smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@]1(CNC(=O)N[C@@H](C(=O)[O-])c2cccs2)CCC[N@H+]1Cc1ccccc1 ZINC000397908503 939138528 /nfs/dbraw/zinc/13/85/28/939138528.db2.gz XSASRCZFBKWJMG-YLJYHZDGSA-N 0 1 387.505 3.228 10 0 GGAEMN CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H](C(=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000908706058 939306137 /nfs/dbraw/zinc/30/61/37/939306137.db2.gz HZLBLZOQRWXBHO-OAHLLOKOSA-N 0 1 389.418 3.108 10 0 GGAEMN C[N@@H+](CCCNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)Cc1ccccc1 ZINC000908759645 939315230 /nfs/dbraw/zinc/31/52/30/939315230.db2.gz DEQBVMSNFGKBQA-NRFANRHFSA-N 0 1 375.513 3.231 10 0 GGAEMN CC1(C)CCC[C@@](NC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908847182 939335301 /nfs/dbraw/zinc/33/53/01/939335301.db2.gz KPDZUASZJVWGEU-GCJKJVERSA-N 0 1 387.524 3.374 10 0 GGAEMN CC(C)[N@H+]1CCC[C@H](CNC(=O)N[C@H](C(=O)[O-])c2ccc3ccccc3c2)C1 ZINC000908903504 939347707 /nfs/dbraw/zinc/34/77/07/939347707.db2.gz FSIBEBKKFHIOOF-UZLBHIALSA-N 0 1 383.492 3.385 10 0 GGAEMN CC(C)[N@H+]1CCC[C@@H](CNC(=O)N[C@@H](C(=O)[O-])c2ccc3ccccc3c2)C1 ZINC000908903501 939347912 /nfs/dbraw/zinc/34/79/12/939347912.db2.gz FSIBEBKKFHIOOF-OXJNMPFZSA-N 0 1 383.492 3.385 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@@H](C(=O)[O-])c1ccc(Br)cc1 ZINC000908909862 939349365 /nfs/dbraw/zinc/34/93/65/939349365.db2.gz BTSTUWOVRAAGSR-BDJLRTHQSA-N 0 1 394.269 3.101 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@@H](C(=O)[O-])c1ccc(Br)cc1 ZINC000908909864 939349524 /nfs/dbraw/zinc/34/95/24/939349524.db2.gz BTSTUWOVRAAGSR-MEDUHNTESA-N 0 1 394.269 3.101 10 0 GGAEMN C[C@@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2ccccc2C1 ZINC000908914665 939351355 /nfs/dbraw/zinc/35/13/55/939351355.db2.gz ZXUAZDWXXSSCNA-AOMKIAJQSA-N 0 1 387.524 3.156 10 0 GGAEMN CC1(C)CCC[C@](NC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908924840 939353966 /nfs/dbraw/zinc/35/39/66/939353966.db2.gz MERFLCRAXFRJTA-PGRDOPGGSA-N 0 1 387.524 3.231 10 0 GGAEMN C[C@@](NC(=O)NC[C@]1(C)CCC[N@H+]1Cc1ccccc1)(C(=O)[O-])c1ccccc1 ZINC000908960003 939361831 /nfs/dbraw/zinc/36/18/31/939361831.db2.gz OOAQVZUHJJNMLN-GOTSBHOMSA-N 0 1 395.503 3.340 10 0 GGAEMN C[C@@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+](C)Cc1ccccc1 ZINC000908988993 939366983 /nfs/dbraw/zinc/36/69/83/939366983.db2.gz MKFMQSKTAVEGHR-KKSFZXQISA-N 0 1 375.513 3.230 10 0 GGAEMN C[C@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+](C)Cc1ccccc1 ZINC000908988986 939367290 /nfs/dbraw/zinc/36/72/90/939367290.db2.gz MKFMQSKTAVEGHR-IERDGZPVSA-N 0 1 375.513 3.230 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1)C1CCCCCC1 ZINC000908998794 939369218 /nfs/dbraw/zinc/36/92/18/939369218.db2.gz UTONDPNOGUYMRU-PMACEKPBSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1 ZINC000909071785 939377147 /nfs/dbraw/zinc/37/71/47/939377147.db2.gz ZHQPHWRTNQYKEY-NRJQMVOHSA-N 0 1 387.524 3.230 10 0 GGAEMN C[C@@H]1C[C@H](NC(=O)N[C@]2(C(=O)[O-])CCCC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000909094220 939380376 /nfs/dbraw/zinc/38/03/76/939380376.db2.gz HPYKRYRRWHQYFY-TVTNDZMWSA-N 0 1 387.524 3.372 10 0 GGAEMN CC[N@@H+](Cc1ccc(C(=O)N[C@H](C(=O)[O-])c2cccc(OC)c2)cc1)C(C)C ZINC000909944647 939744597 /nfs/dbraw/zinc/74/45/97/939744597.db2.gz KPUCDTIFHWTFGK-FQEVSTJZSA-N 0 1 384.476 3.481 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@H](C(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000910379498 939755347 /nfs/dbraw/zinc/75/53/47/939755347.db2.gz IPQUSSNPEJSJOG-ZBEGNZNMSA-N 0 1 383.370 3.358 10 0 GGAEMN CCCc1ccc(C(=O)N[C@]2(C(=O)[O-])CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001123268513 939817987 /nfs/dbraw/zinc/81/79/87/939817987.db2.gz RYHGBMGTWDFUHT-HSZRJFAPSA-N 0 1 380.488 3.488 10 0 GGAEMN Cc1ccc(CC(=O)N[C@]2(C(=O)[O-])CCC[N@@H+](Cc3ccccc3)C2)cc1C ZINC001123372878 939823378 /nfs/dbraw/zinc/82/33/78/939823378.db2.gz YBCOGPRRDFJERZ-HSZRJFAPSA-N 0 1 380.488 3.082 10 0 GGAEMN Cc1ccc(CC(=O)N[C@@]2(C(=O)[O-])CCC[N@@H+](Cc3ccccc3)C2)cc1C ZINC001123372879 939823529 /nfs/dbraw/zinc/82/35/29/939823529.db2.gz YBCOGPRRDFJERZ-QHCPKHFHSA-N 0 1 380.488 3.082 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CCCC2)[C@H]1c1ccc(F)c(F)c1 ZINC000663046931 939851159 /nfs/dbraw/zinc/85/11/59/939851159.db2.gz YESIRZBJBRROGS-GBESFXJTSA-N 0 1 394.462 3.496 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CCCC2)[C@H]1c1ccc(F)c(F)c1 ZINC000663046931 939851160 /nfs/dbraw/zinc/85/11/60/939851160.db2.gz YESIRZBJBRROGS-GBESFXJTSA-N 0 1 394.462 3.496 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CCCC2)[C@@H]1c1ccc(F)c(F)c1 ZINC000663046936 939851197 /nfs/dbraw/zinc/85/11/97/939851197.db2.gz YESIRZBJBRROGS-OTWHNJEPSA-N 0 1 394.462 3.496 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CCCC2)[C@@H]1c1ccc(F)c(F)c1 ZINC000663046936 939851199 /nfs/dbraw/zinc/85/11/99/939851199.db2.gz YESIRZBJBRROGS-OTWHNJEPSA-N 0 1 394.462 3.496 10 0 GGAEMN O=C([O-])[C@H](Cc1ccc2c(c1)OCO2)[NH2+]Cc1ncc(-c2ccccc2)s1 ZINC000426786950 1126090569 /nfs/dbraw/zinc/09/05/69/1126090569.db2.gz ZNUDTUQFGCKIFS-HNNXBMFYSA-N 0 1 382.441 3.324 10 0 GGAEMN COc1ccc(-c2nc(CNC3(CO)Cc4ccccc4C3)cs2)cc1OC ZINC000512307846 1126095587 /nfs/dbraw/zinc/09/55/87/1126095587.db2.gz GRGANJYASORILX-UHFFFAOYSA-N 0 1 396.512 3.447 10 0 GGAEMN COC(=O)c1ccc(-c2nc(CNC3(CO)Cc4ccccc4C3)cs2)cc1 ZINC000512292768 1126095607 /nfs/dbraw/zinc/09/56/07/1126095607.db2.gz BQUZJWJLJJYPCH-UHFFFAOYSA-N 0 1 394.496 3.216 10 0 GGAEMN COc1cc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc2c1OCCO2 ZINC000604766671 1126100385 /nfs/dbraw/zinc/10/03/85/1126100385.db2.gz ZCDPVSUGNQZESA-BEFAXECRSA-N 0 1 397.393 3.091 10 0 GGAEMN COc1cc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc2c1OCCO2 ZINC000604766676 1126100423 /nfs/dbraw/zinc/10/04/23/1126100423.db2.gz ZCDPVSUGNQZESA-DNVCBOLYSA-N 0 1 397.393 3.091 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@H](Cc3ccccc3)[C@H](O)C(F)(F)F)ccc21 ZINC000684379266 1126106469 /nfs/dbraw/zinc/10/64/69/1126106469.db2.gz XTIMUQBVSLYFFP-PBHICJAKSA-N 0 1 396.434 3.224 10 0 GGAEMN CC(C)(C)OC(=O)Nc1cnc(CN[C@](C)(CO)Cc2ccc(F)cc2)cn1 ZINC000865715194 1126114863 /nfs/dbraw/zinc/11/48/63/1126114863.db2.gz LISOKSOWRSZKMN-FQEVSTJZSA-N 0 1 390.459 3.046 10 0 GGAEMN CC(C)(C)OC(=O)Nc1cnc(CN[C@@](C)(CO)Cc2ccc(F)cc2)cn1 ZINC000865715195 1126114886 /nfs/dbraw/zinc/11/48/86/1126114886.db2.gz LISOKSOWRSZKMN-HXUWFJFHSA-N 0 1 390.459 3.046 10 0 GGAEMN C[C@@](CO)(Cc1ccc(F)cc1)NCc1ccn(-c2c(F)cccc2F)n1 ZINC001198231718 1126156077 /nfs/dbraw/zinc/15/60/77/1126156077.db2.gz WXESPRGNFDNNRI-FQEVSTJZSA-N 0 1 375.394 3.373 10 0 GGAEMN C[C@@](CO)(Cc1ccccc1F)NCc1ccn(-c2c(F)cccc2F)n1 ZINC001308117358 1126163348 /nfs/dbraw/zinc/16/33/48/1126163348.db2.gz IIQQCDBDOXOHOZ-FQEVSTJZSA-N 0 1 375.394 3.373 10 0 GGAEMN CCc1cc2c(C[NH2+][C@@](C)(CO)Cc3ccccc3OC)cc(=O)oc2cc1[O-] ZINC001620536935 1126240877 /nfs/dbraw/zinc/24/08/77/1126240877.db2.gz IDTRTUSGARFEHX-HSZRJFAPSA-N 0 1 397.471 3.153 10 0 GGAEMN COC(=O)c1ccc(-c2nc(CN[C@](C)(CO)Cc3ccccc3F)co2)cc1 ZINC001648466463 1126250600 /nfs/dbraw/zinc/25/06/00/1126250600.db2.gz IJCYKBYYOZQPKM-QFIPXVFZSA-N 0 1 398.434 3.351 10 0 GGAEMN Cc1nn(C)c(Cl)c1CN[C@](C)(CO)Cc1ccc(Br)cc1 ZINC001655737057 1126256329 /nfs/dbraw/zinc/25/63/29/1126256329.db2.gz ZOKMXNFJDSRSKY-INIZCTEOSA-N 0 1 386.721 3.228 10 0 GGAEMN CN(C[C@H]1COc2ccccc2O1)C(=O)CN(C)[C@H]1CCCc2ccccc21 ZINC000241588404 529972780 /nfs/dbraw/zinc/97/27/80/529972780.db2.gz PCXQMOCMSIGFOQ-ICSRJNTNSA-N 0 1 380.488 3.294 10 0 GGAEMN CCOC(=O)C1(c2ccccc2)CCN(CCC(=O)Nc2nccs2)CC1 ZINC000004474052 204045972 /nfs/dbraw/zinc/04/59/72/204045972.db2.gz WOPVVOHQVBTSLP-UHFFFAOYSA-N 0 1 387.505 3.069 10 0 GGAEMN Cc1cc(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)no1 ZINC000006146666 204168472 /nfs/dbraw/zinc/16/84/72/204168472.db2.gz IBUPGRNTFNWPET-UHFFFAOYSA-N 0 1 375.381 3.175 10 0 GGAEMN CC(=O)N1CCOc2cc(S(=O)(=O)Nc3ccccc3C)c(Cl)cc21 ZINC000006779706 204204225 /nfs/dbraw/zinc/20/42/25/204204225.db2.gz OJKTWDVYTORUTG-UHFFFAOYSA-N 0 1 380.853 3.195 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2c(c1)C[C@@H](C)N2C(=O)C1CC1 ZINC000006866805 204215985 /nfs/dbraw/zinc/21/59/85/204215985.db2.gz MKFWEMVZAOZRBF-CYBMUJFWSA-N 0 1 386.473 3.184 10 0 GGAEMN Nc1cccc(S(=O)(=O)Nc2ccccc2C(=O)OCc2ccccc2)c1 ZINC000006509821 204181429 /nfs/dbraw/zinc/18/14/29/204181429.db2.gz KEMFICPJXKLOTC-UHFFFAOYSA-N 0 1 382.441 3.427 10 0 GGAEMN CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)Nc1cccc2c1CCCC2 ZINC000006887619 204219660 /nfs/dbraw/zinc/21/96/60/204219660.db2.gz BYPHHXWZHYQOMV-UHFFFAOYSA-N 0 1 390.505 3.498 10 0 GGAEMN COC(=O)C1C(C)=NC(=O)N[C@@H]1c1ccc(N2CCC(c3ccccc3)=N2)cc1 ZINC000006754187 204200587 /nfs/dbraw/zinc/20/05/87/204200587.db2.gz FAVJBWXFPPFFSH-HXUWFJFHSA-N 0 1 390.443 3.102 10 0 GGAEMN COc1ccc2nc(SCC(=O)N3c4ccccc4NC(=O)C[C@@H]3C)[nH]c2c1 ZINC000006974972 204228019 /nfs/dbraw/zinc/22/80/19/204228019.db2.gz CHZKFYMYKWQMBJ-LBPRGKRZSA-N 0 1 396.472 3.428 10 0 GGAEMN C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CSc1nc(-c2cccs2)n[nH]1 ZINC000007161181 204235061 /nfs/dbraw/zinc/23/50/61/204235061.db2.gz YSMOJHZAWIZNJU-LLVKDONJSA-N 0 1 399.501 3.389 10 0 GGAEMN COc1ccc2nc(SCC(=O)N(C)Cc3ccc4c(c3)OCCO4)[nH]c2c1 ZINC000007219983 204236675 /nfs/dbraw/zinc/23/66/75/204236675.db2.gz ONNGZAKJIKHQRK-UHFFFAOYSA-N 0 1 399.472 3.093 10 0 GGAEMN Cc1sc2nc(CN3CCOCC3)nc(Nc3ccc4cn[nH]c4c3)c2c1C ZINC000008709993 204284844 /nfs/dbraw/zinc/28/48/44/204284844.db2.gz MOTJEGXAJVLIDF-UHFFFAOYSA-N 0 1 394.504 3.182 10 0 GGAEMN CC(=O)Nc1cc(C(=O)CSc2nnc(-c3ccoc3C)n2C)ccc1O ZINC000008707114 204284918 /nfs/dbraw/zinc/28/49/18/204284918.db2.gz HIPUVXSZZKVQMK-UHFFFAOYSA-N 0 1 386.433 3.023 10 0 GGAEMN Cn1cccc1[C@H]1CCCN1CC(=O)N1CCN(c2ccccc2Cl)CC1 ZINC000008780378 204289860 /nfs/dbraw/zinc/28/98/60/204289860.db2.gz SESLSZMJOLGXIQ-HXUWFJFHSA-N 0 1 386.927 3.164 10 0 GGAEMN O=C(C[C@@H]1Sc2ccccc2NC1=O)NC[C@H](c1ccco1)N1CCCC1 ZINC000008777802 204290602 /nfs/dbraw/zinc/29/06/02/204290602.db2.gz HKTDSCAIXANXNJ-QAPCUYQASA-N 0 1 385.489 3.036 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)/C=C/c2cc(C(=O)OC)c(C)o2)CC1 ZINC000008780454 204290628 /nfs/dbraw/zinc/29/06/28/204290628.db2.gz RDVOPGMMEQDNJM-MDZDMXLPSA-N 0 1 397.475 3.168 10 0 GGAEMN CCn1c(SCC(=O)c2ccc(O)c(NC(C)=O)c2)nnc1-c1ccco1 ZINC000008878725 204293039 /nfs/dbraw/zinc/29/30/39/204293039.db2.gz IWYRROSMOKZXHK-UHFFFAOYSA-N 0 1 386.433 3.197 10 0 GGAEMN C[C@@H](C(=O)NC(=O)NC1CCCCC1)N(C)CCOc1ccc(Cl)cc1 ZINC000008120600 204262179 /nfs/dbraw/zinc/26/21/79/204262179.db2.gz GLTNDLFWYIRHSI-AWEZNQCLSA-N 0 1 381.904 3.198 10 0 GGAEMN COc1ccccc1NC(=O)c1cncc(NS(=O)(=O)c2ccc(C)cc2)c1 ZINC000009151992 204301291 /nfs/dbraw/zinc/30/12/91/204301291.db2.gz GPTRHRZIVIKSLU-UHFFFAOYSA-N 0 1 397.456 3.452 10 0 GGAEMN Cc1ccc(N2C[C@H](C(=O)NC[C@@H](c3ccco3)N3CCCCC3)CC2=O)cc1 ZINC000009451263 204310617 /nfs/dbraw/zinc/31/06/17/204310617.db2.gz YYNAYXNPXNWTNI-QUCCMNQESA-N 0 1 395.503 3.284 10 0 GGAEMN Cc1ccc(N2C[C@@H](C(=O)NC[C@H](c3ccco3)N3CCCCC3)CC2=O)cc1 ZINC000009451276 204310849 /nfs/dbraw/zinc/31/08/49/204310849.db2.gz YYNAYXNPXNWTNI-AZUAARDMSA-N 0 1 395.503 3.284 10 0 GGAEMN COc1cn(CC(=O)Nc2cccc(C)c2)c(CN2CCC(C)CC2)cc1=O ZINC000009621970 204318065 /nfs/dbraw/zinc/31/80/65/204318065.db2.gz OXBZPSZXMIQVHS-UHFFFAOYSA-N 0 1 383.492 3.036 10 0 GGAEMN CCc1ccc(NC(=O)Cn2cc(OC)c(=O)cc2CN2CCCCCC2)cc1 ZINC000009622049 204318638 /nfs/dbraw/zinc/31/86/38/204318638.db2.gz AKZKFURGLMCPFS-UHFFFAOYSA-N 0 1 397.519 3.434 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2c(C)cccc2C)c1C(=O)N1CCCC1 ZINC000009684073 204318865 /nfs/dbraw/zinc/31/88/65/204318865.db2.gz MGBZNQRIEONGHW-UHFFFAOYSA-N 0 1 375.494 3.285 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2ccc(C)c(F)c2)c(C)n1C ZINC000009684817 204319678 /nfs/dbraw/zinc/31/96/78/204319678.db2.gz FZPTVWPALCASQJ-UHFFFAOYSA-N 0 1 393.484 3.126 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(C)c(C)c2)c1C(=O)N1CCCC1 ZINC000009684187 204319780 /nfs/dbraw/zinc/31/97/80/204319780.db2.gz ODJAJGAJEMGQQI-UHFFFAOYSA-N 0 1 375.494 3.285 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2C(=O)N2CCCC2)cc1 ZINC000009684125 204319786 /nfs/dbraw/zinc/31/97/86/204319786.db2.gz XHNXXPVUYVRMJJ-UHFFFAOYSA-N 0 1 391.493 3.067 10 0 GGAEMN Cc1c(C(=O)N2CCCCC2)c(S(=O)(=O)Nc2ccccc2C)c(C)n1C ZINC000009685033 204319842 /nfs/dbraw/zinc/31/98/42/204319842.db2.gz QDFJFSBZJUYVAK-UHFFFAOYSA-N 0 1 389.521 3.377 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2cccc(Cl)c2)c1C(=O)N1CCCC1 ZINC000009684044 204319861 /nfs/dbraw/zinc/31/98/61/204319861.db2.gz JDIFITNOVPVETL-UHFFFAOYSA-N 0 1 381.885 3.322 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(F)cc2C)c1C(=O)N1CCCC1 ZINC000009684285 204319866 /nfs/dbraw/zinc/31/98/66/204319866.db2.gz HPIGVQFMNRQTEX-UHFFFAOYSA-N 0 1 379.457 3.116 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(C)c(F)c2)c1C(=O)N1CCCC1 ZINC000009684247 204319904 /nfs/dbraw/zinc/31/99/04/204319904.db2.gz YKPPOHXBGHNEMX-UHFFFAOYSA-N 0 1 379.457 3.116 10 0 GGAEMN COc1cc(NC(=O)c2[nH]nc3c2CCc2ccccc2-3)cc(OC)c1OC ZINC000009728255 204321909 /nfs/dbraw/zinc/32/19/09/204321909.db2.gz YKOFKDYDFLKEPL-UHFFFAOYSA-N 0 1 379.416 3.453 10 0 GGAEMN CC1CCC2(CC1)NC(=O)N(NC(=O)c1cc3cc(Cl)ccc3o1)C2=O ZINC000009884814 204326731 /nfs/dbraw/zinc/32/67/31/204326731.db2.gz YOVFEGSVSVOUQU-UHFFFAOYSA-N 0 1 375.812 3.232 10 0 GGAEMN COc1cc(NC(=O)CSc2nc(C=Cc3ccco3)n[nH]2)cc(OC)c1 ZINC000010624032 204337314 /nfs/dbraw/zinc/33/73/14/204337314.db2.gz UINSPAJPCCYYCK-AATRIKPKSA-N 0 1 386.433 3.316 10 0 GGAEMN CNC(=O)[C@@H]1C[C@H](Sc2nc3ccccc3[nH]2)CN1Cc1cccc(C)c1 ZINC000011785147 204352587 /nfs/dbraw/zinc/35/25/87/204352587.db2.gz ZXFFIWWHQOHAEC-LPHOPBHVSA-N 0 1 380.517 3.353 10 0 GGAEMN Cc1c[nH]c(C(=O)N2CC[C@@H](C3CCN(Cc4cccc(F)c4F)CC3)C2)n1 ZINC000011819805 204355729 /nfs/dbraw/zinc/35/57/29/204355729.db2.gz CAWAZAOPWBZBFT-MRXNPFEDSA-N 0 1 388.462 3.371 10 0 GGAEMN Cc1ccc(CN(C)C(=O)CN2CCC[C@H](C(=O)Nc3ccccc3)C2)cc1 ZINC000012326992 204399435 /nfs/dbraw/zinc/39/94/35/204399435.db2.gz MWBMSVDVVAMTMO-FQEVSTJZSA-N 0 1 379.504 3.304 10 0 GGAEMN Cc1nc(C(=O)N2CC[C@@H](C3CCN(Cc4cccc(F)c4F)CC3)C2)c[nH]1 ZINC000012299902 204391577 /nfs/dbraw/zinc/39/15/77/204391577.db2.gz ZEBSTYDNMIDXSY-MRXNPFEDSA-N 0 1 388.462 3.371 10 0 GGAEMN Cc1ccc(CN(C)C(=O)CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)cc1 ZINC000012326998 204399289 /nfs/dbraw/zinc/39/92/89/204399289.db2.gz MWBMSVDVVAMTMO-HXUWFJFHSA-N 0 1 379.504 3.304 10 0 GGAEMN CCCN1CCN(C(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)CC1 ZINC000012820215 204454533 /nfs/dbraw/zinc/45/45/33/204454533.db2.gz PZUDYDICXDUDHM-SFHVURJKSA-N 0 1 379.932 3.039 10 0 GGAEMN CCOC(=O)C1=C(CN(C)c2ccc(F)cc2)NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000020214356 204705300 /nfs/dbraw/zinc/70/53/00/204705300.db2.gz AIONUTCNSBSJHU-FQEVSTJZSA-N 0 1 397.450 3.442 10 0 GGAEMN O=C(c1cc(-c2cn[nH]c2)nc2ccc(F)cc21)N1CCN2CCCC[C@@H]2C1 ZINC000020209469 204706838 /nfs/dbraw/zinc/70/68/38/204706838.db2.gz CAZXQPAKEYGHHZ-MRXNPFEDSA-N 0 1 379.439 3.074 10 0 GGAEMN C[NH+]1CCN([C@@H](c2sc3nc(-c4ccco4)nn3c2[O-])c2ccccc2)CC1 ZINC000022577345 204784222 /nfs/dbraw/zinc/78/42/22/204784222.db2.gz DAOSXKJUJSVTQJ-MRXNPFEDSA-N 0 1 395.488 3.093 10 0 GGAEMN CC(C)OC[C@H](O)CN(Cc1ccc(F)cc1)Cc1ccc2c(c1)OCO2 ZINC000036102565 205005558 /nfs/dbraw/zinc/00/55/58/205005558.db2.gz ZGNIUCXMGYMDAK-LJQANCHMSA-N 0 1 375.440 3.343 10 0 GGAEMN COCCCN(Cc1ccc(F)cc1F)C[C@@H](O)COCc1ccccc1 ZINC000036099707 205006249 /nfs/dbraw/zinc/00/62/49/205006249.db2.gz HDJVYNBBLVPTMZ-HXUWFJFHSA-N 0 1 379.447 3.381 10 0 GGAEMN CC(C)OC[C@@H](O)CN(Cc1ccc(F)cc1)Cc1ccc2c(c1)OCO2 ZINC000036102567 205006696 /nfs/dbraw/zinc/00/66/96/205006696.db2.gz ZGNIUCXMGYMDAK-IBGZPJMESA-N 0 1 375.440 3.343 10 0 GGAEMN Cc1ccc(C)c(Cc2c(C)nc(C)nc2N2CCN(CC(C)(C)O)CC2)c1 ZINC000036316566 205010900 /nfs/dbraw/zinc/01/09/00/205010900.db2.gz PWDXPLFLLUWWIP-UHFFFAOYSA-N 0 1 382.552 3.194 10 0 GGAEMN CCc1nc(C)nc(N2CCN(C[C@H](O)C(C)C)CC2)c1Cc1ccc(C)cc1 ZINC000036340621 205011058 /nfs/dbraw/zinc/01/10/58/205011058.db2.gz VCNXQJXWXYFFPO-QHCPKHFHSA-N 0 1 396.579 3.386 10 0 GGAEMN CCc1nc(C)nc(N2CCN(C[C@@H](O)C(C)C)CC2)c1Cc1ccc(C)cc1 ZINC000036340623 205011132 /nfs/dbraw/zinc/01/11/32/205011132.db2.gz VCNXQJXWXYFFPO-HSZRJFAPSA-N 0 1 396.579 3.386 10 0 GGAEMN CC[C@H](O)CN1CCN(c2nc(C)nc(C)c2Cc2cc(C)ccc2C)CC1 ZINC000036340300 205011492 /nfs/dbraw/zinc/01/14/92/205011492.db2.gz LMUFGNBIJOISGW-NRFANRHFSA-N 0 1 382.552 3.194 10 0 GGAEMN CCCC[C@@H](O)CN1CCN(c2nc(C)nc(C)c2Cc2ccccc2)CC1 ZINC000036340447 205011507 /nfs/dbraw/zinc/01/15/07/205011507.db2.gz QORZXCBRLUVTSH-OAQYLSRUSA-N 0 1 382.552 3.357 10 0 GGAEMN COc1cccc([C@H](CNC(=O)Cc2csc(-c3ccco3)n2)N(C)C)c1 ZINC000040051370 205048281 /nfs/dbraw/zinc/04/82/81/205048281.db2.gz IXWLDQPJVAWMLG-KRWDZBQOSA-N 0 1 385.489 3.373 10 0 GGAEMN COC(=O)c1ccc(CN(C)Cc2ccc(C(=O)NCC(F)(F)F)cc2)cc1 ZINC000040071660 205049595 /nfs/dbraw/zinc/04/95/95/205049595.db2.gz UVKQOLGVQYSPEN-UHFFFAOYSA-N 0 1 394.393 3.397 10 0 GGAEMN CN(C)[C@H](CNC(=O)Nc1cccc(-c2nnnn2C2CC2)c1)c1cccs1 ZINC000043946419 205085201 /nfs/dbraw/zinc/08/52/01/205085201.db2.gz PQCPZVXUSWBDPI-MRXNPFEDSA-N 0 1 397.508 3.161 10 0 GGAEMN CC(C)COc1ccccc1NC(=O)NC[C@H](O)CN1CCc2ccccc2C1 ZINC000048118032 205112532 /nfs/dbraw/zinc/11/25/32/205112532.db2.gz CIPRUHBCXCDGIM-FQEVSTJZSA-N 0 1 397.519 3.262 10 0 GGAEMN Cn1cnnc1-c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1 ZINC000047992027 205113606 /nfs/dbraw/zinc/11/36/06/205113606.db2.gz MZQZTBRQJJLWNC-UHFFFAOYSA-N 0 1 382.367 3.302 10 0 GGAEMN COc1cc(OC)c(OC)cc1CNCc1c[nH]nc1-c1ccc2c(c1)OCO2 ZINC000048375445 205123234 /nfs/dbraw/zinc/12/32/34/205123234.db2.gz FVTNUSRQEVNLPU-UHFFFAOYSA-N 0 1 397.431 3.121 10 0 GGAEMN Cc1c(F)cc(C(N)=O)cc1NS(=O)(=O)c1ccccc1C(F)(F)F ZINC000055615104 205150942 /nfs/dbraw/zinc/15/09/42/205150942.db2.gz JBOUSCALYCHBRT-UHFFFAOYSA-N 0 1 376.331 3.053 10 0 GGAEMN CCCN1CCN(C(=O)c2cnn(-c3ccc(C)cc3)c2-n2cccc2)CC1 ZINC000057996611 205163090 /nfs/dbraw/zinc/16/30/90/205163090.db2.gz QUDDZLBZQUOYGV-UHFFFAOYSA-N 0 1 377.492 3.139 10 0 GGAEMN CCOc1nnc(CSc2nc(-c3ccc(OC)cc3OC)n[nH]2)s1 ZINC000058217521 205171010 /nfs/dbraw/zinc/17/10/10/205171010.db2.gz XHYJQMWGZVAFKD-UHFFFAOYSA-N 0 1 379.467 3.031 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 ZINC000058281101 205172382 /nfs/dbraw/zinc/17/23/82/205172382.db2.gz IKMBBAAGPAQPTE-UHFFFAOYSA-N 0 1 383.496 3.489 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCN(Cc2ccccc2Br)CC1 ZINC000060363120 205181590 /nfs/dbraw/zinc/18/15/90/205181590.db2.gz LVFCJOMXHWENJV-UHFFFAOYSA-N 0 1 399.292 3.283 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCCS2 ZINC000064952187 205202574 /nfs/dbraw/zinc/20/25/74/205202574.db2.gz DRUBBHZNUOIITQ-UHFFFAOYSA-N 0 1 392.502 3.345 10 0 GGAEMN O=C(NCCc1nnc(-c2ccc(F)c(F)c2)[nH]1)c1ccc(Br)o1 ZINC000064969430 205203337 /nfs/dbraw/zinc/20/33/37/205203337.db2.gz BYFWTMDJIKAEST-UHFFFAOYSA-N 0 1 397.179 3.078 10 0 GGAEMN COc1ccc2oc(-c3noc(C(=O)NCCN4CCC(C)CC4)n3)c(C)c2c1 ZINC000065010355 205205731 /nfs/dbraw/zinc/20/57/31/205205731.db2.gz HNRJBEXOXJMYBR-UHFFFAOYSA-N 0 1 398.463 3.262 10 0 GGAEMN CCn1nc(-c2csc(S(=O)(=O)Nc3ccc(F)cc3F)c2)ccc1=O ZINC000065129008 205212068 /nfs/dbraw/zinc/21/20/68/205212068.db2.gz UPFVQIZMBGDZAP-UHFFFAOYSA-N 0 1 397.428 3.071 10 0 GGAEMN CC(C)CN1CCN(C(=O)c2csc(-c3ccc(N4CCCC4)nc3)n2)CC1 ZINC000065165272 205214044 /nfs/dbraw/zinc/21/40/44/205214044.db2.gz ISHKZGAVVLPHAA-UHFFFAOYSA-N 0 1 399.564 3.219 10 0 GGAEMN Cc1ccc(CC(=O)Nc2ccc(N3CCC[N@H+](C)CC3)cc2C(=O)[O-])cc1 ZINC000064589195 205192680 /nfs/dbraw/zinc/19/26/80/205192680.db2.gz XZJNKEGBFAIHBB-UHFFFAOYSA-N 0 1 381.476 3.016 10 0 GGAEMN COc1cc(CNC(=O)C2=CCN(Cc3ccc(F)cc3)CC2)cc(OC)c1 ZINC000064818071 205196164 /nfs/dbraw/zinc/19/61/64/205196164.db2.gz IMOBUTCYVBCLQH-UHFFFAOYSA-N 0 1 384.451 3.291 10 0 GGAEMN Cc1cc(Br)c(O)c(C(=O)NC[C@H]2COc3ccccc3C2)c1 ZINC000065521280 205236680 /nfs/dbraw/zinc/23/66/80/205236680.db2.gz KGNOHAZGAGDBSK-LBPRGKRZSA-N 0 1 376.250 3.444 10 0 GGAEMN Cc1nnc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2ccc(F)cc2C)o1 ZINC000065194112 205217384 /nfs/dbraw/zinc/21/73/84/205217384.db2.gz ZBUHLZGXVZJBRL-UHFFFAOYSA-N 0 1 378.429 3.249 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)Nc1cccn2c1nnc2C1CCC1 ZINC000065228818 205220782 /nfs/dbraw/zinc/22/07/82/205220782.db2.gz JRRHTRWYPMHGHY-UHFFFAOYSA-N 0 1 392.868 3.460 10 0 GGAEMN O=C(Cc1n[nH]c(Cc2ccc(Cl)cc2)n1)NCc1ccc(F)cc1F ZINC000065232823 205221006 /nfs/dbraw/zinc/22/10/06/205221006.db2.gz ZPRUXPRZXOYSTJ-UHFFFAOYSA-N 0 1 376.794 3.186 10 0 GGAEMN O=C(Cc1n[nH]c(Cc2ccc(F)cc2)n1)NCc1cccc(C(F)(F)F)c1 ZINC000065232789 205221167 /nfs/dbraw/zinc/22/11/67/205221167.db2.gz MEDUWWFHBOSKHZ-UHFFFAOYSA-N 0 1 392.356 3.412 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@H](c3[nH]ncc3Cc3ccccc3)C2)c(=O)[nH]1 ZINC000067714544 205256101 /nfs/dbraw/zinc/25/61/01/205256101.db2.gz FAUBGDLQNWXUAW-KRWDZBQOSA-N 0 1 376.460 3.017 10 0 GGAEMN Cn1cnc2cc(C(=O)N3CCC(c4[nH]ncc4-c4ccccc4)CC3)cnc21 ZINC000067741792 205258663 /nfs/dbraw/zinc/25/86/63/205258663.db2.gz QVJHNDHJJDOUBJ-UHFFFAOYSA-N 0 1 386.459 3.378 10 0 GGAEMN CN(C)c1ncc(CN2CCC(n3nccc3NC(=O)C(C)(C)C)CC2)s1 ZINC000067872902 205267141 /nfs/dbraw/zinc/26/71/41/205267141.db2.gz FLDIGJLYXHGCNR-UHFFFAOYSA-N 0 1 390.557 3.227 10 0 GGAEMN CC(C)(NC(=O)NC[C@H](c1ccco1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000069384393 205273705 /nfs/dbraw/zinc/27/37/05/205273705.db2.gz JZUGGMSOKINEII-QGZVFWFLSA-N 0 1 399.491 3.422 10 0 GGAEMN Cc1ccc(C(=O)NC[C@H]2CCCO2)c(C2CCN(Cc3ccccn3)CC2)n1 ZINC000096281656 205556067 /nfs/dbraw/zinc/55/60/67/205556067.db2.gz SKWVGUKHAHOCCD-HXUWFJFHSA-N 0 1 394.519 3.073 10 0 GGAEMN Cc1ccc(NC(=O)C2CCN(c3nc4[nH]cnc(=O)c4s3)CC2)cc1F ZINC000096331552 205559969 /nfs/dbraw/zinc/55/99/69/205559969.db2.gz VDJSOPCXMWAQQR-UHFFFAOYSA-N 0 1 387.440 3.095 10 0 GGAEMN Cc1cc(F)ccc1NC(=O)C1CCN(c2nc3[nH]cnc(=O)c3s2)CC1 ZINC000096331575 205561236 /nfs/dbraw/zinc/56/12/36/205561236.db2.gz KPJKGSFHFJGNBK-UHFFFAOYSA-N 0 1 387.440 3.095 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nnc(C3CC3)o2)cc1 ZINC000096379624 205563312 /nfs/dbraw/zinc/56/33/12/205563312.db2.gz BVHONRQKTRTMEX-UHFFFAOYSA-N 0 1 388.449 3.368 10 0 GGAEMN CN(CC(=O)OC(C)(C)C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000225414320 206045751 /nfs/dbraw/zinc/04/57/51/206045751.db2.gz RATMJKOGDBCVSD-UHFFFAOYSA-N 0 1 395.253 3.117 10 0 GGAEMN Cc1cc(C)c(NS(=O)(=O)c2cc3c(cc2Cl)n(C)c(=O)n3C)c(C)c1 ZINC000064976658 206106186 /nfs/dbraw/zinc/10/61/86/206106186.db2.gz AMFYTDDMCSHZPF-UHFFFAOYSA-N 0 1 393.896 3.256 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@H]1CCCN(C(=O)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000239366891 206124492 /nfs/dbraw/zinc/12/44/92/206124492.db2.gz AGONIMNQMLJPTE-SFHVURJKSA-N 0 1 382.460 3.490 10 0 GGAEMN CCN(CC)CC(=O)N1N=C(c2cccs2)C[C@H]1c1cccc(O)c1OC ZINC000242047939 206129337 /nfs/dbraw/zinc/12/93/37/206129337.db2.gz VRKVEOYGCIGZMA-INIZCTEOSA-N 0 1 387.505 3.482 10 0 GGAEMN CCCN1CCN(c2ncc3c(n2)CCN(Cc2cccc(Cl)c2)C3)CC1 ZINC000015779521 221344137 /nfs/dbraw/zinc/34/41/37/221344137.db2.gz YTAVRANNWBNZKE-UHFFFAOYSA-N 0 1 385.943 3.220 10 0 GGAEMN Cc1cc(N2CCCC2)nc(N2CCN(C(=O)CCCc3ccccc3)CC2)n1 ZINC000064593952 136157211 /nfs/dbraw/zinc/15/72/11/136157211.db2.gz VIEDKEWYTPJJKS-UHFFFAOYSA-N 0 1 393.535 3.057 10 0 GGAEMN Cc1ccc(NC(=O)N2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)c(C)c1 ZINC000064800102 136157674 /nfs/dbraw/zinc/15/76/74/136157674.db2.gz LKBQVCRVURJYOY-UHFFFAOYSA-N 0 1 394.523 3.356 10 0 GGAEMN Cc1ccc(Cl)cc1N1CCN(C(=O)c2cc(-c3cccnc3)[nH]n2)CC1 ZINC000085690397 136175372 /nfs/dbraw/zinc/17/53/72/136175372.db2.gz YMIJIUFSIZJPFS-UHFFFAOYSA-N 0 1 381.867 3.396 10 0 GGAEMN Oc1cccc(N2CCN(C[C@H](O)COc3cccc4ccccc43)CC2)c1 ZINC000153773621 136192438 /nfs/dbraw/zinc/19/24/38/136192438.db2.gz LLXIHMMXHLPBCW-NRFANRHFSA-N 0 1 378.472 3.107 10 0 GGAEMN Cc1ccc(Oc2nccnc2SCC(=O)NCCN2CCCCC2)cc1 ZINC000065110954 222100776 /nfs/dbraw/zinc/10/07/76/222100776.db2.gz WJADDFGESSMVMD-UHFFFAOYSA-N 0 1 386.521 3.272 10 0 GGAEMN Cc1nc(CCCC(=O)Nc2n[nH]c3nc(Br)ccc23)cs1 ZINC000408516158 534322498 /nfs/dbraw/zinc/32/24/98/534322498.db2.gz JEIMOCFKWSJUKZ-UHFFFAOYSA-N 0 1 380.271 3.447 10 0 GGAEMN Cc1ccc2c(=O)c(C(=O)NC[C@H](O)c3ccc(Cl)cc3Cl)c[n-]c2[nH+]1 ZINC000303441648 534401278 /nfs/dbraw/zinc/40/12/78/534401278.db2.gz FWAQKDPMFCEDFF-HNNXBMFYSA-N 0 1 392.242 3.414 10 0 GGAEMN CCn1nnc2cc(C(=O)NC[C@@H](c3ccc(OC)cc3)N3CCCC3)ccc21 ZINC000008231395 523761070 /nfs/dbraw/zinc/76/10/70/523761070.db2.gz LQNKRTZVLHUXFE-NRFANRHFSA-N 0 1 393.491 3.027 10 0 GGAEMN Cc1ccc(-n2nnc(C[N@H+]3CCC[C@H](C(=O)[O-])C3)c2-c2ccncc2)cc1F ZINC000057345472 525934366 /nfs/dbraw/zinc/93/43/66/525934366.db2.gz NLTWIGBDXWVWCZ-INIZCTEOSA-N 0 1 395.438 3.073 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)N(Cc2ccccn2)C2CC2)CC1 ZINC000043574827 535753326 /nfs/dbraw/zinc/75/33/26/535753326.db2.gz AHUDWAVQUOVJPI-UHFFFAOYSA-N 0 1 379.508 3.420 10 0 GGAEMN OC[C@@H]1CCCC[C@H]1NCc1ncc(Br)cc1Br ZINC000229603581 565927562 /nfs/dbraw/zinc/92/75/62/565927562.db2.gz NVNRJYQILJJYMV-JOYOIKCWSA-N 0 1 378.108 3.247 10 0 GGAEMN C[C@@H]1CN(C)C[C@@H](C)N1C(=O)c1cc(Br)cc(Br)c1 ZINC000536973002 566414479 /nfs/dbraw/zinc/41/44/79/566414479.db2.gz DSRDMUQRXSBHPZ-NXEZZACHSA-N 0 1 390.119 3.376 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1cccc(Br)c1 ZINC000116249254 564206510 /nfs/dbraw/zinc/20/65/10/564206510.db2.gz QIDJAHGNKWXSIN-KSSFIOAISA-N 0 1 388.309 3.485 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2cccc(Br)c2C)CCN1CCOC ZINC000117453201 564227709 /nfs/dbraw/zinc/22/77/09/564227709.db2.gz JHBBAOXJBDDXMV-AWEZNQCLSA-N 0 1 384.318 3.332 10 0 GGAEMN CCCN1C(=O)N=NC1SCc1cc(OC)c(OC)cc1Br ZINC000007831515 564241589 /nfs/dbraw/zinc/24/15/89/564241589.db2.gz BRLZNMXUEJPIAQ-UHFFFAOYSA-N 0 1 388.287 3.466 10 0 GGAEMN C[C@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1cccc(Cl)c1 ZINC000007918886 564242978 /nfs/dbraw/zinc/24/29/78/564242978.db2.gz HVLAGASYCGPMMW-LBPRGKRZSA-N 0 1 377.897 3.207 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1cccc(Cl)c1 ZINC000007918889 564243082 /nfs/dbraw/zinc/24/30/82/564243082.db2.gz HVLAGASYCGPMMW-GFCCVEGCSA-N 0 1 377.897 3.207 10 0 GGAEMN COC(=O)c1ccc(CN(C)C[C@H](c2cccs2)N2CCOCC2)s1 ZINC000119002560 564250212 /nfs/dbraw/zinc/25/02/12/564250212.db2.gz ABGUSHGUSKJWAT-OAHLLOKOSA-N 0 1 380.535 3.102 10 0 GGAEMN Cc1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)oc1C ZINC000119027995 564251096 /nfs/dbraw/zinc/25/10/96/564251096.db2.gz AGUHPOJOJRFSOX-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN Cc1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)oc1C ZINC000119027995 564251098 /nfs/dbraw/zinc/25/10/98/564251098.db2.gz AGUHPOJOJRFSOX-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN CCN1CCC[C@H](NC(=O)[C@@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000119167994 564257965 /nfs/dbraw/zinc/25/79/65/564257965.db2.gz ASAMCMNOFZEGIC-BBRMVZONSA-N 0 1 381.314 3.259 10 0 GGAEMN CN1CCN(c2ccc(CNC(=O)c3cc(Cl)sc3Cl)cn2)CC1 ZINC000011533486 564263888 /nfs/dbraw/zinc/26/38/88/564263888.db2.gz HSAATXOQMFEADS-UHFFFAOYSA-N 0 1 385.320 3.132 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)[nH]n1 ZINC000119304556 564264907 /nfs/dbraw/zinc/26/49/07/564264907.db2.gz DEDVNBLRDXWNAN-CHWSQXEVSA-N 0 1 386.253 3.315 10 0 GGAEMN Cc1nccn1-c1ccc([C@@H](C)NC(=O)CSc2n[nH]c(=S)s2)cc1 ZINC000119381885 564268224 /nfs/dbraw/zinc/26/82/24/564268224.db2.gz PQFWVHYVFRBKTG-SNVBAGLBSA-N 0 1 391.547 3.290 10 0 GGAEMN