000409118971 571137515 /nfs/dbraw/zinc/13/75/15/571137515.db2.gz VLSGIBQXMHORAK-UHFFFAOYSA-N 0 0 353.465 6.339 40 0 FKABRN CCOc1ccc(/C=C2\C(=O)Nc3ccccc32)c2c(OCC)cccc12 ZINC000409118999 263528714 /nfs/dbraw/zinc/52/87/14/263528714.db2.gz QVFFZWYNFMFNGK-JXAWBTAJSA-N 0 0 359.425 5.130 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3cccc(F)c3)c(Cl)c2)c1 ZINC000409119018 570727661 /nfs/dbraw/zinc/72/76/61/570727661.db2.gz QJQTYVLDTGHFDI-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1cccc(NCc2cccc(OCc3cccc4ccccc43)c2)c1 ZINC000409119067 570727635 /nfs/dbraw/zinc/72/76/35/570727635.db2.gz PJHXOWGCHIMOTG-UHFFFAOYSA-N 0 0 353.465 6.339 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccccc1OCc1ccccc1F ZINC000409119164 570727723 /nfs/dbraw/zinc/72/77/23/570727723.db2.gz RPJRIMDWDWNMGP-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(Cl)cc1NCc1ccc(OCc2ccc(F)cc2)cc1 ZINC000409119183 571137532 /nfs/dbraw/zinc/13/75/32/571137532.db2.gz RGLORQHQEICZFA-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccccc1NCc1cc(Cl)ccc1OCc1cccc(Cl)c1 ZINC000409119216 571137719 /nfs/dbraw/zinc/13/77/19/571137719.db2.gz RPSKAEKGDKZVCB-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2)c(C)c1 ZINC000409119284 263528890 /nfs/dbraw/zinc/52/88/90/263528890.db2.gz SOBRHFGAQHAFPV-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3ccccc3)c(Cl)c2)cc1 ZINC000409119400 571137615 /nfs/dbraw/zinc/13/76/15/571137615.db2.gz SIGPUCCGHQHHJM-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN Cc1ccc(NCc2ccccc2OCc2cccc(Cl)c2)c(C)c1 ZINC000409119415 570727671 /nfs/dbraw/zinc/72/76/71/570727671.db2.gz WNQKISJZKGAYAU-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCOc1ccc(NCc2cccc(OCc3ccc(F)cc3)c2)cc1 ZINC000409119433 571138042 /nfs/dbraw/zinc/13/80/42/571138042.db2.gz SLRGVFZJIRKSSA-UHFFFAOYSA-N 0 0 351.421 5.416 40 0 FKABRN Cc1ccc(C)c(NCc2ccccc2OCc2cccc(Cl)c2)c1 ZINC000409119498 570727825 /nfs/dbraw/zinc/72/78/25/570727825.db2.gz WVQVKHNOFLELRZ-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN Cc1ccc(NCc2cc(Cl)ccc2OCc2cccc(F)c2)cc1 ZINC000409119499 571137946 /nfs/dbraw/zinc/13/79/46/571137946.db2.gz PVRIWCDBESPILQ-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1ccc(NCc2c(OCc3ccccc3)ccc3ccccc32)c(C)c1 ZINC000409119515 571138031 /nfs/dbraw/zinc/13/80/31/571138031.db2.gz WVYXUYLQWPQWDF-UHFFFAOYSA-N 0 0 367.492 6.648 40 0 FKABRN COc1cc(CNc2cc(C)ccc2C)ccc1OCc1ccc(C)cc1 ZINC000409119523 571137995 /nfs/dbraw/zinc/13/79/95/571137995.db2.gz UHYPYVGIAFGDER-UHFFFAOYSA-N 0 0 361.485 5.812 40 0 FKABRN CCOc1ccc(/C=C2/c3ccccc3N(CC(C)C)C2=O)cc1OCC ZINC000409119551 263529003 /nfs/dbraw/zinc/52/90/03/263529003.db2.gz QAYIOSHQDTZGCD-UYRXBGFRSA-N 0 0 365.473 5.027 40 0 FKABRN Cc1ccc(Cl)cc1NCc1cccc(OCc2ccccc2F)c1 ZINC000409119580 570727624 /nfs/dbraw/zinc/72/76/24/570727624.db2.gz UKVHAJXHCQUHSC-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCOc1cc(CNc2cccc(C)c2)ccc1OCc1ccccc1F ZINC000409119614 571137940 /nfs/dbraw/zinc/13/79/40/571137940.db2.gz QFEDJAIVAGNYKI-UHFFFAOYSA-N 0 0 365.448 5.724 40 0 FKABRN COc1cc(CNc2ccccc2C)ccc1OCc1cccc(Cl)c1 ZINC000409119657 263529274 /nfs/dbraw/zinc/52/92/74/263529274.db2.gz PXXDUFLWRBTLGY-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN CCCSc1nc2sc(CC)c(C)c2c(=O)n1-c1ccc(C)cc1 ZINC000409119692 570728093 /nfs/dbraw/zinc/72/80/93/570728093.db2.gz XOFNOFSYBVDHMU-UHFFFAOYSA-N 0 0 358.532 5.129 40 0 FKABRN Cc1cccc(NCc2ccc(OCc3ccc(F)cc3)c(Cl)c2)c1 ZINC000409119697 571137986 /nfs/dbraw/zinc/13/79/86/571137986.db2.gz UCCOPEPPYCWTAO-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3cccc(F)c3)c(Cl)c2)cc1 ZINC000409119727 571137999 /nfs/dbraw/zinc/13/79/99/571137999.db2.gz