C[C@H](C(=O)Nc1cc(-c2nccn2C)n[nH]1)c1ccc(Br)s1 ZINC000119435996 564270984 /nfs/dbraw/zinc/27/09/84/564270984.db2.gz KQLUANKIPKMIKW-QMMMGPOBSA-N 0 1 380.271 3.376 10 0 GGAEMN CC(C)N(CCS(=O)(=O)c1ccc(Br)cc1)C1CCOCC1 ZINC000119649295 564280991 /nfs/dbraw/zinc/28/09/91/564280991.db2.gz NNBNGPACRHJKLQ-UHFFFAOYSA-N 0 1 390.343 3.112 10 0 GGAEMN CC(C)(C)n1cc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)cn1 ZINC000119739982 564286092 /nfs/dbraw/zinc/28/60/92/564286092.db2.gz QDDSSPSNFLPVPD-UHFFFAOYSA-N 0 1 389.301 3.476 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@@H](C)CS2 ZINC000015730838 564289732 /nfs/dbraw/zinc/28/97/32/564289732.db2.gz SHGKVWWJFGJIEB-NSHDSACASA-N 0 1 378.475 3.176 10 0 GGAEMN CN1C[C@H](NCc2csc(-c3cccc(Br)c3)n2)CCC1=O ZINC000119932677 564296022 /nfs/dbraw/zinc/29/60/22/564296022.db2.gz GWNBSYANGYJDAF-CYBMUJFWSA-N 0 1 380.311 3.283 10 0 GGAEMN O=C(Nc1ccccc1Br)N1CCC(CN2CCOCC2)CC1 ZINC000020532055 564306503 /nfs/dbraw/zinc/30/65/03/564306503.db2.gz LPGSZNZKYVXZLU-UHFFFAOYSA-N 0 1 382.302 3.025 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(Sc3nncn3C)cc2)c(C)s1 ZINC000021867362 564312360 /nfs/dbraw/zinc/31/23/60/564312360.db2.gz WFTUDVDNOGVVRO-UHFFFAOYSA-N 0 1 380.520 3.445 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)Nc2cccnc2Br)ccc1F ZINC000120471918 564320933 /nfs/dbraw/zinc/32/09/33/564320933.db2.gz ZHTXKTDAVUTYPB-UHFFFAOYSA-N 0 1 381.249 3.367 10 0 GGAEMN CC1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000120511420 564324126 /nfs/dbraw/zinc/32/41/26/564324126.db2.gz OLFNFXWFXHCUNP-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CC1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000120511420 564324127 /nfs/dbraw/zinc/32/41/27/564324127.db2.gz OLFNFXWFXHCUNP-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CC(=O)N1CCc2cc(NS(=O)(=O)c3cc(C)c(F)cc3Cl)ccc21 ZINC000120644558 564330399 /nfs/dbraw/zinc/33/03/99/564330399.db2.gz GPXQIYBTIHMRSM-UHFFFAOYSA-N 0 1 382.844 3.497 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(CS(C)(=O)=O)c2)c(Cl)cc1F ZINC000121123482 564353898 /nfs/dbraw/zinc/35/38/98/564353898.db2.gz FSVVLVLMSGANRG-UHFFFAOYSA-N 0 1 391.873 3.133 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3cccc(Br)c3C)CCO2)n[nH]1 ZINC000121353719 564366026 /nfs/dbraw/zinc/36/60/26/564366026.db2.gz AHSQWPCEHYZGAD-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc3c(c2)CCC(=O)N3C)c(Cl)cc1F ZINC000121438306 564369110 /nfs/dbraw/zinc/36/91/10/564369110.db2.gz UARPFJKUKHVJNI-UHFFFAOYSA-N 0 1 382.844 3.497 10 0 GGAEMN O[C@@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000121578405 564375238 /nfs/dbraw/zinc/37/52/38/564375238.db2.gz FHRZRRFTKTYTTE-YPMHNXCESA-N 0 1 375.778 3.493 10 0 GGAEMN Cc1ccc(CN2CCCN(Cc3cnn(C)c3)CC2)cc1Br ZINC000121571490 564375800 /nfs/dbraw/zinc/37/58/00/564375800.db2.gz PMVDIQGQVZAVHQ-UHFFFAOYSA-N 0 1 377.330 3.199 10 0 GGAEMN COc1ccsc1S(=O)(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000121626140 564378820 /nfs/dbraw/zinc/37/88/20/564378820.db2.gz AAOUQLAZRFHZTF-SWLSCSKDSA-N 0 1 386.564 3.180 10 0 GGAEMN Brc1ccc(-c2noc(CN3CCCC[C@H]3c3nnc[nH]3)n2)s1 ZINC000121706981 564382609 /nfs/dbraw/zinc/38/26/09/564382609.db2.gz UQGFWJWTDKMDJZ-VIFPVBQESA-N 0 1 395.286 3.406 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H](C)Cc2ccccc2Br)n[nH]1 ZINC000121885646 564391261 /nfs/dbraw/zinc/39/12/61/564391261.db2.gz BHXAKRJVOZVXLJ-VXGBXAGGSA-N 0 1 379.302 3.342 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H](C)Cc2ccccc2Br)n[nH]1 ZINC000121885342 564391512 /nfs/dbraw/zinc/39/15/12/564391512.db2.gz BHXAKRJVOZVXLJ-NWDGAFQWSA-N 0 1 379.302 3.342 10 0 GGAEMN O=C(Cc1nc2cc3c(cc2[nH]c1=O)OCCCO3)c1ccc(Cl)s1 ZINC000032876209 564406677 /nfs/dbraw/zinc/40/66/77/564406677.db2.gz LHLGOSUDLWNSIU-UHFFFAOYSA-N 0 1 376.821 3.225 10 0 GGAEMN Cc1cccc(Cc2nc(CCNC(=O)c3ccc(Br)cc3)n[nH]2)c1 ZINC000035509234 564415456 /nfs/dbraw/zinc/41/54/56/564415456.db2.gz IPUQYSLQHDVQST-UHFFFAOYSA-N 0 1 399.292 3.439 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2cc(Cl)c(C)cc2Br)c1 ZINC000123044035 564436840 /nfs/dbraw/zinc/43/68/40/564436840.db2.gz VUTFYUXXJZEFQE-UHFFFAOYSA-N 0 1 378.679 3.428 10 0 GGAEMN COC(=O)[C@@H]1CCCCN1C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1 ZINC000042647470 564448895 /nfs/dbraw/zinc/44/88/95/564448895.db2.gz JMZWHPHTYWPODM-HNNXBMFYSA-N 0 1 392.253 3.007 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@H]3C[C@H]3c3cccc(Br)c3)cc21 ZINC000124078404 564471119 /nfs/dbraw/zinc/47/11/19/564471119.db2.gz QFZIILLGNZYRCW-STQMWFEESA-N 0 1 399.248 3.167 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000124387095 564480400 /nfs/dbraw/zinc/48/04/00/564480400.db2.gz IUPVVYPNQMYLTC-AWEZNQCLSA-N 0 1 396.329 3.475 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)CCc3cc(Br)cs3)cc21 ZINC000124445118 564482973 /nfs/dbraw/zinc/48/29/73/564482973.db2.gz YPBWJVXSTNERNF-UHFFFAOYSA-N 0 1 393.266 3.057 10 0 GGAEMN CC1=C(C(=O)OC(C)(C)C)[C@H](c2ccccc2Br)n2nnnc2N1 ZINC000045896105 564491225 /nfs/dbraw/zinc/49/12/25/564491225.db2.gz FTYJZOBJSZECMS-ZDUSSCGKSA-N 0 1 392.257 3.066 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H]2CCc3c2cccc3Br)n[nH]1 ZINC000124759370 564491312 /nfs/dbraw/zinc/49/13/12/564491312.db2.gz BFKCPHHKMRBVAB-QLJPJBMISA-N 0 1 377.286 3.398 10 0 GGAEMN Cc1cc(NC(=O)N(C)Cc2nnc[nH]2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000481137652 564504342 /nfs/dbraw/zinc/50/43/42/564504342.db2.gz KVBKFYKKROTBAG-UHFFFAOYSA-N 0 1 380.239 3.270 10 0 GGAEMN C[C@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CCC1 ZINC000125204919 564506796 /nfs/dbraw/zinc/50/67/96/564506796.db2.gz HWPUTWKMRSEFQP-JTQLQIEISA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCC1 ZINC000125204919 564506799 /nfs/dbraw/zinc/50/67/99/564506799.db2.gz HWPUTWKMRSEFQP-JTQLQIEISA-N 0 1 378.274 3.222 10 0 GGAEMN O=C(COc1cc(Cl)c(Cl)cc1Cl)NCCCCN1CCOCC1 ZINC000048286626 564535612 /nfs/dbraw/zinc/53/56/12/564535612.db2.gz GCZKNGNXZXIUGW-UHFFFAOYSA-N 0 1 395.714 3.254 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(-c3nnc(N(C)C)o3)cc2)c(C)s1 ZINC000126317014 564544475 /nfs/dbraw/zinc/54/44/75/564544475.db2.gz CSMAYCCOXZJICM-UHFFFAOYSA-N 0 1 378.479 3.282 10 0 GGAEMN Cc1nc([C@H](NC(=O)Nc2cncc(Br)c2)c2ccccc2)n[nH]1 ZINC000126506779 564551334 /nfs/dbraw/zinc/55/13/34/564551334.db2.gz MMLQHOYSDIFDSG-CQSZACIVSA-N 0 1 387.241 3.182 10 0 GGAEMN CN(C)C[C@H](NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 ZINC000049379369 564551630 /nfs/dbraw/zinc/55/16/30/564551630.db2.gz MLLYDFALIPRSKH-INIZCTEOSA-N 0 1 380.275 3.351 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)N[C@@H]1CCN(C2CC2)C1 ZINC000051380790 564563419 /nfs/dbraw/zinc/56/34/19/564563419.db2.gz IKIJISSDNDXRON-CYBMUJFWSA-N 0 1 387.318 3.174 10 0 GGAEMN O=C(CSc1nc(C(F)(F)F)cc(=O)[nH]1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000126994121 564569753 /nfs/dbraw/zinc/56/97/53/564569753.db2.gz OHMRWKDUBAOXDI-SSDOTTSWSA-N 0 1 389.321 3.094 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CSc1nc(C(F)(F)F)cc(=O)[nH]1 ZINC000127040308 564571567 /nfs/dbraw/zinc/57/15/67/564571567.db2.gz BRVRIQZLVHYRFI-UHFFFAOYSA-N 0 1 391.337 3.340 10 0 GGAEMN O=C(Nc1ccc(I)cc1)c1cc(=O)c2ccccc2[nH]1 ZINC000052634109 564575238 /nfs/dbraw/zinc/57/52/38/564575238.db2.gz SLRXLJYCKVWNLO-UHFFFAOYSA-N 0 1 390.180 3.385 10 0 GGAEMN Cc1noc([C@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000052862386 564578490 /nfs/dbraw/zinc/57/84/90/564578490.db2.gz LZACBSRJCGZLES-STQMWFEESA-N 0 1 386.279 3.304 10 0 GGAEMN Cc1cc(C(=O)N2[C@@H](C)CN(C)C[C@@H]2C)c2ccc(Br)cc2n1 ZINC000127297906 564580047 /nfs/dbraw/zinc/58/00/47/564580047.db2.gz OXYJXTKKSSQMBW-STQMWFEESA-N 0 1 376.298 3.470 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@@H]2CCC[C@H]21 ZINC000053376298 564587049 /nfs/dbraw/zinc/58/70/49/564587049.db2.gz BTTLOZUAEJJCID-HZPDHXFCSA-N 0 1 376.254 3.233 10 0 GGAEMN O=C1NCCN1C1CCN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000127664713 564591689 /nfs/dbraw/zinc/59/16/89/564591689.db2.gz BFAUBEGYLQGDPP-UHFFFAOYSA-N 0 1 382.291 3.259 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)c1cnn2c1CCCC2 ZINC000127977919 564602576 /nfs/dbraw/zinc/60/25/76/564602576.db2.gz KSRRNKSTHXBIPZ-UHFFFAOYSA-N 0 1 387.241 3.019 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000054815106 564610271 /nfs/dbraw/zinc/61/02/71/564610271.db2.gz ADYORDZKVGXCDD-HNNXBMFYSA-N 0 1 393.285 3.236 10 0 GGAEMN Cn1cc([C@H]2CCN(Cc3cc(Br)c4c(c3)OCCCO4)C2)cn1 ZINC000128359828 564616342 /nfs/dbraw/zinc/61/63/42/564616342.db2.gz FEUGKWHITBFXFC-AWEZNQCLSA-N 0 1 392.297 3.333 10 0 GGAEMN COc1nc(C)c(Br)cc1C(=O)Nc1cc(C(F)(F)F)n[nH]1 ZINC000485515109 564618051 /nfs/dbraw/zinc/61/80/51/564618051.db2.gz KMOGFEYTAUQZPV-UHFFFAOYSA-N 0 1 379.136 3.155 10 0 GGAEMN O=C(Nc1cccc(I)c1)c1cc(=O)c2ccccc2[nH]1 ZINC000055544712 564623364 /nfs/dbraw/zinc/62/33/64/564623364.db2.gz TZBWTSUCBKEVKI-UHFFFAOYSA-N 0 1 390.180 3.385 10 0 GGAEMN Cc1ccc(Br)c(NC(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c1 ZINC000128996203 564636187 /nfs/dbraw/zinc/63/61/87/564636187.db2.gz ZQSSCBMXGXIRRR-CQSZACIVSA-N 0 1 396.329 3.475 10 0 GGAEMN Cc1cc(=O)[nH]c(-c2ccc(NS(=O)(=O)c3ccccc3Cl)cc2)n1 ZINC000129114035 564639063 /nfs/dbraw/zinc/63/90/63/564639063.db2.gz SFWMDKHKZZQLMS-UHFFFAOYSA-N 0 1 375.837 3.200 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc(I)cc1)N1CCCSCC1 ZINC000129429786 564648544 /nfs/dbraw/zinc/64/85/44/564648544.db2.gz CBQUEZOTUPFSAQ-NSHDSACASA-N 0 1 390.290 3.057 10 0 GGAEMN C[C@@H](Sc1nc2ccccc2s1)C(=O)NCCCCN1CCOCC1 ZINC000129504297 564651111 /nfs/dbraw/zinc/65/11/11/564651111.db2.gz HRJGMZRLRZOCKC-CQSZACIVSA-N 0 1 379.551 3.006 10 0 GGAEMN CC[C@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000129771487 564660151 /nfs/dbraw/zinc/66/01/51/564660151.db2.gz USDYWGSBYRGMEK-NSHDSACASA-N 0 1 378.274 3.176 10 0 GGAEMN CC[C@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000129771487 564660153 /nfs/dbraw/zinc/66/01/53/564660153.db2.gz USDYWGSBYRGMEK-NSHDSACASA-N 0 1 378.274 3.176 10 0 GGAEMN Cn1ncc(Br)c1CNCCCNc1ccc(C(F)(F)F)cn1 ZINC000486931212 564670945 /nfs/dbraw/zinc/67/09/45/564670945.db2.gz AWMLMLGGDFYXBR-UHFFFAOYSA-N 0 1 392.223 3.188 10 0 GGAEMN COCc1ccc(CN2CCN(c3ccc(Br)cn3)CC2)cc1 ZINC000130377444 564679495 /nfs/dbraw/zinc/67/94/95/564679495.db2.gz PSSMASAWOXAYTF-UHFFFAOYSA-N 0 1 376.298 3.313 10 0 GGAEMN Cc1cccc2nc(CN[C@H](C(N)=O)c3ccc(Br)cc3F)[nH]c21 ZINC000130517408 564685037 /nfs/dbraw/zinc/68/50/37/564685037.db2.gz UMNKPRXUINDGEF-INIZCTEOSA-N 0 1 391.244 3.089 10 0 GGAEMN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(C(N)=O)cc1)c1cccc(Br)c1 ZINC000130923206 564695400 /nfs/dbraw/zinc/69/54/00/564695400.db2.gz ZYARFRGLULVFIW-NEPJUHHUSA-N 0 1 390.281 3.226 10 0 GGAEMN CC(C)(C)OC(=O)CSCC(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000130937825 564696176 /nfs/dbraw/zinc/69/61/76/564696176.db2.gz JHRMLFIRKSHCFZ-CQSZACIVSA-N 0 1 384.567 3.076 10 0 GGAEMN COC(=O)c1cc(C)ccc1S(=O)(=O)Nc1ccc(Br)cc1 ZINC000131426326 564710939 /nfs/dbraw/zinc/71/09/39/564710939.db2.gz OPMWRUKTQBNCHW-UHFFFAOYSA-N 0 1 384.251 3.345 10 0 GGAEMN Cc1ccsc1-c1nsc(NC(=O)c2cc(S(C)(=O)=O)cs2)n1 ZINC000131467383 564713033 /nfs/dbraw/zinc/71/30/33/564713033.db2.gz TUTJRNWVRMLIGX-UHFFFAOYSA-N 0 1 385.517 3.292 10 0 GGAEMN CNS(=O)(=O)c1cccc(CN[C@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000131947787 564729097 /nfs/dbraw/zinc/72/90/97/564729097.db2.gz GJIOZHYDFKMAGL-KRWDZBQOSA-N 0 1 380.897 3.252 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)NCCN1CCCCC1 ZINC000065101516 564739846 /nfs/dbraw/zinc/73/98/46/564739846.db2.gz HKFSWAMZQRLEQT-UHFFFAOYSA-N 0 1 389.334 3.424 10 0 GGAEMN CN(C)c1nc(CSc2nc(-c3ccccc3Br)n[nH]2)ns1 ZINC000132398662 564742496 /nfs/dbraw/zinc/74/24/96/564742496.db2.gz IYTUKYPVMAQUDO-UHFFFAOYSA-N 0 1 397.327 3.444 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)C(=O)NCCCCN1CCOCC1 ZINC000132928699 564757740 /nfs/dbraw/zinc/75/77/40/564757740.db2.gz ISNYLKQEVDUXIN-MRXNPFEDSA-N 0 1 397.357 3.246 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCO[C@@H](c2ccccc2Br)C1 ZINC000134220795 564796455 /nfs/dbraw/zinc/79/64/55/564796455.db2.gz JVPGRNJMHGOUFD-SJKOYZFVSA-N 0 1 390.281 3.192 10 0 GGAEMN C[C@@H](CNC(=O)[C@@H]1CCCc2[nH]ncc21)Oc1ccccc1Br ZINC000134467973 564804574 /nfs/dbraw/zinc/80/45/74/564804574.db2.gz ICSANHWQQAOALP-NWDGAFQWSA-N 0 1 378.270 3.176 10 0 GGAEMN CC(C)(C)N(Cc1ccccc1Br)C[C@@H](O)CN1CCCC1=O ZINC000134865669 564816950 /nfs/dbraw/zinc/81/69/50/564816950.db2.gz GVNDGWNEVMWNEJ-HNNXBMFYSA-N 0 1 383.330 3.033 10 0 GGAEMN CN1CC[C@@H](CNC(=O)NCc2cscn2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135285053 564827203 /nfs/dbraw/zinc/82/72/03/564827203.db2.gz HGTOPAAJZIARNK-LRDDRELGSA-N 0 1 382.892 3.428 10 0 GGAEMN O=C(CC1CCSCC1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000135677012 564838271 /nfs/dbraw/zinc/83/82/71/564838271.db2.gz LKVTXVJGNCGHFY-UHFFFAOYSA-N 0 1 395.326 3.384 10 0 GGAEMN O=C(CC1CCSCC1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000135677012 564838277 /nfs/dbraw/zinc/83/82/77/564838277.db2.gz LKVTXVJGNCGHFY-UHFFFAOYSA-N 0 1 395.326 3.384 10 0 GGAEMN COc1c(Br)cc(CNCc2ccnn2C)cc1Br ZINC000070141322 564849628 /nfs/dbraw/zinc/84/96/28/564849628.db2.gz LKBYQRCQTOWTMC-UHFFFAOYSA-N 0 1 389.091 3.244 10 0 GGAEMN C[C@@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000084063650 564868805 /nfs/dbraw/zinc/86/88/05/564868805.db2.gz BQGABDJVAXDGMB-MWLCHTKSSA-N 0 1 390.119 3.483 10 0 GGAEMN C[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1nnc2ccccn21 ZINC000070869434 564852168 /nfs/dbraw/zinc/85/21/68/564852168.db2.gz APGGXUAUCBOGQD-RYUDHWBXSA-N 0 1 381.263 3.127 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cc3n[nH]cc3cc2C)cc1Cl ZINC000137438289 564862485 /nfs/dbraw/zinc/86/24/85/564862485.db2.gz AGWFMQOYABMALX-UHFFFAOYSA-N 0 1 379.825 3.112 10 0 GGAEMN C[C@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000084063652 564869416 /nfs/dbraw/zinc/86/94/16/564869416.db2.gz BQGABDJVAXDGMB-ONGXEEELSA-N 0 1 390.119 3.483 10 0 GGAEMN CCOc1c(Br)cc(CN2CCCC[C@H]2CC(N)=O)cc1OC ZINC000092588386 564878299 /nfs/dbraw/zinc/87/82/99/564878299.db2.gz DTRHAFABWBKZAB-ZDUSSCGKSA-N 0 1 385.302 3.086 10 0 GGAEMN CCOc1cc(CN2CCCC[C@H]2CC(N)=O)cc(Br)c1OC ZINC000092588741 564878500 /nfs/dbraw/zinc/87/85/00/564878500.db2.gz RHLZLZNMTSJFLD-ZDUSSCGKSA-N 0 1 385.302 3.086 10 0 GGAEMN CCOc1cc(CN2CCCC[C@@H]2CC(N)=O)cc(Br)c1OC ZINC000092588740 564878814 /nfs/dbraw/zinc/87/88/14/564878814.db2.gz RHLZLZNMTSJFLD-CYBMUJFWSA-N 0 1 385.302 3.086 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1CCCC[C@@H]1CC(N)=O ZINC000092588989 564879562 /nfs/dbraw/zinc/87/95/62/564879562.db2.gz DATTUUUKBQMHJY-MRXNPFEDSA-N 0 1 399.329 3.094 10 0 GGAEMN CCC(=O)N[C@H]1CCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000092705677 564880670 /nfs/dbraw/zinc/88/06/70/564880670.db2.gz VSQDTBGIFAMPOC-INIZCTEOSA-N 0 1 379.298 3.216 10 0 GGAEMN O=C(c1cc2c(cc(Br)cc2F)[nH]1)N1CCCN(C2CC2)CC1 ZINC000148974105 564884981 /nfs/dbraw/zinc/88/49/81/564884981.db2.gz LIYMCBRGWYCFHE-UHFFFAOYSA-N 0 1 380.261 3.380 10 0 GGAEMN NC(=O)c1c(F)cc(Br)cc1NCCN1CCc2sccc2C1 ZINC000094149554 564897131 /nfs/dbraw/zinc/89/71/31/564897131.db2.gz XEHFLOJZOGRVRT-UHFFFAOYSA-N 0 1 398.301 3.219 10 0 GGAEMN C[C@@H]1CN2CCCC[C@@H]2CN1C(=O)c1csc(I)c1 ZINC000096658524 564903044 /nfs/dbraw/zinc/90/30/44/564903044.db2.gz IFUKBNLXCJNFEE-ZYHUDNBSSA-N 0 1 390.290 3.052 10 0 GGAEMN C[C@H](NC[C@@H]1CCC(=O)N1)c1ccc(Br)cc1Br ZINC000096715538 564903350 /nfs/dbraw/zinc/90/33/50/564903350.db2.gz AZYOCPZPCRVNCH-WPRPVWTQSA-N 0 1 376.092 3.141 10 0 GGAEMN CC[C@](O)(CNC(=O)[C@H]1CCCc2[nH]ncc21)c1ccc(Br)cc1 ZINC000151161736 564908145 /nfs/dbraw/zinc/90/81/45/564908145.db2.gz CYDYGHFAGVXHTM-KSSFIOAISA-N 0 1 392.297 3.006 10 0 GGAEMN O=C(NCCNCc1cccc2c1OCCO2)c1ccc(Cl)c(Cl)c1 ZINC000097497841 564908637 /nfs/dbraw/zinc/90/86/37/564908637.db2.gz DQWPUYGONVPWQK-UHFFFAOYSA-N 0 1 381.259 3.284 10 0 GGAEMN O=C(Nc1ccn(-c2ccc(Br)cc2)n1)[C@H]1CCCc2[nH]ncc21 ZINC000498863833 564910453 /nfs/dbraw/zinc/91/04/53/564910453.db2.gz CXQGYXKGXNPTKD-ZDUSSCGKSA-N 0 1 386.253 3.417 10 0 GGAEMN COc1ccc(C(=O)C=C(O)C(=O)Nc2ccccc2Br)cc1 ZINC000101354893 564915549 /nfs/dbraw/zinc/91/55/49/564915549.db2.gz OMUAWDNCPPAWLJ-UHFFFAOYSA-N 0 1 376.206 3.238 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC2(c3ccc(Br)cc3)CC2)n[nH]1 ZINC000151362997 564916249 /nfs/dbraw/zinc/91/62/49/564916249.db2.gz ZWDFLROCPQACMR-NSHDSACASA-N 0 1 377.286 3.400 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000101564082 564917823 /nfs/dbraw/zinc/91/78/23/564917823.db2.gz BLGRZGASDWCLAB-KBPBESRZSA-N 0 1 389.323 3.114 10 0 GGAEMN COc1ccc(Br)c(CC(=O)Nc2cccc(-c3nnc[nH]3)c2)c1 ZINC000151557357 564926557 /nfs/dbraw/zinc/92/65/57/564926557.db2.gz BLZCCWVPYMLZBF-UHFFFAOYSA-N 0 1 387.237 3.424 10 0 GGAEMN CCOC(=O)C1CCN(C(=O)CN[C@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000102686958 564932649 /nfs/dbraw/zinc/93/26/49/564932649.db2.gz CRRBIOQIDMHTQI-GFCCVEGCSA-N 0 1 387.307 3.446 10 0 GGAEMN Cc1ccc(CS(=O)(=O)c2nc3cc(Br)c(C)[nH]c-3n2)cc1 ZINC000152026270 564944318 /nfs/dbraw/zinc/94/43/18/564944318.db2.gz WABJATKWLKTTME-UHFFFAOYSA-N 0 1 380.267 3.311 10 0 GGAEMN C[C@@H]1CC[C@H](C(N)=O)CN1CCOc1ccc(Cl)cc1Br ZINC000103286240 564945729 /nfs/dbraw/zinc/94/57/29/564945729.db2.gz ARJNBEPWVQJIHE-MNOVXSKESA-N 0 1 375.694 3.067 10 0 GGAEMN COCc1c(Br)cccc1NC(=O)N1CCN2CCCC[C@H]2C1 ZINC000105028545 564962620 /nfs/dbraw/zinc/96/26/20/564962620.db2.gz IVRJLADIBOYOIP-ZDUSSCGKSA-N 0 1 382.302 3.298 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NC1CCCCC1 ZINC000105570044 564968762 /nfs/dbraw/zinc/96/87/62/564968762.db2.gz OIJXVKRBZVKMLR-UHFFFAOYSA-N 0 1 378.274 3.366 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NC1CCCCC1 ZINC000105570044 564968767 /nfs/dbraw/zinc/96/87/67/564968767.db2.gz OIJXVKRBZVKMLR-UHFFFAOYSA-N 0 1 378.274 3.366 10 0 GGAEMN Cc1nc(C[C@H]2CCC[N@@H+](C[C@H](O)c3ccccc3Br)C2)no1 ZINC000152890498 564975340 /nfs/dbraw/zinc/97/53/40/564975340.db2.gz JRQWWGKZHPYPDG-CJNGLKHVSA-N 0 1 380.286 3.129 10 0 GGAEMN Cc1nc(C[C@H]2CCCN(C[C@H](O)c3ccccc3Br)C2)no1 ZINC000152890498 564975345 /nfs/dbraw/zinc/97/53/45/564975345.db2.gz JRQWWGKZHPYPDG-CJNGLKHVSA-N 0 1 380.286 3.129 10 0 GGAEMN CC[C@@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)N(C)C ZINC000152865372 564975539 /nfs/dbraw/zinc/97/55/39/564975539.db2.gz APEJHHUBAKFZBE-INIZCTEOSA-N 0 1 382.291 3.482 10 0 GGAEMN CN(Cc1ccc(Br)cc1F)[C@H]1CCCN(c2cccnn2)C1 ZINC000106079490 564977214 /nfs/dbraw/zinc/97/72/14/564977214.db2.gz AEMZNYJVGNSXJE-HNNXBMFYSA-N 0 1 379.277 3.479 10 0 GGAEMN CN(Cc1cc(Br)ccc1F)[C@@H]1CCCN(c2cccnn2)C1 ZINC000106075458 564977263 /nfs/dbraw/zinc/97/72/63/564977263.db2.gz RIODJACVLJRYJT-OAHLLOKOSA-N 0 1 379.277 3.479 10 0 GGAEMN C[C@@H](O)CN1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)C[C@H]1C ZINC000106098486 564978163 /nfs/dbraw/zinc/97/81/63/564978163.db2.gz UEAXFVJBBWLNKU-HUUCEWRRSA-N 0 1 379.957 3.274 10 0 GGAEMN Brc1ccc(N2CCN(CCCOc3ccccc3)CC2)nc1 ZINC000106121411 564978401 /nfs/dbraw/zinc/97/84/01/564978401.db2.gz YLENQWYZWTZUGK-UHFFFAOYSA-N 0 1 376.298 3.435 10 0 GGAEMN Cc1nc(C)n(C[C@@H]2CCCN(C[C@H](O)c3ccccc3Br)C2)n1 ZINC000152954059 564979148 /nfs/dbraw/zinc/97/91/48/564979148.db2.gz VAFDDSNJDZDNNR-QAPCUYQASA-N 0 1 393.329 3.103 10 0 GGAEMN Cc1nc(C)n(C[C@@H]2CCCN(C[C@H](O)c3cccc(Br)c3)C2)n1 ZINC000106180502 564979340 /nfs/dbraw/zinc/97/93/40/564979340.db2.gz ZCXGIWFRXQVMFS-QAPCUYQASA-N 0 1 393.329 3.103 10 0 GGAEMN CCN1CCN([C@@H]2CCN(C(=O)c3sc4ccccc4c3Cl)C2)CC1 ZINC000106799053 564989536 /nfs/dbraw/zinc/98/95/36/564989536.db2.gz DMFCVVJQMCSYES-CQSZACIVSA-N 0 1 377.941 3.407 10 0 GGAEMN CC(C)n1nnnc1CSc1nc(-c2ccccc2Br)n[nH]1 ZINC000107078205 564993864 /nfs/dbraw/zinc/99/38/64/564993864.db2.gz IUMDYPHBMILMKK-UHFFFAOYSA-N 0 1 380.275 3.094 10 0 GGAEMN CC[C@@H]1CN(CCC(=O)Nc2ccc(Cl)cc2F)CCN1CC(F)F ZINC000153437751 564995682 /nfs/dbraw/zinc/99/56/82/564995682.db2.gz JRIHHCLRPPMFJU-CYBMUJFWSA-N 0 1 377.838 3.469 10 0 GGAEMN O=C(Cn1ncc2ccccc21)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000107234882 564996981 /nfs/dbraw/zinc/99/69/81/564996981.db2.gz YIGBFHZEKHJUMN-UHFFFAOYSA-N 0 1 397.236 3.223 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1cc(CO)ccc1C ZINC000107301412 564998164 /nfs/dbraw/zinc/99/81/64/564998164.db2.gz QQRSOZNCUOBHBT-UHFFFAOYSA-N 0 1 386.267 3.059 10 0 GGAEMN CSCCCCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000153645374 565004893 /nfs/dbraw/zinc/00/48/93/565004893.db2.gz PAOXROOZGPNUAO-UHFFFAOYSA-N 0 1 398.330 3.177 10 0 GGAEMN CSCCCCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000153645374 565004896 /nfs/dbraw/zinc/00/48/96/565004896.db2.gz PAOXROOZGPNUAO-UHFFFAOYSA-N 0 1 398.330 3.177 10 0 GGAEMN O=C(NCCCC1CC1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000153757134 565010162 /nfs/dbraw/zinc/01/01/62/565010162.db2.gz MWOUIGUKJHBIQP-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN O=C(NCCCC1CC1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000153757134 565010166 /nfs/dbraw/zinc/01/01/66/565010166.db2.gz MWOUIGUKJHBIQP-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN Cc1ccc(NCCCNC(=O)c2cc(Br)cc3nc[nH]c32)nc1 ZINC000502985610 565010199 /nfs/dbraw/zinc/01/01/99/565010199.db2.gz VAAGLVNPGIEOSY-UHFFFAOYSA-N 0 1 388.269 3.261 10 0 GGAEMN Cc1cc(C(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c(C)cc1Br ZINC000153973889 565020516 /nfs/dbraw/zinc/02/05/16/565020516.db2.gz OWZUAYDAGXMIHX-OAHLLOKOSA-N 0 1 395.341 3.391 10 0 GGAEMN O=C(Nc1ccn(Cc2ccncc2)n1)c1cc(Br)cc2nc[nH]c21 ZINC000503483591 565020787 /nfs/dbraw/zinc/02/07/87/565020787.db2.gz RPKXCUIJGGHYNT-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN COc1ccc2[nH]nc(NC(=O)c3cc(Br)cc4nc[nH]c43)c2c1 ZINC000503517867 565021877 /nfs/dbraw/zinc/02/18/77/565021877.db2.gz IGXYPHHZPUNGID-UHFFFAOYSA-N 0 1 386.209 3.463 10 0 GGAEMN O=C(Nc1ccn(CC(F)(F)F)n1)c1cc(Br)cc2nc[nH]c21 ZINC000503692226 565026056 /nfs/dbraw/zinc/02/60/56/565026056.db2.gz JVJKKENWXNOQPZ-UHFFFAOYSA-N 0 1 388.147 3.337 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)Cn1c(C)c(Br)c2ccccc21 ZINC000110015833 565034251 /nfs/dbraw/zinc/03/42/51/565034251.db2.gz JJTCUZYQAUDOID-UHFFFAOYSA-N 0 1 389.297 3.493 10 0 GGAEMN CN(C)S(=O)(=O)c1ccc2[nH]c(-c3cc(Cl)c(O)cc3Cl)nc2c1 ZINC000154479096 565040946 /nfs/dbraw/zinc/04/09/46/565040946.db2.gz MFSZWZLGCQITFE-UHFFFAOYSA-N 0 1 386.260 3.493 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000110529858 565041750 /nfs/dbraw/zinc/04/17/50/565041750.db2.gz OCUTZWOLWIFXKU-LLVKDONJSA-N 0 1 377.794 3.027 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C ZINC000154698288 565049571 /nfs/dbraw/zinc/04/95/71/565049571.db2.gz ODDTWDNRIZBJDX-JQWIXIFHSA-N 0 1 384.851 3.462 10 0 GGAEMN O=C(NCCNCc1nc(-c2cccc(Br)c2)c[nH]1)c1ccccc1 ZINC000111383721 565054013 /nfs/dbraw/zinc/05/40/13/565054013.db2.gz CSDDFLKYPMHCLT-UHFFFAOYSA-N 0 1 399.292 3.359 10 0 GGAEMN C[C@]1(CNC(=O)CSc2n[n-]c(=S)s2)CCC[N@H+]1Cc1ccccc1 ZINC000154837931 565054466 /nfs/dbraw/zinc/05/44/66/565054466.db2.gz JHTUFAITIUYECR-QGZVFWFLSA-N 0 1 394.591 3.090 10 0 GGAEMN COCC[N@H+]1CCC[C@H]1CNC(=O)N(C)[C@@H](C)c1ccccc1Br ZINC000111864415 565058456 /nfs/dbraw/zinc/05/84/56/565058456.db2.gz BUFLZNYUBBEWFA-GJZGRUSLSA-N 0 1 398.345 3.262 10 0 GGAEMN CC(C)(C)NC(=O)CN1CCC(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000155163877 565063349 /nfs/dbraw/zinc/06/33/49/565063349.db2.gz IHNRBKWLGKSQEJ-UHFFFAOYSA-N 0 1 396.329 3.014 10 0 GGAEMN O=C(NCCNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1ccccc1 ZINC000112372994 565063512 /nfs/dbraw/zinc/06/35/12/565063512.db2.gz CVDJZAKPLCGSMW-UHFFFAOYSA-N 0 1 399.292 3.359 10 0 GGAEMN Brc1cccc(-c2nc(CN[C@H]3CCc4ncnn4C3)cs2)c1 ZINC000113338469 565069347 /nfs/dbraw/zinc/06/93/47/565069347.db2.gz GCCXHMMOUGPOCW-ZDUSSCGKSA-N 0 1 390.310 3.269 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000113408086 565069908 /nfs/dbraw/zinc/06/99/08/565069908.db2.gz QCVJKJUBEFAPDW-INIZCTEOSA-N 0 1 386.323 3.392 10 0 GGAEMN O=C(c1cccc2c[nH]nc21)N1CCN(Cc2ccc(Br)cc2)CC1 ZINC000155683907 565070524 /nfs/dbraw/zinc/07/05/24/565070524.db2.gz VDFMQBOEKUSNEG-UHFFFAOYSA-N 0 1 399.292 3.283 10 0 GGAEMN C[C@H](N[C@@H](CO)c1ccccc1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000183635394 565085016 /nfs/dbraw/zinc/08/50/16/565085016.db2.gz FMUOBUPTXDBVBC-KSSFIOAISA-N 0 1 391.309 3.119 10 0 GGAEMN CC[C@H](CSC)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000183723602 565091053 /nfs/dbraw/zinc/09/10/53/565091053.db2.gz DOHHKNKIBOXFLH-GFCCVEGCSA-N 0 1 398.330 3.175 10 0 GGAEMN CC[C@H](CSC)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000183723602 565091058 /nfs/dbraw/zinc/09/10/58/565091058.db2.gz DOHHKNKIBOXFLH-GFCCVEGCSA-N 0 1 398.330 3.175 10 0 GGAEMN CC[C@@H](CSC)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000183723587 565091578 /nfs/dbraw/zinc/09/15/78/565091578.db2.gz DOHHKNKIBOXFLH-LBPRGKRZSA-N 0 1 398.330 3.175 10 0 GGAEMN CC[C@@H](CSC)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000183723587 565091583 /nfs/dbraw/zinc/09/15/83/565091583.db2.gz DOHHKNKIBOXFLH-LBPRGKRZSA-N 0 1 398.330 3.175 10 0 GGAEMN C[C@@H]1C[C@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@@H+]1C ZINC000292013390 565091967 /nfs/dbraw/zinc/09/19/67/565091967.db2.gz UQYVPGGDVYDGDH-VXGBXAGGSA-N 0 1 392.297 3.258 10 0 GGAEMN C[C@@H]1C[C@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@H+]1C ZINC000292013390 565091972 /nfs/dbraw/zinc/09/19/72/565091972.db2.gz UQYVPGGDVYDGDH-VXGBXAGGSA-N 0 1 392.297 3.258 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@@H+]1C ZINC000292013378 565092563 /nfs/dbraw/zinc/09/25/63/565092563.db2.gz UQYVPGGDVYDGDH-NEPJUHHUSA-N 0 1 392.297 3.258 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@H+]1C ZINC000292013378 565092568 /nfs/dbraw/zinc/09/25/68/565092568.db2.gz UQYVPGGDVYDGDH-NEPJUHHUSA-N 0 1 392.297 3.258 10 0 GGAEMN OC[C@@H](CNCc1cn(-c2ccc(Cl)c(Cl)c2)nn1)c1ccccc1 ZINC000183867149 565100330 /nfs/dbraw/zinc/10/03/30/565100330.db2.gz KKNICWBDIJWSDY-CQSZACIVSA-N 0 1 377.275 3.440 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NCc1ccc(O)c(Br)c1)C2 ZINC000369577197 565100874 /nfs/dbraw/zinc/10/08/74/565100874.db2.gz FXSYQSCOMGLQIC-LBPRGKRZSA-N 0 1 392.297 3.423 10 0 GGAEMN COC(=O)c1ccc(CN[C@@H](CO)c2cccc(Br)c2)cc1F ZINC000183912461 565103248 /nfs/dbraw/zinc/10/32/48/565103248.db2.gz RLGLUQPFIQJOKD-INIZCTEOSA-N 0 1 382.229 3.198 10 0 GGAEMN CC(C)(C)OC(=O)c1ccc(CNC(=O)CSc2n[nH]c(=S)s2)cc1 ZINC000267192291 565109570 /nfs/dbraw/zinc/10/95/70/565109570.db2.gz WXDQUHSJQUVSML-UHFFFAOYSA-N 0 1 397.547 3.191 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cccc(Br)c2Cl)[nH]n1 ZINC000184239690 565121673 /nfs/dbraw/zinc/12/16/73/565121673.db2.gz NRZZPMHIKTZRBO-UHFFFAOYSA-N 0 1 380.633 3.478 10 0 GGAEMN CC(=Cc1c(Cl)cccc1Cl)C(=O)N1CCO[C@@H](c2n[nH]c(C)n2)C1 ZINC000184247568 565122846 /nfs/dbraw/zinc/12/28/46/565122846.db2.gz OEBIQUBLEJMUNV-TUPIDYKKSA-N 0 1 381.263 3.423 10 0 GGAEMN O=C(N[C@@H]1CCc2c1cccc2Br)N1CCC[C@@H](c2nc[nH]n2)C1 ZINC000370112638 565128838 /nfs/dbraw/zinc/12/88/38/565128838.db2.gz PIIYUPYYNYXVSR-IAQYHMDHSA-N 0 1 390.285 3.144 10 0 GGAEMN O=C(N[C@H]1CCc2c1cccc2Br)N1CCC[C@H](c2nc[nH]n2)C1 ZINC000370112639 565128904 /nfs/dbraw/zinc/12/89/04/565128904.db2.gz PIIYUPYYNYXVSR-NHYWBVRUSA-N 0 1 390.285 3.144 10 0 GGAEMN O=C(N[C@@H]1CCc2c1cccc2Br)N1CCC[C@H](c2nc[nH]n2)C1 ZINC000370112640 565129298 /nfs/dbraw/zinc/12/92/98/565129298.db2.gz PIIYUPYYNYXVSR-XHDPSFHLSA-N 0 1 390.285 3.144 10 0 GGAEMN O=C(NCCOc1ccc(Br)cc1)N1CCC(c2cnc[nH]2)CC1 ZINC000370221489 565133313 /nfs/dbraw/zinc/13/33/13/565133313.db2.gz VGSMZUQEEOEBBI-UHFFFAOYSA-N 0 1 393.285 3.140 10 0 GGAEMN O=C(c1c(O)cc(Cl)cc1Cl)N1CCC(c2nnc3n2CCC3)CC1 ZINC000370267087 565135383 /nfs/dbraw/zinc/13/53/83/565135383.db2.gz WUYMDNYDQMOFDF-UHFFFAOYSA-N 0 1 381.263 3.257 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)Nc2cccc(C3SCCS3)c2)CC1 ZINC000267991327 565136632 /nfs/dbraw/zinc/13/66/32/565136632.db2.gz RLKLBNGIWAJFAE-MRXNPFEDSA-N 0 1 381.567 3.086 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Br)c(Cl)c2)CCN1C[C@@H](C)O ZINC000157613601 565138707 /nfs/dbraw/zinc/13/87/07/565138707.db2.gz UBNMJJJWNJMNTF-YPMHNXCESA-N 0 1 389.721 3.020 10 0 GGAEMN Cc1ccc(C(=O)Nc2nc(C3CCC3)n[nH]2)cc1I ZINC000184549247 565142854 /nfs/dbraw/zinc/14/28/54/565142854.db2.gz MFRIJOPESSUIJM-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN Cc1ccc(C(=O)Nc2n[nH]c(C3CCC3)n2)cc1I ZINC000184549247 565142862 /nfs/dbraw/zinc/14/28/62/565142862.db2.gz MFRIJOPESSUIJM-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN O=C(N[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCCc2[nH]ncc21 ZINC000268191652 565144584 /nfs/dbraw/zinc/14/45/84/565144584.db2.gz ZWDLOXNATRFHAP-SMDDNHRTSA-N 0 1 376.254 3.232 10 0 GGAEMN C[C@@H](Oc1ccc(F)cc1Br)C(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184570037 565144883 /nfs/dbraw/zinc/14/48/83/565144883.db2.gz LMNIVWAXBQJMIV-MRVPVSSYSA-N 0 1 383.221 3.380 10 0 GGAEMN C[C@@H](Oc1ccc(F)cc1Br)C(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184570037 565144886 /nfs/dbraw/zinc/14/48/86/565144886.db2.gz LMNIVWAXBQJMIV-MRVPVSSYSA-N 0 1 383.221 3.380 10 0 GGAEMN C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184594855 565146657 /nfs/dbraw/zinc/14/66/57/565146657.db2.gz HLDYUQCYWULKTA-MRVPVSSYSA-N 0 1 382.251 3.136 10 0 GGAEMN C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184594855 565146663 /nfs/dbraw/zinc/14/66/63/565146663.db2.gz HLDYUQCYWULKTA-MRVPVSSYSA-N 0 1 382.251 3.136 10 0 GGAEMN COc1ccc(Br)c(NC(=O)N2CCCC[C@@H]2c2nnc[nH]2)c1 ZINC000184701668 565152649 /nfs/dbraw/zinc/15/26/49/565152649.db2.gz SPWZSSPFSKHBNI-CYBMUJFWSA-N 0 1 380.246 3.335 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Nc2ccc(I)cc2C)n[nH]1 ZINC000158007086 565153047 /nfs/dbraw/zinc/15/30/47/565153047.db2.gz USQWQMWCDCVRDW-SNVBAGLBSA-N 0 1 398.248 3.384 10 0 GGAEMN CC(C)C(=O)N1CCCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000184963841 565168911 /nfs/dbraw/zinc/16/89/11/565168911.db2.gz DCHWKUGAOGDZIE-UHFFFAOYSA-N 0 1 379.302 3.016 10 0 GGAEMN Brc1ccc2nc(CN3CCCC[C@@H]3CN3CCOCC3)[nH]c2c1 ZINC000184976148 565169312 /nfs/dbraw/zinc/16/93/12/565169312.db2.gz RDSXGCJONIIYJJ-OAHLLOKOSA-N 0 1 393.329 3.012 10 0 GGAEMN CCO[C@@H]1C[C@H](O)C12CCN(Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000184974114 565169478 /nfs/dbraw/zinc/16/94/78/565169478.db2.gz VNTZVAFLDONMOC-JKSUJKDBSA-N 0 1 394.313 3.077 10 0 GGAEMN Brc1ccc2nc(CN3CCO[C@@H](c4nccs4)C3)[nH]c2c1 ZINC000184969914 565169750 /nfs/dbraw/zinc/16/97/50/565169750.db2.gz JFDRNFHEHBSOGB-CYBMUJFWSA-N 0 1 379.283 3.355 10 0 GGAEMN CO[C@@H]1CC[C@H]2OCCN(Cc3nc4ccc(Br)cc4[nH]3)[C@@H]2C1 ZINC000184989890 565170322 /nfs/dbraw/zinc/17/03/22/565170322.db2.gz IAIAHNYOKZJVHG-DAXOMENPSA-N 0 1 380.286 3.094 10 0 GGAEMN Cn1ccnc1CC1CCN(C[C@H](O)c2ccc(F)c(Br)c2)CC1 ZINC000185004054 565170788 /nfs/dbraw/zinc/17/07/88/565170788.db2.gz UVKNYRVDKOCLJF-KRWDZBQOSA-N 0 1 396.304 3.310 10 0 GGAEMN COC(=O)c1coc(C(=O)Nc2nnc(Cc3cccc(Cl)c3)s2)c1 ZINC000185029861 565173294 /nfs/dbraw/zinc/17/32/94/565173294.db2.gz IKFZERHWVNPCQQ-UHFFFAOYSA-N 0 1 377.809 3.414 10 0 GGAEMN Cc1cc2cc(S(=O)(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)ccc2nc1Cl ZINC000293527421 565173626 /nfs/dbraw/zinc/17/36/26/565173626.db2.gz PCVRPMCWWGGCGS-ZFWWWQNUSA-N 0 1 381.929 3.300 10 0 GGAEMN Cc1cc2cc(S(=O)(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)ccc2nc1Cl ZINC000293527414 565173648 /nfs/dbraw/zinc/17/36/48/565173648.db2.gz PCVRPMCWWGGCGS-HIFRSBDPSA-N 0 1 381.929 3.300 10 0 GGAEMN Cc1cc2cc(S(=O)(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)ccc2nc1Cl ZINC000293527410 565174050 /nfs/dbraw/zinc/17/40/50/565174050.db2.gz PCVRPMCWWGGCGS-DZGCQCFKSA-N 0 1 381.929 3.300 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOC[C@H]1c1ccco1 ZINC000371035987 565174270 /nfs/dbraw/zinc/17/42/70/565174270.db2.gz JJZKYNFEIGJWPV-ZDUSSCGKSA-N 0 1 376.210 3.132 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3ccc(C)c(Br)c3)CCO2)n[nH]1 ZINC000158607817 565175366 /nfs/dbraw/zinc/17/53/66/565175366.db2.gz KAKKFKROXNOFIZ-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)CSCc2ccc(Br)cc2)n[nH]1 ZINC000269061298 565176257 /nfs/dbraw/zinc/17/62/57/565176257.db2.gz BGJXRMWJAYTHLV-LLVKDONJSA-N 0 1 382.327 3.461 10 0 GGAEMN COc1ccc(CNCc2cccc(N3CCCS3(=O)=O)c2)cc1Cl ZINC000185094943 565177668 /nfs/dbraw/zinc/17/76/68/565177668.db2.gz FQILWPBKKDUZST-UHFFFAOYSA-N 0 1 380.897 3.178 10 0 GGAEMN CC(C)Cc1ncc(CNCc2cccc(N3CCCS3(=O)=O)c2)s1 ZINC000185096987 565177802 /nfs/dbraw/zinc/17/78/02/565177802.db2.gz ZOLIGCZNELOQFF-UHFFFAOYSA-N 0 1 379.551 3.171 10 0 GGAEMN CC[C@H](NCCCS(=O)(=O)c1ccc(NC(C)=O)cc1)c1nccs1 ZINC000185107926 565178153 /nfs/dbraw/zinc/17/81/53/565178153.db2.gz PYARRTDSSBVAKY-INIZCTEOSA-N 0 1 381.523 3.006 10 0 GGAEMN COCCN1CCCN(C(=O)C[C@H](C)c2ccc(Br)cc2)CC1 ZINC000269279445 565184262 /nfs/dbraw/zinc/18/42/62/565184262.db2.gz PKSVDRUWJHRTDW-HNNXBMFYSA-N 0 1 383.330 3.123 10 0 GGAEMN COCCN1CCCN(C(=O)C[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000269279448 565184555 /nfs/dbraw/zinc/18/45/55/565184555.db2.gz PKSVDRUWJHRTDW-OAHLLOKOSA-N 0 1 383.330 3.123 10 0 GGAEMN Cc1cc(N2CC[C@@H](NCc3cnn4ccccc34)C2=O)ccc1Br ZINC000185189394 565185611 /nfs/dbraw/zinc/18/56/11/565185611.db2.gz FKGMGTOUQDMHNM-QGZVFWFLSA-N 0 1 399.292 3.300 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)[C@@H](O)c2c(Cl)cccc2Cl)n[nH]1 ZINC000269324473 565186353 /nfs/dbraw/zinc/18/63/53/565186353.db2.gz MPUPUILKWLOFEW-YRXQGLPXSA-N 0 1 385.295 3.377 10 0 GGAEMN Cc1ccsc1[C@H](NCCN1C(=O)CNC1=O)c1ccc(Cl)cc1F ZINC000185202346 565186690 /nfs/dbraw/zinc/18/66/90/565186690.db2.gz RWEXXXIVGBWBMP-OAHLLOKOSA-N 0 1 381.860 3.080 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000371361582 565188698 /nfs/dbraw/zinc/18/86/98/565188698.db2.gz RYABXFTWFXYQIP-SNVBAGLBSA-N 0 1 376.247 3.190 10 0 GGAEMN C[C@@H]1CN(C(=O)c2c[nH]c3ccc(I)cc3c2=O)[C@H]1C ZINC000293901708 565189837 /nfs/dbraw/zinc/18/98/37/565189837.db2.gz CAKMEYAWRMWICP-BDAKNGLRSA-N 0 1 382.201 3.025 10 0 GGAEMN O=C(Nc1ccccc1-c1nnc[nH]1)c1n[nH]c2ccc(Br)cc21 ZINC000371402551 565191433 /nfs/dbraw/zinc/19/14/33/565191433.db2.gz YOXSNKVBOVKNAL-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN CCCNC(=O)[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159047702 565192608 /nfs/dbraw/zinc/19/26/08/565192608.db2.gz JTJKLSDHETUWQP-LBPRGKRZSA-N 0 1 379.302 3.064 10 0 GGAEMN CCCCNC(=O)[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159051231 565192665 /nfs/dbraw/zinc/19/26/65/565192665.db2.gz DFRVHFFDEVYSLB-ZDUSSCGKSA-N 0 1 393.329 3.454 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1ccc2cc(Br)ccc2c1 ZINC000159080540 565193879 /nfs/dbraw/zinc/19/38/79/565193879.db2.gz HHIKYLJJEIZAKM-UHFFFAOYSA-N 0 1 391.309 3.445 10 0 GGAEMN O=C(CCOc1ccc(Cl)cc1Br)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371443582 565194313 /nfs/dbraw/zinc/19/43/13/565194313.db2.gz RJWAUQFYEFFSJI-LLVKDONJSA-N 0 1 398.688 3.268 10 0 GGAEMN CCCC(=O)NC[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159161966 565196706 /nfs/dbraw/zinc/19/67/06/565196706.db2.gz MJMJJVFWOUNZPS-CYBMUJFWSA-N 0 1 393.329 3.454 10 0 GGAEMN O=C(COc1ccc(Cl)c(Cl)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000371552470 565199691 /nfs/dbraw/zinc/19/96/91/565199691.db2.gz JJYUFIMJNSQMQO-MRXNPFEDSA-N 0 1 377.231 3.396 10 0 GGAEMN O=C(COc1cc(Cl)ccc1Cl)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000371562072 565200068 /nfs/dbraw/zinc/20/00/68/565200068.db2.gz KVQXFUADZGKVME-INIZCTEOSA-N 0 1 377.231 3.396 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1ccc(Br)cc1F ZINC000371562051 565200086 /nfs/dbraw/zinc/20/00/86/565200086.db2.gz KTNCFPJRFYECQK-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C(=O)Nc3cc(Cl)cc(Cl)c3)[nH]c21 ZINC000159297877 565200707 /nfs/dbraw/zinc/20/07/07/565200707.db2.gz NRMUEBXYYRCRAE-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCCC2(CC2)C1 ZINC000185444259 565201484 /nfs/dbraw/zinc/20/14/84/565201484.db2.gz SGKUSNJUIMCXPX-UHFFFAOYSA-N 0 1 390.285 3.320 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCCC2(CC2)C1 ZINC000185444259 565201488 /nfs/dbraw/zinc/20/14/88/565201488.db2.gz SGKUSNJUIMCXPX-UHFFFAOYSA-N 0 1 390.285 3.320 10 0 GGAEMN O[C@H](COC1CCOCC1)CN1CCC[C@@H]1c1ccc(Br)s1 ZINC000371715966 565207277 /nfs/dbraw/zinc/20/72/77/565207277.db2.gz MFJZYUHRZNVZDZ-GXTWGEPZSA-N 0 1 390.343 3.204 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000294398628 565210505 /nfs/dbraw/zinc/21/05/05/565210505.db2.gz XIXPUOZIKQWGBN-INIZCTEOSA-N 0 1 390.281 3.357 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000371840256 565211441 /nfs/dbraw/zinc/21/14/41/565211441.db2.gz GAWSEOSBMLRNPJ-CABCVRRESA-N 0 1 377.231 3.051 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000371840257 565211835 /nfs/dbraw/zinc/21/18/35/565211835.db2.gz GAWSEOSBMLRNPJ-GJZGRUSLSA-N 0 1 377.231 3.051 10 0 GGAEMN Cc1cc(Br)ccc1CC(=O)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000371875294 565213121 /nfs/dbraw/zinc/21/31/21/565213121.db2.gz AHMRRPCJFUCVQT-QGZVFWFLSA-N 0 1 385.265 3.324 10 0 GGAEMN O=C1COc2ccc(CN[C@H]3CCOc4c(Br)cccc43)cc2N1 ZINC000294628815 565219916 /nfs/dbraw/zinc/21/99/16/565219916.db2.gz JPMPCOZWMYTSMB-AWEZNQCLSA-N 0 1 389.249 3.393 10 0 GGAEMN Brc1ccc(CNCc2n[nH]c(COc3ccccc3)n2)s1 ZINC000185762349 565220153 /nfs/dbraw/zinc/22/01/53/565220153.db2.gz RZKMMAZWAJSOBE-UHFFFAOYSA-N 0 1 379.283 3.498 10 0 GGAEMN Cc1ccc(NC(=O)N[C@H](c2nnc[nH]2)c2ccccc2)c(Br)n1 ZINC000372049232 565220403 /nfs/dbraw/zinc/22/04/03/565220403.db2.gz QNOKBZWJRLJKCO-ZDUSSCGKSA-N 0 1 387.241 3.182 10 0 GGAEMN Cc1ccc(CCC(=O)Nc2cc(-c3nccn3C)n[nH]2)c(Br)c1 ZINC000185799634 565221897 /nfs/dbraw/zinc/22/18/97/565221897.db2.gz NABMLKLAYJMKFZ-UHFFFAOYSA-N 0 1 388.269 3.452 10 0 GGAEMN COC(=O)c1c(C)oc(C)c1S(=O)(=O)N[C@H](CC(C)(C)C)C(F)(F)F ZINC000185811977 565222480 /nfs/dbraw/zinc/22/24/80/565222480.db2.gz BEEYYLWYFPVQIX-SNVBAGLBSA-N 0 1 385.404 3.328 10 0 GGAEMN CCOc1cc(CNCc2n[nH]c(C3CC3)n2)cc(Br)c1OC ZINC000294687778 565223204 /nfs/dbraw/zinc/22/32/04/565223204.db2.gz CAULOGWQQJVVKP-UHFFFAOYSA-N 0 1 381.274 3.142 10 0 GGAEMN CN1CC[C@H](NC(=O)c2[nH]nc(C3CC3)c2Br)[C@H]1c1ccccc1 ZINC000270638794 565224575 /nfs/dbraw/zinc/22/45/75/565224575.db2.gz KLUBREIDXBBACM-SUMWQHHRSA-N 0 1 389.297 3.225 10 0 GGAEMN CC(C)Cc1ncc(CNCc2ccc(N3CCCS3(=O)=O)cc2)s1 ZINC000185853330 565224928 /nfs/dbraw/zinc/22/49/28/565224928.db2.gz NEBDCGPSIUSNFN-UHFFFAOYSA-N 0 1 379.551 3.171 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000270769927 565228531 /nfs/dbraw/zinc/22/85/31/565228531.db2.gz RQCASKXMFJZKIT-SKDRFNHKSA-N 0 1 394.273 3.014 10 0 GGAEMN Cc1ccc(I)c(C(=O)N[C@H](C)c2n[nH]c(C(C)C)n2)c1 ZINC000270806676 565228643 /nfs/dbraw/zinc/22/86/43/565228643.db2.gz XIGRWYUGIPGDTM-SNVBAGLBSA-N 0 1 398.248 3.332 10 0 GGAEMN Cc1ccc(I)c(C(=O)N[C@@H](C)c2n[nH]c(C(C)C)n2)c1 ZINC000270806673 565229005 /nfs/dbraw/zinc/22/90/05/565229005.db2.gz XIGRWYUGIPGDTM-JTQLQIEISA-N 0 1 398.248 3.332 10 0 GGAEMN O=C1Nc2ccccc2[C@@]12CC[N@@H+](Cc1nc3ccc(Br)cc3[nH]1)C2 ZINC000372302483 565229583 /nfs/dbraw/zinc/22/95/83/565229583.db2.gz RYTUAUBUZFWRKO-IBGZPJMESA-N 0 1 397.276 3.421 10 0 GGAEMN O=C1Nc2ccccc2[C@@]12CC[N@H+](Cc1nc3ccc(Br)cc3[nH]1)C2 ZINC000372302483 565229586 /nfs/dbraw/zinc/22/95/86/565229586.db2.gz RYTUAUBUZFWRKO-IBGZPJMESA-N 0 1 397.276 3.421 10 0 GGAEMN O=C1Nc2ccccc2[C@@]12CCN(Cc1nc3cc(Br)ccc3[nH]1)C2 ZINC000372302483 565229590 /nfs/dbraw/zinc/22/95/90/565229590.db2.gz RYTUAUBUZFWRKO-IBGZPJMESA-N 0 1 397.276 3.421 10 0 GGAEMN O=C1Nc2ccccc2[C@]12CC[N@@H+](Cc1nc3ccc(Br)cc3[nH]1)C2 ZINC000372302484 565229727 /nfs/dbraw/zinc/22/97/27/565229727.db2.gz RYTUAUBUZFWRKO-LJQANCHMSA-N 0 1 397.276 3.421 10 0 GGAEMN O=C1Nc2ccccc2[C@]12CC[N@H+](Cc1nc3ccc(Br)cc3[nH]1)C2 ZINC000372302484 565229733 /nfs/dbraw/zinc/22/97/33/565229733.db2.gz RYTUAUBUZFWRKO-LJQANCHMSA-N 0 1 397.276 3.421 10 0 GGAEMN O=C1Nc2ccccc2[C@]12CCN(Cc1nc3cc(Br)ccc3[nH]1)C2 ZINC000372302484 565229738 /nfs/dbraw/zinc/22/97/38/565229738.db2.gz RYTUAUBUZFWRKO-LJQANCHMSA-N 0 1 397.276 3.421 10 0 GGAEMN CS[C@H](CO)[C@@H](C)N[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186205327 565246314 /nfs/dbraw/zinc/24/63/14/565246314.db2.gz FMRFCCWKYBHIDR-LYRGGWFBSA-N 0 1 382.327 3.031 10 0 GGAEMN O=S(=O)(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(Cl)ccc1Cl ZINC000372591188 565246682 /nfs/dbraw/zinc/24/66/82/565246682.db2.gz HAHHCZQMEFJZFZ-CQSZACIVSA-N 0 1 383.260 3.179 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000160457095 565247129 /nfs/dbraw/zinc/24/71/29/565247129.db2.gz CQEJMJIFKJPUST-JTQLQIEISA-N 0 1 376.092 3.036 10 0 GGAEMN COc1cc(CN[C@H](CO)c2ccc(Br)cc2)cc2c1OCCO2 ZINC000271295395 565247455 /nfs/dbraw/zinc/24/74/55/565247455.db2.gz NNSBBEHDXSRKDS-OAHLLOKOSA-N 0 1 394.265 3.052 10 0 GGAEMN O=S(=O)(C[C@@H]1CCCC1(F)F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000295148519 565247933 /nfs/dbraw/zinc/24/79/33/565247933.db2.gz DZJZFZIMNNDZLB-KBPBESRZSA-N 0 1 378.510 3.240 10 0 GGAEMN O=S(=O)(C[C@H]1CCCC1(F)F)NC[C@H](c1cccs1)N1CCCC1 ZINC000295148526 565248399 /nfs/dbraw/zinc/24/83/99/565248399.db2.gz DZJZFZIMNNDZLB-ZIAGYGMSSA-N 0 1 378.510 3.240 10 0 GGAEMN CC(C)C(=O)NCCCN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186301242 565253318 /nfs/dbraw/zinc/25/33/18/565253318.db2.gz ZUFBHGXPJVHLNT-QGZVFWFLSA-N 0 1 391.313 3.080 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)c2cnccc2N(C)C)cc1Br ZINC000186392824 565259631 /nfs/dbraw/zinc/25/96/31/565259631.db2.gz YEKUYVVQXPXHGW-NSHDSACASA-N 0 1 378.270 3.410 10 0 GGAEMN OCC1(CN[C@@H](c2ccc(Br)cc2)c2cncnc2)CCCC1 ZINC000186426083 565260848 /nfs/dbraw/zinc/26/08/48/565260848.db2.gz QZHQZOPJEOVOPZ-KRWDZBQOSA-N 0 1 376.298 3.471 10 0 GGAEMN CN(Cc1cc(-c2cnn(C)c2)no1)C[C@H](O)c1ccccc1Br ZINC000295362879 565261011 /nfs/dbraw/zinc/26/10/11/565261011.db2.gz PEJALYKQVJMNEW-KRWDZBQOSA-N 0 1 391.269 3.003 10 0 GGAEMN COc1cc(I)ccc1NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000295511980 565270384 /nfs/dbraw/zinc/27/03/84/565270384.db2.gz QAIONTLCXQBNJF-SNVBAGLBSA-N 0 1 397.216 3.082 10 0 GGAEMN O=c1ccc2c([nH]1)CCC[C@@H]2NCc1cc2c(cc1Br)OCO2 ZINC000271917193 565271937 /nfs/dbraw/zinc/27/19/37/565271937.db2.gz MWMKXZKHZYVNCC-ZDUSSCGKSA-N 0 1 377.238 3.446 10 0 GGAEMN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCC([N@@H+](C)CC(=O)[O-])CC1 ZINC000186620853 565272038 /nfs/dbraw/zinc/27/20/38/565272038.db2.gz NAWZMMKOQOVXRZ-GFCCVEGCSA-N 0 1 387.307 3.179 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H]1[C@@H]1CCCC1=O ZINC000272218634 565281365 /nfs/dbraw/zinc/28/13/65/565281365.db2.gz SUBODPDLTUTCFW-FZMZJTMJSA-N 0 1 376.254 3.299 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)COc2ccc(Br)cc2Cl)n[nH]1 ZINC000161517440 565286598 /nfs/dbraw/zinc/28/65/98/565286598.db2.gz WGEYRMLVGMNTMW-SECBINFHSA-N 0 1 386.677 3.260 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)CSCc2cc(-c3cccs3)on2)n[nH]1 ZINC000161541716 565287473 /nfs/dbraw/zinc/28/74/73/565287473.db2.gz OOJLLVKLOMSAHM-LLVKDONJSA-N 0 1 376.507 3.415 10 0 GGAEMN Cc1ccc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cn1 ZINC000161659645 565290189 /nfs/dbraw/zinc/29/01/89/565290189.db2.gz KGZYMUPWXOOUNJ-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1ccc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cn1 ZINC000161659645 565290191 /nfs/dbraw/zinc/29/01/91/565290191.db2.gz KGZYMUPWXOOUNJ-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)[C@H](C)CC(=O)c2cccc(Br)c2)n[nH]1 ZINC000161698544 565291233 /nfs/dbraw/zinc/29/12/33/565291233.db2.gz RARQMBYENZKXAX-NEPJUHHUSA-N 0 1 392.297 3.437 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Cc2c[nH]c3cc(Br)ccc23)n[nH]1 ZINC000161713913 565291817 /nfs/dbraw/zinc/29/18/17/565291817.db2.gz GHLGUVYONQEMOD-SNVBAGLBSA-N 0 1 375.270 3.252 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2cc3c(cc(Br)cc3F)[nH]2)n[nH]1 ZINC000161783505 565293403 /nfs/dbraw/zinc/29/34/03/565293403.db2.gz LUCCHKPDCFJLJW-QMMMGPOBSA-N 0 1 379.233 3.462 10 0 GGAEMN CCc1nc(CNCc2cc(Br)c(OC(F)F)c(OC)c2)n[nH]1 ZINC000295965986 565296406 /nfs/dbraw/zinc/29/64/06/565296406.db2.gz IFJUHZXSJZZARV-UHFFFAOYSA-N 0 1 391.216 3.029 10 0 GGAEMN Cc1ccc(CC(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)cc1Br ZINC000373688611 565298098 /nfs/dbraw/zinc/29/80/98/565298098.db2.gz UMFQEPNBBFFXDB-QGZVFWFLSA-N 0 1 385.265 3.324 10 0 GGAEMN CCS(=O)(=O)CCCCCN1CCC(c2nc(C(F)(F)F)c[nH]2)CC1 ZINC000373712344 565299363 /nfs/dbraw/zinc/29/93/63/565299363.db2.gz OBPKJGCZMDZNAV-UHFFFAOYSA-N 0 1 381.464 3.213 10 0 GGAEMN CCOc1c(Br)cc(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1OC ZINC000162009863 565301210 /nfs/dbraw/zinc/30/12/10/565301210.db2.gz UCKZIDQOFYYYQR-JTQLQIEISA-N 0 1 396.285 3.249 10 0 GGAEMN CC[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@]2(CCOC2)O1 ZINC000373802987 565304226 /nfs/dbraw/zinc/30/42/26/565304226.db2.gz BYGGAEMWVCIAOZ-CXAGYDPISA-N 0 1 380.286 3.095 10 0 GGAEMN C[C@@H](CC(=O)NCCCCN1CCOCC1)c1ccc(Br)cc1 ZINC000162120927 565305241 /nfs/dbraw/zinc/30/52/41/565305241.db2.gz YMZVZZQJBBDTDG-HNNXBMFYSA-N 0 1 383.330 3.171 10 0 GGAEMN Cc1nnc(SCCC(=O)N2C[C@@H](c3cccc(Cl)c3)OC[C@H]2C)[nH]1 ZINC000187049413 565305464 /nfs/dbraw/zinc/30/54/64/565305464.db2.gz FMYWRPAAYKREOG-ABAIWWIYSA-N 0 1 380.901 3.237 10 0 GGAEMN Cc1nccn1-c1ncccc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000373863418 565307316 /nfs/dbraw/zinc/30/73/16/565307316.db2.gz BECXFQCQLXLADG-UHFFFAOYSA-N 0 1 397.236 3.467 10 0 GGAEMN CCOc1cccc(CCN[C@@H](C(N)=O)c2cccc(Br)c2)c1 ZINC000162289481 565311203 /nfs/dbraw/zinc/31/12/03/565311203.db2.gz MRFLMMZBVBMCLB-QGZVFWFLSA-N 0 1 377.282 3.207 10 0 GGAEMN COC(=O)c1cc2cccc(NC(=O)CCSc3nnc(C)[nH]3)c2s1 ZINC000296300296 565311563 /nfs/dbraw/zinc/31/15/63/565311563.db2.gz ZMPJPSCUXMXOMH-UHFFFAOYSA-N 0 1 376.463 3.235 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C ZINC000187177227 565315060 /nfs/dbraw/zinc/31/50/60/565315060.db2.gz ISHQLGLNAUAUGL-GXFFZTMASA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000374017448 565316008 /nfs/dbraw/zinc/31/60/08/565316008.db2.gz KYZBCWLSSQKIJM-VFVRVIDISA-N 0 1 394.313 3.484 10 0 GGAEMN C[C@@H]1C[C@]2(CCO1)CN(Cc1nc3ccc(Br)cc3[nH]1)C[C@H](C)O2 ZINC000374017443 565316237 /nfs/dbraw/zinc/31/62/37/565316237.db2.gz KYZBCWLSSQKIJM-FHSNZYRGSA-N 0 1 394.313 3.484 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3c(Br)cc(C)cc3C2)n[nH]1 ZINC000187218030 565317207 /nfs/dbraw/zinc/31/72/07/565317207.db2.gz DXSSOOCJPAVMFM-LBPRGKRZSA-N 0 1 391.313 3.488 10 0 GGAEMN C[C@H](N[C@H]1CCCN(c2cnn(C)c2)C1)c1ncc(Br)cc1F ZINC000187248784 565319563 /nfs/dbraw/zinc/31/95/63/565319563.db2.gz PMCSKMMOPUBWQC-AAEUAGOBSA-N 0 1 382.281 3.036 10 0 GGAEMN CN1C(=O)CCc2cc(CN[C@H](CO)c3cccc(Br)c3)ccc21 ZINC000187306203 565322128 /nfs/dbraw/zinc/32/21/28/565322128.db2.gz QTQJDSVOBBZFEH-QGZVFWFLSA-N 0 1 389.293 3.181 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Br)cc1)N1CCC(c2c[nH]cn2)CC1 ZINC000374209401 565325326 /nfs/dbraw/zinc/32/53/26/565325326.db2.gz QFUOLTYFABBUCY-GFCCVEGCSA-N 0 1 377.286 3.379 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc(Br)cc1)N1CCC(c2c[nH]cn2)CC1 ZINC000374209403 565325908 /nfs/dbraw/zinc/32/59/08/565325908.db2.gz QFUOLTYFABBUCY-LBPRGKRZSA-N 0 1 377.286 3.379 10 0 GGAEMN Cc1cc(C2CCN(C(=O)c3n[nH]c4ccc(Br)cc43)CC2)n[nH]1 ZINC000273578806 565326327 /nfs/dbraw/zinc/32/63/27/565326327.db2.gz FHPFXLUBKCCTGH-UHFFFAOYSA-N 0 1 388.269 3.377 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(Br)cc1F ZINC000162858726 565330192 /nfs/dbraw/zinc/33/01/92/565330192.db2.gz VRZKOQOKTKOXAF-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cc(Br)ccc1F ZINC000162915402 565331102 /nfs/dbraw/zinc/33/11/02/565331102.db2.gz XNQCKVNRLONRRU-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN Cc1ccc(CS(=O)(=O)c2nc3cc(Br)c(C)[nH]c-3n2)c(C)n1 ZINC000187438191 565332024 /nfs/dbraw/zinc/33/20/24/565332024.db2.gz OLQMIZUVYPZEEZ-UHFFFAOYSA-N 0 1 395.282 3.015 10 0 GGAEMN CC(C)c1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)no1 ZINC000162940397 565332869 /nfs/dbraw/zinc/33/28/69/565332869.db2.gz DNXBPEYKMWZZNZ-UHFFFAOYSA-N 0 1 390.241 3.276 10 0 GGAEMN CC(C)c1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)no1 ZINC000162940397 565332873 /nfs/dbraw/zinc/33/28/73/565332873.db2.gz DNXBPEYKMWZZNZ-UHFFFAOYSA-N 0 1 390.241 3.276 10 0 GGAEMN CC(C)c1nnc2n1C[C@@H](N[C@H](C)c1ncc(Br)cc1F)CC2 ZINC000187446290 565333196 /nfs/dbraw/zinc/33/31/96/565333196.db2.gz QAPNNZPSUJWOCX-PWSUYJOCSA-N 0 1 382.281 3.364 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3cc(C)cc(Br)c3)CCO2)n[nH]1 ZINC000187517478 565338364 /nfs/dbraw/zinc/33/83/64/565338364.db2.gz JSRBGNRYOBZJDU-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)Nc3cc(Br)c(C)cc3C)CCO2)n[nH]1 ZINC000187538803 565339276 /nfs/dbraw/zinc/33/92/76/565339276.db2.gz PPKDOLYIMKPUNM-AWEZNQCLSA-N 0 1 394.273 3.098 10 0 GGAEMN Cc1cc(F)cc([C@@]2(F)CCN(C(=O)CSc3n[nH]c(=S)s3)C2)c1 ZINC000374483382 565341221 /nfs/dbraw/zinc/34/12/21/565341221.db2.gz HDDACHNNXJHUHF-OAHLLOKOSA-N 0 1 387.502 3.464 10 0 GGAEMN CC[C@@H]1CN(C(=O)CCCc2ccccc2Br)CC[N@H+]1C[C@@H](C)O ZINC000163404075 565344691 /nfs/dbraw/zinc/34/46/91/565344691.db2.gz IQCYOADFJLSANE-NVXWUHKLSA-N 0 1 397.357 3.075 10 0 GGAEMN CC[C@@H]1CN(C(=O)CCCc2ccccc2Br)CCN1C[C@@H](C)O ZINC000163404075 565344696 /nfs/dbraw/zinc/34/46/96/565344696.db2.gz IQCYOADFJLSANE-NVXWUHKLSA-N 0 1 397.357 3.075 10 0 GGAEMN C[C@@H]1CN(Cc2csc(-c3ccc(Br)cc3)n2)CCN1CCO ZINC000187664167 565348039 /nfs/dbraw/zinc/34/80/39/565348039.db2.gz MMPSSJCSOJXNDO-CYBMUJFWSA-N 0 1 396.354 3.071 10 0 GGAEMN CNC(=O)CC(=O)Nc1ccc(-c2nc3ccc(Br)cc3[nH]2)cc1 ZINC000187716474 565351536 /nfs/dbraw/zinc/35/15/36/565351536.db2.gz OCJCIMDOFKZGRU-UHFFFAOYSA-N 0 1 387.237 3.067 10 0 GGAEMN O=C(c1ccc(Br)c(C(F)(F)F)c1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000163867636 565352352 /nfs/dbraw/zinc/35/23/52/565352352.db2.gz ZSCNYSDCKBYDAH-PHIMTYICSA-N 0 1 377.204 3.434 10 0 GGAEMN CS(=O)(=O)N1CC[C@H](CN2CCc3sccc3[C@H]2c2cccs2)C1 ZINC000374774570 565354095 /nfs/dbraw/zinc/35/40/95/565354095.db2.gz BFRFWKQDHDWBNU-DYVFJYSZSA-N 0 1 382.576 3.039 10 0 GGAEMN Cc1cc(Br)cc(C)c1CNC(=O)NCc1n[nH]c(C(C)C)n1 ZINC000297133483 565358124 /nfs/dbraw/zinc/35/81/24/565358124.db2.gz HSNBGNHSHHEXLA-UHFFFAOYSA-N 0 1 380.290 3.307 10 0 GGAEMN CSC[C@@H](O)CN1CCC[C@@H]1c1ccc(I)cc1 ZINC000187912362 565362604 /nfs/dbraw/zinc/36/26/04/565362604.db2.gz NGWMQZMIJGNOQT-UONOGXRCSA-N 0 1 377.291 3.152 10 0 GGAEMN C[C@H]1N(C(=O)c2[nH]nc3ccc(Br)cc32)CCC12CCOCC2 ZINC000374973016 565363221 /nfs/dbraw/zinc/36/32/21/565363221.db2.gz OBTGVWVFVPDDFO-LLVKDONJSA-N 0 1 378.270 3.357 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)N[C@H](C)c3cc(Cl)ccc3Cl)CCO2)n[nH]1 ZINC000187946665 565365649 /nfs/dbraw/zinc/36/56/49/565365649.db2.gz IWTLTGKJWQRSKJ-YMTOWFKASA-N 0 1 384.267 3.264 10 0 GGAEMN O=C(c1cc(Br)sc1Br)N1CCN2CCC1CC2 ZINC000188607910 565412360 /nfs/dbraw/zinc/41/23/60/565412360.db2.gz WPIDVEZMLFGJAU-UHFFFAOYSA-N 0 1 394.132 3.193 10 0 GGAEMN CCOc1cc(CN2CCC[C@H](Cn3ccnn3)C2)cc(Br)c1O ZINC000297309845 565367890 /nfs/dbraw/zinc/36/78/90/565367890.db2.gz BQIKTHBGBIANDE-ZDUSSCGKSA-N 0 1 395.301 3.057 10 0 GGAEMN C[C@@H]1CC[C@](CO)(N(C)CC(=O)Nc2c(F)cc(F)cc2Br)C1 ZINC000187994863 565369852 /nfs/dbraw/zinc/36/98/52/565369852.db2.gz VYYCGUWSZPKZPU-HWPZZCPQSA-N 0 1 391.256 3.149 10 0 GGAEMN Brc1cc2c(cc1CN[C@@H](c1nnc[nH]1)c1ccccc1)OCO2 ZINC000375189096 565373881 /nfs/dbraw/zinc/37/38/81/565373881.db2.gz WXPNRUHCCYCRDY-MRXNPFEDSA-N 0 1 387.237 3.175 10 0 GGAEMN Brc1cc2c(cc1CN[C@H](c1nnc[nH]1)c1ccccc1)OCO2 ZINC000375189095 565373996 /nfs/dbraw/zinc/37/39/96/565373996.db2.gz WXPNRUHCCYCRDY-INIZCTEOSA-N 0 1 387.237 3.175 10 0 GGAEMN CO[C@@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)CC[C@@H]1C ZINC000188106438 565379040 /nfs/dbraw/zinc/37/90/40/565379040.db2.gz JBLKAOYAODNRPK-WCQYABFASA-N 0 1 378.270 3.336 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N[C@@H](Cc1ccccc1)C(F)(F)F ZINC000168559074 565381319 /nfs/dbraw/zinc/38/13/19/565381319.db2.gz KYXJQCCPGOMEEX-VIFPVBQESA-N 0 1 379.454 3.209 10 0 GGAEMN CC(C)C(=O)N1CCC(NC(=O)c2cn[nH]c2-c2ccc(Cl)s2)CC1 ZINC000188127906 565381862 /nfs/dbraw/zinc/38/18/62/565381862.db2.gz AZXXGTDAVOBJKG-UHFFFAOYSA-N 0 1 380.901 3.168 10 0 GGAEMN Cc1ccc(CNCc2cccc(N3CCOCC3)n2)cc1Br ZINC000274806913 565381908 /nfs/dbraw/zinc/38/19/08/565381908.db2.gz POJCIJREANXHLQ-UHFFFAOYSA-N 0 1 376.298 3.279 10 0 GGAEMN O=C(Cc1ccc(F)cc1Br)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000375333841 565382221 /nfs/dbraw/zinc/38/22/21/565382221.db2.gz QZYPMVKGKNMTKQ-INIZCTEOSA-N 0 1 389.228 3.155 10 0 GGAEMN Cc1cc(C[C@@H](C)NCc2ncc(Br)cc2Br)n[nH]1 ZINC000274826030 565383359 /nfs/dbraw/zinc/38/33/59/565383359.db2.gz IEARZJVCVVLATM-MRVPVSSYSA-N 0 1 388.107 3.359 10 0 GGAEMN Cc1cc(C[C@@H](C)NCc2ncc(Br)cc2Br)[nH]n1 ZINC000274826030 565383362 /nfs/dbraw/zinc/38/33/62/565383362.db2.gz IEARZJVCVVLATM-MRVPVSSYSA-N 0 1 388.107 3.359 10 0 GGAEMN Brc1ccc2c(c1)CC[C@@H]2NCc1cccc(N2CCOCC2)n1 ZINC000274824248 565383451 /nfs/dbraw/zinc/38/34/51/565383451.db2.gz YXWAZMZITOLCQU-SFHVURJKSA-N 0 1 388.309 3.458 10 0 GGAEMN Brc1ccc2nc(CN3CCOC4(CCOCC4)CC3)[nH]c2c1 ZINC000375407442 565386049 /nfs/dbraw/zinc/38/60/49/565386049.db2.gz YOGHBHAHBAYXCU-UHFFFAOYSA-N 0 1 380.286 3.097 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CC1)N1CCO[C@@H]2CCCC[C@H]21 ZINC000170871921 565396888 /nfs/dbraw/zinc/39/68/88/565396888.db2.gz ZECSVOKQSWZAQH-IAGOWNOFSA-N 0 1 393.325 3.198 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CC1)N1CCO[C@@H]2CCCC[C@@H]21 ZINC000170871917 565397448 /nfs/dbraw/zinc/39/74/48/565397448.db2.gz ZECSVOKQSWZAQH-DLBZAZTESA-N 0 1 393.325 3.198 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NC(C1CC1)C1CC1 ZINC000170933192 565399536 /nfs/dbraw/zinc/39/95/36/565399536.db2.gz NWSSNFBUIHHHTI-UHFFFAOYSA-N 0 1 390.285 3.222 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NC(C1CC1)C1CC1 ZINC000170933192 565399538 /nfs/dbraw/zinc/39/95/38/565399538.db2.gz NWSSNFBUIHHHTI-UHFFFAOYSA-N 0 1 390.285 3.222 10 0 GGAEMN O=C(CCc1ccco1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223138 565418678 /nfs/dbraw/zinc/41/86/78/565418678.db2.gz OBFJVTDZUNDUJH-UHFFFAOYSA-N 0 1 375.226 3.076 10 0 GGAEMN O=C(CCc1ccco1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223138 565418684 /nfs/dbraw/zinc/41/86/84/565418684.db2.gz OBFJVTDZUNDUJH-UHFFFAOYSA-N 0 1 375.226 3.076 10 0 GGAEMN O=C(Cc1ccsc1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223586 565418695 /nfs/dbraw/zinc/41/86/95/565418695.db2.gz VLJUZIRDLSHPNH-UHFFFAOYSA-N 0 1 377.267 3.155 10 0 GGAEMN O=C(Cc1ccsc1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223586 565418703 /nfs/dbraw/zinc/41/87/03/565418703.db2.gz VLJUZIRDLSHPNH-UHFFFAOYSA-N 0 1 377.267 3.155 10 0 GGAEMN Cc1ccc(CC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)s1 ZINC000171222239 565418991 /nfs/dbraw/zinc/41/89/91/565418991.db2.gz VLVWUHMHAKEVMQ-UHFFFAOYSA-N 0 1 391.294 3.463 10 0 GGAEMN Cc1ccc(CC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)s1 ZINC000171222239 565418997 /nfs/dbraw/zinc/41/89/97/565418997.db2.gz VLVWUHMHAKEVMQ-UHFFFAOYSA-N 0 1 391.294 3.463 10 0 GGAEMN Cc1nc(C)c(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)s1 ZINC000171222941 565419650 /nfs/dbraw/zinc/41/96/50/565419650.db2.gz SCFAGKHENKHIFN-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN Cc1nc(C)c(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)s1 ZINC000171222941 565419655 /nfs/dbraw/zinc/41/96/55/565419655.db2.gz SCFAGKHENKHIFN-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc(F)cc1 ZINC000171223517 565419684 /nfs/dbraw/zinc/41/96/84/565419684.db2.gz ICPXTCLABIOPGN-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc(F)cc1 ZINC000171223517 565419687 /nfs/dbraw/zinc/41/96/87/565419687.db2.gz ICPXTCLABIOPGN-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc(F)c(F)c1 ZINC000171223285 565419738 /nfs/dbraw/zinc/41/97/38/565419738.db2.gz XGGDAEWTSZLACV-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc(F)c(F)c1 ZINC000171223285 565419740 /nfs/dbraw/zinc/41/97/40/565419740.db2.gz XGGDAEWTSZLACV-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN COc1cccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000171223635 565419762 /nfs/dbraw/zinc/41/97/62/565419762.db2.gz AHDHBUTXORGAFR-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN COc1cccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000171223635 565419763 /nfs/dbraw/zinc/41/97/63/565419763.db2.gz AHDHBUTXORGAFR-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN Cc1nc(C[C@H]2CCCN(C[C@H](O)c3cccc(Br)c3)C2)no1 ZINC000171407075 565430289 /nfs/dbraw/zinc/43/02/89/565430289.db2.gz CPSGIXYQQLFILT-CJNGLKHVSA-N 0 1 380.286 3.129 10 0 GGAEMN CN(Cc1cncc(Br)c1)C[C@@H](c1cccs1)N1CCOCC1 ZINC000171501006 565434664 /nfs/dbraw/zinc/43/46/64/565434664.db2.gz WGEVNYGAKWZATC-INIZCTEOSA-N 0 1 396.354 3.411 10 0 GGAEMN CCOCCN1CCN(CCOc2cc(F)cc(Br)c2)C[C@@H]1C ZINC000188956516 565435065 /nfs/dbraw/zinc/43/50/65/565435065.db2.gz KDOWXHZUGBBACE-AWEZNQCLSA-N 0 1 389.309 3.010 10 0 GGAEMN CN(Cc1cncc(Br)c1)C[C@H](c1cccs1)N1CCOCC1 ZINC000171501011 565434983 /nfs/dbraw/zinc/43/49/83/565434983.db2.gz WGEVNYGAKWZATC-MRXNPFEDSA-N 0 1 396.354 3.411 10 0 GGAEMN CN(C)[C@H](Cc1ccccc1)C(=O)NCCc1ccc(Br)s1 ZINC000171606745 565439535 /nfs/dbraw/zinc/43/95/35/565439535.db2.gz APHZQGUXGPSHJH-OAHLLOKOSA-N 0 1 381.339 3.342 10 0 GGAEMN C[C@](O)(CN1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1)C(F)(F)F ZINC000376625913 565446016 /nfs/dbraw/zinc/44/60/16/565446016.db2.gz IEUGTKQHASUTPZ-HOCLYGCPSA-N 0 1 376.806 3.401 10 0 GGAEMN COc1cccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)c1OC ZINC000171772265 565449365 /nfs/dbraw/zinc/44/93/65/565449365.db2.gz SGJWZRYLLMRUJZ-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN CC(=O)Nc1cccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)c1 ZINC000171772617 565449692 /nfs/dbraw/zinc/44/96/92/565449692.db2.gz MNKAQRMGSXVSCY-UHFFFAOYSA-N 0 1 387.237 3.214 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc(Br)cc(Br)c1 ZINC000376802527 565455337 /nfs/dbraw/zinc/45/53/37/565455337.db2.gz BGQGYOQKAYQTSZ-LLVKDONJSA-N 0 1 399.086 3.222 10 0 GGAEMN CCOc1ncccc1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000171955473 565459104 /nfs/dbraw/zinc/45/91/04/565459104.db2.gz LAMLVVBZBXQISW-UHFFFAOYSA-N 0 1 375.226 3.049 10 0 GGAEMN COc1ccc(CCN2CCN(c3ccc(Br)cn3)CC2)cc1 ZINC000301060145 565460947 /nfs/dbraw/zinc/46/09/47/565460947.db2.gz BQDAGLBMIZUNKP-UHFFFAOYSA-N 0 1 376.298 3.217 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1CCO[C@@H](c2nccs2)C1 ZINC000189399198 565464073 /nfs/dbraw/zinc/46/40/73/565464073.db2.gz XIQBCENPXHMBRU-SNVBAGLBSA-N 0 1 380.882 3.462 10 0 GGAEMN CCc1nc([C@H]2CN(Cc3ccc(Br)c(Cl)c3)CCO2)n[nH]1 ZINC000189449954 565466647 /nfs/dbraw/zinc/46/66/47/565466647.db2.gz BSQILCDXHNHIOS-CYBMUJFWSA-N 0 1 385.693 3.357 10 0 GGAEMN O=C(COc1ccc(Br)cc1F)Nc1cccc(-c2nnc[nH]2)c1 ZINC000377168679 565469122 /nfs/dbraw/zinc/46/91/22/565469122.db2.gz OUPXJGUPFMOHLQ-UHFFFAOYSA-N 0 1 391.200 3.391 10 0 GGAEMN COc1cc(C(=O)N2CCC(c3cnc[nH]3)CC2)cc(OC)c1Br ZINC000377273659 565472294 /nfs/dbraw/zinc/47/22/94/565472294.db2.gz QBOMRFVWCDCAEI-UHFFFAOYSA-N 0 1 394.269 3.209 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNc2ncnc3ccc(Br)cc32)C1 ZINC000301238284 565474269 /nfs/dbraw/zinc/47/42/69/565474269.db2.gz FCLMQONGGCHPNX-AWEZNQCLSA-N 0 1 379.302 3.161 10 0 GGAEMN CCc1nc(CN2CCC(CN=c3nc([C@@H](C)OC)[n-]s3)CC2)cs1 ZINC000377309016 565474401 /nfs/dbraw/zinc/47/44/01/565474401.db2.gz OUIOKNUVJLKVJB-GFCCVEGCSA-N 0 1 381.571 3.010 10 0 GGAEMN CCc1nc(C[NH+]2CCC(CN=c3[n-]c([C@@H](C)OC)ns3)CC2)cs1 ZINC000377309016 565474404 /nfs/dbraw/zinc/47/44/04/565474404.db2.gz OUIOKNUVJLKVJB-GFCCVEGCSA-N 0 1 381.571 3.010 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCCC[C@H]1c1ncon1 ZINC000189600890 565476336 /nfs/dbraw/zinc/47/63/36/565476336.db2.gz VJVZAQNDNVYKJA-ZDUSSCGKSA-N 0 1 390.241 3.466 10 0 GGAEMN COc1cnccc1[C@@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000189630915 565478393 /nfs/dbraw/zinc/47/83/93/565478393.db2.gz REGGPGWNVSLQEU-SECBINFHSA-N 0 1 375.226 3.220 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCC[C@H]1c1ncon1 ZINC000172376603 565482416 /nfs/dbraw/zinc/48/24/16/565482416.db2.gz AIAQQHGAHJEPCQ-LBPRGKRZSA-N 0 1 376.214 3.076 10 0 GGAEMN Cc1noc(C)c1C[C@@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000172408999 565483423 /nfs/dbraw/zinc/48/34/23/565483423.db2.gz RWGSCYCKHZGTDS-MRVPVSSYSA-N 0 1 377.242 3.291 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC(Cn2cccn2)CC1 ZINC000172394086 565484057 /nfs/dbraw/zinc/48/40/57/565484057.db2.gz FDOJHYHPYYWKGO-UHFFFAOYSA-N 0 1 388.269 3.074 10 0 GGAEMN Cc1cc(C[C@@H](C)N2C(=O)[C@@H](c3cccc(Br)c3)N(C)C2=O)n[nH]1 ZINC000277258924 565485576 /nfs/dbraw/zinc/48/55/76/565485576.db2.gz IOHTYYUUPJNXNG-IAQYHMDHSA-N 0 1 391.269 3.047 10 0 GGAEMN C[C@@H](NC[C@@H](O)CC(F)(F)F)c1cc2c(cc1Br)OCCO2 ZINC000189833729 565491320 /nfs/dbraw/zinc/49/13/20/565491320.db2.gz KCLPKZBIJFBLNL-BDAKNGLRSA-N 0 1 384.192 3.184 10 0 GGAEMN NC(=O)c1cccc(S(=O)(=O)Nc2cc(F)ccc2SCC(F)F)c1 ZINC000172561564 565491807 /nfs/dbraw/zinc/49/18/07/565491807.db2.gz WIMSOQRJMAQIAW-UHFFFAOYSA-N 0 1 390.408 3.083 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)C2(c3ccccc3Br)CC2)C[C@@H](C)O1 ZINC000189847799 565492223 /nfs/dbraw/zinc/49/22/23/565492223.db2.gz AFCYOXKJGVYIRC-HUUCEWRRSA-N 0 1 395.341 3.096 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@H]1CCN(CC(F)(F)F)C1=O ZINC000189976237 565500460 /nfs/dbraw/zinc/50/04/60/565500460.db2.gz DMNQYOWXADCVLD-CABZTGNLSA-N 0 1 395.219 3.272 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)C2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000377845169 565502939 /nfs/dbraw/zinc/50/29/39/565502939.db2.gz OXJCRKFKAAOYQA-XJKSGUPXSA-N 0 1 376.444 3.170 10 0 GGAEMN O=C([O-])c1csc(C[NH2+]Cc2cc(Br)c3c(c2)OCCCO3)n1 ZINC000277544666 565505773 /nfs/dbraw/zinc/50/57/73/565505773.db2.gz ZTWKWIKWOTYCHU-UHFFFAOYSA-N 0 1 399.266 3.055 10 0 GGAEMN Cc1cc(Br)c2c(c1)CN(C(=O)N[C@H]1CCc3nc[nH]c3C1)CC2 ZINC000378044388 565510338 /nfs/dbraw/zinc/51/03/38/565510338.db2.gz ANUAPFUZZRIHBC-ZDUSSCGKSA-N 0 1 389.297 3.106 10 0 GGAEMN O=C(N[C@@H]1CCc2c1cccc2Br)N[C@H]1CCc2nc[nH]c2C1 ZINC000378051240 565510486 /nfs/dbraw/zinc/51/04/86/565510486.db2.gz HJDXFQKBAHAHPT-IINYFYTJSA-N 0 1 375.270 3.016 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378063686 565510556 /nfs/dbraw/zinc/51/05/56/565510556.db2.gz XDPSLFSMYXYQBY-CQSZACIVSA-N 0 1 377.286 3.180 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)c1cccc2nn[nH]c21 ZINC000190148157 565512128 /nfs/dbraw/zinc/51/21/28/565512128.db2.gz ZLKUOJKKEGXNAX-UHFFFAOYSA-N 0 1 395.282 3.071 10 0 GGAEMN CCN1CCN(c2ccc(CNc3cc(C)c(Br)cn3)cn2)CC1 ZINC000301823308 565512538 /nfs/dbraw/zinc/51/25/38/565512538.db2.gz LATBNUMOUPMNQW-UHFFFAOYSA-N 0 1 390.329 3.302 10 0 GGAEMN CCN(Cc1cccc(Br)c1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378102707 565513263 /nfs/dbraw/zinc/51/32/63/565513263.db2.gz SCSOVZAZXDRUNK-AWEZNQCLSA-N 0 1 377.286 3.261 10 0 GGAEMN CC[C@@H](Cc1cccc(Br)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378200156 565515339 /nfs/dbraw/zinc/51/53/39/565515339.db2.gz JZDCQNSYEHSUGD-DZGCQCFKSA-N 0 1 376.298 3.415 10 0 GGAEMN O=C(Cc1csc(-c2ccc(Cl)s2)n1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378320298 565520868 /nfs/dbraw/zinc/52/08/68/565520868.db2.gz XHWFDLCGAWYCII-SECBINFHSA-N 0 1 378.910 3.464 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)c3[nH]c4ccc(Cl)cc4c3Cl)CCO2)n[nH]1 ZINC000173086451 565525510 /nfs/dbraw/zinc/52/55/10/565525510.db2.gz IZYWNJINSCYDJS-LBPRGKRZSA-N 0 1 380.235 3.115 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)[C@@H](C)Sc3ccccc3Cl)CCO2)n[nH]1 ZINC000173096084 565527177 /nfs/dbraw/zinc/52/71/77/565527177.db2.gz OTLKEICTYFVVMP-YPMHNXCESA-N 0 1 380.901 3.101 10 0 GGAEMN C[C@@H](Nc1ccc2nnc(-c3cc(Cl)cc(Cl)c3)n2n1)c1nnc[nH]1 ZINC000302070295 565528208 /nfs/dbraw/zinc/52/82/08/565528208.db2.gz VNFOMXKEXAFVSE-MRVPVSSYSA-N 0 1 375.223 3.389 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1C(F)(F)F ZINC000378456204 565528813 /nfs/dbraw/zinc/52/88/13/565528813.db2.gz CELDIZWOKIIRBD-SECBINFHSA-N 0 1 388.187 3.478 10 0 GGAEMN O=C(CCc1ccc(Br)cc1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000378527149 565532960 /nfs/dbraw/zinc/53/29/60/565532960.db2.gz CGEKCAXVYSXGGD-QGZVFWFLSA-N 0 1 385.265 3.406 10 0 GGAEMN O=C(CCc1ccccc1Br)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000378530578 565532996 /nfs/dbraw/zinc/53/29/96/565532996.db2.gz RINKPTSUPJODTQ-KRWDZBQOSA-N 0 1 385.265 3.406 10 0 GGAEMN CC(=O)c1csc(C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)c1 ZINC000190539477 565540286 /nfs/dbraw/zinc/54/02/86/565540286.db2.gz LKCNKCBLHOPGSV-CQSZACIVSA-N 0 1 377.535 3.310 10 0 GGAEMN C[C@@H]1CN(c2ccc3cc(Br)cc(Cl)c3n2)CCN1CCO ZINC000302409818 565540983 /nfs/dbraw/zinc/54/09/83/565540983.db2.gz LJDXZPAQKPOHLA-LLVKDONJSA-N 0 1 384.705 3.154 10 0 GGAEMN CC[C@H]1CN(c2nnc(Cc3ccc(Cl)cc3)s2)CCN1C[C@@H](C)O ZINC000302402656 565541346 /nfs/dbraw/zinc/54/13/46/565541346.db2.gz FXYNGQKLXOAURD-CJNGLKHVSA-N 0 1 380.945 3.064 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(Br)ccc2Cl)CCN1C ZINC000173274323 565543087 /nfs/dbraw/zinc/54/30/87/565543087.db2.gz YPEKDPPJPOXVOI-CMPLNLGQSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)CCN1C ZINC000173276654 565543342 /nfs/dbraw/zinc/54/33/42/565543342.db2.gz MFAFDTTVRNEBDF-MNOVXSKESA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C ZINC000173278861 565543397 /nfs/dbraw/zinc/54/33/97/565543397.db2.gz XVZJLDHDASLCKC-QWRGUYRKSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CCN1C ZINC000173272709 565543492 /nfs/dbraw/zinc/54/34/92/565543492.db2.gz HYBJPSIASSRXPA-ZYHUDNBSSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)CCN1C ZINC000173276626 565543516 /nfs/dbraw/zinc/54/35/16/565543516.db2.gz MFAFDTTVRNEBDF-GHMZBOCLSA-N 0 1 384.851 3.462 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)CCc2ccccc2)[C@@H]1c1cccs1 ZINC000173323334 565548177 /nfs/dbraw/zinc/54/81/77/565548177.db2.gz HIBNARLHJKKSKD-IEBWSBKVSA-N 0 1 378.563 3.293 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)CCc2ccccc2)[C@@H]1c1cccs1 ZINC000173323351 565548218 /nfs/dbraw/zinc/54/82/18/565548218.db2.gz HIBNARLHJKKSKD-PKOBYXMFSA-N 0 1 378.563 3.293 10 0 GGAEMN Cc1cc(C(=O)N2CCC[C@@H]2c2ccc(I)cc2)n[nH]1 ZINC000173326409 565548963 /nfs/dbraw/zinc/54/89/63/565548963.db2.gz QXAIIAQHGWTHFB-CQSZACIVSA-N 0 1 381.217 3.300 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2ccc(F)cc2F)[C@@H]1c1cccs1 ZINC000173325270 565549259 /nfs/dbraw/zinc/54/92/59/565549259.db2.gz HTNOZOYCNAGHBA-SJKOYZFVSA-N 0 1 386.489 3.388 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@H](C)c3ncc(Br)cc3F)C2)n(C)n1 ZINC000278412829 565556508 /nfs/dbraw/zinc/55/65/08/565556508.db2.gz HTOJCWGRJFQCKS-OCCSQVGLSA-N 0 1 396.308 3.345 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@@H](C)c3ncc(Br)cc3F)C2)n(C)n1 ZINC000278412825 565556712 /nfs/dbraw/zinc/55/67/12/565556712.db2.gz HTOJCWGRJFQCKS-JSGCOSHPSA-N 0 1 396.308 3.345 10 0 GGAEMN C[C@@H]1CN(c2ccnc3c(Cl)cc(Br)cc23)CCN1CCO ZINC000302798411 565558026 /nfs/dbraw/zinc/55/80/26/565558026.db2.gz RKBWDWSTMYUOFE-LLVKDONJSA-N 0 1 384.705 3.154 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccc(F)cc2OCC(F)F)ccc1F ZINC000190817206 565560755 /nfs/dbraw/zinc/56/07/55/565560755.db2.gz GQINNIZXORNBNG-UHFFFAOYSA-N 0 1 379.331 3.418 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@H](C)c3ncc(Br)s3)C2)n(C)n1 ZINC000278478818 565561000 /nfs/dbraw/zinc/56/10/00/565561000.db2.gz OMGUJGYGUIBMOT-VXGBXAGGSA-N 0 1 384.347 3.267 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@H](C)c3ncc(Br)s3)C2)n(C)n1 ZINC000278478811 565561042 /nfs/dbraw/zinc/56/10/42/565561042.db2.gz OMGUJGYGUIBMOT-NEPJUHHUSA-N 0 1 384.347 3.267 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NC(=O)c2sc(CC3CC3)nc2C)c1 ZINC000190809331 565561056 /nfs/dbraw/zinc/56/10/56/565561056.db2.gz XKFOPUHUOABVJH-UHFFFAOYSA-N 0 1 380.491 3.156 10 0 GGAEMN COC(=O)Cc1ccc(S(=O)(=O)Nc2cc(C)c(Cl)cc2OC)cc1 ZINC000392959285 565566646 /nfs/dbraw/zinc/56/66/46/565566646.db2.gz AFOCVAZPQPKMSM-UHFFFAOYSA-N 0 1 383.853 3.173 10 0 GGAEMN Cc1ccc(S(C)(=O)=O)cc1NS(=O)(=O)c1cccc2ccccc21 ZINC000392770637 565567253 /nfs/dbraw/zinc/56/72/53/565567253.db2.gz RLGBWJIVFPYTEP-UHFFFAOYSA-N 0 1 375.471 3.353 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)C2(c3ccccc3Br)CC2)n[nH]1 ZINC000190994390 565575867 /nfs/dbraw/zinc/57/58/67/565575867.db2.gz XYZDXEXSPYIEEK-UHFFFAOYSA-N 0 1 378.226 3.019 10 0 GGAEMN CCOc1c(Br)cc(CNCc2c[nH]nn2)cc1Br ZINC000398344402 565577831 /nfs/dbraw/zinc/57/78/31/565577831.db2.gz LVDRCQZHOSFRQU-UHFFFAOYSA-N 0 1 390.079 3.018 10 0 GGAEMN C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[C@@]2(CNC(=O)C2)C1 ZINC000278833853 565579289 /nfs/dbraw/zinc/57/92/89/565579289.db2.gz IPIQRURKKQRXFV-DYZYQPBXSA-N 0 1 381.263 3.316 10 0 GGAEMN CC[C@@H](NC(=O)N1CCN2CCCC[C@@H]2C1)c1nc(C(F)(F)F)cs1 ZINC000173732908 565580763 /nfs/dbraw/zinc/58/07/63/565580763.db2.gz OXPPDNJXSKTXJG-VXGBXAGGSA-N 0 1 376.448 3.493 10 0 GGAEMN CC1CCN(CCNS(=O)(=O)c2c(Cl)cccc2Br)CC1 ZINC000313805881 565584438 /nfs/dbraw/zinc/58/44/38/565584438.db2.gz VJPXQBORGAJCNC-UHFFFAOYSA-N 0 1 395.750 3.113 10 0 GGAEMN C[C@H]1C[C@H](NC(=O)c2nscc2Br)CN1Cc1ccccc1 ZINC000404817778 565584389 /nfs/dbraw/zinc/58/43/89/565584389.db2.gz QSQGLRDVJSCFBY-AAEUAGOBSA-N 0 1 380.311 3.298 10 0 GGAEMN O=S(=O)(NCCN1CCCCCC1)c1c(Cl)cccc1Br ZINC000313753937 565584831 /nfs/dbraw/zinc/58/48/31/565584831.db2.gz JCSWBEOEGFGBTO-UHFFFAOYSA-N 0 1 395.750 3.257 10 0 GGAEMN C[C@@H]1CN(C2CCOCC2)CCN1C(=O)c1c(Cl)cc(F)cc1Cl ZINC000278911261 565585009 /nfs/dbraw/zinc/58/50/09/565585009.db2.gz SXOZNDOBHQLDMY-LLVKDONJSA-N 0 1 375.271 3.458 10 0 GGAEMN C[C@H](CCNCc1cc(Cl)ccc1I)[S@@](C)=O ZINC000405280401 565585186 /nfs/dbraw/zinc/58/51/86/565585186.db2.gz BCJXVCAORBXWBC-VVVCHXIZSA-N 0 1 385.698 3.191 10 0 GGAEMN C[C@@H](CCNCc1cc(Cl)ccc1I)[S@](C)=O ZINC000405280404 565585662 /nfs/dbraw/zinc/58/56/62/565585662.db2.gz BCJXVCAORBXWBC-XYZCENFISA-N 0 1 385.698 3.191 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2I)C[C@H]1C(=O)[O-] ZINC000405277854 565585945 /nfs/dbraw/zinc/58/59/45/565585945.db2.gz ZAXZFHPBIIECPR-LDYMZIIASA-N 0 1 379.625 3.097 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3cccc(Br)c3)C2)n[nH]1 ZINC000407975289 565588619 /nfs/dbraw/zinc/58/86/19/565588619.db2.gz FZONTFCGJWJDOF-GFCCVEGCSA-N 0 1 384.299 3.049 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)c2cccc(I)c2)n[nH]1 ZINC000407981277 565589309 /nfs/dbraw/zinc/58/93/09/565589309.db2.gz RSMAHDRTBNEHFG-CYBMUJFWSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1cc([C@@H]2CCCN(C(=O)[C@@H]3COc4ccc(Br)cc43)C2)n[nH]1 ZINC000407981337 565589501 /nfs/dbraw/zinc/58/95/01/565589501.db2.gz SFJZPQZORPYEIJ-IUODEOHRSA-N 0 1 390.281 3.363 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3ccc(Br)c(C)c3)C2)n[nH]1 ZINC000407977126 565589577 /nfs/dbraw/zinc/58/95/77/565589577.db2.gz PXHXSEDRHFHWFP-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000407977955 565589705 /nfs/dbraw/zinc/58/97/05/565589705.db2.gz ZUXWXRZIKIYHOQ-ZDUSSCGKSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3C)C2)n[nH]1 ZINC000407978111 565589771 /nfs/dbraw/zinc/58/97/71/565589771.db2.gz VZYBRXRIUQWJNJ-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3cc(C)ccc3Br)C2)n[nH]1 ZINC000407978238 565590019 /nfs/dbraw/zinc/59/00/19/565590019.db2.gz WXZFQTWTOWEPJI-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN COc1cc(Cl)c(Cl)cc1NC(=O)N1CCO[C@H](c2n[nH]c(C)n2)C1 ZINC000191273240 565592366 /nfs/dbraw/zinc/59/23/66/565592366.db2.gz WTYBQVDOPYBQED-ZDUSSCGKSA-N 0 1 386.239 3.034 10 0 GGAEMN CC(C)NC(=O)CCN1CCN([C@@H](C)c2ccc(Br)cc2)CC1 ZINC000173855465 565593118 /nfs/dbraw/zinc/59/31/18/565593118.db2.gz UMSMCPYZELYXJN-HNNXBMFYSA-N 0 1 382.346 3.042 10 0 GGAEMN CC(C)NC(=O)CCN1CCN([C@H](C)c2ccc(Br)cc2)CC1 ZINC000173855478 565593280 /nfs/dbraw/zinc/59/32/80/565593280.db2.gz UMSMCPYZELYXJN-OAHLLOKOSA-N 0 1 382.346 3.042 10 0 GGAEMN O=C(c1cc(C2CCCCC2)[nH]n1)N1CCn2c(Br)cnc2C1 ZINC000279232667 565603007 /nfs/dbraw/zinc/60/30/07/565603007.db2.gz QKEIZZBCQOAVFT-UHFFFAOYSA-N 0 1 378.274 3.072 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000191444664 565604710 /nfs/dbraw/zinc/60/47/10/565604710.db2.gz LYWFAOVMUXHARM-GXTWGEPZSA-N 0 1 382.302 3.008 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000191441071 565604963 /nfs/dbraw/zinc/60/49/63/565604963.db2.gz LUTRQSMWGYUFJH-YUELXQCFSA-N 0 1 396.329 3.397 10 0 GGAEMN CCOC(=O)C1CCC(O)(C[N@@H+](C)Cc2ccccc2Br)CC1 ZINC000191442363 565605230 /nfs/dbraw/zinc/60/52/30/565605230.db2.gz SFBLABHYRGVJKC-UHFFFAOYSA-N 0 1 384.314 3.365 10 0 GGAEMN CCOC(=O)C1CCC(O)(CN(C)Cc2ccccc2Br)CC1 ZINC000191442363 565605231 /nfs/dbraw/zinc/60/52/31/565605231.db2.gz SFBLABHYRGVJKC-UHFFFAOYSA-N 0 1 384.314 3.365 10 0 GGAEMN O=C([O-])[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1Cc1nc(-c2cccc(Br)c2)no1 ZINC000326494312 565623812 /nfs/dbraw/zinc/62/38/12/565623812.db2.gz YNDJNICNXHHEDO-KYOSRNDESA-N 0 1 392.253 3.184 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccncc1Cl ZINC000174281435 565627339 /nfs/dbraw/zinc/62/73/39/565627339.db2.gz YOHAZVNYPUPUDM-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccncc1Cl ZINC000174281435 565627341 /nfs/dbraw/zinc/62/73/41/565627341.db2.gz YOHAZVNYPUPUDM-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN O=C([O-])[C@]1(C(F)(F)F)CC[N@@H+](CCCc2nc(-c3cccs3)no2)C1 ZINC000327403560 565630736 /nfs/dbraw/zinc/63/07/36/565630736.db2.gz KUNRZXHDLWNJCX-AWEZNQCLSA-N 0 1 375.372 3.070 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@H]2CCOc3c(Br)cccc32)C[C@@H]1C ZINC000409703992 565634363 /nfs/dbraw/zinc/63/43/63/565634363.db2.gz CJWCTSJJAGOBHT-XEZPLFJOSA-N 0 1 396.329 3.397 10 0 GGAEMN CC(C)NC(=O)CC[N@H+]1CCC[C@H]1c1ccc(I)cc1 ZINC000174428272 565634464 /nfs/dbraw/zinc/63/44/64/565634464.db2.gz HBJDMFMYRHIXIB-HNNXBMFYSA-N 0 1 386.277 3.343 10 0 GGAEMN CC(C)NC(=O)CCN1CCC[C@H]1c1ccc(I)cc1 ZINC000174428272 565634469 /nfs/dbraw/zinc/63/44/69/565634469.db2.gz HBJDMFMYRHIXIB-HNNXBMFYSA-N 0 1 386.277 3.343 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@H]2CCOc3c(Br)cccc32)C[C@H]1C ZINC000409703987 565634531 /nfs/dbraw/zinc/63/45/31/565634531.db2.gz CJWCTSJJAGOBHT-WWGRRREGSA-N 0 1 396.329 3.397 10 0 GGAEMN COC[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1ccc(C)o1 ZINC000174616712 565646909 /nfs/dbraw/zinc/64/69/09/565646909.db2.gz QYQWGZVAWGQECT-CYBMUJFWSA-N 0 1 378.226 3.344 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Br)cc2Cl)CCN1C[C@@H](C)O ZINC000174636771 565648131 /nfs/dbraw/zinc/64/81/31/565648131.db2.gz GCJDMSWQEXRHCT-DGCLKSJQSA-N 0 1 389.721 3.020 10 0 GGAEMN CC[N@H+]1CCC[C@@H](NC(=O)C(=O)Nc2cccc(Cl)c2SC(C)C)C1 ZINC000174768302 565657390 /nfs/dbraw/zinc/65/73/90/565657390.db2.gz PKTIYEVMKPLLPO-CYBMUJFWSA-N 0 1 383.945 3.380 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)C(=O)Nc2cccc(Cl)c2SC(C)C)C1 ZINC000174768302 565657393 /nfs/dbraw/zinc/65/73/93/565657393.db2.gz PKTIYEVMKPLLPO-CYBMUJFWSA-N 0 1 383.945 3.380 10 0 GGAEMN O=C1[C@H]([N@@H+]2CCC[C@H](c3nnc[nH]3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235706 565659784 /nfs/dbraw/zinc/65/97/84/565659784.db2.gz IUCQIJGWKMRBJU-XHDPSFHLSA-N 0 1 380.279 3.096 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)[C@@H]1C ZINC000174922236 565667782 /nfs/dbraw/zinc/66/77/82/565667782.db2.gz XETPODSNAKRDTG-GHMZBOCLSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)[C@@H]1C ZINC000174922236 565667784 /nfs/dbraw/zinc/66/77/84/565667784.db2.gz XETPODSNAKRDTG-GHMZBOCLSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)c(Br)c2)CCN1C ZINC000192214506 565670478 /nfs/dbraw/zinc/67/04/78/565670478.db2.gz FNESZTSJZSOJIB-GHMZBOCLSA-N 0 1 395.750 3.206 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2n[nH]c3ccc(Br)cc32)[C@H]2CCCO[C@@H]21 ZINC000329733484 565677680 /nfs/dbraw/zinc/67/76/80/565677680.db2.gz QUHIJJWMJMTNSD-KMUNFCNLSA-N 0 1 378.270 3.259 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2n[nH]c3ccc(Br)cc32)[C@@H]2CCCO[C@H]21 ZINC000329733483 565678078 /nfs/dbraw/zinc/67/80/78/565678078.db2.gz QUHIJJWMJMTNSD-COLVAYQJSA-N 0 1 378.270 3.259 10 0 GGAEMN CCN(CCOc1ccc(Br)cc1)Cc1cnc(OC)nc1C ZINC000410382041 565681297 /nfs/dbraw/zinc/68/12/97/565681297.db2.gz NIDLXMYCKYIIKB-UHFFFAOYSA-N 0 1 380.286 3.457 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cc(Br)c(F)cc2F)[nH]n1 ZINC000192371253 565683711 /nfs/dbraw/zinc/68/37/11/565683711.db2.gz MJXNCHGWAADINC-UHFFFAOYSA-N 0 1 382.168 3.103 10 0 GGAEMN O=C1CCN1c1ccc(NS(=O)(=O)c2cc(F)ccc2Br)cc1 ZINC000410415902 565684473 /nfs/dbraw/zinc/68/44/73/565684473.db2.gz FMLULYRLVKMMQX-UHFFFAOYSA-N 0 1 399.241 3.126 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@H]1CCCc2[nH]ncc21 ZINC000280628477 565684897 /nfs/dbraw/zinc/68/48/97/565684897.db2.gz QVYVIAVTTLPLPD-XMZIXOGTSA-N 0 1 378.245 3.404 10 0 GGAEMN Cc1cc(C)n(C[C@H]2CN(C(=O)c3c(O)cc(Cl)cc3Cl)CCO2)n1 ZINC000175227084 565686185 /nfs/dbraw/zinc/68/61/85/565686185.db2.gz MMQUAKXLNRSVDG-CYBMUJFWSA-N 0 1 384.263 3.054 10 0 GGAEMN Cc1nc(C)n(C[C@H]2CCCN(C(=O)c3c(O)cc(Cl)cc3Cl)C2)n1 ZINC000175240028 565687087 /nfs/dbraw/zinc/68/70/87/565687087.db2.gz VDNNRICOCAEHBP-LBPRGKRZSA-N 0 1 383.279 3.460 10 0 GGAEMN CC[C@@H]1CN(C[C@@H](O)COc2c(Cl)cccc2Cl)C[C@@]2(CCOC2)O1 ZINC000330083007 565691058 /nfs/dbraw/zinc/69/10/58/565691058.db2.gz BEZAHNRFVXMCCA-HBUWYVDXSA-N 0 1 390.307 3.003 10 0 GGAEMN C[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C[C@]2(CCCOC2)O1 ZINC000330100334 565692481 /nfs/dbraw/zinc/69/24/81/565692481.db2.gz DVDQAUWWXZQLNK-SIIHOXLZSA-N 0 1 390.307 3.003 10 0 GGAEMN C[C@H](N[C@H]1CCCc2occc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280777978 565694337 /nfs/dbraw/zinc/69/43/37/565694337.db2.gz SBZZHZOJRHOUNJ-HZMBPMFUSA-N 0 1 399.310 3.418 10 0 GGAEMN C[C@@H]1CN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C[C@@]2(CCCOC2)O1 ZINC000330139523 565694749 /nfs/dbraw/zinc/69/47/49/565694749.db2.gz WIPNMBSZGOYPDB-DDUZABMNSA-N 0 1 390.307 3.003 10 0 GGAEMN Cc1ccc(CN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)s1 ZINC000280823746 565697724 /nfs/dbraw/zinc/69/77/24/565697724.db2.gz WXJJHUHKGHPONR-JTQLQIEISA-N 0 1 389.340 3.317 10 0 GGAEMN CN1CC[C@H]2OCCN(C(=O)c3cc(Cl)c4cc(Cl)ccc4n3)[C@H]2C1 ZINC000410844749 565697881 /nfs/dbraw/zinc/69/78/81/565697881.db2.gz CONCCVDXLSYKOW-DLBZAZTESA-N 0 1 380.275 3.087 10 0 GGAEMN Cc1ccc(CN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)s1 ZINC000280823747 565698128 /nfs/dbraw/zinc/69/81/28/565698128.db2.gz WXJJHUHKGHPONR-SNVBAGLBSA-N 0 1 389.340 3.317 10 0 GGAEMN C[C@@H](NCc1ccc(F)c(Br)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000192728826 565707750 /nfs/dbraw/zinc/70/77/50/565707750.db2.gz WAQMEMTYMNTNEM-SNVBAGLBSA-N 0 1 387.274 3.086 10 0 GGAEMN CO[C@@H](C)c1nc(C)c(C(=O)NCC2(N3CCSCC3)CCCC2)s1 ZINC000175563523 565709476 /nfs/dbraw/zinc/70/94/76/565709476.db2.gz MNIRFUQSMIIHBZ-AWEZNQCLSA-N 0 1 383.583 3.250 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)Nc2ccc3c(C)n[nH]c3c2)cc1OC ZINC000192801413 565711152 /nfs/dbraw/zinc/71/11/52/565711152.db2.gz FXFPWNGZBUEKBF-UHFFFAOYSA-N 0 1 381.841 3.343 10 0 GGAEMN O=C(NCC1(CN2CCOCC2)CCCCC1)c1coc(Br)c1 ZINC000175663330 565714734 /nfs/dbraw/zinc/71/47/34/565714734.db2.gz LMHHZTZUNYVOPD-UHFFFAOYSA-N 0 1 385.302 3.055 10 0 GGAEMN C[C@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CC[N@H+]1C ZINC000281181738 565717020 /nfs/dbraw/zinc/71/70/20/565717020.db2.gz FFHQSJJEFWANSG-NKKGCODLSA-N 0 1 380.330 3.429 10 0 GGAEMN C[C@@H]1CCCN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@@H]1CO ZINC000330724320 565720357 /nfs/dbraw/zinc/72/03/57/565720357.db2.gz GQBIORPVUOUEPH-BDJLRTHQSA-N 0 1 378.270 3.072 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccccc2SCC(N)=O)c(Cl)cc1F ZINC000193032080 565726683 /nfs/dbraw/zinc/72/66/83/565726683.db2.gz SJAYGDGUPZRSIB-UHFFFAOYSA-N 0 1 388.873 3.166 10 0 GGAEMN Cc1ccc([C@@H](CN2CCOCC2)NCc2ccc(Br)cn2)cc1 ZINC000411447177 565729373 /nfs/dbraw/zinc/72/93/73/565729373.db2.gz BGIGQQOUJBCMGF-LJQANCHMSA-N 0 1 390.325 3.316 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2Br)CCN1C ZINC000281418642 565730125 /nfs/dbraw/zinc/73/01/25/565730125.db2.gz IREXLIXYZYVDIC-PWSUYJOCSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1CC[C@H](CCC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)O1 ZINC000175911348 565733008 /nfs/dbraw/zinc/73/30/08/565733008.db2.gz WKBXOJOHOGFICA-SMDDNHRTSA-N 0 1 393.285 3.198 10 0 GGAEMN C[C@H]1CC[C@H](CCC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)O1 ZINC000175911348 565733014 /nfs/dbraw/zinc/73/30/14/565733014.db2.gz WKBXOJOHOGFICA-SMDDNHRTSA-N 0 1 393.285 3.198 10 0 GGAEMN CSc1ccc(NC(=O)CN[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1 ZINC000193156621 565735281 /nfs/dbraw/zinc/73/52/81/565735281.db2.gz FDFRTWOYRPSJGS-CYBMUJFWSA-N 0 1 378.519 3.101 10 0 GGAEMN CSc1ccc(NC(=O)CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1 ZINC000193156603 565735831 /nfs/dbraw/zinc/73/58/31/565735831.db2.gz FDFRTWOYRPSJGS-ZDUSSCGKSA-N 0 1 378.519 3.101 10 0 GGAEMN O=S(=O)(CCNCc1cnc(-c2ccccc2)[nH]1)c1ccc(Cl)cc1 ZINC000175982107 565738747 /nfs/dbraw/zinc/73/87/47/565738747.db2.gz FKFPSWXSFDLURC-UHFFFAOYSA-N 0 1 375.881 3.294 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NCC(=O)N(C)Cc1ccco1 ZINC000411612797 565740079 /nfs/dbraw/zinc/74/00/79/565740079.db2.gz AZGSVDJCANUCBJ-LBPRGKRZSA-N 0 1 381.270 3.360 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000281813024 565750382 /nfs/dbraw/zinc/75/03/82/565750382.db2.gz GZNOUWDIOVHPBC-ZUZCIYMTSA-N 0 1 393.285 3.235 10 0 GGAEMN Cc1nnc([C@@H](C)N2CC[C@H](Cc3cccc(I)c3)C2)[nH]1 ZINC000411776818 565751964 /nfs/dbraw/zinc/75/19/64/565751964.db2.gz XYZXHZJYVLVXSY-BXUZGUMPSA-N 0 1 396.276 3.343 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@H](C)C(=O)N1CCC[C@@H](C(N)=O)C1 ZINC000331293236 565753414 /nfs/dbraw/zinc/75/34/14/565753414.db2.gz LNBZACBZYFFWDN-UKRRQHHQSA-N 0 1 396.329 3.352 10 0 GGAEMN O=S(=O)(NCCC[C@@H]1CCCC[C@@H]1O)c1cc(C(F)(F)F)ccc1O ZINC000331352280 565756498 /nfs/dbraw/zinc/75/64/98/565756498.db2.gz ZHBKMTWUHFDOEI-AAEUAGOBSA-N 0 1 381.416 3.021 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(OCC(F)(F)F)c(F)c2)[nH]1 ZINC000281952036 565757441 /nfs/dbraw/zinc/75/74/41/565757441.db2.gz AMPALSIWCFEJCC-UHFFFAOYSA-N 0 1 378.351 3.314 10 0 GGAEMN COc1ccc(-c2cc(C(=O)N3CCC=C(Br)C3)n[nH]2)cc1OC ZINC000281960829 565757564 /nfs/dbraw/zinc/75/75/64/565757564.db2.gz VRTODNUJVBDUFY-UHFFFAOYSA-N 0 1 