XRYVDDHQNQZWSU-UHFFFAOYSA-N 0 0 369.867 6.233 40 0 FKABRN O=C1Nc2ccccc2/C1=C/c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000409119730 263529208 /nfs/dbraw/zinc/52/92/08/263529208.db2.gz UBTYLPFUSDNBEP-GDNBJRDFSA-N 0 0 356.208 5.746 40 0 FKABRN Cc1ccc(Cl)cc1NCc1cccc(OCc2cccc(F)c2)c1 ZINC000409119853 571138046 /nfs/dbraw/zinc/13/80/46/571138046.db2.gz TZOKGXDPQYEGHV-UHFFFAOYSA-N 0 0 355.840 5.979 40 0 FKABRN Cc1c(Cl)cccc1NCc1ccc(OCc2ccccc2)c(Cl)c1 ZINC000409119880 571137977 /nfs/dbraw/zinc/13/79/77/571137977.db2.gz QWUZAOUUJXXBCV-UHFFFAOYSA-N 0 0 372.295 6.493 40 0 FKABRN Cc1ccc(COc2ccc(CNc3cccc(C)c3C)cc2Cl)cc1 ZINC000409119926 571138027 /nfs/dbraw/zinc/13/80/27/571138027.db2.gz UNLDZDUTQOSVSR-UHFFFAOYSA-N 0 0 365.904 6.456 40 0 FKABRN CCN1C(=O)/C(=C\c2ccccc2OCc2cccc(F)c2)c2ccccc21 ZINC000409120002 570728054 /nfs/dbraw/zinc/72/80/54/570728054.db2.gz RYADHWIUNZCNRX-QNGOZBTKSA-N 0 0 373.427 5.312 40 0 FKABRN CCOc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000409120005 570728107 /nfs/dbraw/zinc/72/81/07/570728107.db2.gz SBKOJCUUFFGEFW-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN COc1cc(CNc2ccccc2C)ccc1OCc1ccccc1Cl ZINC000409120020 263529788 /nfs/dbraw/zinc/52/97/88/263529788.db2.gz SGIKQTPGHCDSDH-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN CCOc1ccc(NCc2ccc(OCc3ccccc3Cl)cc2)cc1 ZINC000409120047 263529508 /nfs/dbraw/zinc/52/95/08/263529508.db2.gz UMQFMILNWCFPNF-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN Cc1cccc(NCc2ccccc2OCc2cccc3ccccc32)c1 ZINC000409120061 571138303 /nfs/dbraw/zinc/13/83/03/571138303.db2.gz UTAGGLSDWYAHNZ-UHFFFAOYSA-N 0 0 353.465 6.339 40 0 FKABRN CCOc1ccc(NCc2ccccc2OCc2ccc(Cl)cc2)cc1 ZINC000409120150 263530160 /nfs/dbraw/zinc/53/01/60/263530160.db2.gz YFXXDUWVVNXQEX-UHFFFAOYSA-N 0 0 367.876 5.930 40 0 FKABRN Cc1ccc(COc2ccc(CNc3ccc(C)cc3)cc2Cl)cc1 ZINC000409120223 570728123 /nfs/dbraw/zinc/72/81/23/570728123.db2.gz SMHNWUZSMOFBJR-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCOc1cc(CNc2cccc(C)c2)ccc1OCc1ccc(C)cc1 ZINC000409120278 263530105 /nfs/dbraw/zinc/53/01/05/263530105.db2.gz WEOMCKWDBPNKGN-UHFFFAOYSA-N 0 0 361.485 5.893 40 0 FKABRN CCCCSc1nc2sc(CC)c(C)c2c(=O)n1-c1ccc(C)cc1 ZINC000409120339 571138332 /nfs/dbraw/zinc/13/83/32/571138332.db2.gz TZPQZEJPEQTTNC-UHFFFAOYSA-N 0 0 372.559 5.519 40 0 FKABRN CCc1ccc(NCc2ccc(OCc3cccc(F)c3)c(OC)c2)cc1 ZINC000409120386 570728240 /nfs/dbraw/zinc/72/82/40/570728240.db2.gz ZERYLYCIZNZMLK-UHFFFAOYSA-N 0 0 365.448 5.588 40 0 FKABRN CCc1ccc(NCc2cccc(OCc3cccc4ccccc43)c2)cc1 ZINC000409120388 263529697 /nfs/dbraw/zinc/52/96/97/263529697.db2.gz VSNFGHJOMFSQCZ-UHFFFAOYSA-N 0 0 367.492 6.593 40 0 FKABRN CCc1ccc(NCc2cc(Cl)ccc2OCc2ccccc2)cc1 ZINC000409120437 570728008 /nfs/dbraw/zinc/72/80/08/570728008.db2.gz ZLYBMSUIBCTHHA-UHFFFAOYSA-N 0 0 351.877 6.094 40 0 FKABRN CCOc1cc(CNc2ccccc2C)ccc1OCc1ccccc1F ZINC000409120444 571138284 /nfs/dbraw/zinc/13/82/84/571138284.db2.gz ZMHSXICGKHQTJP-UHFFFAOYSA-N 0 0 365.448 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FKABRN COc1cc(CNc2ccccc2C)cc(Cl)c1OCc1ccccc1 ZINC000409120818 570728235 /nfs/dbraw/zinc/72/82/35/570728235.db2.gz USSGPPVXODXXOD-UHFFFAOYSA-N 0 0 367.876 5.848 40 0 FKABRN Cc1ccc(COc2cccc(CNc3cc(Cl)ccc3C)c2)cc1 ZINC000409120835 570728082 /nfs/dbraw/zinc/72/80/82/570728082.db2.gz VADOSIDXIBURSZ-UHFFFAOYSA-N 0 0 351.877 6.148 40 0 FKABRN CCN1c2ccccc2/C(=C/c2ccccc2OCc2ccc(C)cc2)C1=O ZINC000409120851 570728212 /nfs/dbraw/zinc/72/82/12/570728212.db2.gz VGJSVHHNPQKTPO-JWGURIENSA-N 0 0 369.464 5.481 40 0 FKABRN Cc1ccc(NCc2ccc(OCc3cccc(F)c3)c(Cl)c2)c(C)c1 ZINC000409121038 571138369 /nfs/dbraw/zinc/13/83/69/571138369.db2.gz XVWCJBXTCUUIJK-UHFFFAOYSA-N 0 0 369.867 6.287 40 0 FKABRN Cc1ccccc1NCc1c(OCc2ccccc2F)ccc2ccccc21 ZINC000409121059 571138286 /nfs/dbraw/zinc/13/82/86/571138286.db2.gz VRWRXCSQFFBNRL-UHFFFAOYSA-N 0 0 371.455 6.478 40 0 FKABRN CCCOc1ccc(CNc2ccc(Oc3ccccc3)cc2)cc1Cl ZINC000409121076 263529725 /nfs/dbraw/zinc/52/97/25/263529725.db2.gz VTIYJFCXRKLSBN-UHFFFAOYSA-N 0 0 367.876 6.533 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0 0 370.905 5.019 40 0 FKABRN O=C1Nc2ccccc2/C1=C\c1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000409207251 263541503 /nfs/dbraw/zinc/54/15/03/263541503.db2.gz URZGTQRUZQXUFI-GXDHUFHOSA-N 0 0 356.208 5.746 40 0 FKABRN Cc1s/c(=N\C(=O)c2ccc(C(C)(C)C)cc2)n(C)c1-c1ccccc1 ZINC000409207261 263541449 /nfs/dbraw/zinc/54/14/49/263541449.db2.gz VATVZWBZMVLJFC-LNVKXUELSA-N 0 0 364.514 5.101 40 0 FKABRN Cc1[nH]c2ccccc2c1/C=C1/SC(=O)N(c2cccc(Cl)c2)C1=O ZINC000409208341 263541375 /nfs/dbraw/zinc/54/13/75/263541375.db2.gz FHBARAWRNHSVQK-LICLKQGHSA-N 0 0 368.845 5.371 40 0 FKABRN CC(C)(C)c1ccc(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000409209531 263541411 /nfs/dbraw/zinc/54/14/11/263541411.db2.gz GFXIFENLHZFGIE-GZTJUZNOSA-N 0 0 371.889 5.878 40 0 FKABRN Cc1cc(C)c(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)c(C)c1 ZINC000409215077 571218975 /nfs/dbraw/zinc/21/89/75/571218975.db2.gz ZLVWWIHSFCXJBR-LICLKQGHSA-N 0 0 357.862 5.506 40 0 FKABRN CC(C)Oc1ccc(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000409215708 263542650 /nfs/dbraw/zinc/54/26/50/263542650.db2.gz ADMATJGXDNEHDC-LICLKQGHSA-N 0 0 373.861 5.368 40 0 FKABRN CCCCCN1C(=O)S/C(=C\c2c(OCC)ccc3ccccc32)C1=O ZINC000409217155 568485310 /nfs/dbraw/zinc/48/53/10/568485310.db2.gz SQTDLIYQFZGAHF-RGEXLXHISA-N 0 0 369.486 5.465 40 0 FKABRN O=C1S/C(=C/c2ccc(Cl)s2)C(=O)N1c1cccc(Cl)c1 ZINC000409218068 570741748 /nfs/dbraw/zinc/74/17/48/570741748.db2.gz YKMNYUUGMBIIRB-YRNVUSSQSA-N 0 0 356.255 5.296 40 0 FKABRN CCCCCN1C(=O)S/C(=C\c2cc(Cl)cc(Cl)c2OC)C1=O ZINC000409218712 571219084 /nfs/dbraw/zinc/21/90/84/571219084.db2.gz XRGHQSQEVMHLMZ-JYRVWZFOSA-N 0 0 374.289 5.229 40 0 FKABRN Cc1ccc(Cl)cc1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 ZINC000409223190 571225621 /nfs/dbraw/zinc/22/56/21/571225621.db2.gz FSSQXULYIOCMNF-UHFFFAOYSA-N 0 0 357.862 5.116 40 0 FKABRN Cc1cc(-c2ccccc2)nc2c(-c3ccccc3)c(C(F)(F)F)nn21 ZINC000409224421 570742682 /nfs/dbraw/zinc/74/26/82/570742682.db2.gz LIPQWLMXKIYGBY-UHFFFAOYSA-N 0 0 353.347 5.391 40 0 FKABRN Cc1c(Cl)cccc1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 ZINC000409225346 570741892 /nfs/dbraw/zinc/74/18/92/570741892.db2.gz OORGJAAGWHTMLA-UHFFFAOYSA-N 0 0 357.862 5.116 40 0 FKABRN O=C1NC(=Cc2ccc(-c3ccccc3)cc2)C(=O)N1c1ccc(Cl)cc1 ZINC000409233750 570744468 /nfs/dbraw/zinc/74/44/68/570744468.db2.gz WQKNMWHLRFGCJO-XSFVSMFZSA-N 0 0 374.827 5.104 40 0 FKABRN Cc1ccc(Sc2ccc(/C=C3\SC(=O)N(C(C)C)C3=O)cc2)cc1 ZINC000409246309 570745356 /nfs/dbraw/zinc/74/53/56/570745356.db2.gz ASFBPPQWZVJKLJ-PDGQHHTCSA-N 0 0 369.511 5.591 40 0 FKABRN Cc1cccc(NC(=O)COc2ccc(CNc3ccc(C)c(C)c3)cc2)c1 ZINC000409248442 571231746 /nfs/dbraw/zinc/23/17/46/571231746.db2.gz GOWLLCINOZFRCM-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN O=C(Nc1c(F)cccc1F)/C(=C/c1ccccc1Cl)c1ccccc1 ZINC000409250839 571231716 /nfs/dbraw/zinc/23/17/16/571231716.db2.gz MZZYCNSJSZDLOH-DTQAZKPQSA-N 0 0 369.798 5.798 40 0 FKABRN CCc1ccc(NCc2ccc(OCC(=O)Nc3cccc(C)c3)cc2)cc1 ZINC000409252084 263547730 /nfs/dbraw/zinc/54/77/30/263547730.db2.gz SEUYBILXIODMDM-UHFFFAOYSA-N 0 0 374.484 5.187 40 0 FKABRN Cc1cccc(NC(=O)COc2cccc(CNc3ccc(C)c(C)c3)c2)c1 ZINC000409254399 570746805 /nfs/dbraw/zinc/74/68/05/570746805.db2.gz DEUDLOKLPDREBO-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN Cc1cccc(NC(=O)COc2ccc(CNc3cc(C)ccc3C)cc2)c1 ZINC000409254807 571231631 /nfs/dbraw/zinc/23/16/31/571231631.db2.gz FTLHAYVVEPGTCO-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN O=C(Nc1cc(Cl)ccc1Cl)/C(=C/c1ccco1)c1ccccc1 ZINC000409255546 571231678 /nfs/dbraw/zinc/23/16/78/571231678.db2.gz LYKNLUIQZQFQKZ-FOWTUZBSSA-N 0 0 358.224 5.766 40 0 FKABRN Cc1cccc(NC(=O)COc2cccc(CNc3cccc(C)c3C)c2)c1 ZINC000409255852 571231652 /nfs/dbraw/zinc/23/16/52/571231652.db2.gz LKEPLHBSHVBJMO-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN CCc1ccc(NCc2cccc(OCC(=O)Nc3cccc(C)c3)c2)cc1 ZINC000409257507 571231689 /nfs/dbraw/zinc/23/16/89/571231689.db2.gz SAJVWJFRBYUPCG-UHFFFAOYSA-N 0 0 374.484 5.187 40 0 FKABRN Cc1cccc(NC(=O)COc2cccc(CNc3cc(C)ccc3C)c2)c1 ZINC000409259403 263547825 /nfs/dbraw/zinc/54/78/25/263547825.db2.gz ZGPLRHAMRWMGLZ-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN O=C(CSCc1ccc(Cl)cc1)Nc1cc(Cl)ccc1Cl ZINC000409263199 570747071 /nfs/dbraw/zinc/74/70/71/570747071.db2.gz IGEJXJYCYIQIAK-UHFFFAOYSA-N 0 0 360.693 5.519 40 0 FKABRN Cc1cccc(NC(=O)COc2ccc(CNc3ccc(C)cc3C)cc2)c1 ZINC000409263286 571231435 /nfs/dbraw/zinc/23/14/35/571231435.db2.gz BMRXGDPEYGZDGK-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN Cc1cccc(NC(=O)COc2cccc(CNc3ccc(C)cc3C)c2)c1 ZINC000409263309 263547225 /nfs/dbraw/zinc/54/72/25/263547225.db2.gz BOYWDEKRJFXORU-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN Cc1cccc(NC(=O)COc2ccc(CNc3cccc(C)c3C)cc2)c1 ZINC000409264237 570747236 /nfs/dbraw/zinc/74/72/36/570747236.db2.gz PYEZZOHDLRDZGE-UHFFFAOYSA-N 0 0 374.484 5.241 40 0 FKABRN O=C(CSCc1cccc(Cl)c1)Nc1ccc(Cl)c(Cl)c1 ZINC000409264836 571231514 /nfs/dbraw/zinc/23/15/14/571231514.db2.gz GFOCFGPHGZFTKX-UHFFFAOYSA-N 0 0 360.693 5.519 40 0 FKABRN O=C(Nc1ccc(C(F)(F)F)cc1)/C(=C/c1ccccc1)c1ccccc1 ZINC000409268626 571231659 /nfs/dbraw/zinc/23/16/59/571231659.db2.gz WUBXAXAVFNPJOB-HMMYKYKNSA-N 0 0 367.370 5.885 40 0 FKABRN O=C(CSCc1ccccc1Cl)Nc1ccc(C(F)(F)F)cc1 ZINC000409271781 571231741 /nfs/dbraw/zinc/23/17/41/571231741.db2.gz NAMWXDZNQAKUJO-UHFFFAOYSA-N 0 0 359.800 5.231 40 0 FKABRN O=C(Nc1c(F)cccc1F)c1ccc(CSc2ccccc2)cc1 ZINC000409272818 263547517 /nfs/dbraw/zinc/54/75/17/263547517.db2.gz SPBUNMUCZJQJKM-UHFFFAOYSA-N 0 0 355.409 5.509 40 0 FKABRN CCCN1C(=O)S/C(=C/c2c(OC(C)C)ccc3ccccc32)C1=O ZINC000409306043 570749592 /nfs/dbraw/zinc/74/95/92/570749592.db2.gz YGDYDQXNUUOIIH-LDADJPATSA-N 0 0 355.459 5.073 40 0 FKABRN CCN1C(=O)S/C(=C/c2ccc(-c3ccccc3C(F)(F)F)o2)C1=O ZINC000409311495 570749653 /nfs/dbraw/zinc/74/96/53/570749653.db2.gz AAJXRAUIHRSQIP-NTEUORMPSA-N 0 0 367.348 5.022 40 0 FKABRN CCCOc1ccc(/C=C2/SC(=O)N(c3cccc(Cl)c3)C2=O)cc1 ZINC000409315559 571234472 /nfs/dbraw/zinc/23/44/72/571234472.db2.gz JTTGXTVVVPCDGC-GZTJUZNOSA-N 0 0 373.861 5.370 40 0 FKABRN CCCOc1ccc(/C=C2/SC(=O)N(c3ccc(Cl)cc3)C2=O)cc1 ZINC000409319882 263548184 /nfs/dbraw/zinc/54/81/84/263548184.db2.gz NEHNHPLLNMKGJO-SFQUDFHCSA-N 0 0 373.861 5.370 40 0 FKABRN CCCCOc1ccc(/C=C2/SC(=O)N(c3ccccc3)C2=O)cc1 ZINC000409323438 263547960 /nfs/dbraw/zinc/54/79/60/263547960.db2.gz NWZMISXKBKKMCA-NBVRZTHBSA-N 0 0 353.443 5.106 40 0 FKABRN CCCn1cc(/C=C2/SC(=O)N(c3ccccc3)C2=O)c2ccccc21 ZINC000409324963 570750890 /nfs/dbraw/zinc/75/08/90/570750890.db2.gz WGGOCZBDGQVZSR-CPNJWEJPSA-N 0 0 362.454 5.292 40 0 FKABRN CC(C)Oc1ccccc1/C=C1/SC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000409331658 263549113 /nfs/dbraw/zinc/54/91/13/263549113.db2.gz OCYXMJNGVDOWBX-GZTJUZNOSA-N 0 0 373.861 5.368 40 0 FKABRN CC1(C)CC(=O)[C@@H]2C(=Nc3ccccc3S[C@H]2c2ccc(Cl)cc2)C1 