392.253 3.219 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000281977007 565758858 /nfs/dbraw/zinc/75/88/58/565758858.db2.gz RVJUTLGSMCQJMQ-HNNXBMFYSA-N 0 1 393.285 3.236 10 0 GGAEMN C[C@@H](COCC(F)(F)F)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000282036144 565761782 /nfs/dbraw/zinc/76/17/82/565761782.db2.gz FSRLDJRAVIGHSP-ZETCQYMHSA-N 0 1 380.164 3.023 10 0 GGAEMN C[C@H](c1ccncc1)N1CCC(NC(=O)N2CCC=C(Br)C2)CC1 ZINC000282055867 565763160 /nfs/dbraw/zinc/76/31/60/565763160.db2.gz AQJMGBOIRSTCIH-CQSZACIVSA-N 0 1 393.329 3.301 10 0 GGAEMN CCN(CC(=O)NCC(=O)Nc1ccccc1Br)C1CC(C)(C)C1 ZINC000412032312 565766819 /nfs/dbraw/zinc/76/68/19/565766819.db2.gz HDWQSKBMEBRUHC-UHFFFAOYSA-N 0 1 396.329 3.014 10 0 GGAEMN CC(C)N(CC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)C[C@@H]1CCC(=O)N1 ZINC000412064404 565768639 /nfs/dbraw/zinc/76/86/39/565768639.db2.gz JXNPTWQPEPXIPI-JSGCOSHPSA-N 0 1 386.323 3.160 10 0 GGAEMN CC(C)N(CC[S@@](=O)c1cc(Cl)ccc1Cl)C[C@@H]1CCC(=O)N1 ZINC000412092260 565771190 /nfs/dbraw/zinc/77/11/90/565771190.db2.gz VSIPVSGEYWTHHW-ZAMGYDSWSA-N 0 1 377.337 3.090 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCC[C@H]1C[C@@H](O)c1ccccc1 ZINC000176487158 565776750 /nfs/dbraw/zinc/77/67/50/565776750.db2.gz DMFBMMFCQIILMJ-QWHCGFSZSA-N 0 1 381.548 3.407 10 0 GGAEMN Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000282381999 565777086 /nfs/dbraw/zinc/77/70/86/565777086.db2.gz YTHRSTPGVXMYSB-CYBMUJFWSA-N 0 1 390.241 3.163 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)[C@H](C)Oc2ccc(Br)cc2)n[nH]1 ZINC000331723098 565779095 /nfs/dbraw/zinc/77/90/95/565779095.db2.gz KTYAATSHZJLKPF-NHYWBVRUSA-N 0 1 393.285 3.397 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2occc2Br)CC1 ZINC000176546106 565783274 /nfs/dbraw/zinc/78/32/74/565783274.db2.gz UTKLJSBLKOJKNQ-UHFFFAOYSA-N 0 1 378.270 3.436 10 0 GGAEMN CN1CCN([C@H]2CCCCN(C(=O)c3cc(Cl)sc3Cl)C2)CC1 ZINC000176670460 565792792 /nfs/dbraw/zinc/79/27/92/565792792.db2.gz ZMIUXSCOXSMLTR-LBPRGKRZSA-N 0 1 376.353 3.297 10 0 GGAEMN CSc1cc(C(=O)N2CCC[C@@H](c3nc(=O)[nH][nH]3)C2)c(Cl)cc1Cl ZINC000282896113 565802011 /nfs/dbraw/zinc/80/20/11/565802011.db2.gz LEPQBEGIYYLUJP-MRVPVSSYSA-N 0 1 387.292 3.147 10 0 GGAEMN O=C(c1s[n-]c(=O)c1Cl)N1CCC[N@@H+](CCCc2ccccc2)CC1 ZINC000282937920 565803742 /nfs/dbraw/zinc/80/37/42/565803742.db2.gz DEVXCVWXNSVNNL-UHFFFAOYSA-N 0 1 379.913 3.283 10 0 GGAEMN O=C(NC[C@@H](CCO)c1ccccc1)c1n[nH]c2ccc(Br)cc21 ZINC000176822828 565806375 /nfs/dbraw/zinc/80/63/75/565806375.db2.gz QUKOVEHFGQAPSK-CYBMUJFWSA-N 0 1 388.265 3.221 10 0 GGAEMN O=S(=O)(NC1CCN(C2CC2)CC1)c1c(Cl)cccc1Br ZINC000283009023 565806652 /nfs/dbraw/zinc/80/66/52/565806652.db2.gz ONJKCLJAYCLIQC-UHFFFAOYSA-N 0 1 393.734 3.008 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2ccccc2NC(=O)c2s[n-]c(=O)c2Cl)C[C@H](C)O1 ZINC000283009990 565806697 /nfs/dbraw/zinc/80/66/97/565806697.db2.gz LFKCDCLQZHXFPP-PHIMTYICSA-N 0 1 381.885 3.364 10 0 GGAEMN C[C@@H]1C[N@H+](Cc2ccccc2NC(=O)c2s[n-]c(=O)c2Cl)C[C@H](C)O1 ZINC000283009990 565806703 /nfs/dbraw/zinc/80/67/03/565806703.db2.gz LFKCDCLQZHXFPP-PHIMTYICSA-N 0 1 381.885 3.364 10 0 GGAEMN CCN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1s[n-]c(=O)c1Cl ZINC000283244480 565814389 /nfs/dbraw/zinc/81/43/89/565814389.db2.gz CHKARRZYLNKHJX-AWEZNQCLSA-N 0 1 379.913 3.486 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOc2ccc(Br)cc2C1 ZINC000283388844 565817871 /nfs/dbraw/zinc/81/78/71/565817871.db2.gz DQJNOZNFMYZSTP-CYBMUJFWSA-N 0 1 376.254 3.013 10 0 GGAEMN O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)c1c(O)cc(Cl)cc1Cl ZINC000176999636 565821794 /nfs/dbraw/zinc/82/17/94/565821794.db2.gz NEBQIZJYBYMYCG-LBPRGKRZSA-N 0 1 386.256 3.348 10 0 GGAEMN COC(=O)[C@H]1CSCCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1 ZINC000412952163 565823253 /nfs/dbraw/zinc/82/32/53/565823253.db2.gz MGXFNTKHIPYAGE-LLVKDONJSA-N 0 1 379.865 3.177 10 0 GGAEMN CCSc1ccc(Cl)cc1NC(=O)N1CCO[C@@H](c2n[nH]c(C)n2)C1 ZINC000177085194 565827347 /nfs/dbraw/zinc/82/73/47/565827347.db2.gz DVHOFCCRUPRMMH-CYBMUJFWSA-N 0 1 381.889 3.484 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000177095416 565828777 /nfs/dbraw/zinc/82/87/77/565828777.db2.gz YRHIIOBHIOADJH-LBPRGKRZSA-N 0 1 379.810 3.279 10 0 GGAEMN CC(=O)c1ccc(NS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)cc1Cl ZINC000194660412 565828951 /nfs/dbraw/zinc/82/89/51/565828951.db2.gz YRSMDQOJKZWOAH-UHFFFAOYSA-N 0 1 380.853 3.045 10 0 GGAEMN CN(C)C(=O)CCN1CCN(c2ncc(-c3ccc(Cl)cc3)s2)CC1 ZINC000413200117 565840003 /nfs/dbraw/zinc/84/00/03/565840003.db2.gz UHGKVYWSSNEFSZ-UHFFFAOYSA-N 0 1 378.929 3.064 10 0 GGAEMN COCC(C)(C)CC(=O)Nc1cc(Br)ccc1N1CCN(C)CC1 ZINC000413265314 565843101 /nfs/dbraw/zinc/84/31/01/565843101.db2.gz XRSCUTOZUCZBSU-UHFFFAOYSA-N 0 1 398.345 3.202 10 0 GGAEMN CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc(Br)cc(Cl)c1[O-] ZINC000177423196 565850266 /nfs/dbraw/zinc/85/02/66/565850266.db2.gz CWNHCJQBZQVVMR-NSHDSACASA-N 0 1 375.694 3.364 10 0 GGAEMN O=C(Nc1ccc(-c2nc3ccc(Br)cc3[nH]2)cc1)[C@@H]1CNC(=O)C1 ZINC000177435035 565850654 /nfs/dbraw/zinc/85/06/54/565850654.db2.gz SXDCWZOOYONQOB-NSHDSACASA-N 0 1 399.248 3.067 10 0 GGAEMN O=C(Nc1ccc(-c2nc3ccc(Br)cc3[nH]2)cc1)[C@H]1CNC(=O)C1 ZINC000177435021 565850692 /nfs/dbraw/zinc/85/06/92/565850692.db2.gz SXDCWZOOYONQOB-LLVKDONJSA-N 0 1 399.248 3.067 10 0 GGAEMN CC(C)Oc1ccc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)nn1 ZINC000194982091 565852022 /nfs/dbraw/zinc/85/20/22/565852022.db2.gz HYKXEJXUNYOQKJ-UHFFFAOYSA-N 0 1 375.372 3.225 10 0 GGAEMN COc1ccc(CCC(=O)N2CCN3CCCC[C@@H]3C2)cc1Br ZINC000195088592 565858085 /nfs/dbraw/zinc/85/80/85/565858085.db2.gz OVFXWMXGCZUWHQ-OAHLLOKOSA-N 0 1 381.314 3.087 10 0 GGAEMN COc1ccc(CCC(=O)N2CCN3CCCC[C@H]3C2)cc1Br ZINC000195088610 565858609 /nfs/dbraw/zinc/85/86/09/565858609.db2.gz OVFXWMXGCZUWHQ-HNNXBMFYSA-N 0 1 381.314 3.087 10 0 GGAEMN CC1(CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCC1 ZINC000177553985 565858717 /nfs/dbraw/zinc/85/87/17/565858717.db2.gz JMSQJCHRWYCHDO-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN CC1(CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCC1 ZINC000177553985 565858719 /nfs/dbraw/zinc/85/87/19/565858719.db2.gz JMSQJCHRWYCHDO-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN CCCCOC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000195206837 565866497 /nfs/dbraw/zinc/86/64/97/565866497.db2.gz SVSKWSUTRNUHIX-QGZVFWFLSA-N 0 1 389.367 3.331 10 0 GGAEMN O=S(=O)([C@H]1C[C@@H]2CC[C@H]1C2)N1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000333181210 565870209 /nfs/dbraw/zinc/87/02/09/565870209.db2.gz PVZDVGMOSJXXIU-VOAKCMCISA-N 0 1 377.432 3.126 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)CCc2cccs2)[C@@H]1c1cccs1 ZINC000195384381 565879253 /nfs/dbraw/zinc/87/92/53/565879253.db2.gz WKKQUTNFGSPHNK-WMLDXEAASA-N 0 1 384.592 3.355 10 0 GGAEMN C[C@H]1CNCCN1C(=O)N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000333514659 565885991 /nfs/dbraw/zinc/88/59/91/565885991.db2.gz FYSXXBHCGLZPOS-MEDUHNTESA-N 0 1 391.313 3.311 10 0 GGAEMN O[C@H](COc1ccc(Br)c(F)c1)CN1CCc2ccccc2C1 ZINC000200437647 565895167 /nfs/dbraw/zinc/89/51/67/565895167.db2.gz LXXJLRYGDXPPDB-HNNXBMFYSA-N 0 1 380.257 3.386 10 0 GGAEMN C[C@@H](NC(=O)CN[C@](C)(CO)c1ccc(Br)cc1)c1cccs1 ZINC000285248163 565897215 /nfs/dbraw/zinc/89/72/15/565897215.db2.gz AILPTYNWWDYEIO-SJKOYZFVSA-N 0 1 397.338 3.185 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000218767660 565900889 /nfs/dbraw/zinc/90/08/89/565900889.db2.gz UQGUXGPVYJUDNW-SNVBAGLBSA-N 0 1 376.092 3.036 10 0 GGAEMN COC[C@H](CCO)N[C@@H](C)c1ccc(Br)cc1Br ZINC000223952480 565909983 /nfs/dbraw/zinc/90/99/83/565909983.db2.gz JDRMLIAEIPQKDJ-ONGXEEELSA-N 0 1 381.108 3.260 10 0 GGAEMN NS(=O)(=O)c1ccc(CNC2(c3ccc(F)cc3)CC2)cc1Br ZINC000414338088 565912427 /nfs/dbraw/zinc/91/24/27/565912427.db2.gz QYDNOXTWICZRDJ-UHFFFAOYSA-N 0 1 399.285 3.015 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](NCc2cncnc2)C1=O ZINC000285573073 565914065 /nfs/dbraw/zinc/91/40/65/565914065.db2.gz ULNFMVYXBRDBAO-INIZCTEOSA-N 0 1 389.297 3.141 10 0 GGAEMN COc1cc(OC)c(S(=O)(=O)Nc2ccc3c(c2)CCCO3)cc1Cl ZINC000414379678 565919718 /nfs/dbraw/zinc/91/97/18/565919718.db2.gz JEMWGUDOJLQOST-UHFFFAOYSA-N 0 1 383.853 3.483 10 0 GGAEMN CN1C(=O)N([C@@H]2CCc3nc[nH]c3C2)C(=O)[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000348983288 565920080 /nfs/dbraw/zinc/92/00/80/565920080.db2.gz HSOVESJJSWOXFG-BMIGLBTASA-N 0 1 379.247 3.209 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3cc(Br)cc(F)c32)n[nH]1 ZINC000178528052 565924276 /nfs/dbraw/zinc/92/42/76/565924276.db2.gz MYDZJEKXKILGEX-VIFPVBQESA-N 0 1 381.249 3.323 10 0 GGAEMN CN(C(=O)c1[nH]nc2ccc(Br)cc21)[C@@H]1CCCc2c1cnn2C ZINC000178657890 565931172 /nfs/dbraw/zinc/93/11/72/565931172.db2.gz IBXOBLDECYHVKT-CQSZACIVSA-N 0 1 388.269 3.209 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H](C)Cc2cccc(Br)c2)n[nH]1 ZINC000178697807 565934058 /nfs/dbraw/zinc/93/40/58/565934058.db2.gz XIPJPVJHQQYSEY-VXGBXAGGSA-N 0 1 379.302 3.342 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000178688734 565934117 /nfs/dbraw/zinc/93/41/17/565934117.db2.gz VMQOLTYELVGVOV-NWDGAFQWSA-N 0 1 379.302 3.342 10 0 GGAEMN Cc1nn(C)c(S(=O)(=O)[N-]c2ccc(Cl)c(C[NH+](C)C)c2)c1C(F)F ZINC000414452060 565934353 /nfs/dbraw/zinc/93/43/53/565934353.db2.gz JVRKMQXTNCRNDT-UHFFFAOYSA-N 0 1 392.859 3.182 10 0 GGAEMN COc1cc(C)c(S(=O)(=O)Nc2nc(CN(C)C)cs2)cc1C(C)C ZINC000414462944 565937891 /nfs/dbraw/zinc/93/78/91/565937891.db2.gz VBAUNYMHOVPBHH-UHFFFAOYSA-N 0 1 383.539 3.446 10 0 GGAEMN [O-]c1c(Br)cc(CN2CC[N@H+]3CCC[C@@H]3C2)cc1Br ZINC000236593985 565940012 /nfs/dbraw/zinc/94/00/12/565940012.db2.gz FGMFPDNXMJSSTO-LLVKDONJSA-N 0 1 390.119 3.197 10 0 GGAEMN Brc1ccc(-c2nccc(CN3CCC[C@@H](n4cncn4)C3)n2)cc1 ZINC000178861152 565941919 /nfs/dbraw/zinc/94/19/19/565941919.db2.gz HSQVAOCBTPKALO-QGZVFWFLSA-N 0 1 399.296 3.335 10 0 GGAEMN NC(=O)c1csc(CNC2(c3ccc(Br)cc3)CCOCC2)c1 ZINC000178863194 565942515 /nfs/dbraw/zinc/94/25/15/565942515.db2.gz HPAIPBABXSZMPT-UHFFFAOYSA-N 0 1 395.322 3.405 10 0 GGAEMN Ic1cncc(-c2nc(-c3ccn4cncc4c3)no2)c1 ZINC000351092399 565946451 /nfs/dbraw/zinc/94/64/51/565946451.db2.gz PDLFZPDFVUQXTL-UHFFFAOYSA-N 0 1 389.156 3.051 10 0 GGAEMN COc1nccnc1CNC1CCN(Cc2cccc(Br)c2)CC1 ZINC000414575572 565949295 /nfs/dbraw/zinc/94/92/95/565949295.db2.gz BWSDPYPNIDGBPJ-UHFFFAOYSA-N 0 1 391.313 3.002 10 0 GGAEMN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3CN2Cc1nnc(-c2ccccc2Br)o1 ZINC000286376821 565956295 /nfs/dbraw/zinc/95/62/95/565956295.db2.gz GMFWVTHBOGRLGY-GPMVNZHBSA-N 0 1 390.281 3.354 10 0 GGAEMN Cc1noc([C@@H]2CCCCN2C(=O)c2[nH]nc3ccc(Br)cc32)n1 ZINC000286524021 565965147 /nfs/dbraw/zinc/96/51/47/565965147.db2.gz UNDBRGZZTZUCTO-ZDUSSCGKSA-N 0 1 390.241 3.384 10 0 GGAEMN CCOC1CC2(C1)CCN(C(=O)c1[nH]nc3ccc(Br)cc31)C2 ZINC000286572955 565968075 /nfs/dbraw/zinc/96/80/75/565968075.db2.gz GIKJCPCFLLDEJJ-UHFFFAOYSA-N 0 1 378.270 3.357 10 0 GGAEMN CN(C)C(=O)c1cccc(CN[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000286566955 565968544 /nfs/dbraw/zinc/96/85/44/565968544.db2.gz PIQHWQMJPBAKEE-LJQANCHMSA-N 0 1 391.309 3.148 10 0 GGAEMN Cc1nc(CN2CCCN(C[C@@H](C)c3cccc(Br)c3)CC2)no1 ZINC000179488616 565983867 /nfs/dbraw/zinc/98/38/67/565983867.db2.gz CAOPJQCJXSZEKF-CQSZACIVSA-N 0 1 393.329 3.452 10 0 GGAEMN CCCC(=O)N[C@H]1CCC[N@@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000245199127 565987220 /nfs/dbraw/zinc/98/72/20/565987220.db2.gz BLGRZGASDWCLAB-UONOGXRCSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000245199127 565987224 /nfs/dbraw/zinc/98/72/24/565987224.db2.gz BLGRZGASDWCLAB-UONOGXRCSA-N 0 1 389.323 3.114 10 0 GGAEMN O=C(Nc1nncs1)C1CCN(Cc2ccccc2Br)CC1 ZINC000363035666 565988270 /nfs/dbraw/zinc/98/82/70/565988270.db2.gz RXZPLMHAOZDTOE-UHFFFAOYSA-N 0 1 381.299 3.151 10 0 GGAEMN CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2C)[C@@H](C)C1 ZINC000245413776 565989248 /nfs/dbraw/zinc/98/92/48/565989248.db2.gz CCKGUALUAAGPSW-ZFWWWQNUSA-N 0 1 378.460 3.365 10 0 GGAEMN O=C(c1cccc(-c2nnc[nH]2)c1)N1CCc2cccc(Br)c2C1 ZINC000179557985 565989285 /nfs/dbraw/zinc/98/92/85/565989285.db2.gz CITPIAODUATJNW-UHFFFAOYSA-N 0 1 383.249 3.433 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000245461308 565991880 /nfs/dbraw/zinc/99/18/80/565991880.db2.gz MYAUQQOQEJUTOM-NHAGDIPZSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1[C@@H]2CCCC[C@@H]21 ZINC000245461308 565991884 /nfs/dbraw/zinc/99/18/84/565991884.db2.gz MYAUQQOQEJUTOM-NHAGDIPZSA-N 0 1 375.270 3.287 10 0 GGAEMN CCc1nc([C@H]2CN(C[C@H](C)c3cccc(Br)c3)CCO2)n[nH]1 ZINC000245502939 565993022 /nfs/dbraw/zinc/99/30/22/565993022.db2.gz HFQPATXGOPCGCA-SWLSCSKDSA-N 0 1 379.302 3.307 10 0 GGAEMN CCCOc1c(Br)cc(CN2C[C@@H](C(N)=O)CC[C@H]2C)cc1OC ZINC000245513916 565993142 /nfs/dbraw/zinc/99/31/42/565993142.db2.gz DRKJAFVDFHVMHW-OCCSQVGLSA-N 0 1 399.329 3.332 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2cc(Cl)ccc2F)[C@H]1c1ccccc1 ZINC000245620649 565998754 /nfs/dbraw/zinc/99/87/54/565998754.db2.gz FALMTGYZMVZRKR-ZWKOTPCHSA-N 0 1 382.888 3.344 10 0 GGAEMN C[C@H]1CN(C(=O)Nc2ccc(Br)cc2OC(F)(F)F)CCN1 ZINC000415574290 566005259 /nfs/dbraw/zinc/00/52/59/566005259.db2.gz DKVBOYDOLUENCK-QMMMGPOBSA-N 0 1 382.180 3.173 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1cc2c(c(Br)c1)OCO2 ZINC000363539291 566010376 /nfs/dbraw/zinc/01/03/76/566010376.db2.gz ILLGQKKPQRSWIN-UHFFFAOYSA-N 0 1 387.193 3.215 10 0 GGAEMN COc1ccsc1S(=O)(=O)NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000245969704 566011902 /nfs/dbraw/zinc/01/19/02/566011902.db2.gz AAOUQLAZRFHZTF-WFASDCNBSA-N 0 1 386.564 3.180 10 0 GGAEMN Cc1ccc(I)cc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000245965991 566012042 /nfs/dbraw/zinc/01/20/42/566012042.db2.gz DRDSIWUDAYPYTL-JSGCOSHPSA-N 0 1 386.277 3.154 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1ccc(Br)cc1 ZINC000246034352 566014348 /nfs/dbraw/zinc/01/43/48/566014348.db2.gz MNOSYDKOSNNVPQ-XKQJLSEDSA-N 0 1 381.314 3.270 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2ccc(Cl)nc2)[C@H]1c1cccs1 ZINC000246072109 566015268 /nfs/dbraw/zinc/01/52/68/566015268.db2.gz FBVGAWAHKHZRQB-PBHICJAKSA-N 0 1 399.969 3.299 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Br)c(Cl)c2)CCN1C[C@H](C)O ZINC000246082768 566016349 /nfs/dbraw/zinc/01/63/49/566016349.db2.gz UBNMJJJWNJMNTF-WCQYABFASA-N 0 1 389.721 3.020 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Cl)cc(Br)c2)CCN1C[C@H](C)O ZINC000246143841 566019086 /nfs/dbraw/zinc/01/90/86/566019086.db2.gz TZAWXJZXMANFRE-XHDPSFHLSA-N 0 1 389.721 3.020 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)CCCc2cc(Cl)sc2Cl)C[C@H]1C ZINC000246230906 566022761 /nfs/dbraw/zinc/02/27/61/566022761.db2.gz XMAFGBWJJPYREM-NEPJUHHUSA-N 0 1 379.353 3.291 10 0 GGAEMN O=C(CCc1cccc(Br)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000363855611 566024530 /nfs/dbraw/zinc/02/45/30/566024530.db2.gz AVCXYCSEBMTAGU-QGZVFWFLSA-N 0 1 385.265 3.406 10 0 GGAEMN Cc1ncc(C(=O)NCCc2nnc(-c3ccccc3)[nH]2)c(Cl)c1Cl ZINC000363896502 566026312 /nfs/dbraw/zinc/02/63/12/566026312.db2.gz NCNOZEAQFVHFCS-UHFFFAOYSA-N 0 1 376.247 3.454 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)N2CCN3CCCC[C@H]3C2)cc1Br ZINC000246407087 566028764 /nfs/dbraw/zinc/02/87/64/566028764.db2.gz KLTXYHGGSAANST-ZFWWWQNUSA-N 0 1 396.329 3.398 10 0 GGAEMN C[C@H](c1ccc(Br)cc1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000246557190 566033051 /nfs/dbraw/zinc/03/30/51/566033051.db2.gz JYSAAVGLXWGPJP-GDBMZVCRSA-N 0 1 381.314 3.081 10 0 GGAEMN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CC[C@@H](Oc2cccnc2)C1 ZINC000246759152 566040023 /nfs/dbraw/zinc/04/00/23/566040023.db2.gz PZXBMLBEAPFEHP-GDBMZVCRSA-N 0 1 383.275 3.281 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)CCN1C[C@@H](C)O ZINC000246843049 566042446 /nfs/dbraw/zinc/04/24/46/566042446.db2.gz MMQLCUWDJVDUPZ-DMRZNYOFSA-N 0 1 385.335 3.401 10 0 GGAEMN C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000246849764 566044417 /nfs/dbraw/zinc/04/44/17/566044417.db2.gz VNZIUCZQZKPEGN-PWSUYJOCSA-N 0 1 382.835 3.216 10 0 GGAEMN Brc1ccc(Cc2nc(CN3CC[N@H+]4CCCC[C@H]4C3)no2)cc1 ZINC000246904050 566045673 /nfs/dbraw/zinc/04/56/73/566045673.db2.gz RPLBWUVLGOVAFJ-INIZCTEOSA-N 0 1 391.313 3.093 10 0 GGAEMN Cc1cnn([C@H]2CCC[N@@H+](C[C@@H](O)COc3cccc(Br)c3)C2)c1 ZINC000246946213 566047526 /nfs/dbraw/zinc/04/75/26/566047526.db2.gz BEOQJFBOKBVMGO-DLBZAZTESA-N 0 1 394.313 3.031 10 0 GGAEMN COc1cc(Br)c(S(=O)(=O)Nc2ncccc2F)cc1Cl ZINC000180263344 566048988 /nfs/dbraw/zinc/04/89/88/566048988.db2.gz WINPPLRXWIIIOP-UHFFFAOYSA-N 0 1 395.637 3.446 10 0 GGAEMN COC(=O)c1cc(Br)cc(NC(=O)C(C)(C)c2cnc[nH]2)c1C ZINC000416273346 566050662 /nfs/dbraw/zinc/05/06/62/566050662.db2.gz FXXYWAVTFYGAMU-UHFFFAOYSA-N 0 1 380.242 3.184 10 0 GGAEMN C[C@@H]1CN(C(=O)CCCc2cc(Cl)sc2Cl)[C@H](C)CN1CCO ZINC000416285058 566050729 /nfs/dbraw/zinc/05/07/29/566050729.db2.gz BLVJEDHDLUQGOY-VXGBXAGGSA-N 0 1 379.353 3.291 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)CCN1CCOC ZINC000247094701 566051368 /nfs/dbraw/zinc/05/13/68/566051368.db2.gz MGBFKFHHFBUZAU-FGTMMUONSA-N 0 1 395.341 3.122 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)CCN1CCOC ZINC000247094726 566051845 /nfs/dbraw/zinc/05/18/45/566051845.db2.gz MGBFKFHHFBUZAU-KURKYZTESA-N 0 1 395.341 3.122 10 0 GGAEMN CO[C@@H]1CC[C@H]2OCCN(CCC(=O)Nc3cccc(Br)c3)[C@H]2C1 ZINC000247139621 566052944 /nfs/dbraw/zinc/05/29/44/566052944.db2.gz XDGHEFYRFBJDRY-IXDOHACOSA-N 0 1 397.313 3.046 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)CNC(=O)c3cccc(Br)c3)ccc12 ZINC000180343014 566056216 /nfs/dbraw/zinc/05/62/16/566056216.db2.gz PNGRXZJGMYKTSN-UHFFFAOYSA-N 0 1 387.237 3.002 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccc(Br)cc1 ZINC000247228328 566056651 /nfs/dbraw/zinc/05/66/51/566056651.db2.gz NRHDLDSVOUUIAY-RDTXWAMCSA-N 0 1 388.309 3.485 10 0 GGAEMN C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000247400566 566060469 /nfs/dbraw/zinc/06/04/69/566060469.db2.gz PJCXYTLMKSCUNS-QWRGUYRKSA-N 0 1 382.835 3.216 10 0 GGAEMN C[C@H](O)CN1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)C[C@H]1C ZINC000247808871 566066637 /nfs/dbraw/zinc/06/66/37/566066637.db2.gz UEAXFVJBBWLNKU-CABCVRRESA-N 0 1 379.957 3.274 10 0 GGAEMN C[C@H](NC[C@@H](O)COC(C)(C)C)c1cc2c(cc1Br)OCCO2 ZINC000180482662 566066949 /nfs/dbraw/zinc/06/69/49/566066949.db2.gz ZIHHPEAYIWYZEZ-NWDGAFQWSA-N 0 1 388.302 3.047 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)[N-]c3ccc(C[NH+](C)C)c(Cl)c3)cn21 ZINC000416422778 566067127 /nfs/dbraw/zinc/06/71/27/566067127.db2.gz OPJAVHJSIWHTCT-LBPRGKRZSA-N 0 1 382.917 3.296 10 0 GGAEMN Brc1ccc2nc(CN[C@H](c3nc[nH]n3)c3ccccc3)[nH]c2c1 ZINC000364750304 566067663 /nfs/dbraw/zinc/06/76/63/566067663.db2.gz NVSFHQDWAXMASG-INIZCTEOSA-N 0 1 383.253 3.323 10 0 GGAEMN Brc1ccc2nc(CN[C@@H](c3nc[nH]n3)c3ccccc3)[nH]c2c1 ZINC000364750305 566068276 /nfs/dbraw/zinc/06/82/76/566068276.db2.gz NVSFHQDWAXMASG-MRXNPFEDSA-N 0 1 383.253 3.323 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000248064141 566072004 /nfs/dbraw/zinc/07/20/04/566072004.db2.gz ZEDPLJCYNNPSJG-LPHOPBHVSA-N 0 1 395.341 3.035 10 0 GGAEMN CC(C)c1n[nH]c(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c1Br ZINC000248140002 566073397 /nfs/dbraw/zinc/07/33/97/566073397.db2.gz YHNHBAMUUQKCSO-GUYCJALGSA-N 0 1 391.313 3.471 10 0 GGAEMN CC[C@@H](C)N[C@@H](CNS(=O)(=O)c1ccc(Cl)c(OC)c1)c1ccco1 ZINC000416481605 566074602 /nfs/dbraw/zinc/07/46/02/566074602.db2.gz VORKTZMMXJNUCQ-DOMZBBRYSA-N 0 1 386.901 3.349 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(Br)c1)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000248198301 566074888 /nfs/dbraw/zinc/07/48/88/566074888.db2.gz XUPYBKYLZOYUFF-QWQRMKEZSA-N 0 1 381.314 3.403 10 0 GGAEMN O=C(CN1CCN2CCCC[C@H]2C1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000248343594 566076040 /nfs/dbraw/zinc/07/60/40/566076040.db2.gz KMZQYTMCBKOMRB-ZDUSSCGKSA-N 0 1 375.822 3.467 10 0 GGAEMN O[C@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000248388599 566076353 /nfs/dbraw/zinc/07/63/53/566076353.db2.gz FHRZRRFTKTYTTE-WCQYABFASA-N 0 1 375.778 3.493 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cccc(Br)c2Cl)CCN1C[C@H](C)O ZINC000248414679 566077306 /nfs/dbraw/zinc/07/73/06/566077306.db2.gz NBONBDPONREMBL-NWDGAFQWSA-N 0 1 389.721 3.020 10 0 GGAEMN CO[C@@H]1CC[C@H]2OCCN(Cc3nc4ccc(Br)cc4[nH]3)[C@H]2C1 ZINC000248394479 566077508 /nfs/dbraw/zinc/07/75/08/566077508.db2.gz IAIAHNYOKZJVHG-UHOFOFEASA-N 0 1 380.286 3.094 10 0 GGAEMN CC(C)Sc1ccccc1NS(=O)(=O)c1cc(C(=O)N(C)C)n(C)c1 ZINC000180649344 566079690 /nfs/dbraw/zinc/07/96/90/566079690.db2.gz PEQHOCATOVWWET-UHFFFAOYSA-N 0 1 381.523 3.028 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCC(=O)Nc1ccc(Br)cc1 ZINC000248560299 566080917 /nfs/dbraw/zinc/08/09/17/566080917.db2.gz NBHQJGDXEAXLOP-WQVCFCJDSA-N 0 1 395.297 3.495 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCC(=O)Nc1ccc(Br)cc1 ZINC000248560297 566081315 /nfs/dbraw/zinc/08/13/15/566081315.db2.gz NBHQJGDXEAXLOP-MAZHCROVSA-N 0 1 395.297 3.495 10 0 GGAEMN CS[C@H](CO)[C@@H](C)N[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248546064 566081833 /nfs/dbraw/zinc/08/18/33/566081833.db2.gz FMRFCCWKYBHIDR-HFBAOOFYSA-N 0 1 382.327 3.031 10 0 GGAEMN CN(C)CCN(Cc1ccsc1)S(=O)(=O)c1cccc2ncccc21 ZINC000416555397 566087399 /nfs/dbraw/zinc/08/73/99/566087399.db2.gz FBQISNXHRMMCDX-UHFFFAOYSA-N 0 1 375.519 3.049 10 0 GGAEMN CCS(=O)(=O)C[C@@H](C)N[C@H]1CCCOc2ccc(Br)cc21 ZINC000180821680 566091280 /nfs/dbraw/zinc/09/12/80/566091280.db2.gz VMJABMSBSTWEDD-RISCZKNCSA-N 0 1 376.316 3.076 10 0 GGAEMN O=C(Nc1cc(Cl)c(F)c(Cl)c1)C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000365250000 566091688 /nfs/dbraw/zinc/09/16/88/566091688.db2.gz RQAHGJAUKOGZEB-UHFFFAOYSA-N 0 1 385.226 3.200 10 0 GGAEMN O[C@@H](C[N@H+]1CCCN(c2nnc(C(F)(F)F)s2)CC1)C1CCCCC1 ZINC000365274712 566092931 /nfs/dbraw/zinc/09/29/31/566092931.db2.gz BXMFXCLPBSAOJM-ZDUSSCGKSA-N 0 1 378.464 3.010 10 0 GGAEMN COc1ccc([C@@H](C)NCC(=O)Nc2ccc(Br)cn2)cc1OC ZINC000180846851 566093938 /nfs/dbraw/zinc/09/39/38/566093938.db2.gz AAXRNLFXGBQMDJ-LLVKDONJSA-N 0 1 394.269 3.151 10 0 GGAEMN CCOCCN1CCN(CCOc2cc(F)cc(Br)c2)C[C@H]1C ZINC000249270397 566099219 /nfs/dbraw/zinc/09/92/19/566099219.db2.gz KDOWXHZUGBBACE-CQSZACIVSA-N 0 1 389.309 3.010 10 0 GGAEMN C[C@@H](CC(=O)N1CCN(CC(C)(C)O)C[C@@H]1C)c1ccc(Br)cc1 ZINC000249350998 566099823 /nfs/dbraw/zinc/09/98/23/566099823.db2.gz KJRCAAIEVLYURT-GJZGRUSLSA-N 0 1 397.357 3.246 10 0 GGAEMN Cc1cc(S(=O)(=O)N2CCCC[C@@H]2c2nnc[nH]2)c(C)cc1Br ZINC000180933510 566100971 /nfs/dbraw/zinc/10/09/71/566100971.db2.gz ZVULMUNLLBHHKG-CYBMUJFWSA-N 0 1 399.314 3.100 10 0 GGAEMN CSC[C@@H](O)CN1CCC[C@H]1c1ccc(I)cc1 ZINC000249455176 566102854 /nfs/dbraw/zinc/10/28/54/566102854.db2.gz NGWMQZMIJGNOQT-KBPBESRZSA-N 0 1 377.291 3.152 10 0 GGAEMN C[C@@H]1CN(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)[C@H](C)CN1CCO ZINC000416736901 566105469 /nfs/dbraw/zinc/10/54/69/566105469.db2.gz PWIKRSQJGMCKDL-GHMZBOCLSA-N 0 1 379.810 3.278 10 0 GGAEMN C[C@H]1CN(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](C)CN1CCO ZINC000416736905 566105747 /nfs/dbraw/zinc/10/57/47/566105747.db2.gz PWIKRSQJGMCKDL-QWRGUYRKSA-N 0 1 379.810 3.278 10 0 GGAEMN Cc1noc([C@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000249762229 566107851 /nfs/dbraw/zinc/10/78/51/566107851.db2.gz LZACBSRJCGZLES-QWHCGFSZSA-N 0 1 386.279 3.304 10 0 GGAEMN CO[C@@H]1CN([C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC[C@H]1C ZINC000251518168 566110416 /nfs/dbraw/zinc/11/04/16/566110416.db2.gz CMOLDTPNTRFKPD-CKEIUWERSA-N 0 1 383.330 3.153 10 0 GGAEMN CCc1nn(C)c(CC)c1CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000289178980 566110460 /nfs/dbraw/zinc/11/04/60/566110460.db2.gz ADGJSFUOMFXKRF-GOSISDBHSA-N 0 1 380.330 3.305 10 0 GGAEMN CO[C@@H]1CN([C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC[C@H]1C ZINC000251518181 566110534 /nfs/dbraw/zinc/11/05/34/566110534.db2.gz CMOLDTPNTRFKPD-JKIFEVAISA-N 0 1 383.330 3.153 10 0 GGAEMN COc1cc(CN[C@](C)(CO)c2ccc(Br)cc2)cc(OC)c1O ZINC000289207712 566111515 /nfs/dbraw/zinc/11/15/15/566111515.db2.gz BVOMZEGDIJWVBC-GOSISDBHSA-N 0 1 396.281 3.169 10 0 GGAEMN CC[C@H]1CN([C@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)CCN1CCOC ZINC000252352752 566113936 /nfs/dbraw/zinc/11/39/36/566113936.db2.gz MJEUEFFCBPTFQD-HIFRSBDPSA-N 0 1 388.339 3.363 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)Nc3cc(Br)ccc3F)cn21 ZINC000416945183 566114308 /nfs/dbraw/zinc/11/43/08/566114308.db2.gz DUVVIGDFFGGOAL-VIFPVBQESA-N 0 1 388.262 3.483 10 0 GGAEMN C[C@@H]1CN(C(=O)Nc2ccc(Br)c(Cl)c2)[C@H](C)CN1CCO ZINC000416941687 566114876 /nfs/dbraw/zinc/11/48/76/566114876.db2.gz IJPOMYJRKPPLHL-GHMZBOCLSA-N 0 1 390.709 3.021 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccc(Br)cc1 ZINC000181106551 566116085 /nfs/dbraw/zinc/11/60/85/566116085.db2.gz MNOSYDKOSNNVPQ-XOKHGSTOSA-N 0 1 381.314 3.270 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)CSc1n[n-]c(=S)s1 ZINC000365861466 566123330 /nfs/dbraw/zinc/12/33/30/566123330.db2.gz XQSDACQPJJDZHL-ZDUSSCGKSA-N 0 1 394.591 3.042 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)CSc1n[n-]c(=S)s1 ZINC000365861460 566123681 /nfs/dbraw/zinc/12/36/81/566123681.db2.gz XQSDACQPJJDZHL-CYBMUJFWSA-N 0 1 394.591 3.042 10 0 GGAEMN Cc1cc(NC(=O)C[N@@H+]2[C@@H]3CCCC[C@H]3C[C@H]2C(=O)[O-])ccc1Br ZINC000261597166 566124956 /nfs/dbraw/zinc/12/49/56/566124956.db2.gz ACRSYPPBFINJDM-MAZHCROVSA-N 0 1 395.297 3.414 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)C[N@@H+]1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)[O-] ZINC000261599564 566125352 /nfs/dbraw/zinc/12/53/52/566125352.db2.gz AUPHMBQDDDKJIB-MAZHCROVSA-N 0 1 395.297 3.414 10 0 GGAEMN C[C@@H](NC(=O)[C@@](C)(N)c1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000261629464 566126929 /nfs/dbraw/zinc/12/69/29/566126929.db2.gz BRBQAILQOMYQFP-ZMZPIMSZSA-N 0 1 391.265 3.229 10 0 GGAEMN CCCN(CCc1ccccn1)C(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000261691636 566128692 /nfs/dbraw/zinc/12/86/92/566128692.db2.gz DZFLLERWXXTNSJ-LJQANCHMSA-N 0 1 390.325 3.499 10 0 GGAEMN Brc1c(CNC2CCN(c3nccs3)CC2)nc2ccccn12 ZINC000289546153 566128870 /nfs/dbraw/zinc/12/88/70/566128870.db2.gz FYOWTPGZMIVBLJ-UHFFFAOYSA-N 0 1 392.326 3.312 10 0 GGAEMN Cc1c(C[S@](C)=O)cccc1NS(=O)(=O)c1ccc(C(F)(F)F)nc1 ZINC000181264201 566128865 /nfs/dbraw/zinc/12/88/65/566128865.db2.gz YHKULDLJANPLTI-DEOSSOPVSA-N 0 1 392.424 3.088 10 0 GGAEMN Cc1nn(C)cc1[C@@H](C)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181275825 566129923 /nfs/dbraw/zinc/12/99/23/566129923.db2.gz HABRZJIWTDDDBK-SNVBAGLBSA-N 0 1 375.274 3.127 10 0 GGAEMN Cc1nn(C)cc1[C@@H](C)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000181275825 566129924 /nfs/dbraw/zinc/12/99/24/566129924.db2.gz HABRZJIWTDDDBK-SNVBAGLBSA-N 0 1 375.274 3.127 10 0 GGAEMN Cc1ccc(OCCC(=O)N2CCCC[C@H]2c2nnc[nH]2)c(Br)c1 ZINC000181369593 566137335 /nfs/dbraw/zinc/13/73/35/566137335.db2.gz TVOKVMMSVRGCBX-AWEZNQCLSA-N 0 1 393.285 3.398 10 0 GGAEMN O=C(Cc1c[nH]c2cc(Br)ccc12)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181378815 566137344 /nfs/dbraw/zinc/13/73/44/566137344.db2.gz JFONYPDCEGSYFT-HNNXBMFYSA-N 0 1 388.269 3.345 10 0 GGAEMN CCOc1ccc(CNC(=O)[C@@](C)(N)c2ccc(Br)cc2)cc1F ZINC000261862457 566137723 /nfs/dbraw/zinc/13/77/23/566137723.db2.gz WZQLCMABAGPLSB-SFHVURJKSA-N 0 1 395.272 3.477 10 0 GGAEMN COCCc1nc(C)c([C@@H](C)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)s1 ZINC000181395198 