ZINC000409336861 571235506 /nfs/dbraw/zinc/23/55/06/571235506.db2.gz WXRXIYDGTKJONV-PMACEKPBSA-N 0 0 369.917 6.265 40 0 FKABRN CC1(C)CC(=O)[C@H]2C(=Nc3ccccc3S[C@H]2c2ccc(Cl)cc2)C1 ZINC000409336868 571235488 /nfs/dbraw/zinc/23/54/88/571235488.db2.gz WXRXIYDGTKJONV-UXHICEINSA-N 0 0 369.917 6.265 40 0 FKABRN CC1(C)CC(=O)[C@@H]2C(=Nc3ccccc3S[C@@H]2c2ccc(Cl)cc2)C1 ZINC000409336870 571235462 /nfs/dbraw/zinc/23/54/62/571235462.db2.gz WXRXIYDGTKJONV-VQTJNVASSA-N 0 0 369.917 6.265 40 0 FKABRN CC1(C)CC(=O)[C@H]2C(=Nc3ccccc3S[C@@H]2c2ccc(Cl)cc2)C1 ZINC000409336873 570751784 /nfs/dbraw/zinc/75/17/84/570751784.db2.gz WXRXIYDGTKJONV-WOJBJXKFSA-N 0 0 369.917 6.265 40 0 FKABRN CC(C)Oc1ccccc1/C=C1/SC(=O)N(c2cccc(Cl)c2)C1=O ZINC000409348325 571236971 /nfs/dbraw/zinc/23/69/71/571236971.db2.gz SLNHQXIRDCDMNA-LICLKQGHSA-N 0 0 373.861 5.368 40 0 FKABRN CCOc1cc(C(=O)Nc2ccccc2C(F)(F)F)cc(Cl)c1OC ZINC000409368929 263552309 /nfs/dbraw/zinc/55/23/09/263552309.db2.gz SRURVVXYFHAYBS-UHFFFAOYSA-N 0 0 373.758 5.018 40 0 FKABRN CCOc1cc(C(=O)Nc2cc(Cl)ccc2Cl)cc(Cl)c1OC ZINC000409368935 571238128 /nfs/dbraw/zinc/23/81/28/571238128.db2.gz SXBQOCPDMBBNHD-UHFFFAOYSA-N 0 0 374.651 5.306 40 0 FKABRN CCCOc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)cc1OC ZINC000409369003 570753770 /nfs/dbraw/zinc/75/37/70/570753770.db2.gz WWAVMLGDMYDSTF-UHFFFAOYSA-N 0 0 354.233 5.043 40 0 FKABRN CCOc1c(Cl)cc(C(=O)Nc2ccccc2C(F)(F)F)cc1OC ZINC000409369152 570753904 /nfs/dbraw/zinc/75/39/04/570753904.db2.gz FMHCLNVYIQHVEK-UHFFFAOYSA-N 0 0 373.758 5.018 40 0 FKABRN CCOc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)cc(Cl)c1OC ZINC000409373598 570754039 /nfs/dbraw/zinc/75/40/39/570754039.db2.gz XNIFAHAGAJNMIY-UHFFFAOYSA-N 0 0 373.758 5.018 40 0 FKABRN O=C(Cn1cc(C(=O)C2CC2)c2ccccc21)Nc1ccc2ccccc2c1 ZINC000409373642 263552625 /nfs/dbraw/zinc/55/26/25/263552625.db2.gz XBISFAHOCPJTNH-UHFFFAOYSA-N 0 0 368.436 5.026 40 0 FKABRN CC1=Nc2ccccc2Nc2c1c(-c1ccccc1)nn2-c1ccccc1 ZINC000409379532 571238658 /nfs/dbraw/zinc/23/86/58/571238658.db2.gz XKZUTVCMVLFFIF-UHFFFAOYSA-N 0 0 350.425 5.737 40 0 FKABRN Cc1ccc(CN(c2ccc(C)c(C)c2)S(=O)(=O)c2ccccc2)cc1 ZINC000409380449 263553855 /nfs/dbraw/zinc/55/38/55/263553855.db2.gz DQMLVPRBAMMDRN-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1ccc(CN(c2ccc(C)cc2)S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000409380532 263553506 /nfs/dbraw/zinc/55/35/06/263553506.db2.gz GESSNIOGSICKAT-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1cccc(N(Cc2ccccc2C)S(=O)(=O)c2ccccc2)c1C ZINC000409380552 571238602 /nfs/dbraw/zinc/23/86/02/571238602.db2.gz GTZLMPNKLMAUPU-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1ccc(N(Cc2ccccc2C)S(=O)(=O)c2ccccc2)c(C)c1 ZINC000409380766 263553319 /nfs/dbraw/zinc/55/33/19/263553319.db2.gz HTCZAPXLLZPBEP-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1ccc(CN(c2cc(C)ccc2C)S(=O)(=O)c2ccccc2)cc1 ZINC000409380774 263553483 /nfs/dbraw/zinc/55/34/83/263553483.db2.gz HZUMXAXVXZGAPW-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1cccc(CN(c2ccc(C)c(C)c2)S(=O)(=O)c2ccccc2)c1 ZINC000409381356 263553510 /nfs/dbraw/zinc/55/35/10/263553510.db2.gz LRDDZBJRMRCATP-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1ccc(CN(c2cccc(C)c2)S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000409381480 571238600 /nfs/dbraw/zinc/23/86/00/571238600.db2.gz MPORMYOJBZCDNN-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1ccc(S(=O)(=O)N(Cc2cccc(C)c2)c2cccc(C)c2)cc1 ZINC000409381931 263553713 /nfs/dbraw/zinc/55/37/13/263553713.db2.gz PGDOUJOUAKYJTE-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN O=C(CSCc1c(F)cccc1Cl)Nc1ccc2ccccc2c1 ZINC000409382168 263554001 /nfs/dbraw/zinc/55/40/01/263554001.db2.gz PMKJSWQZBAGUPP-UHFFFAOYSA-N 0 0 359.853 5.504 40 0 FKABRN Cc1ccc(N(Cc2cccc(C)c2)S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000409382291 263553935 /nfs/dbraw/zinc/55/39/35/263553935.db2.gz QXPGWAVRRIESGY-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN Cc1ccc(S(=O)(=O)N(Cc2cccc(Cl)c2)c2ccccc2)cc1 ZINC000409383880 263555283 /nfs/dbraw/zinc/55/52/83/263555283.db2.gz NEJITFHUUONYKH-UHFFFAOYSA-N 0 0 371.889 5.044 40 0 FKABRN Cc1ccc(S(=O)(=O)N(Cc2ccccc2)c2ccc(C)c(C)c2)cc1 ZINC000409383927 570754480 /nfs/dbraw/zinc/75/44/80/570754480.db2.gz PMJJAYGKFLBYQK-UHFFFAOYSA-N 0 0 365.498 5.007 40 0 FKABRN COc1ccc(NC(=O)c2ccc(CSc3ccc(C)cc3)cc2)cc1 ZINC000409383947 570754928 /nfs/dbraw/zinc/75/49/28/570754928.db2.gz QUZLBYNYBZIYFR-UHFFFAOYSA-N 0 0 363.482 5.548 40 0 FKABRN Cc1cc(-c2ccc(Cl)cc2)nc(SCc2ccc(Cl)cc2)n1 ZINC000409384387 571239289 /nfs/dbraw/zinc/23/92/89/571239289.db2.gz ARZDMCZUZPCTSG-UHFFFAOYSA-N 0 0 361.297 6.051 40 0 FKABRN Cc1ccc(-c2cc(C(F)(F)F)nc(SCc3ccccc3)n2)cc1 ZINC000409384464 570754935 /nfs/dbraw/zinc/75/49/35/570754935.db2.gz CKUJWVAPSNEOFO-UHFFFAOYSA-N 0 0 360.404 5.763 40 0 FKABRN COc1ccc(-c2cc(C)nc(SCc3ccccc3Cl)n2)cc1 ZINC000409384479 570754905 /nfs/dbraw/zinc/75/49/05/570754905.db2.gz CRWCUORAIHUKSD-UHFFFAOYSA-N 0 0 356.878 5.406 40 0 FKABRN Cc1cc(-c2ccc(Cl)cc2)nc(SCc2ccccc2Cl)n1 ZINC000409384999 570754902 /nfs/dbraw/zinc/75/49/02/570754902.db2.gz HHXUBQPGELAGCL-UHFFFAOYSA-N 0 0 361.297 6.051 40 0 FKABRN COc1ccc(-c2cc(C)nc(SCc3cccc4ccccc43)n2)cc1 ZINC000409385152 571239220 /nfs/dbraw/zinc/23/92/20/571239220.db2.gz JOYQVDFACPWOPH-UHFFFAOYSA-N 0 0 372.493 5.906 40 0 FKABRN Fc1ccccc1OCc1nnc(SCc2cccc3ccccc32)o1 ZINC000409385516 571239870 /nfs/dbraw/zinc/23/98/70/571239870.db2.gz MTBZDHWBWTVPMP-UHFFFAOYSA-N 0 0 366.417 5.233 40 0 FKABRN Cc1ccc(-c2cc(C)nc(SCc3cccc4ccccc43)n2)cc1 ZINC000409386458 571239656 /nfs/dbraw/zinc/23/96/56/571239656.db2.gz UCRKTHXZQXEMSR-UHFFFAOYSA-N 0 0 356.494 6.206 40 0 FKABRN COc1ccc(-c2cc(C)nc(SCc3ccc(Cl)cc3)n2)cc1 ZINC000409386642 571239640 /nfs/dbraw/zinc/23/96/40/571239640.db2.gz WBSIQCXVGDXKFX-UHFFFAOYSA-N 0 0 356.878 5.406 40 0 FKABRN Cc1cc(C(F)(F)F)nc(SCc2ccc(Cl)cc2Cl)n1 ZINC000409387045 570756926 /nfs/dbraw/zinc/75/69/26/570756926.db2.gz ZBGMQMPOFBPTDD-UHFFFAOYSA-N 0 0 353.196 5.403 40 0 FKABRN O=C(Cc1ccc(Cl)cc1)Sc1nc2cc3ccccc3cc2[nH]1 ZINC000409390890 571241333 /nfs/dbraw/zinc/24/13/33/571241333.db2.gz GDWKSHNIKKFSGE-UHFFFAOYSA-N 0 0 352.846 5.231 40 0 FKABRN O=C(Sc1nc2cc3ccccc3cc2[nH]1)c1cccc2ccccc21 ZINC000409390927 570755793 /nfs/dbraw/zinc/75/57/93/570755793.db2.gz GGPCUVBBAKRKLR-UHFFFAOYSA-N 0 0 354.434 5.802 40 0 FKABRN O=C(CSc1nc2cc3ccccc3cc2[nH]1)Nc1cccc(Cl)c1 ZINC000409392222 571242371 /nfs/dbraw/zinc/24/23/71/571242371.db2.gz OCUHXXYIPAFVQR-UHFFFAOYSA-N 0 0 367.861 5.100 40 0 FKABRN Brc1ccc(CSc2nc3cc4ccccc4cc3[nH]2)cc1 ZINC000409392321 570755950 /nfs/dbraw/zinc/75/59/50/570755950.db2.gz OYJKKJYGROZVKU-UHFFFAOYSA-N 0 0 369.287 5.771 40 0 FKABRN Clc1ccc(CSc2nc3cc4ccccc4cc3[nH]2)cc1Cl ZINC000409392363 571242348 /nfs/dbraw/zinc/24/23/48/571242348.db2.gz PHFYLJVIYVEEIB-UHFFFAOYSA-N 0 0 359.281 6.315 40 0 FKABRN Clc1ccc(CSc2nc3cc4ccccc4cc3[nH]2)c(Cl)c1 ZINC000409392366 263556347 /nfs/dbraw/zinc/55/63/47/263556347.db2.gz PIZBXXKIYJMGJP-UHFFFAOYSA-N 0 0 359.281 6.315 40 0 FKABRN O=C(CSc1nc2cc3ccccc3cc2[nH]1)Nc1ccc(Cl)cc1 ZINC000409392648 570755981 /nfs/dbraw/zinc/75/59/81/570755981.db2.gz QZRDYEXZBZQPQO-UHFFFAOYSA-N 0 0 367.861 5.100 40 0 FKABRN O=C(Sc1nc2cc3ccccc3cc2[nH]1)c1ccc2ccccc2c1 ZINC000409393718 571242329 /nfs/dbraw/zinc/24/23/29/571242329.db2.gz