566138250 /nfs/dbraw/zinc/13/82/50/566138250.db2.gz IYNVTRMDDCJGER-QWHCGFSZSA-N 0 1 382.551 3.456 10 0 GGAEMN Cc1ccc(I)c(C(=O)N2CCCC[C@@H]2c2nnc[nH]2)c1 ZINC000181391794 566138363 /nfs/dbraw/zinc/13/83/63/566138363.db2.gz KYKFUVSAJVWJQD-CYBMUJFWSA-N 0 1 396.232 3.085 10 0 GGAEMN O=C(CCCOc1cccc(Br)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181399273 566138630 /nfs/dbraw/zinc/13/86/30/566138630.db2.gz CCABJXHVZGPONR-OAHLLOKOSA-N 0 1 393.285 3.480 10 0 GGAEMN CCc1cnc(CCNC(=O)[C@@](C)(N)c2ccc(Br)cc2)s1 ZINC000261870995 566138732 /nfs/dbraw/zinc/13/87/32/566138732.db2.gz SJYRLLBHBSQRDH-INIZCTEOSA-N 0 1 382.327 3.001 10 0 GGAEMN CNC(=O)c1ccc(CN[C@@H]2CCOc3c(Br)cccc32)cc1 ZINC000366270826 566143919 /nfs/dbraw/zinc/14/39/19/566143919.db2.gz OMEFJGSHTLWEDS-MRXNPFEDSA-N 0 1 375.266 3.422 10 0 GGAEMN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@H](c1cccs1)N(C)C ZINC000366278856 566145299 /nfs/dbraw/zinc/14/52/99/566145299.db2.gz JQAAFYUKSFPDOQ-ZIAGYGMSSA-N 0 1 379.551 3.440 10 0 GGAEMN Cc1ccc2c(c1)[C@@H](NCCN(C)S(=O)(=O)c1cccs1)CCCO2 ZINC000181503418 566145856 /nfs/dbraw/zinc/14/58/56/566145856.db2.gz QBNYENOGRAJDEP-INIZCTEOSA-N 0 1 380.535 3.181 10 0 GGAEMN Cc1ccc2c(c1)[C@H](NCCN(C)S(=O)(=O)c1cccs1)CCCO2 ZINC000181503403 566146041 /nfs/dbraw/zinc/14/60/41/566146041.db2.gz QBNYENOGRAJDEP-MRXNPFEDSA-N 0 1 380.535 3.181 10 0 GGAEMN C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ncsc1Br ZINC000289912077 566147136 /nfs/dbraw/zinc/14/71/36/566147136.db2.gz NKBGPCFBOLJDBX-WCQYABFASA-N 0 1 380.311 3.156 10 0 GGAEMN [NH3+]C1C[C@H]2CCC[C@@H](C1)C2[N-]S(=O)(=O)c1c(Cl)cc(F)cc1Cl ZINC000262104285 566147307 /nfs/dbraw/zinc/14/73/07/566147307.db2.gz TWWRCINLQUPAGP-FOCQTFQBSA-N 0 1 381.300 3.317 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H]2C[C@H](c3ccc(Br)cc3)C2)[nH]1 ZINC000366422594 566151413 /nfs/dbraw/zinc/15/14/13/566151413.db2.gz FNOBYNMCQSABBS-MQMHXKEQSA-N 0 1 395.326 3.420 10 0 GGAEMN COCc1cnc(C[NH2+][C@H](CC(=O)[O-])c2cccc(Br)c2)s1 ZINC000417560252 566157450 /nfs/dbraw/zinc/15/74/50/566157450.db2.gz ZMKXIFAJDINWQA-CYBMUJFWSA-N 0 1 385.283 3.358 10 0 GGAEMN C[C@@H](CN1CCN(C)CC1)NC(=O)c1sc2ccccc2c1Br ZINC000290143819 566159429 /nfs/dbraw/zinc/15/94/29/566159429.db2.gz BWQJRUNAPKZSLA-LBPRGKRZSA-N 0 1 396.354 3.030 10 0 GGAEMN COC[C@@H](NCC(=O)N(C)Cc1cc(Br)cs1)c1ccccc1 ZINC000181695037 566159503 /nfs/dbraw/zinc/15/95/03/566159503.db2.gz UDJUFGZHNWFZOU-MRXNPFEDSA-N 0 1 397.338 3.446 10 0 GGAEMN O=C(c1ccc(C2SCCCS2)cc1)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000366663901 566163113 /nfs/dbraw/zinc/16/31/13/566163113.db2.gz RGMPRQDOKDWZAX-AWEZNQCLSA-N 0 1 375.523 3.088 10 0 GGAEMN O=C(c1ccc(C2SCCCS2)cc1)N1CCC[C@@H](c2nn[nH]n2)C1 ZINC000366663902 566163243 /nfs/dbraw/zinc/16/32/43/566163243.db2.gz RGMPRQDOKDWZAX-CQSZACIVSA-N 0 1 375.523 3.088 10 0 GGAEMN Brc1ccccc1CCCN1CCCN(c2cccnn2)CC1 ZINC000181799077 566166168 /nfs/dbraw/zinc/16/61/68/566166168.db2.gz QTVSODHYSOYXNQ-UHFFFAOYSA-N 0 1 375.314 3.384 10 0 GGAEMN O=C(NCC1(c2cccc(Br)c2)CC1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417655336 566170096 /nfs/dbraw/zinc/17/00/96/566170096.db2.gz DTAILHXEAAGTQP-IYBDPMFKSA-N 0 1 378.314 3.017 10 0 GGAEMN CC[C@H](N[C@@H](C)c1cc2cc(Br)ccc2o1)C(=O)N1CCOCC1 ZINC000181871851 566170677 /nfs/dbraw/zinc/17/06/77/566170677.db2.gz VLXKMBXDZNWIBM-WFASDCNBSA-N 0 1 395.297 3.483 10 0 GGAEMN CC[C@@H](N[C@@H](C)c1cc2cc(Br)ccc2o1)C(=O)N1CCOCC1 ZINC000181871870 566170899 /nfs/dbraw/zinc/17/08/99/566170899.db2.gz VLXKMBXDZNWIBM-SWLSCSKDSA-N 0 1 395.297 3.483 10 0 GGAEMN CC[C@H](N[C@H](C)c1cc2cc(Br)ccc2o1)C(=O)N1CCOCC1 ZINC000181871888 566171185 /nfs/dbraw/zinc/17/11/85/566171185.db2.gz VLXKMBXDZNWIBM-DOMZBBRYSA-N 0 1 395.297 3.483 10 0 GGAEMN COC(=O)c1sc(NC2CC(N3CCC(C(F)(F)F)CC3)C2)nc1Cl ZINC000366855457 566173253 /nfs/dbraw/zinc/17/32/53/566173253.db2.gz FYZLOHLWMRNCPK-UHFFFAOYSA-N 0 1 397.850 3.222 10 0 GGAEMN CN(C)C(=O)c1ccccc1CN(C)[C@@H](CO)c1cccc(Br)c1 ZINC000417804444 566175089 /nfs/dbraw/zinc/17/50/89/566175089.db2.gz CGTSZNYKIGYRRV-SFHVURJKSA-N 0 1 391.309 3.316 10 0 GGAEMN O=C(CCc1cc(Cl)ccc1Br)N[C@H]1CCc2nc[nH]c2C1 ZINC000367043594 566181561 /nfs/dbraw/zinc/18/15/61/566181561.db2.gz AOTLDJMXQXMKAG-LBPRGKRZSA-N 0 1 382.689 3.432 10 0 GGAEMN O=C(CSCC(=O)N1CCCC[C@@H]1c1nnc[nH]1)c1ccc(Cl)cc1 ZINC000182101839 566183240 /nfs/dbraw/zinc/18/32/40/566183240.db2.gz VPPOUHKAGFLRIE-CQSZACIVSA-N 0 1 378.885 3.128 10 0 GGAEMN C[C@H](NC[C@@H]1CCC2(CCOCC2)[C@@H]1O)c1ncc(Br)s1 ZINC000367125306 566186929 /nfs/dbraw/zinc/18/69/29/566186929.db2.gz DNULMKWJKNFREZ-GMXVVIOVSA-N 0 1 375.332 3.124 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1cn2ccc(Br)cc2n1 ZINC000263480350 566187140 /nfs/dbraw/zinc/18/71/40/566187140.db2.gz GEDYMRIQKSEADY-UGFHNGPFSA-N 0 1 378.270 3.315 10 0 GGAEMN C[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(Br)nc1 ZINC000290786850 566188802 /nfs/dbraw/zinc/18/88/02/566188802.db2.gz UJMYTXWHYACBEE-LBPRGKRZSA-N 0 1 395.276 3.066 10 0 GGAEMN COC(=O)c1ccc(C[N@H+]2[C@H](C(=O)[O-])C[C@H]3CCCC[C@@H]32)c(Br)c1 ZINC000263534639 566188761 /nfs/dbraw/zinc/18/87/61/566188761.db2.gz YMZZANZDMXZTON-RLCCDNCMSA-N 0 1 396.281 3.453 10 0 GGAEMN COc1cc(Br)c(C[N@H+]2[C@@H]3CCCC[C@H]3C[C@H]2C(=O)[O-])cc1O ZINC000263521392 566189096 /nfs/dbraw/zinc/18/90/96/566189096.db2.gz RDTHQTSWWNUHHN-GDLCADMTSA-N 0 1 384.270 3.381 10 0 GGAEMN O=C1CC[C@H](NCc2coc(-c3ccc(Br)cc3)n2)C2(CCC2)N1 ZINC000367251276 566192820 /nfs/dbraw/zinc/19/28/20/566192820.db2.gz FENQAYUQMBWHTI-HNNXBMFYSA-N 0 1 390.281 3.395 10 0 GGAEMN COC(=O)c1cc(CN[C@@H]2CCOc3c(Br)cccc32)cn1C ZINC000367317713 566195733 /nfs/dbraw/zinc/19/57/33/566195733.db2.gz MVTLOHPFWLIXKV-CQSZACIVSA-N 0 1 379.254 3.188 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@H](C)c3ccc(Br)s3)C2=O)n(C)n1 ZINC000182346022 566198175 /nfs/dbraw/zinc/19/81/75/566198175.db2.gz JPPHHHJZWLVMMF-NEPJUHHUSA-N 0 1 397.342 3.399 10 0 GGAEMN CCC[C@H]1CNCCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000418152118 566201416 /nfs/dbraw/zinc/20/14/16/566201416.db2.gz HHVPRSOJUIFZNA-SWLSCSKDSA-N 0 1 382.302 3.056 10 0 GGAEMN Cc1ccc(CN2CCC(C(=O)Nc3nncs3)CC2)c(Br)c1 ZINC000367698348 566212300 /nfs/dbraw/zinc/21/23/00/566212300.db2.gz FCXLQWIIQJFMDS-UHFFFAOYSA-N 0 1 395.326 3.460 10 0 GGAEMN C[C@H](NCC(=O)NCc1ccc2c(c1)OCO2)c1cccc(Br)c1 ZINC000182571789 566212945 /nfs/dbraw/zinc/21/29/45/566212945.db2.gz YMEHTZDGRICYOE-LBPRGKRZSA-N 0 1 391.265 3.145 10 0 GGAEMN CNS(=O)(=O)c1cccc(CN[C@@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000367730094 566213976 /nfs/dbraw/zinc/21/39/76/566213976.db2.gz WJGOBPJWDPOBIC-QGZVFWFLSA-N 0 1 380.897 3.252 10 0 GGAEMN CC(C)OCCCC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000182600824 566214764 /nfs/dbraw/zinc/21/47/64/566214764.db2.gz MQMMHQXFTKGKQG-UHFFFAOYSA-N 0 1 381.274 3.056 10 0 GGAEMN CC(C)OCCCC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000182600824 566214768 /nfs/dbraw/zinc/21/47/68/566214768.db2.gz MQMMHQXFTKGKQG-UHFFFAOYSA-N 0 1 381.274 3.056 10 0 GGAEMN O=C(NCC1(c2ccccc2Br)CC1)N[C@H]1CCc2nc[nH]c2C1 ZINC000367907540 566221942 /nfs/dbraw/zinc/22/19/42/566221942.db2.gz RWDKKHFVKVHPQJ-LBPRGKRZSA-N 0 1 389.297 3.061 10 0 GGAEMN CCOC(=O)CC1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)CC1 ZINC000264727094 566222436 /nfs/dbraw/zinc/22/24/36/566222436.db2.gz ILZNOSHWNAPMEJ-UHFFFAOYSA-N 0 1 394.269 3.131 10 0 GGAEMN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000367912095 566223545 /nfs/dbraw/zinc/22/35/45/566223545.db2.gz RKZANZDLZBTFBE-LLVKDONJSA-N 0 1 381.249 3.010 10 0 GGAEMN NC(=O)[C@H]1CCCCC[C@H]1Nc1nc(C(F)(F)F)c(Br)s1 ZINC000418886226 566227195 /nfs/dbraw/zinc/22/71/95/566227195.db2.gz KKOXJQIEJQNELF-NKWVEPMBSA-N 0 1 386.237 3.192 10 0 GGAEMN CC(C)[C@@H]1C[C@@H](CN[C@H](C(N)=O)c2ccc(Br)cc2F)CCO1 ZINC000419256934 566231668 /nfs/dbraw/zinc/23/16/68/566231668.db2.gz YALXBBZDXYTFDA-UVBJJODRSA-N 0 1 387.293 3.155 10 0 GGAEMN CC(C)[C@@H]1C[C@H](CN[C@@H](C(N)=O)c2ccc(Br)cc2F)CCO1 ZINC000419256935 566231677 /nfs/dbraw/zinc/23/16/77/566231677.db2.gz YALXBBZDXYTFDA-XFBWCDHKSA-N 0 1 387.293 3.155 10 0 GGAEMN COCCOc1cccc(CNC(=O)CN[C@@H](C)c2ccc(Cl)s2)c1 ZINC000182986352 566233181 /nfs/dbraw/zinc/23/31/81/566233181.db2.gz QAWIKSHTRKNEBJ-ZDUSSCGKSA-N 0 1 382.913 3.394 10 0 GGAEMN O=C(NCCc1nc2cc(Cl)ccc2s1)N[C@H]1CCc2nc[nH]c2C1 ZINC000368203027 566233472 /nfs/dbraw/zinc/23/34/72/566233472.db2.gz JWCZUZAWMKVIBU-NSHDSACASA-N 0 1 375.885 3.072 10 0 GGAEMN C[C@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)s1 ZINC000183001765 566234360 /nfs/dbraw/zinc/23/43/60/566234360.db2.gz CTHSPNBHSQSIIR-JTQLQIEISA-N 0 1 383.926 3.268 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccccc1SCC(N)=O)c1ccc(Cl)s1 ZINC000183001781 566234393 /nfs/dbraw/zinc/23/43/93/566234393.db2.gz CTHSPNBHSQSIIR-SNVBAGLBSA-N 0 1 383.926 3.268 10 0 GGAEMN CC[C@@H](NCc1ccc(Br)s1)c1cccc(S(N)(=O)=O)c1 ZINC000183031685 566235861 /nfs/dbraw/zinc/23/58/61/566235861.db2.gz ZXAFQVWZERGOPR-CYBMUJFWSA-N 0 1 389.340 3.399 10 0 GGAEMN CC[C@H](NCc1ccc(Br)s1)c1cccc(S(N)(=O)=O)c1 ZINC000183031668 566236178 /nfs/dbraw/zinc/23/61/78/566236178.db2.gz ZXAFQVWZERGOPR-ZDUSSCGKSA-N 0 1 389.340 3.399 10 0 GGAEMN O=C(Nc1ccccc1I)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000183059136 566236772 /nfs/dbraw/zinc/23/67/72/566236772.db2.gz JMLQWDFBLRYRNO-GFCCVEGCSA-N 0 1 397.220 3.168 10 0 GGAEMN COCc1c(Br)cccc1NC(=O)N1CCCC[C@H]1c1nnc[nH]1 ZINC000183078269 566237363 /nfs/dbraw/zinc/23/73/63/566237363.db2.gz DUNGPGWEVPKWMU-AWEZNQCLSA-N 0 1 394.273 3.473 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2sccc2Cl)C1 ZINC000419553851 566238041 /nfs/dbraw/zinc/23/80/41/566238041.db2.gz ATYFZASVPAMCGO-ZDUSSCGKSA-N 0 1 376.975 3.108 10 0 GGAEMN Cc1cc2cc(C(=O)NCCCCN3CCOCC3)oc2c(Br)c1 ZINC000183126934 566238576 /nfs/dbraw/zinc/23/85/76/566238576.db2.gz PRMJPHAZPCAXLO-UHFFFAOYSA-N 0 1 395.297 3.346 10 0 GGAEMN O=S(=O)(C=Cc1cccc(Br)c1)N[C@H]1CCCc2cn[nH]c21 ZINC000368562359 566241674 /nfs/dbraw/zinc/24/16/74/566241674.db2.gz GAAPLGQVMIURED-NPQIQWPPSA-N 0 1 382.283 3.140 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)c2c[nH]c3cccc(Br)c23)n[nH]1 ZINC000183286335 566242957 /nfs/dbraw/zinc/24/29/57/566242957.db2.gz XXRLAGDBVUFVQJ-UHFFFAOYSA-N 0 1 377.198 3.083 10 0 GGAEMN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@@H](c1ccsc1)N(C)C ZINC000368639176 566243296 /nfs/dbraw/zinc/24/32/96/566243296.db2.gz SNQVCYDXZLMKBQ-HIFRSBDPSA-N 0 1 379.551 3.440 10 0 GGAEMN Cc1nc2cc(NCc3c(Br)cnn3C)ccc2n1[C@H](C)CO ZINC000419771607 566244276 /nfs/dbraw/zinc/24/42/76/566244276.db2.gz YAMXAOUXTZPWKK-SNVBAGLBSA-N 0 1 378.274 3.006 10 0 GGAEMN COc1ccc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(Cl)c1Cl ZINC000266195592 566246912 /nfs/dbraw/zinc/24/69/12/566246912.db2.gz NNIAQMSAQXFYKQ-QWRGUYRKSA-N 0 1 381.325 3.105 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000183483447 566247675 /nfs/dbraw/zinc/24/76/75/566247675.db2.gz WDSHTPJWUGZCFN-KRWDZBQOSA-N 0 1 390.281 3.124 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@@H]1CCCN1CC(F)(F)F)c1ccc(Cl)cc1 ZINC000575104104 566251655 /nfs/dbraw/zinc/25/16/55/566251655.db2.gz GYPQVSKJRSYNBJ-GJZGRUSLSA-N 0 1 377.838 3.086 10 0 GGAEMN O=C(Nc1cc(-c2ccc(Br)o2)no1)[C@H]1CCCc2[nH]ncc21 ZINC000419943852 566253759 /nfs/dbraw/zinc/25/37/59/566253759.db2.gz JDWRNKJVRGFLGH-QMMMGPOBSA-N 0 1 377.198 3.479 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOC[C@H]1CC1CCC1 ZINC000575156484 566254289 /nfs/dbraw/zinc/25/42/89/566254289.db2.gz WSLVEEBXGPGZHT-CYBMUJFWSA-N 0 1 378.270 3.357 10 0 GGAEMN Cc1c(Cl)cc(F)c(NC(=O)N2CCN(CC(C)(C)O)[C@H](C)C2)c1F ZINC000444872254 566255628 /nfs/dbraw/zinc/25/56/28/566255628.db2.gz KNYXRWBUMDOTSW-SNVBAGLBSA-N 0 1 375.847 3.236 10 0 GGAEMN CN(C)C(=O)N(C)[C@H]1CCN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000668687401 566256603 /nfs/dbraw/zinc/25/66/03/566256603.db2.gz COIOJJVFWMWZHV-HNNXBMFYSA-N 0 1 384.307 3.457 10 0 GGAEMN [O-]c1c(Br)cc(C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)cc1Br ZINC000668705217 566257850 /nfs/dbraw/zinc/25/78/50/566257850.db2.gz HBPDGPLAZGODIY-MNOVXSKESA-N 0 1 391.103 3.386 10 0 GGAEMN [O-]c1c(Br)cc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)cc1Br ZINC000668705217 566257859 /nfs/dbraw/zinc/25/78/59/566257859.db2.gz HBPDGPLAZGODIY-MNOVXSKESA-N 0 1 391.103 3.386 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2cccc(Br)c2[O-])[C@@H]1c1ccccc1 ZINC000534844957 566258076 /nfs/dbraw/zinc/25/80/76/566258076.db2.gz ROSYJFPJZQTSPC-HOTGVXAUSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2cccc(Br)c2[O-])[C@H]1c1ccccc1 ZINC000534844958 566258659 /nfs/dbraw/zinc/25/86/59/566258659.db2.gz ROSYJFPJZQTSPC-HZPDHXFCSA-N 0 1 375.266 3.330 10 0 GGAEMN COC(=O)c1cnc(CN(Cc2cccc(Br)c2)CC2CC2)cn1 ZINC000599385332 566260257 /nfs/dbraw/zinc/26/02/57/566260257.db2.gz DRYKOXFBBXYZFG-UHFFFAOYSA-N 0 1 390.281 3.438 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN(Cc2cc(Br)cc3c2OCC3)C1 ZINC000668731373 566260950 /nfs/dbraw/zinc/26/09/50/566260950.db2.gz BINWBDAYBNAVPB-CQSZACIVSA-N 0 1 381.314 3.121 10 0 GGAEMN COc1ccc(CCC(=O)N2CCN(C3CCC3)CC2)c(Br)c1 ZINC000668723223 566261120 /nfs/dbraw/zinc/26/11/20/566261120.db2.gz PSEBASFXSFGMMZ-UHFFFAOYSA-N 0 1 381.314 3.087 10 0 GGAEMN COC(=O)c1cnc(CN2CCC(c3cccc(Br)c3)CC2)cn1 ZINC000599396099 566261636 /nfs/dbraw/zinc/26/16/36/566261636.db2.gz QJMKUGHAOQEBNV-UHFFFAOYSA-N 0 1 390.281 3.405 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2C[C@@H](O)C3(CC3)C2)C1=O ZINC000509142107 566266206 /nfs/dbraw/zinc/26/62/06/566266206.db2.gz UXFQFKZODIXORR-HZPDHXFCSA-N 0 1 393.325 3.018 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](N2C[C@H](O)C3(CC3)C2)C1=O ZINC000509142102 566266654 /nfs/dbraw/zinc/26/66/54/566266654.db2.gz UXFQFKZODIXORR-HOTGVXAUSA-N 0 1 393.325 3.018 10 0 GGAEMN Cc1ccc2c([n-]cc(C(=O)N[C@@H](C)c3ccc(Br)cn3)c2=O)[nH+]1 ZINC000481935405 566267880 /nfs/dbraw/zinc/26/78/80/566267880.db2.gz NSTZGNSTZFPVAO-JTQLQIEISA-N 0 1 387.237 3.292 10 0 GGAEMN CCOC1(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCCC1 ZINC000509164290 566269653 /nfs/dbraw/zinc/26/96/53/566269653.db2.gz FZOMCYOMDUSJBI-UHFFFAOYSA-N 0 1 393.285 3.200 10 0 GGAEMN CCOC1(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCCC1 ZINC000509164290 566269656 /nfs/dbraw/zinc/26/96/56/566269656.db2.gz FZOMCYOMDUSJBI-UHFFFAOYSA-N 0 1 393.285 3.200 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)CCCOc2ccc(Cl)cc2Cl)CC1 ZINC000535000726 566270751 /nfs/dbraw/zinc/27/07/51/566270751.db2.gz TZEUIWNMBJBFMU-HNNXBMFYSA-N 0 1 389.323 3.068 10 0 GGAEMN Brc1cnc(CN2CCCc3[nH]ncc3C2)c(Br)c1 ZINC000668840015 566271312 /nfs/dbraw/zinc/27/13/12/566271312.db2.gz AUDRLOUOLYLZFV-UHFFFAOYSA-N 0 1 386.091 3.278 10 0 GGAEMN CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C[C@H](O)CC1(O)CCC1 ZINC000625061222 566272722 /nfs/dbraw/zinc/27/27/22/566272722.db2.gz SPEYPMMTPFKRQG-CQSZACIVSA-N 0 1 389.323 3.310 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1 ZINC000462302373 566278435 /nfs/dbraw/zinc/27/84/35/566278435.db2.gz XVFWJBGINCEQFL-ZFWWWQNUSA-N 0 1 389.359 3.169 10 0 GGAEMN Fc1ccc([C@H](NCCCCn2cc(Br)cn2)c2cn[nH]n2)cc1 ZINC000556243812 566278530 /nfs/dbraw/zinc/27/85/30/566278530.db2.gz NFRCAOCDYCNSNL-INIZCTEOSA-N 0 1 393.264 3.062 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@H]1CCN(C)[C@H](C)C1 ZINC000462302370 566278604 /nfs/dbraw/zinc/27/86/04/566278604.db2.gz XVFWJBGINCEQFL-HIFRSBDPSA-N 0 1 389.359 3.169 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2cc(F)cc(F)c2)[C@H]1c1cccs1 ZINC000462318758 566280986 /nfs/dbraw/zinc/28/09/86/566280986.db2.gz WXCHCYQNDDMIFW-PXAZEXFGSA-N 0 1 386.489 3.388 10 0 GGAEMN CN(C)Cc1cc(-c2noc(-c3nn(C)cc3Br)n2)ccc1F ZINC000556291777 566282171 /nfs/dbraw/zinc/28/21/71/566282171.db2.gz BBLZFQQQYZUSFO-UHFFFAOYSA-N 0 1 380.221 3.100 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2cnc(C3CCCC3)s2)Oc2ccccc21 ZINC000575802848 566286506 /nfs/dbraw/zinc/28/65/06/566286506.db2.gz WNTTWFJCIIHCRX-AWEZNQCLSA-N 0 1 378.519 3.125 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)c2ccccc2n1C ZINC000556348654 566289498 /nfs/dbraw/zinc/28/94/98/566289498.db2.gz FITVVNFCWYTSLZ-UHFFFAOYSA-N 0 1 377.853 3.040 10 0 GGAEMN CCN(CCOc1ccc(Br)cc1)C(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000669217516 566290718 /nfs/dbraw/zinc/29/07/18/566290718.db2.gz BWFHZCNVRMSLFP-ZDUSSCGKSA-N 0 1 392.297 3.205 10 0 GGAEMN Cc1nc2c(n1[C@@H]1CCN(C(=O)c3ncsc3Br)C1)CCCC2 ZINC000575832522 566290713 /nfs/dbraw/zinc/29/07/13/566290713.db2.gz GDKAFVBGWVWSHD-LLVKDONJSA-N 0 1 395.326 3.377 10 0 GGAEMN CO[C@@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccccc2Br)n[nH]1 ZINC000648517805 566291490 /nfs/dbraw/zinc/29/14/90/566291490.db2.gz ZINFRZQEECUNFF-DGCLKSJQSA-N 0 1 379.258 3.378 10 0 GGAEMN C[C@H](NC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ncc(Br)cn1 ZINC000575851660 566292001 /nfs/dbraw/zinc/29/20/01/566292001.db2.gz HNZJJLVJAQXYDE-UONOGXRCSA-N 0 1 389.297 3.052 10 0 GGAEMN C[C@H]1CCC[N@@H+](CCNS(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000556376602 566291962 /nfs/dbraw/zinc/29/19/62/566291962.db2.gz GHMFHHZFUJWWNK-NSHDSACASA-N 0 1 395.750 3.113 10 0 GGAEMN COC[C@H](NS(=O)(=O)c1cccc(Br)c1Cl)c1ccco1 ZINC000556376273 566292142 /nfs/dbraw/zinc/29/21/42/566292142.db2.gz XSDCUKJHIPDJBK-JTQLQIEISA-N 0 1 394.674 3.362 10 0 GGAEMN O=C(N[C@H](CCO)C1CCCCC1)c1n[nH]c2ccc(Br)cc21 ZINC000535281810 566292333 /nfs/dbraw/zinc/29/23/33/566292333.db2.gz ZURYTKVNGVVZHH-CQSZACIVSA-N 0 1 380.286 3.387 10 0 GGAEMN COc1cncc(CNC2(c3ccc(Br)cc3)CCOCC2)n1 ZINC000625232667 566293208 /nfs/dbraw/zinc/29/32/08/566293208.db2.gz MSKKKAUZYOGPID-UHFFFAOYSA-N 0 1 378.270 3.043 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1 ZINC000625241242 566293866 /nfs/dbraw/zinc/29/38/66/566293866.db2.gz BGCDBQADQQKBKJ-SNVBAGLBSA-N 0 1 393.340 3.192 10 0 GGAEMN COCC[N@H+]1CCC[C@H]1CN[C@@H](C)c1ccccc1I ZINC000482241771 566295720 /nfs/dbraw/zinc/29/57/20/566295720.db2.gz JFVGFAURTGPOAA-KBPBESRZSA-N 0 1 388.293 3.053 10 0 GGAEMN CC1(C)CN(C(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CCN1 ZINC000669386898 566296253 /nfs/dbraw/zinc/29/62/53/566296253.db2.gz BFSWIGCTDSUOQU-UWVGGRQHSA-N 0 1 375.357 3.289 10 0 GGAEMN CC1(C)CN(C(=O)N[C@H]2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CCN1 ZINC000669386897 566296792 /nfs/dbraw/zinc/29/67/92/566296792.db2.gz BFSWIGCTDSUOQU-URLYPYJESA-N 0 1 375.357 3.289 10 0 GGAEMN CO[C@H](CC(C)C)CS(=O)(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000420674934 566296844 /nfs/dbraw/zinc/29/68/44/566296844.db2.gz NTQHRPKCMJEGQN-LZLYRXPVSA-N 0 1 388.599 3.112 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)CCN1C ZINC000420674959 566297372 /nfs/dbraw/zinc/29/73/72/566297372.db2.gz NYXXLSUPLHZLDC-JQWIXIFHSA-N 0 1 382.860 3.045 10 0 GGAEMN COC(=O)c1c(F)cc(NS(=O)(=O)c2ccc3ncsc3c2)cc1F ZINC000509390968 566297693 /nfs/dbraw/zinc/29/76/93/566297693.db2.gz JIYJCTLZDWIAQK-UHFFFAOYSA-N 0 1 384.385 3.162 10 0 GGAEMN COc1cc(NC(=O)[C@@H]2Cc3ccccc3CN2)cc(OC)c1Br ZINC000575923784 566298137 /nfs/dbraw/zinc/29/81/37/566298137.db2.gz HKZNYVNBYCYIDB-AWEZNQCLSA-N 0 1 391.265 3.119 10 0 GGAEMN CNC(=O)C[C@@H](NCc1cccc(I)c1)c1ccccc1 ZINC000556412806 566298283 /nfs/dbraw/zinc/29/82/83/566298283.db2.gz VMDSDBCHPFCBFJ-MRXNPFEDSA-N 0 1 394.256 3.258 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2c(F)ccc(C(F)(F)F)c2Br)C1 ZINC000625299230 566303156 /nfs/dbraw/zinc/30/31/56/566303156.db2.gz UTCDEJPIBVYCNF-QMMMGPOBSA-N 0 1 383.183 3.431 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2c(F)ccc(C(F)(F)F)c2Br)C1 ZINC000625299228 566303645 /nfs/dbraw/zinc/30/36/45/566303645.db2.gz UTCDEJPIBVYCNF-MRVPVSSYSA-N 0 1 383.183 3.431 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@@H]2CCc3[nH]cnc3C2)c(C)cc1Br ZINC000599941418 566305995 /nfs/dbraw/zinc/30/59/95/566305995.db2.gz VEYAJUYMPDEDIA-SNVBAGLBSA-N 0 1 392.253 3.011 10 0 GGAEMN Cc1cnn(CCN2CCN([C@@H](C)c3ccc(Br)cc3)CC2)c1 ZINC000556497721 566308559 /nfs/dbraw/zinc/30/85/59/566308559.db2.gz RWTXEWWABWHQIV-INIZCTEOSA-N 0 1 377.330 3.333 10 0 GGAEMN COc1cc(Br)c(CNC[C@@H](O)Cc2ccc(F)cc2)cc1OC ZINC000576029970 566309326 /nfs/dbraw/zinc/30/93/26/566309326.db2.gz IJFYCZXRIOVAIP-HNNXBMFYSA-N 0 1 398.272 3.299 10 0 GGAEMN COc1cc(Cl)c(Cl)cc1C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1 ZINC000535563660 566312196 /nfs/dbraw/zinc/31/21/96/566312196.db2.gz ZHSPLZYHAZYUEX-UHFFFAOYSA-N 0 1 379.203 3.230 10 0 GGAEMN CN(C(=O)c1cc2c(cncc2Br)s1)[C@H]1CN2CCC1CC2 ZINC000648779198 566313576 /nfs/dbraw/zinc/31/35/76/566313576.db2.gz DZYUPVCHZUEXBW-ZDUSSCGKSA-N 0 1 380.311 3.225 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1n[nH]c2ccc(Br)cc21 ZINC000600092524 566313853 /nfs/dbraw/zinc/31/38/53/566313853.db2.gz HQZLOKUVHICZAQ-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN COCCN(CCOC1CCOCC1)Cc1cc(Br)cs1 ZINC000625371192 566314682 /nfs/dbraw/zinc/31/46/82/566314682.db2.gz VYQAHXXOZRPZKC-UHFFFAOYSA-N 0 1 378.332 3.155 10 0 GGAEMN C[C@H]1C[C@H](NC(=O)c2cc3c(cncc3Br)s2)CN1C1CC1 ZINC000648819017 566316689 /nfs/dbraw/zinc/31/66/89/566316689.db2.gz UGSFIRKLBUWWGW-UWVGGRQHSA-N 0 1 380.311 3.414 10 0 GGAEMN Cc1cc(Br)c(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)s1 ZINC000462529911 566316823 /nfs/dbraw/zinc/31/68/23/566316823.db2.gz RWBXWVJMNFGWAS-UHFFFAOYSA-N 0 1 395.388 3.362 10 0 GGAEMN O=C([C@H]1CCc2cc(Br)ccc21)N1CCC(c2nc[nH]n2)CC1 ZINC000648815300 566316853 /nfs/dbraw/zinc/31/68/53/566316853.db2.gz LDUHHLPMMCXTHZ-HNNXBMFYSA-N 0 1 375.270 3.003 10 0 GGAEMN CC(C)(C)OC(=O)[C@]1(C)CCCN1C(=O)c1cccc(Br)c1O ZINC000600144458 566317208 /nfs/dbraw/zinc/31/72/08/566317208.db2.gz WYDFSSCGTGSKLQ-KRWDZBQOSA-N 0 1 384.270 3.491 10 0 GGAEMN O=C(Cc1c(F)ccc(Br)c1F)Nc1cnn(-c2ccncc2)c1 ZINC000669648940 566317282 /nfs/dbraw/zinc/31/72/82/566317282.db2.gz ZGFHCGJFBQCQFJ-UHFFFAOYSA-N 0 1 393.191 3.489 10 0 GGAEMN C[C@@H]1C[C@H](NC(=O)c2cc3c(cncc3Br)s2)CN1C1CC1 ZINC000648819019 566317766 /nfs/dbraw/zinc/31/77/66/566317766.db2.gz UGSFIRKLBUWWGW-ZJUUUORDSA-N 0 1 380.311 3.414 10 0 GGAEMN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc2c(cncc2Br)s1 ZINC000648822078 566318820 /nfs/dbraw/zinc/31/88/20/566318820.db2.gz KERWTSHPTDVVBG-TVQRCGJNSA-N 0 1 380.311 3.271 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2cc3c(cncc3Br)s2)n[nH]1 ZINC000648832384 566319106 /nfs/dbraw/zinc/31/91/06/566319106.db2.gz MTVCZZGUKQRBQC-MRVPVSSYSA-N 0 1 379.283 3.451 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc2c(cncc2Br)s1 ZINC000648835494 566320310 /nfs/dbraw/zinc/32/03/10/566320310.db2.gz URWWXHWXDWQWRE-MRVPVSSYSA-N 0 1 377.267 3.069 10 0 GGAEMN O=C(NC[C@@H]1OCCc2ccccc21)c1cc(Br)cc2nc[nH]c21 ZINC000669704690 566321694 /nfs/dbraw/zinc/32/16/94/566321694.db2.gz MELFLUJNFFMPQL-INIZCTEOSA-N 0 1 386.249 3.369 10 0 GGAEMN COc1ccc(-c2n[nH]c(Sc3nc([C@@H](C)OC)ns3)n2)c(OC)c1 ZINC000509638860 566322645 /nfs/dbraw/zinc/32/26/45/566322645.db2.gz KDWZSXOPJUNUMP-MRVPVSSYSA-N 0 1 379.467 3.199 10 0 GGAEMN O=C(NCCC[C@H]1CCCC[C@H]1O)c1cc(Br)cc2nc[nH]c21 ZINC000669711751 566324624 /nfs/dbraw/zinc/32/46/24/566324624.db2.gz OHJIUGQVUDZEFY-IAQYHMDHSA-N 0 1 380.286 3.387 10 0 GGAEMN CCCN(CC(F)(F)F)C(=O)CN[C@@H](c1cccs1)C1(CO)CCC1 ZINC000625465801 566327507 /nfs/dbraw/zinc/32/75/07/566327507.db2.gz SMVBANBMNIGIAV-HNNXBMFYSA-N 0 1 378.460 3.342 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000556752513 566328711 /nfs/dbraw/zinc/32/87/11/566328711.db2.gz FQZAMFJTJFYITM-XBFCOCLRSA-N 0 1 390.285 3.222 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@H]1CCC[C@@H]2C[C@@H]21 ZINC000556752513 566328718 /nfs/dbraw/zinc/32/87/18/566328718.db2.gz FQZAMFJTJFYITM-XBFCOCLRSA-N 0 1 390.285 3.222 10 0 GGAEMN CCCN1CCC[C@@H]1C(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000482732961 566329511 /nfs/dbraw/zinc/32/95/11/566329511.db2.gz CRTVSKBPLPFNCH-JKSUJKDBSA-N 0 1 384.307 3.089 10 0 GGAEMN O=C([C@H]1CCCN(Cc2nc3cc(Br)ccc3o2)C1)N1CCCC1 ZINC000509683492 566330095 /nfs/dbraw/zinc/33/00/95/566330095.db2.gz IXIRVCJFKFYALJ-ZDUSSCGKSA-N 0 1 392.297 3.425 10 0 GGAEMN CCN1CCN(CC(=O)NCC2(c3ccc(Cl)cc3Cl)CCC2)CC1 ZINC000535832385 566330662 /nfs/dbraw/zinc/33/06/62/566330662.db2.gz XDBDVCGMBBXCPP-UHFFFAOYSA-N 0 1 384.351 3.169 10 0 GGAEMN O=S1(=O)CCC(CN2CCC[C@H]2Cc2ccccc2Br)CC1 ZINC000420959627 566330735 /nfs/dbraw/zinc/33/07/35/566330735.db2.gz FTEOJQZMHOXRTA-INIZCTEOSA-N 0 1 386.355 3.281 10 0 GGAEMN CC(C)c1nc(CNC(=O)c2cc3c(cncc3Br)s2)n[nH]1 ZINC000648917917 566330925 /nfs/dbraw/zinc/33/09/25/566330925.db2.gz FNLDCLYULASBLN-UHFFFAOYSA-N 0 1 380.271 3.230 10 0 GGAEMN CNC(=O)[C@H]1CCN(Cc2csc(-c3cccc(Br)c3)n2)C1 ZINC000420970533 566332982 /nfs/dbraw/zinc/33/29/82/566332982.db2.gz GNEZKGDBOZFTCH-LBPRGKRZSA-N 0 1 380.311 3.141 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000482780739 566332975 /nfs/dbraw/zinc/33/29/75/566332975.db2.gz ZPFRWJLFOPEVGV-GFCCVEGCSA-N 0 1 394.269 3.256 10 0 GGAEMN O=C(NC[C@H](CO)C1CCCCC1)c1cc(Br)cc2nc[nH]c21 ZINC000509733226 566333302 /nfs/dbraw/zinc/33/33/02/566333302.db2.gz AAQZSTNXLJUTID-GFCCVEGCSA-N 0 1 380.286 3.244 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)CCCCc2cn[nH]n2)CC1 ZINC000648957562 566333919 /nfs/dbraw/zinc/33/39/19/566333919.db2.gz CJTFNGSDUQYOJH-UHFFFAOYSA-N 0 1 393.285 3.094 10 0 GGAEMN COC1([C@@H](C)NCc2nnc(-c3ccccc3Br)o2)CCOCC1 ZINC000421028095 566335750 /nfs/dbraw/zinc/33/57/50/566335750.db2.gz HIWWOKIKVIWXSK-GFCCVEGCSA-N 0 1 396.285 3.173 10 0 GGAEMN Cc1cnn(CCN(CCc2ccc(Cl)cc2)C[C@@H](O)C(F)(F)F)c1 ZINC000576379596 566340285 /nfs/dbraw/zinc/34/02/85/566340285.db2.gz LHVRCCUCRDEQMR-MRXNPFEDSA-N 0 1 375.822 3.313 10 0 GGAEMN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CCN(C2CCC2)CC1 ZINC000625597290 566341047 /nfs/dbraw/zinc/34/10/47/566341047.db2.gz WRUWXLBSAGFZDZ-BPQIPLTHSA-N 0 1 375.310 3.032 10 0 GGAEMN CCn1nccc1CN(CCO)CCCc1ccc(Br)cc1OC ZINC000482915951 566342317 /nfs/dbraw/zinc/34/23/17/566342317.db2.gz FSPGDZKWBRVUCA-UHFFFAOYSA-N 0 1 396.329 3.101 10 0 GGAEMN COC1CCC(CNS(=O)(=O)c2cc(F)c(Br)cc2F)CC1 ZINC000536001111 566343089 /nfs/dbraw/zinc/34/30/89/566343089.db2.gz AQRKGLXZVAORSM-UHFFFAOYSA-N 0 1 398.269 3.211 10 0 GGAEMN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)(F)F ZINC000556923057 566344364 /nfs/dbraw/zinc/34/43/64/566344364.db2.gz HYQNMHYCYFVKHX-QWHCGFSZSA-N 0 1 380.432 3.050 10 0 GGAEMN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cc(Br)ccc1F ZINC000556921338 566344996 /nfs/dbraw/zinc/34/49/96/566344996.db2.gz OEGRGWBIBLDXAW-DGCLKSJQSA-N 0 1 393.322 3.053 10 0 GGAEMN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cc(Br)ccc1F ZINC000556921340 566345363 /nfs/dbraw/zinc/34/53/63/566345363.db2.gz OEGRGWBIBLDXAW-YPMHNXCESA-N 0 1 393.322 3.053 10 0 GGAEMN C[C@H]1CC2(CN1C(=O)c1[nH]nc3ccc(Br)cc31)CCOCC2 ZINC000649126696 566346129 /nfs/dbraw/zinc/34/61/29/566346129.db2.gz LAHHRQCXPIPYPT-NSHDSACASA-N 0 1 378.270 3.357 10 0 GGAEMN CCn1c(-c2cc(F)ccc2Br)nnc1N1CCN(C2CC2)CC1 ZINC000670070632 566346449 /nfs/dbraw/zinc/34/64/49/566346449.db2.gz QYADHPJKTHJUIC-UHFFFAOYSA-N 0 1 394.292 3.151 10 0 GGAEMN Cc1c(C(=O)[O-])sc2nc(C[NH+](C)C)nc(NCCc3ccsc3)c12 ZINC000576468268 566348536 /nfs/dbraw/zinc/34/85/36/566348536.db2.gz AEOANLBXTYTXMK-UHFFFAOYSA-N 0 1 376.507 3.476 10 0 GGAEMN C[C@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)CC2(CCCC2)O1 ZINC000649178389 566349337 /nfs/dbraw/zinc/34/93/37/566349337.db2.gz SVYBDYIDDXESRB-NSHDSACASA-N 0 1 378.270 3.499 10 0 GGAEMN CC[C@@H](Cn1cncn1)NCc1ccc(Cl)cc1I ZINC000576484968 566349990 /nfs/dbraw/zinc/34/99/90/566349990.db2.gz RMANAVQKAUNRCL-LBPRGKRZSA-N 0 1 390.656 3.105 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@@H](NCc2sccc2Br)C1 