ZGSZOUBCSZLZAS-UHFFFAOYSA-N 0 0 354.434 5.802 40 0 FKABRN O=C(NCCSCc1cccc(Cl)c1)Nc1ccc(Cl)cc1 ZINC000409406348 570758184 /nfs/dbraw/zinc/75/81/84/570758184.db2.gz BWIXIIBGIFVFDA-UHFFFAOYSA-N 0 0 355.290 5.048 40 0 FKABRN O=C(NCCSCc1ccccc1Cl)Nc1cccc(Cl)c1 ZINC000409408423 570758481 /nfs/dbraw/zinc/75/84/81/570758481.db2.gz CNFMNXYHVKLJRJ-UHFFFAOYSA-N 0 0 355.290 5.048 40 0 FKABRN O=C(NCCSCc1ccc(Cl)cc1)Nc1cccc(Cl)c1 ZINC000409408954 263556658 /nfs/dbraw/zinc/55/66/58/263556658.db2.gz FJMXQSZZASIRNQ-UHFFFAOYSA-N 0 0 355.290 5.048 40 0 FKABRN Cc1ccc(SCc2ccc(C(=O)NC(C(C)C)C(C)C)cc2)cc1 ZINC000409409095 570447959 /nfs/dbraw/zinc/44/79/59/570447959.db2.gz MZZNSWBUYMCHHA-UHFFFAOYSA-N 0 0 355.547 5.698 40 0 FKABRN O=C(NCCSCc1c(F)cccc1Cl)Nc1ccc(Cl)cc1 ZINC000409411744 570757524 /nfs/dbraw/zinc/75/75/24/570757524.db2.gz KUTUGYUNSFGYQB-UHFFFAOYSA-N 0 0 373.280 5.187 40 0 FKABRN O=C(Nc1ccc(Cl)cc1)Nc1ccc(CSc2ccccc2)cc1 ZINC000409411852 263558183 /nfs/dbraw/zinc/55/81/83/263558183.db2.gz MGAVTKXYBPIOAH-UHFFFAOYSA-N 0 0 368.889 6.276 40 0 FKABRN Cc1ccc(Cl)cc1NC(=O)CSCc1c(F)cccc1Cl ZINC000409412336 263557833 /nfs/dbraw/zinc/55/78/33/263557833.db2.gz UQPGMYLEJZQHNF-UHFFFAOYSA-N 0 0 358.265 5.313 40 0 FKABRN Clc1ccc(-c2oc3nc4ccccc4nc3c2Br)cc1 ZINC000409441360 570447971 /nfs/dbraw/zinc/44/79/71/570447971.db2.gz OYLULPNOCYGGGD-UHFFFAOYSA-N 0 0 359.610 5.459 40 0 FKABRN Cc1sc(-c2cccc(C3=NC4=CC=CCC4=N3)c2)nc1-c1ccccc1 ZINC000521395835 571110793 /nfs/dbraw/zinc/11/07/93/571110793.db2.gz JNZKMOXUJUHFIS-UHFFFAOYSA-N 0 0 367.477 5.831 40 0 FKABRN c1sc(-c2cccc(C3=NC4=CC=CCC4=N3)c2)nc1-c1ccccc1 ZINC000521395840 571110720 /nfs/dbraw/zinc/11/07/20/571110720.db2.gz XLGSMTOZVGNAQW-UHFFFAOYSA-N 0 0 353.450 5.522 40 0 FKABRN Cc1c(Br)c(C(F)(F)F)nn1-c1c(Cl)cccc1Cl ZINC000536555958 570805108 /nfs/dbraw/zinc/80/51/08/570805108.db2.gz SCCNNECWVRRFSF-UHFFFAOYSA-N 0 0 373.987 5.269 40 0 FKABRN O=c1[nH]c(-c2cccc(OCc3ccccc3Cl)c2)nc2ccccc12 ZINC000575410915 571069230 /nfs/dbraw/zinc/06/92/30/571069230.db2.gz MANAGUQULHTCBD-UHFFFAOYSA-N 0 0 362.816 5.235 40 0 FKABRN CCC[C@H](F)Cn1cc(C(=O)Nc2cccc3ccccc32)c2ccccc21 ZINC000575440667 571069950 /nfs/dbraw/zinc/06/99/50/571069950.db2.gz HSKUHSPFXOBHMD-SFHVURJKSA-N 0 0 374.459 6.185 40 0 in-vitro FKABRN CCCCCn1nc(C(=O)OC23CC4CC(CC(C4)C2)C3)c2ccccc21 ZINC000575631032 571173888 /nfs/dbraw/zinc/17/38/88/571173888.db2.gz KCCVWUAAHDXNNQ-UHFFFAOYSA-N 0 0 366.505 5.352 40 0 in-vitro FKABRN C[C@H](F)CCCn1cc(C(=O)Nc2cccc3ccccc32)c2ccccc21 ZINC000575631068 571173881 /nfs/dbraw/zinc/17/38/81/571173881.db2.gz PSTMVUJRDHDKHN-KRWDZBQOSA-N 0 0 374.459 6.185 40 0 in-vitro FKABRN C[C@@H](F)CCCn1cc(C(=O)Nc2cccc3ccccc32)c2ccccc21 ZINC000575631069 571173907 /nfs/dbraw/zinc/17/39/07/571173907.db2.gz PSTMVUJRDHDKHN-QGZVFWFLSA-N 0 0 374.459 6.185 40 0 in-vitro FKABRN CC(=O)O[C@@H]1CC[C@]2(C)C(=CC[C@@H]3[C@H]4CC[C@@H](C(C)=O)[C@]4(C)CC[C@H]32)C1 ZINC000584577503 571151028 /nfs/dbraw/zinc/15/10/28/571151028.db2.gz CRRKVZVYZQXICQ-AKCLOJTASA-N 0 0 358.522 5.086 40 0 FKABRN CC(=O)Oc1cc2ccccc2c(-c2ccc(OC(C)=O)c3ccccc32)c1 ZINC000584577824 571151072 /nfs/dbraw/zinc/15/10/72/571151072.db2.gz OVJHVFPGAGZMKN-UHFFFAOYSA-N 0 0 370.404 5.511 40 0 FKABRN CCC[C@H]1CC[C@H](C2CCC(c3ccc(OCC)c(F)c3F)CC2)CC1 ZINC000584578755 570880672 /nfs/dbraw/zinc/88/06/72/570880672.db2.gz CFJCNWQXOICKIF-POSCCBCBSA-N 0 0 364.520 7.244 40 0 FKABRN COc1ccc(CNc2cc(Cl)nc3ccc(C(F)(F)F)cc32)cc1 ZINC000584905804 571156619 /nfs/dbraw/zinc/15/66/19/571156619.db2.gz AROJEYMLFTVRSJ-UHFFFAOYSA-N 0 0 366.770 5.528 40 0 FKABRN CCn1c(-c2ccccc2)c(C)sc1=Nc1cccc(C(F)(F)F)c1 ZINC000584905938 571156617 /nfs/dbraw/zinc/15/66/17/571156617.db2.gz YQSRSVBDZYZHNO-UHFFFAOYSA-N 0 0 362.420 5.796 40 0 FKABRN CCn1c(-c2ccc(Cl)cc2)csc1=Nc1c(C)cc(C)cc1C ZINC000584905954 571156565 /nfs/dbraw/zinc/15/65/65/571156565.db2.gz LFOYYBQILTZFGB-UHFFFAOYSA-N 0 0 356.922 6.048 40 0 FKABRN CCOc1ccc(C(C)C)cc1S(=O)(=O)NC(C)(C)CCC(C)(C)C ZINC000584906266 571156588 /nfs/dbraw/zinc/15/65/88/571156588.db2.gz SEDZTVCJMAWWAG-UHFFFAOYSA-N 0 0 369.571 5.092 40 0 FKABRN O=c1cc(O)c(-c2cccc(-c3cccc(Cl)c3Cl)c2)c(Cl)[nH]1 ZINC000585090178 571156689 /nfs/dbraw/zinc/15/66/89/571156689.db2.gz DQHZAJPNNKERLF-UHFFFAOYSA-N 0 0 366.631 5.787 40 0 FKABRN O=c1cc(O)c(-c2cccc(-c3ccc(F)c(Cl)c3)c2)c(Cl)[nH]1 ZINC000585090179 571156662 /nfs/dbraw/zinc/15/66/62/571156662.db2.gz FFTKWUANMZLOIE-UHFFFAOYSA-N 0 0 350.176 5.273 40 0 FKABRN CCN(Cc1cccc(Br)c1)c1cc(Cl)cc(Cl)c1 ZINC000585090186 571156623 /nfs/dbraw/zinc/15/66/23/571156623.db2.gz GDXXXNAXRQVOBS-UHFFFAOYSA-N 0 0 359.094 5.782 40 0 FKABRN CCN(Cc1cccc(Br)c1)c1ccc(Cl)c(Cl)c1 ZINC000585090198 571156606 /nfs/dbraw/zinc/15/66/06/571156606.db2.gz KCVAPUMYJYRWTI-UHFFFAOYSA-N 0 0 359.094 5.782 40 0 FKABRN CCN(Cc1cccc(Br)c1)c1cccc(OC(F)F)c1 ZINC000585090202 571156639 /nfs/dbraw/zinc/15/66/39/571156639.db2.gz LLUDVOORJIMHRR-UHFFFAOYSA-N 0 0 356.210 5.077 40 0 FKABRN O=c1cc(O)c(-c2cccc(-c3ccc(Cl)c(Cl)c3)c2)c(Cl)[nH]1 ZINC000585090252 571156611 /nfs/dbraw/zinc/15/66/11/571156611.db2.gz YHMBOMKCVOYYCW-UHFFFAOYSA-N 0 0 366.631 5.787 40 0 FKABRN CC[C@@H](C)C(=O)N1CC2(CCOCC2)c2cc(-c3cccc(C)c3)ccc21 ZINC000585105854 571156577 /nfs/dbraw/zinc/15/65/77/571156577.db2.gz UIYNFEVIRKDVAZ-GOSISDBHSA-N 0 0 363.501 5.103 40 0 FKABRN CC[C@H](C)C(=O)N1CC2(CCOCC2)c2cc(-c3cccc(C)c3)ccc21 ZINC000585105855 571156599 /nfs/dbraw/zinc/15/65/99/571156599.db2.gz UIYNFEVIRKDVAZ-SFHVURJKSA-N 0 0 363.501 5.103 40 0 FKABRN CC[C@@H](C)C(=O)N1CC2(CCOCC2)c2cc(-c3ccc(C)cc3)ccc21 ZINC000585105872 571156668 /nfs/dbraw/zinc/15/66/68/571156668.db2.gz VRXTYFDSGPZEDT-GOSISDBHSA-N 0 0 363.501 5.103 40 0 FKABRN CC[C@H](C)C(=O)N1CC2(CCOCC2)c2cc(-c3ccc(C)cc3)ccc21 ZINC000585105873 571156674 /nfs/dbraw/zinc/15/66/74/571156674.db2.gz VRXTYFDSGPZEDT-SFHVURJKSA-N 0 0 363.501 5.103 40 0 FKABRN Brc1cnc(OCc2ccccc2)c(OCc2ccccc2)c1 ZINC000585656383 571049255 /nfs/dbraw/zinc/04/92/55/571049255.db2.gz QETQJINSHFBNRZ-UHFFFAOYSA-N 0 0 370.246 5.002 40 0 FKABRN Cc1cccc([C@@H]2Nc3ccc(Br)cc3[C@@H]3OCCC[C@H]23)c1 ZINC000588228284 571204768 /nfs/dbraw/zinc/20/47/68/571204768.db2.gz MRZKWLTZYIIJDP-AYOQOUSVSA-N 0 0 358.279 5.392 40 0 FKABRN Fc1cccc([C@@H]2Nc3ccc(Br)cc3[C@@H]3OCCC[C@H]23)c1 ZINC000588228305 571204640 /nfs/dbraw/zinc/20/46/40/571204640.db2.gz ROQBYUBBWZYQQL-FHLIZLRMSA-N 0 0 362.242 5.223 40 0 FKABRN O=C(c1cc2c(cccc2Cl)s1)N1CCCC[C@H]1c1cccnc1 ZINC000604405460 571121615 /nfs/dbraw/zinc/12/16/15/571121615.db2.gz TZOFNJOBRFKMDR-INIZCTEOSA-N 0 0 356.878 5.317 40 0 FKABRN O=C(Cc1ccc(C2CCCCC2)cc1)Cc1ccc(C2CCCCC2)cc1 ZINC000685937244 571318930 /nfs/dbraw/zinc/31/89/30/571318930.db2.gz DDZCMCNATZJJDU-UHFFFAOYSA-N 0 0 374.568 7.136 40 0 FKABRN Cc1nn(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C)c1Cl ZINC000685937517 571318999 /nfs/dbraw/zinc/31/89/99/571318999.db2.gz IBHSRNBWFJVJPZ-UHFFFAOYSA-N 0 0 356.697 5.239 40 0 FKABRN Ic1ccc(Oc2cccc(-c3ccccc3)c2)nc1 ZINC000685937766 571319035 /nfs/dbraw/zinc/31/90/35/571319035.db2.gz PZNVKQHDVHKCBK-UHFFFAOYSA-N 0 0 373.193 5.146 40 0 FKABRN Ic1ccc(Oc2ccc(-c3ccccc3)cc2)nc1 ZINC000685937873 571318925 /nfs/dbraw/zinc/31/89/25/571318925.db2.gz YBPLYLZGIAAHJS-UHFFFAOYSA-N 0 0 373.193 5.146 40 0 FKABRN Ic1ccc(Oc2ccccc2-c2ccccc2)nc1 ZINC000685937886 571318934 /nfs/dbraw/zinc/31/89/34/571318934.db2.gz YZDDOWVNSWZHRT-UHFFFAOYSA-N 0 0 373.193 5.146 40 0 FKABRN