ZINC000509944548 566350404 /nfs/dbraw/zinc/35/04/04/566350404.db2.gz PCJDIGLHPNPVAB-CYBMUJFWSA-N 0 1 395.322 3.280 10 0 GGAEMN C[C@@H]1CCCN(CCNS(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509946944 566350564 /nfs/dbraw/zinc/35/05/64/566350564.db2.gz BHFTZYLKNUJHMV-LLVKDONJSA-N 0 1 395.750 3.113 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1c(Cl)cccc1Br ZINC000509943586 566350729 /nfs/dbraw/zinc/35/07/29/566350729.db2.gz MWWDRHZPCWWPIB-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN COC(=O)[C@@H](N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1)c1cccnc1 ZINC000600615486 566350739 /nfs/dbraw/zinc/35/07/39/566350739.db2.gz WFIRMLDHKZKNTJ-IRXDYDNUSA-N 0 1 382.291 3.495 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NC(=O)Cc2c(Cl)cccc2OC)c1 ZINC000462779006 566351308 /nfs/dbraw/zinc/35/13/08/566351308.db2.gz WGWRUQQVBUYCMG-UHFFFAOYSA-N 0 1 383.853 3.029 10 0 GGAEMN O=C(NCc1ccc(Br)s1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000446499627 566351746 /nfs/dbraw/zinc/35/17/46/566351746.db2.gz YMMHLETUAYOVJI-ZDUSSCGKSA-N 0 1 392.282 3.218 10 0 GGAEMN O=C([C@@H]1CCCN(Cc2cc(Br)cc3c2OCC3)C1)N1CCCC1 ZINC000462786730 566352901 /nfs/dbraw/zinc/35/29/01/566352901.db2.gz BECJUSVKCWKVGQ-OAHLLOKOSA-N 0 1 393.325 3.218 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1cc2cc(Br)ccc2s1 ZINC000625706320 566353142 /nfs/dbraw/zinc/35/31/42/566353142.db2.gz AIQAUBAFIMKMLF-UHFFFAOYSA-N 0 1 392.282 3.376 10 0 GGAEMN Cc1ccncc1CN(C)C[C@H](O)COc1cc(F)cc(Br)c1 ZINC000483026501 566353375 /nfs/dbraw/zinc/35/33/75/566353375.db2.gz LOFYIBPCOWFQQE-INIZCTEOSA-N 0 1 383.261 3.163 10 0 GGAEMN O=C(Nc1cc(Cl)cc(Br)c1O)C1(N2CCOCC2)CCC1 ZINC000536134244 566353940 /nfs/dbraw/zinc/35/39/40/566353940.db2.gz ACMJQYGTVUFMCF-UHFFFAOYSA-N 0 1 389.677 3.002 10 0 GGAEMN O=C(c1cc(C(F)(F)F)[nH]n1)N1CCO[C@@H](c2c(F)cccc2Cl)C1 ZINC000649206235 566354041 /nfs/dbraw/zinc/35/40/41/566354041.db2.gz TVGIJLOBCAOWMG-LLVKDONJSA-N 0 1 377.725 3.435 10 0 GGAEMN CCOC(=O)c1c[nH]c(NC(=O)c2cc(F)c(Br)cc2Cl)n1 ZINC000509987781 566354205 /nfs/dbraw/zinc/35/42/05/566354205.db2.gz SSAPHXGFNJVBLG-UHFFFAOYSA-N 0 1 390.596 3.394 10 0 GGAEMN CCn1c(CNC(=O)c2ccc3[nH]nnc3c2)nc2cc(Br)ccc21 ZINC000483041579 566354371 /nfs/dbraw/zinc/35/43/71/566354371.db2.gz AQRXHUXTLGASDO-UHFFFAOYSA-N 0 1 399.252 3.020 10 0 GGAEMN CO[C@H](Cc1ccccc1)CS(=O)(=O)Nc1cc(Cl)c(Cl)cn1 ZINC000421225194 566355713 /nfs/dbraw/zinc/35/57/13/566355713.db2.gz JRCCWSGEEDZXTK-GFCCVEGCSA-N 0 1 375.277 3.388 10 0 GGAEMN O=C(CN1CC[C@H]2CC[C@@H](C1)S2)NCc1ccc(F)cc1C(F)(F)F ZINC000625772637 566357750 /nfs/dbraw/zinc/35/77/50/566357750.db2.gz FULOBFOYXFJYGN-KGLIPLIRSA-N 0 1 376.419 3.431 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)CCc2cccc(Cl)c2)[C@@H]1c1ccccc1 ZINC000510021035 566357643 /nfs/dbraw/zinc/35/76/43/566357643.db2.gz PRJCGARHEDZFJC-MOPGFXCFSA-N 0 1 378.925 3.247 10 0 GGAEMN COCc1cccc(S(=O)(=O)Nc2ccc(OC)nc2C(F)(F)F)c1 ZINC000670329581 566357878 /nfs/dbraw/zinc/35/78/78/566357878.db2.gz XBLNXZDXWDSQNN-UHFFFAOYSA-N 0 1 376.356 3.056 10 0 GGAEMN COC[C@](C)(NS(=O)(=O)c1cc(Cl)ccc1OC(F)F)C(F)(F)F ZINC000421251841 566361010 /nfs/dbraw/zinc/36/10/10/566361010.db2.gz RCDRKNIIMSPVFF-NSHDSACASA-N 0 1 397.749 3.187 10 0 GGAEMN CCn1cc(Br)cc1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000536264826 566361853 /nfs/dbraw/zinc/36/18/53/566361853.db2.gz QJKLVAIUMPBMPH-NVXWUHKLSA-N 0 1 376.298 3.446 10 0 GGAEMN Cc1c(Cl)c(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)nn1C ZINC000421350938 566366143 /nfs/dbraw/zinc/36/61/43/566366143.db2.gz ZFOOTQSJYGGKTE-UHFFFAOYSA-N 0 1 395.692 3.219 10 0 GGAEMN Cc1c(Cl)c(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)nn1C ZINC000421350938 566366148 /nfs/dbraw/zinc/36/61/48/566366148.db2.gz ZFOOTQSJYGGKTE-UHFFFAOYSA-N 0 1 395.692 3.219 10 0 GGAEMN CCN1CCCC[C@H]1CNS(=O)(=O)c1c(Cl)cccc1Br ZINC000510185980 566368548 /nfs/dbraw/zinc/36/85/48/566368548.db2.gz PYJYXWYHGNRCFP-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN CC(=O)N[C@@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000421397269 566370114 /nfs/dbraw/zinc/37/01/14/566370114.db2.gz XPFNGYKXMZEKON-CQSZACIVSA-N 0 1 380.311 3.283 10 0 GGAEMN CS(=O)(=O)NCC1CCN(CCSc2cc(Cl)ccc2Cl)CC1 ZINC000510241542 566371483 /nfs/dbraw/zinc/37/14/83/566371483.db2.gz OGADTIRCHGAJPD-UHFFFAOYSA-N 0 1 397.393 3.347 10 0 GGAEMN O=C(NCc1ccccc1-n1cccn1)c1n[nH]c2ccc(Br)cc21 ZINC000510234620 566371625 /nfs/dbraw/zinc/37/16/25/566371625.db2.gz CQXYBZCICPKRNZ-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1nscc1Br ZINC000649518818 566371766 /nfs/dbraw/zinc/37/17/66/566371766.db2.gz KYKAWSYGKRQTSJ-UHFFFAOYSA-N 0 1 395.326 3.218 10 0 GGAEMN C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281404 566371885 /nfs/dbraw/zinc/37/18/85/566371885.db2.gz MUQRXHCUAPQFRH-GWCFXTLKSA-N 0 1 380.229 3.022 10 0 GGAEMN C[C@@H]1OCC[C@@H]1N(CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281404 566371888 /nfs/dbraw/zinc/37/18/88/566371888.db2.gz MUQRXHCUAPQFRH-GWCFXTLKSA-N 0 1 380.229 3.022 10 0 GGAEMN CN(C)C[C@H](NCC(=O)NC(C1CC1)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000625983704 566371959 /nfs/dbraw/zinc/37/19/59/566371959.db2.gz YGUAKGSLAWYPCP-KRWDZBQOSA-N 0 1 384.351 3.491 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2cccc(F)c2Cl)C1 ZINC000557197764 566372089 /nfs/dbraw/zinc/37/20/89/566372089.db2.gz SWUDHVSFIIHNPK-OAHLLOKOSA-N 0 1 388.936 3.185 10 0 GGAEMN O=C(NCCc1ccsc1)c1n[nH]c2ccc(I)cc21 ZINC000510274261 566372211 /nfs/dbraw/zinc/37/22/11/566372211.db2.gz WTBOQKNMIOISCR-UHFFFAOYSA-N 0 1 397.241 3.202 10 0 GGAEMN COc1ccc(CNC2(CO)Cc3ccccc3C2)c(Br)c1OC ZINC000510265549 566372758 /nfs/dbraw/zinc/37/27/58/566372758.db2.gz VIDKCOSNIADIAD-UHFFFAOYSA-N 0 1 392.293 3.086 10 0 GGAEMN CN(C)C[C@H](NCC(=O)N(C)Cc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000625983151 566373171 /nfs/dbraw/zinc/37/31/71/566373171.db2.gz HOALSNNUWHGFOE-KRWDZBQOSA-N 0 1 384.307 3.437 10 0 GGAEMN COC(=O)C(C)(C)c1ccc(S(=O)(=O)Nc2scnc2C2CC2)cc1 ZINC000576717208 566373322 /nfs/dbraw/zinc/37/33/22/566373322.db2.gz BHTIIEXTASAXEO-UHFFFAOYSA-N 0 1 380.491 3.272 10 0 GGAEMN Cc1cc(Br)ccc1[C@@H]1CCCN1C[C@@H](O)COC1CCOCC1 ZINC000626009250 566374019 /nfs/dbraw/zinc/37/40/19/566374019.db2.gz CBSFCJVVQXSOFZ-APWZRJJASA-N 0 1 398.341 3.451 10 0 GGAEMN CC(C)(COc1ncccc1Br)NCc1cc2n(n1)CCCC2 ZINC000649573201 566374722 /nfs/dbraw/zinc/37/47/22/566374722.db2.gz XVQLQFADDXEHRM-UHFFFAOYSA-N 0 1 379.302 3.324 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@H](O)COc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000625995801 566374879 /nfs/dbraw/zinc/37/48/79/566374879.db2.gz WAHOXKZZPZAVBB-ZBEGNZNMSA-N 0 1 384.263 3.066 10 0 GGAEMN CCC[C@@H](NC(=O)Cc1ccc(SCC)cc1Br)c1nn[nH]n1 ZINC000626024915 566375968 /nfs/dbraw/zinc/37/59/68/566375968.db2.gz ZYOSSWREEPKTGW-CYBMUJFWSA-N 0 1 398.330 3.274 10 0 GGAEMN CCS(=O)(=O)NCCCN1CCC[C@@H]1c1ccc(Br)cc1C ZINC000626010620 566376038 /nfs/dbraw/zinc/37/60/38/566376038.db2.gz YRBOEFGTZYQUIX-MRXNPFEDSA-N 0 1 389.359 3.224 10 0 GGAEMN O=C([C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)N1CCC(c2cnc[nH]2)CC1 ZINC000626025346 566378605 /nfs/dbraw/zinc/37/86/05/566378605.db2.gz UNEHDAKIOCYPTH-BMGDILEWSA-N 0 1 386.293 3.464 10 0 GGAEMN C[C@@H](C(=O)Nc1ncccn1)N1C[C@H](c2ccc(Br)cc2)C[C@H]1C ZINC000626040951 566378733 /nfs/dbraw/zinc/37/87/33/566378733.db2.gz OMHOUAFAETVKPQ-VNHYZAJKSA-N 0 1 389.297 3.444 10 0 GGAEMN Cc1ccc(O)c(CN[C@H](C)c2ccc(Br)cc2OCCCO)n1 ZINC000463035261 566378815 /nfs/dbraw/zinc/37/88/15/566378815.db2.gz ORWJBQWZEVEGSO-CYBMUJFWSA-N 0 1 395.297 3.470 10 0 GGAEMN Cc1ccc(-n2ncc(NS(=O)(=O)c3c[nH]c(=O)s3)c2C(C)C)cc1 ZINC000649627286 566378890 /nfs/dbraw/zinc/37/88/90/566378890.db2.gz JSUWYFAXMOJKFW-UHFFFAOYSA-N 0 1 378.479 3.267 10 0 GGAEMN Cc1ccc(CN(Cc2cc(Cl)cc(S(N)(=O)=O)c2)CC2CC2)cn1 ZINC000649635490 566380297 /nfs/dbraw/zinc/38/02/97/566380297.db2.gz VOXXIBIFHXJTOL-UHFFFAOYSA-N 0 1 379.913 3.103 10 0 GGAEMN FCCCN1CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000626070905 566382317 /nfs/dbraw/zinc/38/23/17/566382317.db2.gz HMICKNWZDYHBFS-UHFFFAOYSA-N 0 1 393.304 3.383 10 0 GGAEMN O=C1[C@H](NCc2ccc3c[nH]nc3c2)CCN1c1cccc(Br)c1 ZINC000447071750 566382703 /nfs/dbraw/zinc/38/27/03/566382703.db2.gz BYFAYDOVMICECH-MRXNPFEDSA-N 0 1 385.265 3.221 10 0 GGAEMN CC(C)n1ncc2c1C[C@H](NC(=O)c1cccc(Br)c1O)CC2 ZINC000557395928 566383266 /nfs/dbraw/zinc/38/32/66/566383266.db2.gz RPJNDHRMHBPJMD-GFCCVEGCSA-N 0 1 378.270 3.219 10 0 GGAEMN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC(C2(O)CC2)CC1 ZINC000649674683 566383806 /nfs/dbraw/zinc/38/38/06/566383806.db2.gz ZYNSZWUQEDMKCB-AWEZNQCLSA-N 0 1 395.341 3.033 10 0 GGAEMN CCCOc1ccc(Br)cc1C[S@@](=O)Cc1n[nH]c(CC)n1 ZINC000447103306 566386729 /nfs/dbraw/zinc/38/67/29/566386729.db2.gz WAQBUWDPZQSRMM-JOCHJYFZSA-N 0 1 386.315 3.367 10 0 GGAEMN Cc1cc(NC(=O)CN2CC[C@@H](C)C2)n(-c2cccc(Br)c2)n1 ZINC000576888733 566387934 /nfs/dbraw/zinc/38/79/34/566387934.db2.gz WCBKKXMXTKBEMO-GFCCVEGCSA-N 0 1 377.286 3.224 10 0 GGAEMN CCN(CC)C(=O)CN1CCCN(CCc2cc(Cl)cc(Cl)c2)CC1 ZINC000447131510 566389343 /nfs/dbraw/zinc/38/93/43/566389343.db2.gz BDHKSWUMRVGTLJ-UHFFFAOYSA-N 0 1 386.367 3.412 10 0 GGAEMN CC[C@@](NS(=O)(=O)c1c(F)cccc1Cl)(C(=O)OC)c1ccccc1 ZINC000510504352 566389441 /nfs/dbraw/zinc/38/94/41/566389441.db2.gz YJQVJKPRFKCHEZ-KRWDZBQOSA-N 0 1 385.844 3.236 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1nc2ccc(Br)cc2o1 ZINC000463216806 566391331 /nfs/dbraw/zinc/39/13/31/566391331.db2.gz YDNRQVRRYGBHPL-ZDUSSCGKSA-N 0 1 380.286 3.471 10 0 GGAEMN CC1(C)[C@H](O)CCN1Cc1coc(-c2ccc(I)cc2)n1 ZINC000463221236 566392559 /nfs/dbraw/zinc/39/25/59/566392559.db2.gz JZLNVALJEVSJCO-CQSZACIVSA-N 0 1 398.244 3.291 10 0 GGAEMN CCOC(=O)CCCCN1CCN(Cc2ccc(Br)cc2)CC1 ZINC000483587880 566392614 /nfs/dbraw/zinc/39/26/14/566392614.db2.gz DFGGLUHZKLFQHO-UHFFFAOYSA-N 0 1 383.330 3.300 10 0 GGAEMN Brc1ccc2oc(CN3CCC(Cn4cnnc4)CC3)nc2c1 ZINC000649784637 566392980 /nfs/dbraw/zinc/39/29/80/566392980.db2.gz FCFRFRNQCLWOKS-UHFFFAOYSA-N 0 1 376.258 3.094 10 0 GGAEMN C[C@@H]1C[C@@H](C)CN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000463241836 566394303 /nfs/dbraw/zinc/39/43/03/566394303.db2.gz FNLMAFVEMGCSSV-NXEZZACHSA-N 0 1 383.233 3.286 10 0 GGAEMN O=C(NCc1ccccc1)c1n[nH]c2ccc(I)cc21 ZINC000463239095 566395274 /nfs/dbraw/zinc/39/52/74/566395274.db2.gz ULXYOXIJDNRMPV-UHFFFAOYSA-N 0 1 377.185 3.098 10 0 GGAEMN O=C(c1cc2cc(Br)ccc2s1)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000626237783 566395922 /nfs/dbraw/zinc/39/59/22/566395922.db2.gz HBFXIIGVVAIYNZ-VIFPVBQESA-N 0 1 392.282 3.197 10 0 GGAEMN O=C(NCc1cccc(F)c1)c1n[nH]c2ccc(I)cc21 ZINC000463316163 566398829 /nfs/dbraw/zinc/39/88/29/566398829.db2.gz RURINERLTFDQPC-UHFFFAOYSA-N 0 1 395.175 3.237 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2ccc(=O)n(C)c2c1 ZINC000447278945 566399662 /nfs/dbraw/zinc/39/96/62/566399662.db2.gz PXQVUAVROXPICU-UHFFFAOYSA-N 0 1 378.837 3.001 10 0 GGAEMN COCc1cnc(CNC(C)(C)COc2ncccc2Br)s1 ZINC000536757351 566400245 /nfs/dbraw/zinc/40/02/45/566400245.db2.gz UWJAYKIQSYJKAR-UHFFFAOYSA-N 0 1 386.315 3.394 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C[C@H]1C ZINC000626314994 566400969 /nfs/dbraw/zinc/40/09/69/566400969.db2.gz XPIHDWVRJVOPNU-RMHMGBASSA-N 0 1 377.326 3.276 10 0 GGAEMN Cc1cc2ncc([C@H](C)N[C@H](CO)c3ccc(Br)cc3)c(C)n2n1 ZINC000536834847 566404222 /nfs/dbraw/zinc/40/42/22/566404222.db2.gz UPJUKXWPRODEQR-YVEFUNNKSA-N 0 1 389.297 3.493 10 0 GGAEMN C[C@@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(F)c1 ZINC000536828745 566404912 /nfs/dbraw/zinc/40/49/12/566404912.db2.gz WDBRHMUOUFTNGT-PWSUYJOCSA-N 0 1 377.890 3.026 10 0 GGAEMN C[C@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(F)c1 ZINC000536828738 566405407 /nfs/dbraw/zinc/40/54/07/566405407.db2.gz WDBRHMUOUFTNGT-CMPLNLGQSA-N 0 1 377.890 3.026 10 0 GGAEMN Cn1cc([C@@H](NCc2nc3ccc(Br)cc3[nH]2)C(F)(F)F)cn1 ZINC000447376342 566407202 /nfs/dbraw/zinc/40/72/02/566407202.db2.gz UBQFZAUUSHICCE-CYBMUJFWSA-N 0 1 388.191 3.452 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(I)cc21)c1cccnc1 ZINC000463438495 566410706 /nfs/dbraw/zinc/41/07/06/566410706.db2.gz XHLSFSRNZZFVFT-SECBINFHSA-N 0 1 392.200 3.054 10 0 GGAEMN CN(Cc1ccco1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463456821 566412389 /nfs/dbraw/zinc/41/23/89/566412389.db2.gz QIDKLCVGAZDFOR-UHFFFAOYSA-N 0 1 381.173 3.033 10 0 GGAEMN CC1=CCN(CCNC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC1 ZINC000626460376 566413326 /nfs/dbraw/zinc/41/33/26/566413326.db2.gz FFSBNTNKXDJYHX-CGTJXYLNSA-N 0 1 375.310 3.103 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2csc3ccccc23)ccc1OC ZINC000484089190 566416259 /nfs/dbraw/zinc/41/62/59/566416259.db2.gz OTVASBUDTYWGLI-UHFFFAOYSA-N 0 1 377.443 3.497 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cc(Cl)cnc2N)cc(OC)c1C(C)C ZINC000484119700 566416292 /nfs/dbraw/zinc/41/62/92/566416292.db2.gz VCZDEEDIKSFXBN-UHFFFAOYSA-N 0 1 385.873 3.259 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CCc2cc(Br)cc(C)c2C1 ZINC000536996923 566416799 /nfs/dbraw/zinc/41/67/99/566416799.db2.gz NYFPOVLXTXLCSZ-UHFFFAOYSA-N 0 1 391.313 3.490 10 0 GGAEMN O=C(CC(F)(F)F)NC[C@@H]1CCCN(CCOc2ccccc2Cl)C1 ZINC000510905453 566418695 /nfs/dbraw/zinc/41/86/95/566418695.db2.gz PXOCRXAUUIYYDN-ZDUSSCGKSA-N 0 1 378.822 3.499 10 0 GGAEMN CCN(Cc1ccccn1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000484183228 566418875 /nfs/dbraw/zinc/41/88/75/566418875.db2.gz XGKUKFPARFHTAK-UHFFFAOYSA-N 0 1 386.249 3.348 10 0 GGAEMN CN(C)CCN(Cc1ccccc1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000510925572 566421627 /nfs/dbraw/zinc/42/16/27/566421627.db2.gz TXYWZOKMZIEIKC-UHFFFAOYSA-N 0 1 389.293 3.222 10 0 GGAEMN CCCN(CC(F)F)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463644142 566423670 /nfs/dbraw/zinc/42/36/70/566423670.db2.gz QHABXMILGIWQLK-UHFFFAOYSA-N 0 1 393.175 3.285 10 0 GGAEMN O=C(c1cc(Br)cc2ccccc21)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000537125016 566425431 /nfs/dbraw/zinc/42/54/31/566425431.db2.gz RGLNTDCLTBUMAT-LBPRGKRZSA-N 0 1 386.253 3.135 10 0 GGAEMN C[C@H](N[C@H](CO)CC1CCCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000510994924 566426131 /nfs/dbraw/zinc/42/61/31/566426131.db2.gz CBBTZBJPEULNGY-JQWIXIFHSA-N 0 1 395.352 3.233 10 0 GGAEMN C[C@@H]1[C@@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)[C@@H](C)CN1C ZINC000650150928 566427832 /nfs/dbraw/zinc/42/78/32/566427832.db2.gz BSASVELCFZVWBO-QJPTWQEYSA-N 0 1 392.297 3.256 10 0 GGAEMN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ncsc2Br)CC1 ZINC000557876982 566431872 /nfs/dbraw/zinc/43/18/72/566431872.db2.gz LQTIAOHWHPHMNU-NSHDSACASA-N 0 1 395.326 3.256 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1CC[S@@](=O)c1cc(Cl)ccc1Cl ZINC000577422357 566433629 /nfs/dbraw/zinc/43/36/29/566433629.db2.gz XQCNPXUXAANQBO-LFPIHBKWSA-N 0 1 391.364 3.482 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)N2CCc3c2cccc3Br)C[C@H](C)O1 ZINC000422137774 566435783 /nfs/dbraw/zinc/43/57/83/566435783.db2.gz AKMITRBDGWPNSW-OKILXGFUSA-N 0 1 396.329 3.021 10 0 GGAEMN CC(C)SCCNC(=O)c1n[nH]c2ccc(I)cc21 ZINC000557939455 566436663 /nfs/dbraw/zinc/43/66/63/566436663.db2.gz YFHAELNVCKLSQK-UHFFFAOYSA-N 0 1 389.262 3.039 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2Br)n[nH]1)c1cnc2cnccc2c1 ZINC000537305764 566437984 /nfs/dbraw/zinc/43/79/84/566437984.db2.gz JVAAISDEVKNHEX-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1cc(Br)cc(Br)c1 ZINC000626662305 566438289 /nfs/dbraw/zinc/43/82/89/566438289.db2.gz HAFLVQXFFWMTFF-UHFFFAOYSA-N 0 1 391.107 3.237 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)N3CC[C@H](c4nc[nH]n4)C3)coc21 ZINC000577486178 566439583 /nfs/dbraw/zinc/43/95/83/566439583.db2.gz ZSACZECKADMTQU-JTQLQIEISA-N 0 1 375.226 3.252 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ncccc2I)sc1C ZINC000537393835 566443088 /nfs/dbraw/zinc/44/30/88/566443088.db2.gz HJALSHWOQDXYSP-UHFFFAOYSA-N 0 1 394.259 3.165 10 0 GGAEMN C[C@@H]1C[C@H]1N1C[C@H](NCc2cccc(Br)c2OC(F)F)CC1=O ZINC000537431887 566444987 /nfs/dbraw/zinc/44/49/87/566444987.db2.gz KYEIXSNJMQQGOS-IRUJWGPZSA-N 0 1 389.240 3.149 10 0 GGAEMN Cc1nn(C)c(CNCCN2CCc3c(Cl)cccc3C2)c1Br ZINC000447896698 566445053 /nfs/dbraw/zinc/44/50/53/566445053.db2.gz JCYBREPHSARRLO-UHFFFAOYSA-N 0 1 397.748 3.292 10 0 GGAEMN Cc1nn(C)c(CN[C@@H]2CCN(c3c(F)cccc3F)C2)c1Br ZINC000447894278 566445488 /nfs/dbraw/zinc/44/54/88/566445488.db2.gz CMNROQCNCHLHCB-LLVKDONJSA-N 0 1 385.256 3.138 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](NCc2cccc(Br)c2OC(F)F)CC1=O ZINC000537431890 566445704 /nfs/dbraw/zinc/44/57/04/566445704.db2.gz KYEIXSNJMQQGOS-XWIASGKRSA-N 0 1 389.240 3.149 10 0 GGAEMN CN1CCN(c2cc(C(=O)NCc3cccc(Cl)c3Cl)ccn2)CC1 ZINC000602085740 566446198 /nfs/dbraw/zinc/44/61/98/566446198.db2.gz JSTODYKZCVQQFY-UHFFFAOYSA-N 0 1 379.291 3.070 10 0 GGAEMN C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc(I)cc32)[C@@H]1C ZINC000464074482 566446533 /nfs/dbraw/zinc/44/65/33/566446533.db2.gz VCIKICWIRRBRQB-NXEZZACHSA-N 0 1 383.233 3.428 10 0 GGAEMN C[C@H](NC(=O)N1CCc2cc(Br)cc(F)c21)C1=CC[N@@H+](C)CC1 ZINC000511247904 566448199 /nfs/dbraw/zinc/44/81/99/566448199.db2.gz KZZCHKWKNQDRJW-NSHDSACASA-N 0 1 382.277 3.311 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](NCc2cn[nH]c2)C1=O ZINC000671730074 566448128 /nfs/dbraw/zinc/44/81/28/566448128.db2.gz JXALTVMLYGOSRY-OAHLLOKOSA-N 0 1 377.286 3.074 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CN[C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000671769497 566449039 /nfs/dbraw/zinc/44/90/39/566449039.db2.gz CBPBMWFMNIDUSE-DZGCQCFKSA-N 0 1 377.337 3.384 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CN[C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000671769499 566449239 /nfs/dbraw/zinc/44/92/39/566449239.db2.gz CBPBMWFMNIDUSE-UKRRQHHQSA-N 0 1 377.337 3.384 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2c2cnc[nH]2)c(C)cc1Br ZINC000602157195 566449988 /nfs/dbraw/zinc/44/99/88/566449988.db2.gz VPSWTVOLHXROPW-NXEZZACHSA-N 0 1 378.226 3.009 10 0 GGAEMN O=c1[nH]nc2n1CCN(Cc1ccc(-c3ccccc3Br)s1)C2 ZINC000484730863 566450483 /nfs/dbraw/zinc/45/04/83/566450483.db2.gz BZIDYEMPLYKGMY-UHFFFAOYSA-N 0 1 391.294 3.491 10 0 GGAEMN C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N=c2nc(-c3ccsc3)[n-]s2)C1 ZINC000448000777 566453124 /nfs/dbraw/zinc/45/31/24/566453124.db2.gz OQBKZGYEVHHLDD-GFCCVEGCSA-N 0 1 379.555 3.321 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC[C@@H](c3n[nH]c(=O)o3)C2)c1 ZINC000626846223 566453898 /nfs/dbraw/zinc/45/38/98/566453898.db2.gz KAJPTZBDCDOJFH-SECBINFHSA-N 0 1 384.205 3.005 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC(c3n[nH]c(=O)o3)CC2)c1 ZINC000626907108 566454864 /nfs/dbraw/zinc/45/48/64/566454864.db2.gz VCDYDUKPTLQGOK-UHFFFAOYSA-N 0 1 384.205 3.005 10 0 GGAEMN CCC1(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCOCC1 ZINC000537609341 566455759 /nfs/dbraw/zinc/45/57/59/566455759.db2.gz OARJWWUOGCPSGE-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN CCC1(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCOCC1 ZINC000537609341 566455761 /nfs/dbraw/zinc/45/57/61/566455761.db2.gz OARJWWUOGCPSGE-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN CCc1cc(C(=O)Nc2nc(-c3ccccc3Br)n[nH]2)cc(=O)[nH]1 ZINC000537597096 566455814 /nfs/dbraw/zinc/45/58/14/566455814.db2.gz VATVJTOMGFOVLG-UHFFFAOYSA-N 0 1 388.225 3.150 10 0 GGAEMN O=C(NCCc1ccc2c[nH]nc2c1)c1cc(Br)cc2nc[nH]c21 ZINC000671880241 566456315 /nfs/dbraw/zinc/45/63/15/566456315.db2.gz PPPLJHZEFRQBQY-UHFFFAOYSA-N 0 1 384.237 3.174 10 0 GGAEMN COCc1ccnc(NS(=O)(=O)c2c(C)cc(Br)cc2C)c1 ZINC000650495285 566460770 /nfs/dbraw/zinc/46/07/70/566460770.db2.gz IXEGWACJDJZMJI-UHFFFAOYSA-N 0 1 385.283 3.408 10 0 GGAEMN CCN1CCN(CC(=O)N(Cc2ccccc2Br)CC(C)C)CC1 ZINC000484857705 566460883 /nfs/dbraw/zinc/46/08/83/566460883.db2.gz ZXGZLNKIUKPJBT-UHFFFAOYSA-N 0 1 396.373 3.071 10 0 GGAEMN C[C@H](CN(C)Cc1ccccc1)NC(=O)C(=O)c1ccc(Br)cc1 ZINC000558310506 566463712 /nfs/dbraw/zinc/46/37/12/566463712.db2.gz VDUQQUZNNJOAFM-CQSZACIVSA-N 0 1 389.293 3.269 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCSC[C@@H]1CCO ZINC000537710250 566463918 /nfs/dbraw/zinc/46/39/18/566463918.db2.gz MJYCEJFEKWPBDU-KRWDZBQOSA-N 0 1 396.354 3.243 10 0 GGAEMN C[C@@H](CC(F)(F)F)NC(=O)c1n[nH]c2ccc(I)cc21 ZINC000464312621 566464337 /nfs/dbraw/zinc/46/43/37/566464337.db2.gz JRACEQQRQZNEHS-LURJTMIESA-N 0 1 397.138 3.238 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1ccc2cc(Br)ccc2c1 ZINC000448246587 566465815 /nfs/dbraw/zinc/46/58/15/566465815.db2.gz FHLNOYYQGIQBLN-UHFFFAOYSA-N 0 1 386.253 3.315 10 0 GGAEMN FC(F)(F)c1nc(N2CCN(C[C@H]3CCCO3)CC2)ccc1Br ZINC000672142515 566466837 /nfs/dbraw/zinc/46/68/37/566466837.db2.gz MODSPKFHPJERTE-LLVKDONJSA-N 0 1 394.235 3.164 10 0 GGAEMN Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](CCO)c1ccccc1Br ZINC000423026156 566468578 /nfs/dbraw/zinc/46/85/78/566468578.db2.gz ARZPODZQAPBEDE-ACJLOTCBSA-N 0 1 378.314 3.386 10 0 GGAEMN Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](CCO)c1ccccc1Br ZINC000423026157 566469772 /nfs/dbraw/zinc/46/97/72/566469772.db2.gz ARZPODZQAPBEDE-FZKQIMNGSA-N 0 1 378.314 3.386 10 0 GGAEMN CC[C@@H](CNC(=O)c1ncsc1Br)N1CCc2ccccc2C1 ZINC000577887742 566472666 /nfs/dbraw/zinc/47/26/66/566472666.db2.gz HGVNXXYWTMAOML-AWEZNQCLSA-N 0 1 394.338 3.472 10 0 GGAEMN C[C@@H]1CCCC[C@H]1N(C)C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511585646 566473053 /nfs/dbraw/zinc/47/30/53/566473053.db2.gz NVOQXMYDMMKPEU-BJZITVGISA-N 0 1 397.357 3.283 10 0 GGAEMN COCCOc1ccc(Br)cc1S(=O)(=O)Nc1ccccc1 ZINC000485093526 566473673 /nfs/dbraw/zinc/47/36/73/566473673.db2.gz BZFMNGVDGDXSJA-UHFFFAOYSA-N 0 1 386.267 3.275 10 0 GGAEMN C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511585647 566474034 /nfs/dbraw/zinc/47/40/34/566474034.db2.gz NVOQXMYDMMKPEU-DKSSEZFCSA-N 0 1 397.357 3.283 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511603316 566475223 /nfs/dbraw/zinc/47/52/23/566475223.db2.gz AEURQQSLGKAXNH-LBTNJELSSA-N 0 1 383.330 3.036 10 0 GGAEMN C[C@](CO)(NCC(=O)NC1CCCCCC1)c1ccc(Br)cc1 ZINC000511593262 566475436 /nfs/dbraw/zinc/47/54/36/566475436.db2.gz LDQMQCFRCQHAEV-GOSISDBHSA-N 0 1 383.330 3.085 10 0 GGAEMN COC(=O)c1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511605656 566475679 /nfs/dbraw/zinc/47/56/79/566475679.db2.gz RFCMPUOWCICRJG-SFHVURJKSA-N 0 1 378.266 3.233 10 0 GGAEMN Cc1cnc(NS(=O)(=O)c2cccnc2C(F)(F)F)c(Br)c1 ZINC000577913472 566475937 /nfs/dbraw/zinc/47/59/37/566475937.db2.gz KTMQKJBRGBAGST-UHFFFAOYSA-N 0 1 396.188 3.367 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)c(C)s1 ZINC000577927881 566476515 /nfs/dbraw/zinc/47/65/15/566476515.db2.gz HPHZOOGRKHATHJ-RYUDHWBXSA-N 0 1 381.523 3.174 10 0 GGAEMN C[C@@H](C1CC1)N(C(=O)CN[C@](C)(CO)c1ccc(Br)cc1)C1CC1 ZINC000511621605 566477102 /nfs/dbraw/zinc/47/71/02/566477102.db2.gz GGCZGCYYNKGEIN-ORAYPTAESA-N 0 1 395.341 3.036 10 0 GGAEMN COc1cc(C[N@H+](CC(=O)[O-])CC2CC2)cc(Br)c1OC(F)F ZINC000650797300 566479177 /nfs/dbraw/zinc/47/91/77/566479177.db2.gz QVRPAVVEHWDRPC-UHFFFAOYSA-N 0 1 394.212 3.356 10 0 GGAEMN CC(C)CC[C@](C)(O)CNCc1cn(-c2ccccc2Br)nn1 ZINC000558485824 566479564 /nfs/dbraw/zinc/47/95/64/566479564.db2.gz KFLDTVGUGAKZKB-KRWDZBQOSA-N 0 1 381.318 3.307 10 0 GGAEMN CC(C)CC[C@@](C)(O)CNCc1cn(-c2ccccc2Br)nn1 ZINC000558485825 566479642 /nfs/dbraw/zinc/47/96/42/566479642.db2.gz KFLDTVGUGAKZKB-QGZVFWFLSA-N 0 1 381.318 3.307 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000577965182 566479874 /nfs/dbraw/zinc/47/98/74/566479874.db2.gz FOODXLDZGOFRAU-GFCCVEGCSA-N 0 1 381.889 3.180 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000577965182 566479879 /nfs/dbraw/zinc/47/98/79/566479879.db2.gz FOODXLDZGOFRAU-GFCCVEGCSA-N 0 1 381.889 3.180 10 0 GGAEMN O=C(Cc1ccc(Br)c(Br)c1)N1CCc2nc[nH]c2C1 ZINC000627374954 566480445 /nfs/dbraw/zinc/48/04/45/566480445.db2.gz HXEHAAWQTNIFBI-UHFFFAOYSA-N 0 1 399.086 3.062 10 0 GGAEMN COc1cccc([C@@H](CNC(=O)Cc2sccc2Br)N(C)C)c1 ZINC000448603241 566481574 /nfs/dbraw/zinc/48/15/74/566481574.db2.gz DPNUOYJDQYBNHE-OAHLLOKOSA-N 0 1 397.338 3.481 10 0 GGAEMN Cc1c([C@H](C)NCC[C@H](C)[S@@](C)=O)nnn1-c1cccc(Br)c1 ZINC000537963150 566482408 /nfs/dbraw/zinc/48/24/08/566482408.db2.gz ALJKLLQFYPOTNB-HDODXQBNSA-N 0 1 399.358 3.146 10 0 GGAEMN Cc1c([C@H](C)NCC[C@@H](C)[S@](C)=O)nnn1-c1cccc(Br)c1 ZINC000537963152 566482466 /nfs/dbraw/zinc/48/24/66/566482466.db2.gz ALJKLLQFYPOTNB-WCBZVUCDSA-N 0 1 399.358 3.146 10 0 GGAEMN C[C@H](NC(=O)c1ccccc1)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000464548418 566484782 /nfs/dbraw/zinc/48/47/82/566484782.db2.gz AULCKIOGBLLISO-JTQLQIEISA-N 0 1 387.237 3.082 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)[C@H]1CCCN1c1nccs1 ZINC000464553437 566484907 /nfs/dbraw/zinc/48/49/07/566484907.db2.gz CEUPGKMMEAQBKJ-GFCCVEGCSA-N 0 1 392.282 3.389 10 0 GGAEMN O=C(Cc1sccc1Br)NCCN1CCc2ccccc2C1 ZINC000448654814 566485455 /nfs/dbraw/zinc/48/54/55/566485455.db2.gz IQLGLTMSZYKBER-UHFFFAOYSA-N 0 1 379.323 3.228 10 0 GGAEMN C[C@@](O)(CNCc1ncc(I)s1)C1CCCCC1 ZINC000511765383 566486444 /nfs/dbraw/zinc/48/64/44/566486444.db2.gz PUTNRNCJFHBWHF-CYBMUJFWSA-N 0 1 380.295 3.169 10 0 GGAEMN COc1cc(Br)c(F)cc1S(=O)(=O)N[C@H]1CCCC1(F)F ZINC000672430607 566490455 /nfs/dbraw/zinc/49/04/55/566490455.db2.gz ACBPKQFVCSSUKN-NSHDSACASA-N 0 1 388.205 3.063 10 0 GGAEMN CC(C)C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)OC(C)C ZINC000511829319 566490982 /nfs/dbraw/zinc/49/09/82/566490982.db2.gz ZLJUFZKRTIMIBZ-AWEZNQCLSA-N 0 1 396.285 3.422 10 0 GGAEMN CCCOc1ccc(Br)cc1CN[C@@]1(CC(=O)OC)CCOC1 ZINC000464619337 566492133 /nfs/dbraw/zinc/49/21/33/566492133.db2.gz OEHQEELLVSUQDG-QGZVFWFLSA-N 0 1 386.286 3.050 10 0 GGAEMN CC[C@@H](NC(=O)c1ccnc(N2CCN(C)CC2)c1)c1ccc(Cl)s1 ZINC000511862017 566492723 /nfs/dbraw/zinc/49/27/23/566492723.db2.gz XFDAADRVSDFQTR-CQSZACIVSA-N 0 1 378.929 3.429 10 0 GGAEMN CC(C)Oc1cc(C(=O)NCCCCN2CCOCC2)ccc1Br ZINC000651113328 566496896 /nfs/dbraw/zinc/49/68/96/566496896.db2.gz LEGGASJLQRCVBT-UHFFFAOYSA-N 0 1 399.329 3.079 10 0 GGAEMN C[C@H](Cn1ncc2ccccc2c1=O)NCc1cscc1Br ZINC000511925949 566497022 /nfs/dbraw/zinc/49/70/22/566497022.db2.gz GXCXCSFBXXBATC-LLVKDONJSA-N 0 1 378.295 3.399 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3c[nH]c(=O)c(Br)c3)cccc21 ZINC000558688378 566498011 /nfs/dbraw/zinc/49/80/11/566498011.db2.gz FVVBWUHSLFZVKS-CQSZACIVSA-N 0 1 392.253 3.187 10 0 GGAEMN O=S(=O)(NCCN[C@@H]1CCCOc2cc(Cl)ccc21)c1ccccc1 ZINC000538206006 566498535 /nfs/dbraw/zinc/49/85/35/566498535.db2.gz AFNLNKRGUAWBCU-QGZVFWFLSA-N 0 1 380.897 3.122 10 0 GGAEMN COCCN1CCCN(C(=O)COc2c(Cl)cc(Cl)cc2Cl)CC1 ZINC000448794755 566498499 /nfs/dbraw/zinc/49/84/99/566498499.db2.gz OOHKOSVZHMHASI-UHFFFAOYSA-N 0 1 395.714 3.206 10 0 GGAEMN CCc1nc(CNC(=O)NC2(c3ccccc3Br)CCC2)n[nH]1 ZINC000651123443 566498643 /nfs/dbraw/zinc/49/86/43/566498643.db2.gz ZFYDFMAVIKXCAI-UHFFFAOYSA-N 0 1 378.274 3.008 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Cl)c(F)cc2Br)CC1 ZINC000448794278 566498792 /nfs/dbraw/zinc/49/87/92/566498792.db2.gz NJGVIFJFILZHBK-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN Cc1cccc2nc(CNCc3ncc(I)s3)[nH]c21 ZINC000511962099 566499686 /nfs/dbraw/zinc/49/96/86/566499686.db2.gz WQWUGSSNFLVDFF-UHFFFAOYSA-N 0 1 384.246 3.222 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)Nc2c(C(N)=O)[nH]nc2C(C)C)c1 ZINC000627700240 566500107 /nfs/dbraw/zinc/50/01/07/566500107.db2.gz ZBQSZPDZEKQFDY-UHFFFAOYSA-N 0 1 383.221 3.094 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)n[nH]1 ZINC000627716180 566501728 /nfs/dbraw/zinc/50/17/28/566501728.db2.gz NODMLUGJPLWSTP-NILFDRSVSA-N 0 1 389.297 3.067 10 0 GGAEMN COC(=O)[C@H]1CCCN([C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000464736671 566501807 /nfs/dbraw/zinc/50/18/07/566501807.db2.gz OPMATOYHILSJOD-UPJWGTAASA-N 0 1 387.307 3.444 10 0 GGAEMN O=C(NCc1ccc2cncn2c1)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000627714934 566501821 /nfs/dbraw/zinc/50/18/21/566501821.db2.gz IAVTXGWOTOUMQL-BPQIPLTHSA-N 0 1 382.261 3.299 10 0 GGAEMN CNC(=O)[C@H](C)CN(C)Cc1cc(Br)c(C)cc1Br ZINC000628189390 566538629 /nfs/dbraw/zinc/53/86/29/566538629.db2.gz ZNGUGQXWJANZNI-SNVBAGLBSA-N 0 1 392.135 3.334 10 0 GGAEMN CC1(C)SC[C@H]1Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1 ZINC000558764608 566505812 /nfs/dbraw/zinc/50/58/12/566505812.db2.gz SQYXWJUBYLSVTQ-CQSZACIVSA-N 0 1 385.461 3.467 10 0 GGAEMN N=c1[nH]oc2cc(CNC(=O)[C@H]3[C@@H]4c5cccc(Br)c5C[C@H]34)ccc12 ZINC000627803112 566507859 /nfs/dbraw/zinc/50/78/59/566507859.db2.gz VNHCWRODYFPBQY-IAOVAPTHSA-N 0 1 398.260 3.205 10 0 GGAEMN Fc1ccc2c(Br)cnc(NCCCCN3CCOCC3)c2c1 ZINC000651298368 566508722 /nfs/dbraw/zinc/50/87/22/566508722.db2.gz LOGFQUZVGXERIB-UHFFFAOYSA-N 0 1 382.277 3.083 10 0 GGAEMN C[C@@H]1CC(C)(C)C[C@@](CO)(NCc2ncc(I)s2)C1 ZINC000512052969 566509032 /nfs/dbraw/zinc/50/90/32/566509032.db2.gz NZEWENKLRAIBBM-YGRLFVJLSA-N 0 1 394.322 3.415 10 0 GGAEMN C[C@@H]1CC[C@@H](C)N(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000464933626 566510008 /nfs/dbraw/zinc/51/00/08/566510008.db2.gz HRVQIIJPPYSUSE-NXEZZACHSA-N 0 1 383.233 3.428 10 0 GGAEMN Cc1cc([C@@H](C)N[C@@H]2CCN(C3CCOCC3)C2=O)sc1Br ZINC000512059612 566510136 /nfs/dbraw/zinc/51/01/36/566510136.db2.gz SIRQPEWOQQVUEE-DGCLKSJQSA-N 0 1 387.343 3.250 10 0 GGAEMN Cc1cc([C@H](C)N[C@H]2CCN(C3CCOCC3)C2=O)sc1Br ZINC000512059611 566510557 /nfs/dbraw/zinc/51/05/57/566510557.db2.gz SIRQPEWOQQVUEE-AAEUAGOBSA-N 0 1 387.343 3.250 10 0 GGAEMN O[C@@H]1CCCC[C@H]1CCCNCc1ncc(I)s1 ZINC000512067512 566510622 /nfs/dbraw/zinc/51/06/22/566510622.db2.gz LQSNHJOFKSUGKJ-WDEREUQCSA-N 0 1 380.295 3.169 10 0 GGAEMN CC1(C)CN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)CCN1CCO ZINC000672867267 566511382 /nfs/dbraw/zinc/51/13/82/566511382.db2.gz LXVXJWFDROAKAY-HNNXBMFYSA-N 0 1 386.323 3.079 10 0 GGAEMN C[C@H](CN1CCN(C)CC1)NC(=O)c1ccc2scc(Br)c2c1 ZINC000448930827 566511655 /nfs/dbraw/zinc/51/16/55/566511655.db2.gz SWKWKMQFXLDRJQ-GFCCVEGCSA-N 0 1 396.354 3.030 10 0 GGAEMN C[C@H]1CC[C@H](C)N(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000464933627 566511820 /nfs/dbraw/zinc/51/18/20/566511820.db2.gz HRVQIIJPPYSUSE-UWVGGRQHSA-N 0 1 383.233 3.428 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc3ccn(C)c(=O)c3c2)c(Cl)cc1F ZINC000578331299 566512794 /nfs/dbraw/zinc/51/27/94/566512794.db2.gz NGWSFGSOYNMISS-UHFFFAOYSA-N 0 1 380.828 3.440 10 0 GGAEMN Cc1nc2c(cccc2C(=O)N(CCO)Cc2cc(Br)cs2)[nH]1 ZINC000558882231 566513137 /nfs/dbraw/zinc/51/31/37/566513137.db2.gz DLYIHKBRQHZSEV-UHFFFAOYSA-N 0 1 394.294 3.330 10 0 GGAEMN COc1ccccc1CN(CCO)Cc1cccc(I)c1 ZINC000578345325 566514711 /nfs/dbraw/zinc/51/47/11/566514711.db2.gz HQEXVILDGTXVAH-UHFFFAOYSA-N 0 1 397.256 3.294 10 0 GGAEMN CN(C(=O)c1cc(Cl)c(Br)cc1F)[C@H]1CN2CCC1CC2 ZINC000448954691 566515047 /nfs/dbraw/zinc/51/50/47/566515047.db2.gz KSHGMYCZOXEQAX-AWEZNQCLSA-N 0 1 375.669 3.408 10 0 GGAEMN CCn1c([C@@H]2CCCS2)nnc1N1CCN(CCc2cccs2)CC1 ZINC000424164023 566516008 /nfs/dbraw/zinc/51/60/08/566516008.db2.gz WFOALFIPADMNQL-INIZCTEOSA-N 0 1 377.583 3.292 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NC(=O)Nc2ccnc(C)c2Br)n[nH]1 ZINC000558955659 566516739 /nfs/dbraw/zinc/51/67/39/566516739.db2.gz BCZWALSFPCVWRS-SCZZXKLOSA-N 0 1 381.278 3.089 10 0 GGAEMN C[C@@H](NS(=O)(=O)c1cc(Br)cc2cccnc21)C(F)(F)F ZINC000424215726 566521625 /nfs/dbraw/zinc/52/16/25/566521625.db2.gz PGZDZJGKGLJRIZ-SSDOTTSWSA-N 0 1 383.189 3.226 10 0 GGAEMN Brc1cccc2c(CN3CCCN(c4cccnn4)CC3)ccnc12 ZINC000449022841 566521617 /nfs/dbraw/zinc/52/16/17/566521617.db2.gz KZUBCHZZYMOXJV-UHFFFAOYSA-N 0 1 398.308 3.500 10 0 GGAEMN CCN(C(=O)c1scc(Br)c1Br)[C@H]1CCN(C)C1 ZINC000628053663 566527949 /nfs/dbraw/zinc/52/79/49/566527949.db2.gz FEKSWFOFOKZJJB-QMMMGPOBSA-N 0 1 396.148 3.439 10 0 GGAEMN O[C@H](CNCc1cc(Cl)sc1Cl)COc1ccc2c(c1)OCO2 ZINC000449096201 566528173 /nfs/dbraw/zinc/52/81/73/566528173.db2.gz FOEMZJLUDNPRFI-SNVBAGLBSA-N 0 1 376.261 3.313 10 0 GGAEMN CCCN1CCN(c2nnc([C@H]3CCCS3)n2Cc2cccs2)CC1 ZINC000424361222 566528692 /nfs/dbraw/zinc/52/86/92/566528692.db2.gz UWGPTTZHGTYVDL-MRXNPFEDSA-N 0 1 377.583 3.488 10 0 GGAEMN C[C@@H](NCc1cccc(S(=O)(=O)N(C)C)c1)c1ccc2ncsc2c1 ZINC000485822447 566528737 /nfs/dbraw/zinc/52/87/37/566528737.db2.gz MZAGVZQMHCUCAK-CYBMUJFWSA-N 0 1 375.519 3.397 10 0 GGAEMN COc1ccc(CNCc2cccc(S(C)(=O)=O)c2)cc1Br ZINC000449110536 566529996 /nfs/dbraw/zinc/52/99/96/566529996.db2.gz DUCJSSUVPHFLJV-UHFFFAOYSA-N 0 1 384.295 3.151 10 0 GGAEMN Nc1ncc(Cl)cc1S(=O)(=O)Nc1cccc(OCC(F)(F)F)c1 ZINC000559150571 566530071 /nfs/dbraw/zinc/53/00/71/566530071.db2.gz ZPUHMYFHPOTMOX-UHFFFAOYSA-N 0 1 381.763 3.059 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651537126 566530829 /nfs/dbraw/zinc/53/08/29/566530829.db2.gz UMBYJCQUGMOHSL-HZMBPMFUSA-N 0 1 378.270 3.094 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651537129 566531206 /nfs/dbraw/zinc/53/12/06/566531206.db2.gz UMBYJCQUGMOHSL-YGRLFVJLSA-N 0 1 378.270 3.094 10 0 GGAEMN COc1ccc(Br)c(CN2CCC[C@H](C(=O)N3CCCC3)C2)c1 ZINC000538733348 566531986 /nfs/dbraw/zinc/53/19/86/566531986.db2.gz JEFXWLWKUWUTRW-AWEZNQCLSA-N 0 1 381.314 3.292 10 0 GGAEMN O=C(CCOc1cccc(Cl)c1Cl)N1CCC(N2CCOCC2)CC1 ZINC000628127043 566532551 /nfs/dbraw/zinc/53/25/51/566532551.db2.gz RITYSSBXUGWXDN-UHFFFAOYSA-N 0 1 387.307 3.086 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(OC(C)C)c(Cl)c2)cn1 ZINC000538756489 566533529 /nfs/dbraw/zinc/53/35/29/566533529.db2.gz FYEWEOWVIBEIHR-UHFFFAOYSA-N 0 1 384.841 3.110 10 0 GGAEMN C[C@@H]1CCC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)[C@@H]1C(=O)[O-] ZINC000424424752 566533600 /nfs/dbraw/zinc/53/36/00/566533600.db2.gz XBHLUXZKKQOSOW-WBMJQRKESA-N 0 1 378.270 3.320 10 0 GGAEMN O=C1[C@@H](N[C@H]2CCc3c2ccc(F)c3Br)CCN1CC(F)(F)F ZINC000449147302 566533929 /nfs/dbraw/zinc/53/39/29/566533929.db2.gz QEEILGQWUNJIHR-RYUDHWBXSA-N 0 1 395.194 3.328 10 0 GGAEMN C[C@H]1CCC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)[C@H]1C(=O)[O-] ZINC000424424749 566534280 /nfs/dbraw/zinc/53/42/80/566534280.db2.gz XBHLUXZKKQOSOW-BLLLJJGKSA-N 0 1 378.270 3.320 10 0 GGAEMN O[C@@H](COc1ccc(F)cc1Br)CN1CCc2ccccc2C1 ZINC000559282869 566539064 /nfs/dbraw/zinc/53/90/64/566539064.db2.gz CHHCLSIMKQURDK-MRXNPFEDSA-N 0 1 380.257 3.386 10 0 GGAEMN CCOC[C@H](C)NCc1cn(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OC ZINC000449260212 566542395 /nfs/dbraw/zinc/54/23/95/566542395.db2.gz VIKGISLJXSCNSN-NSHDSACASA-N 0 1 386.279 3.480 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@@H](C)[C@@H](C)OC ZINC000449268614 566542495 /nfs/dbraw/zinc/54/24/95/566542495.db2.gz HZEQYLNGFCQVFJ-WDEREUQCSA-N 0 1 386.279 3.479 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@@H](C)[C@H](C)OC ZINC000449268613 566543239 /nfs/dbraw/zinc/54/32/39/566543239.db2.gz HZEQYLNGFCQVFJ-QWRGUYRKSA-N 0 1 386.279 3.479 10 0 GGAEMN O=C(NCc1nc2ccc(Cl)cc2[nH]1)C(=O)c1ccc(Br)cc1 ZINC000603868700 566543533 /nfs/dbraw/zinc/54/35/33/566543533.db2.gz NOYCBPWSTWDBMA-UHFFFAOYSA-N 0 1 392.640 3.478 10 0 GGAEMN CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1cccc(Cl)c1 ZINC000673570200 566544020 /nfs/dbraw/zinc/54/40/20/566544020.db2.gz PGKMKECUFJVEHF-LJQANCHMSA-N 0 1 378.925 3.376 10 0 GGAEMN COc1ncc(C(=O)NC[C@H](c2ccc(F)cc2)N(C)C)cc1Br ZINC000424596377 566544114 /nfs/dbraw/zinc/54/41/14/566544114.db2.gz OOENLPJFEOCQAU-OAHLLOKOSA-N 0 1 396.260 3.025 10 0 GGAEMN CN(Cc1cccc(F)c1Br)C1CCN(c2cnccn2)CC1 ZINC000449289811 566544769 /nfs/dbraw/zinc/54/47/69/566544769.db2.gz BWCIICLOOVUPDE-UHFFFAOYSA-N 0 1 379.277 3.479 10 0 GGAEMN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ncsc2Br)C1 ZINC000512599156 566544797 /nfs/dbraw/zinc/54/47/97/566544797.db2.gz YSSDEGOVVYNGKG-DGCLKSJQSA-N 0 1 380.311 3.471 10 0 GGAEMN CN(Cc1ncc(Br)cc1F)C1CCN(CC(F)(F)F)CC1 ZINC000628303396 566544857 /nfs/dbraw/zinc/54/48/57/566544857.db2.gz SRFUDJXKKVVOMJ-UHFFFAOYSA-N 0 1 384.215 3.442 10 0 GGAEMN O=C(NCC/C=C/c1ccc(Br)cc1)[C@H]1CCCc2n[nH]nc21 ZINC000628336830 566549434 /nfs/dbraw/zinc/54/94/34/566549434.db2.gz PZYIMYDUGUFKHD-ZJHLSUJBSA-N 0 1 375.270 3.207 10 0 GGAEMN CSCC[C@H](N[C@H]1CCc2c1ccc(F)c2Br)C(=O)N(C)C ZINC000449329312 566550071 /nfs/dbraw/zinc/55/00/71/566550071.db2.gz NHTYIFMWQNDAAM-KBPBESRZSA-N 0 1 389.334 3.375 10 0 GGAEMN CCc1nc(C)c(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)o1 ZINC000559449633 566550313 /nfs/dbraw/zinc/55/03/13/566550313.db2.gz JJWOYBRVWMTGEQ-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN CCc1nc(C)c(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)o1 ZINC000559449633 566550321 /nfs/dbraw/zinc/55/03/21/566550321.db2.gz JJWOYBRVWMTGEQ-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN COc1cc(Br)c(CNC[C@@H]2Cc3ccccc3CO2)cc1O ZINC000628382988 566551574 /nfs/dbraw/zinc/55/15/74/566551574.db2.gz PYUXAVKRCPXKEZ-HNNXBMFYSA-N 0 1 378.266 3.394 10 0 GGAEMN CNS(=O)(=O)Cc1ccc(CN[C@@H]2CCc3ccc(F)c(Cl)c32)cc1 ZINC000651685214 566551814 /nfs/dbraw/zinc/55/18/14/566551814.db2.gz NWDIEOYUSZNEFD-MRXNPFEDSA-N 0 1 382.888 3.305 10 0 GGAEMN Cc1ccc(CNC[C@@H]2CS(=O)(=O)c3ccccc32)c(Br)c1 ZINC000449359825 566551933 /nfs/dbraw/zinc/55/19/33/566551933.db2.gz RMOYARGCNZQJAB-CQSZACIVSA-N 0 1 380.307 3.418 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2cc(Br)ccc2F)c2ccccc21 ZINC000449362878 566552849 /nfs/dbraw/zinc/55/28/49/566552849.db2.gz NXZMDZNWNRIAJT-GFCCVEGCSA-N 0 1 384.270 3.249 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2ccc(F)cc2Br)c2ccccc21 ZINC000449356012 566552894 /nfs/dbraw/zinc/55/28/94/566552894.db2.gz FHJOXYOXQBSTCY-LBPRGKRZSA-N 0 1 384.270 3.249 10 0 GGAEMN CN(Cc1cnc(-c2ccc(Br)cc2)s1)[C@@]1(CO)CCOC1 ZINC000628367275 566552996 /nfs/dbraw/zinc/55/29/96/566552996.db2.gz RVALCVJOFGUBFB-MRXNPFEDSA-N 0 1 383.311 3.156 10 0 GGAEMN Cc1cccn2cc(CCNC(=O)c3n[nH]c4ccc(Br)cc43)nc12 ZINC000673747169 566554663 /nfs/dbraw/zinc/55/46/63/566554663.db2.gz PHMNSQJJRZTDQT-UHFFFAOYSA-N 0 1 398.264 3.254 10 0 GGAEMN C[C@H]1CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@H]1C ZINC000465986703 566555271 /nfs/dbraw/zinc/55/52/71/566555271.db2.gz WYNQFCUOHGCANC-PHIMTYICSA-N 0 1 378.274 3.032 10 0 GGAEMN C[C@H]1CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@H]1C ZINC000465986703 566555276 /nfs/dbraw/zinc/55/52/76/566555276.db2.gz WYNQFCUOHGCANC-PHIMTYICSA-N 0 1 378.274 3.032 10 0 GGAEMN CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc2cncn2c1 ZINC000559538774 566555345 /nfs/dbraw/zinc/55/53/45/566555345.db2.gz AUYLNZOQUGHLLX-UHFFFAOYSA-N 0 1 377.231 3.352 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)[C@H]1CCOc2ccc(Br)cc21 ZINC000651725743 566556206 /nfs/dbraw/zinc/55/62/06/566556206.db2.gz NOXSVWQXFFTSFU-NSHDSACASA-N 0 1 377.242 3.340 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)[C@H]1CCOc2ccc(Br)cc21 ZINC000651725743 566556212 /nfs/dbraw/zinc/55/62/12/566556212.db2.gz NOXSVWQXFFTSFU-NSHDSACASA-N 0 1 377.242 3.340 10 0 GGAEMN CC(C)(C)c1nc(CNS(=O)(=O)Cc2cc(Cl)sc2Cl)n[nH]1 ZINC000651737643 566557948 /nfs/dbraw/zinc/55/79/48/566557948.db2.gz LUVAAEUSRLZBIG-UHFFFAOYSA-N 0 1 383.326 3.090 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1CC[C@@H](CO)[C@@H]1CC ZINC000449425257 566560257 /nfs/dbraw/zinc/56/02/57/566560257.db2.gz PVQKAFRQQSVRJI-YOEHRIQHSA-N 0 1 386.330 3.457 10 0 GGAEMN OC1(CN2CCN(c3ccc(C(F)(F)F)cc3Cl)CC2)CCOCC1 ZINC000512828454 566560249 /nfs/dbraw/zinc/56/02/49/566560249.db2.gz PJBPHEZQMMVQSB-UHFFFAOYSA-N 0 1 378.822 3.022 10 0 GGAEMN O=C(NCc1ccc(F)cc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000673859082 566561917 /nfs/dbraw/zinc/56/19/17/566561917.db2.gz IRTFQUOPONGWLE-UHFFFAOYSA-N 0 1 390.216 3.491 10 0 GGAEMN O=C(NCc1cc(F)ccc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000673861257 566562508 /nfs/dbraw/zinc/56/25/08/566562508.db2.gz QNBDIVNPKZUFPW-UHFFFAOYSA-N 0 1 390.216 3.491 10 0 GGAEMN C[S@](=O)c1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000512869064 566563934 /nfs/dbraw/zinc/56/39/34/566563934.db2.gz MTRPOQJRROSOHO-VGSWGCGISA-N 0 1 382.323 3.184 10 0 GGAEMN COc1ncc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1Br ZINC000424747415 566566695 /nfs/dbraw/zinc/56/66/95/566566695.db2.gz GDIVJOZRFMYUJX-HZPDHXFCSA-N 0 1 390.281 3.028 10 0 GGAEMN COc1cc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc2c1OCO2 ZINC000512909380 566568172 /nfs/dbraw/zinc/56/81/72/566568172.db2.gz XRTDIECCBYZUJF-SFHVURJKSA-N 0 1 394.265 3.184 10 0 GGAEMN COc1nc(C)c(Br)cc1C(=O)Nc1cccc(-c2nnc[nH]2)c1 ZINC000486210044 566568388 /nfs/dbraw/zinc/56/83/88/566568388.db2.gz NFGQGMJLGUDDPT-UHFFFAOYSA-N 0 1 388.225 3.199 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1ccccc1OCc1ccc(Br)cc1 ZINC000673948218 566568704 /nfs/dbraw/zinc/56/87/04/566568704.db2.gz ZKQLJILOOPGUIF-UHFFFAOYSA-N 0 1 387.237 3.076 10 0 GGAEMN COc1ccc(C[C@H](C)NCc2nn(C)cc2Br)c(C)c1OC ZINC000449484507 566568887 /nfs/dbraw/zinc/56/88/87/566568887.db2.gz MPJVBINQXSQMRF-NSHDSACASA-N 0 1 382.302 3.229 10 0 GGAEMN COc1ccc([C@@H](C)[C@H](C)NCc2nn(C)cc2Br)cc1OC ZINC000449484758 566568984 /nfs/dbraw/zinc/56/89/84/566568984.db2.gz NMMSIOMIHVUYPS-RYUDHWBXSA-N 0 1 382.302 3.482 10 0 GGAEMN COc1ccc(C[C@@H](C)NCc2nn(C)cc2Br)c(C)c1OC ZINC000449484506 566569909 /nfs/dbraw/zinc/56/99/09/566569909.db2.gz MPJVBINQXSQMRF-LLVKDONJSA-N 0 1 382.302 3.229 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(Cl)cc1Br ZINC000512967854 566571449 /nfs/dbraw/zinc/57/14/49/566571449.db2.gz UUERPEVWRPHFOC-CYBMUJFWSA-N 0 1 395.750 3.006 10 0 GGAEMN COc1ccc(CNC[C@]2(CO)CCc3ccccc32)c(Br)c1O ZINC000651884666 566572454 /nfs/dbraw/zinc/57/24/54/566572454.db2.gz NNNKWMOTLAEHHB-IBGZPJMESA-N 0 1 392.293 3.129 10 0 GGAEMN CS(=O)(=O)N1CCC[C@H](CNC2(c3c(Cl)cccc3Cl)CC2)C1 ZINC000539333566 566573707 /nfs/dbraw/zinc/57/37/07/566573707.db2.gz GZHCMJDSEHNRFT-GFCCVEGCSA-N 0 1 377.337 3.244 10 0 GGAEMN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)CCc1cnc[nH]1 ZINC000628675314 566574763 /nfs/dbraw/zinc/57/47/63/566574763.db2.gz BJIRZQYCWZUYSM-HNNXBMFYSA-N 0 1 378.270 3.477 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(Br)cc1Cl ZINC000513022651 566574804 /nfs/dbraw/zinc/57/48/04/566574804.db2.gz WSJZSBLDHZEEQL-ZDUSSCGKSA-N 0 1 395.750 3.006 10 0 GGAEMN CCCCOc1ncccc1CN[C@H](C)Cn1cc(Br)ccc1=O ZINC000559896032 566575369 /nfs/dbraw/zinc/57/53/69/566575369.db2.gz WDCXQBLHGCMBRF-CQSZACIVSA-N 0 1 394.313 3.363 10 0 GGAEMN COCCc1ccccc1NS(=O)(=O)c1ccc(C(=O)OC)c(Cl)c1 ZINC000466414998 566575665 /nfs/dbraw/zinc/57/56/65/566575665.db2.gz CCMHFPILQOLQAB-UHFFFAOYSA-N 0 1 383.853 3.116 10 0 GGAEMN CN(CCN1CCCCC1)S(=O)(=O)c1c(Cl)cccc1Br ZINC000651926414 566577885 /nfs/dbraw/zinc/57/78/85/566577885.db2.gz UHXUIASLHUEXEC-UHFFFAOYSA-N 0 1 395.750 3.209 10 0 GGAEMN COC[C@H]1C[C@@H](O)CN1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000651950091 566579784 /nfs/dbraw/zinc/57/97/84/566579784.db2.gz FHBALGRYEDRUEN-ZIAGYGMSSA-N 0 1 383.311 3.154 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOc2cccc(F)c2C1 ZINC000513120005 566580923 /nfs/dbraw/zinc/58/09/23/566580923.db2.gz HSVXHJXUXRVSLT-UHFFFAOYSA-N 0 1 390.212 3.499 10 0 GGAEMN Cc1cc(CN2CCN(c3ccc(Br)cn3)CC2)cc(C)c1O ZINC000513117778 566581106 /nfs/dbraw/zinc/58/11/06/566581106.db2.gz FZNMCSPXNPJAGC-UHFFFAOYSA-N 0 1 376.298 3.489 10 0 GGAEMN COC(=O)C[C@](C)(NCc1ccnc(OC)c1)c1ccc(Br)cc1 ZINC000513147547 566583009 /nfs/dbraw/zinc/58/30/09/566583009.db2.gz BNMWXXQWGRUISP-SFHVURJKSA-N 0 1 393.281 3.421 10 0 GGAEMN Cn1cc(I)c(CN[C@@H]2CC[C@H](c3ccccc3)C2)n1 ZINC000449604877 566584143 /nfs/dbraw/zinc/58/41/43/566584143.db2.gz LTDCFDQHUOXTHW-UONOGXRCSA-N 0 1 381.261 3.451 10 0 GGAEMN COc1c(Br)ccc(C)c1C(=O)NCc1n[nH]c(C(C)(C)C)n1 ZINC000424889835 566584292 /nfs/dbraw/zinc/58/42/92/566584292.db2.gz IHALZGZXBIOEJQ-UHFFFAOYSA-N 0 1 381.274 3.112 10 0 GGAEMN COc1ccc(Br)c(CN[C@@H]2CCCc3c2ccc(=O)n3C)c1 ZINC000652048001 566585829 /nfs/dbraw/zinc/58/58/29/566585829.db2.gz CPKVEEZTFWOUOJ-MRXNPFEDSA-N 0 1 377.282 3.324 10 0 GGAEMN Cn1c(=O)ccc2c1CCC[C@H]2NCc1cc2c(cc1Br)OCO2 ZINC000652044377 566586465 /nfs/dbraw/zinc/58/64/65/566586465.db2.gz LIQKMUFPWRPEFM-CQSZACIVSA-N 0 1 391.265 3.044 10 0 GGAEMN O[C@H]([C@@H]1CCN(CC2=Cc3cc(Br)ccc3OC2)C1)C(F)(F)F ZINC000449669326 566587807 /nfs/dbraw/zinc/58/78/07/566587807.db2.gz HRTPGEFLDDGTEC-IAQYHMDHSA-N 0 1 392.215 3.470 10 0 GGAEMN Cc1nc(CC(=O)N[C@@H]2CCCSc3ccc(Br)cc32)n[nH]1 ZINC000628828464 566589408 /nfs/dbraw/zinc/58/94/08/566589408.db2.gz ANBXUQVUOJOHGV-GFCCVEGCSA-N 0 1 381.299 3.162 10 0 GGAEMN CC1CCN(CCNS(=O)(=O)c2cccc(Br)c2Cl)CC1 ZINC000560042825 566590346 /nfs/dbraw/zinc/59/03/46/566590346.db2.gz WJMWMTWKWFOSLU-UHFFFAOYSA-N 0 1 395.750 3.113 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1cccc(Br)c1Cl ZINC000560042033 566590854 /nfs/dbraw/zinc/59/08/54/566590854.db2.gz YPCANAIOORGOKT-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c(C)c1Br ZINC000628904415 566595765 /nfs/dbraw/zinc/59/57/65/566595765.db2.gz NFRXTINQBXIQIB-UHFFFAOYSA-N 0 1 395.341 3.393 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2cccc(Cl)c2F)C1 ZINC000466738335 566595969 /nfs/dbraw/zinc/59/59/69/566595969.db2.gz URAXGPHMPROEHR-OAHLLOKOSA-N 0 1 388.936 3.185 10 0 GGAEMN Cn1ncc(Br)c1C(=O)Nc1nc2c(s1)CN(C(C)(C)C)CC2 ZINC000425035022 566599418 /nfs/dbraw/zinc/59/94/18/566599418.db2.gz HDHFZDQERXZYLE-UHFFFAOYSA-N 0 1 398.330 3.048 10 0 GGAEMN O[C@@]1(CCN[C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CCOC1 ZINC000652262082 566599829 /nfs/dbraw/zinc/59/98/29/566599829.db2.gz PBXHKSVGRLQQPX-SJORKVTESA-N 0 1 384.245 3.402 10 0 GGAEMN C[C@H](Cc1cnn(C)c1)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968043 566600587 /nfs/dbraw/zinc/60/05/87/566600587.db2.gz AHGUSGUOTDNNDD-PXAZEXFGSA-N 0 1 383.323 3.325 10 0 GGAEMN CN(C)C[C@H](NC(=O)Cn1cc(Cl)cn1)c1ccc(Cl)c(Cl)c1 ZINC000628968398 566600659 /nfs/dbraw/zinc/60/06/59/566600659.db2.gz FGEHDRQFCBOEOE-AWEZNQCLSA-N 0 1 375.687 3.262 10 0 GGAEMN Cc1noc(CCCC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)n1 ZINC000628968726 566600777 /nfs/dbraw/zinc/60/07/77/566600777.db2.gz MVQQJWKTTGOGAE-OAHLLOKOSA-N 0 1 385.295 3.427 10 0 GGAEMN CN(C)C[C@H](NC(=O)COc1ccccc1O)c1ccc(Cl)c(Cl)c1 ZINC000628968088 566600814 /nfs/dbraw/zinc/60/08/14/566600814.db2.gz DDCVCQAWDIPZEB-HNNXBMFYSA-N 0 1 383.275 3.497 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@@H](O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000628968705 566600845 /nfs/dbraw/zinc/60/08/45/566600845.db2.gz JGCCXTGMJQBWHF-ROUUACIJSA-N 0 1 381.303 3.316 10 0 GGAEMN COc1cc(CC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)ccn1 ZINC000628969532 566601101 /nfs/dbraw/zinc/60/11/01/566601101.db2.gz UKNWAKHTGPVTSK-INIZCTEOSA-N 0 1 382.291 3.359 10 0 GGAEMN CN(C)C[C@H](NC(=O)CSc1nncs1)c1ccc(Cl)c(Cl)c1 ZINC000628968701 566601113 /nfs/dbraw/zinc/60/11/13/566601113.db2.gz MQNIIOGRLWDHGS-LBPRGKRZSA-N 0 1 391.349 3.356 10 0 GGAEMN CN(C)C[C@@H](NC(=O)COc1ccc(O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000628968989 566601186 /nfs/dbraw/zinc/60/11/86/566601186.db2.gz ZQEUZMYKLDCQHG-QGZVFWFLSA-N 0 1 383.275 3.497 10 0 GGAEMN C[C@H]1CN(CCO)CCN1Cc1csc(-c2cccc(Br)c2)n1 ZINC000449785886 566601293 /nfs/dbraw/zinc/60/12/93/566601293.db2.gz JRINYMFDFNIXLX-ZDUSSCGKSA-N 0 1 396.354 3.071 10 0 GGAEMN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)N[C@@H]1CCCN(C)C1 ZINC000674700301 566604261 /nfs/dbraw/zinc/60/42/61/566604261.db2.gz OQRRDUOQIIQQAB-GFCCVEGCSA-N 0 1 387.311 3.058 10 0 GGAEMN O=C(CCSc1ccccc1Br)NC1(c2nn[nH]n2)CCCC1 ZINC000605381675 566604351 /nfs/dbraw/zinc/60/43/51/566604351.db2.gz MBDZHPBGLJPXHC-UHFFFAOYSA-N 0 1 396.314 3.030 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@@H](CCF)C1 ZINC000629022432 566605730 /nfs/dbraw/zinc/60/57/30/566605730.db2.gz KQSNKBOXTCUTAT-ZDUSSCGKSA-N 0 1 382.233 3.040 10 0 GGAEMN Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)NCc2c[nH]nn2)c1C ZINC000674757850 566606645 /nfs/dbraw/zinc/60/66/45/566606645.db2.gz UBEJDMBRIYFIIN-UHFFFAOYSA-N 0 1 380.239 3.236 10 0 GGAEMN O=C(NCc1c[nH]nn1)[C@@H](Oc1cccc(Br)c1)c1ccccc1 ZINC000674754727 566607030 /nfs/dbraw/zinc/60/70/30/566607030.db2.gz DJXKPLKOVZEGRR-INIZCTEOSA-N 0 1 387.237 3.004 10 0 GGAEMN O=C(N[C@@H]1CSc2ccc(Br)cc21)N[C@H]1CCc2nc[nH]c2C1 ZINC000579419094 566607371 /nfs/dbraw/zinc/60/73/71/566607371.db2.gz CBFHUPUICSIOMK-IINYFYTJSA-N 0 1 393.310 3.176 10 0 GGAEMN COc1ccccc1S(=O)(=O)[N-]c1ccc(C[NH+](C)C)c(Br)c1 ZINC000466962147 566610058 /nfs/dbraw/zinc/61/00/58/566610058.db2.gz SQCGKSRXARLXCQ-UHFFFAOYSA-N 0 1 399.310 3.320 10 0 GGAEMN C[NH+](C)Cc1ccc([N-]S(=O)(=O)c2cccs2)cc1Br ZINC000466962079 566610683 /nfs/dbraw/zinc/61/06/83/566610683.db2.gz AYORNBHYKFTUAD-UHFFFAOYSA-N 0 1 375.313 3.373 10 0 GGAEMN CCc1cc(CCC[N@H+]2Cc3cccc(Br)c3C[C@@H]2C(=O)[O-])on1 ZINC000652489852 566614452 /nfs/dbraw/zinc/61/44/52/566614452.db2.gz MRHYZBMSTAJBCK-QGZVFWFLSA-N 0 1 393.281 3.444 10 0 GGAEMN NS(=O)(=O)C[C@H]1CCCN1Cc1cccc(Oc2ccc(Cl)cc2)c1 ZINC000674908991 566617960 /nfs/dbraw/zinc/61/79/60/566617960.db2.gz VONBKAFUYLAGIE-MRXNPFEDSA-N 0 1 380.897 3.385 10 0 GGAEMN C[C@@H](NC(=O)c1ccc(Nc2ccncc2)cc1)c1ncc(Br)cn1 ZINC000486747123 566619277 /nfs/dbraw/zinc/61/92/77/566619277.db2.gz LAWUIPVCGAVYJQ-GFCCVEGCSA-N 0 1 398.264 3.291 10 0 GGAEMN COc1cc2nccc(N3CCN(C(C)=O)C[C@@H]3C)c2cc1Br ZINC000425235864 566621485 /nfs/dbraw/zinc/62/14/85/566621485.db2.gz JEUNOKFXRVRFBL-NSHDSACASA-N 0 1 378.270 3.063 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CNc2cc(Cl)c(Cl)cc2F)C1 ZINC000486779190 566622897 /nfs/dbraw/zinc/62/28/97/566622897.db2.gz YNYDVWGQYLKDMQ-LBPRGKRZSA-N 0 1 392.302 3.017 10 0 GGAEMN COc1cc2nccc(N3CCO[C@@]4(CCCOC4)C3)c2cc1Br ZINC000425248670 566623357 /nfs/dbraw/zinc/62/33/57/566623357.db2.gz AVWJSFYTPKDKDO-SFHVURJKSA-N 0 1 393.281 3.392 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@H]2CCc3ccccc3C2)sc1Br ZINC000540039313 566623898 /nfs/dbraw/zinc/62/38/98/566623898.db2.gz MXMQHUNWDBXFEI-LBPRGKRZSA-N 0 1 387.324 3.050 10 0 GGAEMN CO[C@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CC[C@@H]1C ZINC000467078383 566623884 /nfs/dbraw/zinc/62/38/84/566623884.db2.gz HACLZOJRXCFLAG-ZBEGNZNMSA-N 0 1 378.270 3.336 10 0 GGAEMN O=C(CN1CCCN(CCc2cc(Cl)ccc2Cl)CC1)N1CCCC1 ZINC000486801491 566624133 /nfs/dbraw/zinc/62/41/33/566624133.db2.gz ULRJPEGPNVQILK-UHFFFAOYSA-N 0 1 384.351 3.166 10 0 GGAEMN CCN(CC)C(=O)CN1CCCN(CCc2cc(Cl)ccc2Cl)CC1 ZINC000486798151 566624320 /nfs/dbraw/zinc/62/43/20/566624320.db2.gz KGKBSERZZHOUGA-UHFFFAOYSA-N 0 1 386.367 3.412 10 0 GGAEMN C[C@H]1CN(C(=O)N=c2nc(-c3ccsc3)[n-]s2)CC[N@H+](C2CCC2)C1 ZINC000560424299 566624968 /nfs/dbraw/zinc/62/49/68/566624968.db2.gz HPRCGMHCEFXVSZ-GFCCVEGCSA-N 0 1 377.539 3.027 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000579657984 566626744 /nfs/dbraw/zinc/62/67/44/566626744.db2.gz RPUKVLHPCBLJIP-PWSUYJOCSA-N 0 1 393.285 3.099 10 0 GGAEMN Cc1cnn(C)c1S(=O)(=O)Nc1ccc(C(F)(F)F)c(Br)c1 ZINC000560451438 566626934 /nfs/dbraw/zinc/62/69/34/566626934.db2.gz XRBANXVAPXAFOS-UHFFFAOYSA-N 0 1 398.204 3.311 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2csc(-c3ccc(Br)s3)n2)C1 ZINC000606366685 566626973 /nfs/dbraw/zinc/62/69/73/566626973.db2.gz LZYVATDZSHEBRN-VIFPVBQESA-N 0 1 386.340 3.458 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cc(COc3c(Cl)cccc3Cl)on2)C1 ZINC000675155138 566626944 /nfs/dbraw/zinc/62/69/44/566626944.db2.gz ZVDKIFMBHOGXQR-NSHDSACASA-N 0 1 384.263 3.384 10 0 GGAEMN COC(=O)c1cc(C)ccc1S(=O)(=O)Nc1ccc(CCSC)cc1 ZINC000513817646 566627218 /nfs/dbraw/zinc/62/72/18/566627218.db2.gz MABQDPLRFMAQHO-UHFFFAOYSA-N 0 1 379.503 3.488 10 0 GGAEMN CCOC(=O)COCCN(Cc1cc(Br)ccc1F)C(C)C ZINC000579649865 566627518 /nfs/dbraw/zinc/62/75/18/566627518.db2.gz LXBDMQRPAFRYKV-UHFFFAOYSA-N 0 1 376.266 3.378 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000579657981 566627654 /nfs/dbraw/zinc/62/76/54/566627654.db2.gz RPUKVLHPCBLJIP-CMPLNLGQSA-N 0 1 393.285 3.099 10 0 GGAEMN CO[C@H]1COCC[C@@H]1CC(=O)Nc1cc(Cl)cc(Br)c1O ZINC000450047063 566628500 /nfs/dbraw/zinc/62/85/00/566628500.db2.gz UIGILHJMPHSZQU-PELKAZGASA-N 0 1 378.650 3.188 10 0 GGAEMN O=C(c1cc(=O)[nH]c2ccc(Br)cc21)N1CCN(C2CCC2)CC1 ZINC000606372096 566628765 /nfs/dbraw/zinc/62/87/65/566628765.db2.gz XJDOTLKFGGVNAX-UHFFFAOYSA-N 0 1 390.281 3.013 10 0 GGAEMN O=C(CCc1cccc(F)c1Br)N1CCC(c2n[nH]c(=O)o2)CC1 ZINC000425325219 566630587 /nfs/dbraw/zinc/63/05/87/566630587.db2.gz RJBAPNZEABWSKV-UHFFFAOYSA-N 0 1 398.232 3.016 10 0 GGAEMN O=C(c1cc2c(cccc2Br)[nH]1)N1CCC(c2n[nH]c(=O)o2)CC1 ZINC000425324174 566631532 /nfs/dbraw/zinc/63/15/32/566631532.db2.gz QHBCLBCKCPKYHK-UHFFFAOYSA-N 0 1 391.225 3.039 10 0 GGAEMN CN(CCNC(=O)Cc1sccc1Br)Cc1ccc(F)cc1 ZINC000450098474 566633201 /nfs/dbraw/zinc/63/32/01/566633201.db2.gz VVSVXDFOARAPKG-UHFFFAOYSA-N 0 1 385.302 3.440 10 0 GGAEMN C[C@@H](CNC(=O)[C@H]1CCCc2[nH]ncc21)Oc1ccc(Br)cc1 ZINC000467202957 566633618 /nfs/dbraw/zinc/63/36/18/566633618.db2.gz UCSYFXXBUNADNL-FZMZJTMJSA-N 0 1 378.270 3.176 10 0 GGAEMN Cc1nc2ccc(Cn3nnc(Cc4ccccc4Br)n3)cc2[nH]1 ZINC000467206560 566633897 /nfs/dbraw/zinc/63/38/97/566633897.db2.gz LHVGEVVPLRYMTN-UHFFFAOYSA-N 0 1 383.253 3.259 10 0 GGAEMN Cc1nc2ccc(Cn3ncc(Br)c(Br)c3=O)cc2[nH]1 ZINC000467209255 566633936 /nfs/dbraw/zinc/63/39/36/566633936.db2.gz ZDGJHYILJUXYLR-UHFFFAOYSA-N 0 1 398.058 3.001 10 0 GGAEMN C[C@H](CNC(=O)[C@@H]1CCCc2[nH]ncc21)Oc1cccc(Br)c1 ZINC000467205087 566633990 /nfs/dbraw/zinc/63/39/90/566633990.db2.gz FCEBFYUMAWWMIW-BXUZGUMPSA-N 0 1 378.270 3.176 10 0 GGAEMN C[C@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C2(CCC2)CO1 ZINC000652881061 566636474 /nfs/dbraw/zinc/63/64/74/566636474.db2.gz OJGYJYUWMMQQHU-NSHDSACASA-N 0 1 391.265 3.074 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)c2ccccc2N)c2cccs2)CC1 ZINC000467256970 566636611 /nfs/dbraw/zinc/63/66/11/566636611.db2.gz YXENRRXHGAUDDF-MRXNPFEDSA-N 0 1 379.551 3.082 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCC(=O)Nc1cccc(Br)c1 ZINC000467283585 566638395 /nfs/dbraw/zinc/63/83/95/566638395.db2.gz KESGOSIDXYSDAV-MJEQTWJJSA-N 0 1 395.297 3.051 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCC(=O)Nc1cccc(Br)c1 ZINC000467283586 566638410 /nfs/dbraw/zinc/63/84/10/566638410.db2.gz KESGOSIDXYSDAV-NUTKFTJISA-N 0 1 395.297 3.051 10 0 GGAEMN Cc1cnc(N)c(S(=O)(=O)Nc2ccc(OCC(F)(F)F)c(C)c2)c1 ZINC000540217143 566638388 /nfs/dbraw/zinc/63/83/88/566638388.db2.gz KIHYUEGJEWRRHB-UHFFFAOYSA-N 0 1 375.372 3.023 10 0 GGAEMN Cc1c([C@H](C)N[C@@H](C)C2(S(C)(=O)=O)CC2)cnn1-c1cccc(Cl)c1 ZINC000560582198 566640440 /nfs/dbraw/zinc/64/04/40/566640440.db2.gz YGLIQONBXYQRRZ-JSGCOSHPSA-N 0 1 381.929 3.450 10 0 GGAEMN Cc1nc(S(=O)(=O)NC[C@@H]2CC23CCSCC3)sc1Br ZINC000579822262 566641184 /nfs/dbraw/zinc/64/11/84/566641184.db2.gz HYGRMCQDXQGVNN-VIFPVBQESA-N 0 1 397.385 3.026 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@H](c2nc(C)n[nH]2)C1 ZINC000514092477 566641805 /nfs/dbraw/zinc/64/18/05/566641805.db2.gz AHRYPXYBOKEUCH-LBPRGKRZSA-N 0 1 393.285 3.042 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@H](c2nnc(C)[nH]2)C1 ZINC000514092477 566641810 /nfs/dbraw/zinc/64/18/10/566641810.db2.gz AHRYPXYBOKEUCH-LBPRGKRZSA-N 0 1 393.285 3.042 10 0 GGAEMN C[C@@H]1[C@H](Cc2ccccc2)CCN1Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000425426631 566642303 /nfs/dbraw/zinc/64/23/03/566642303.db2.gz SNAAELAMGHLVOB-WBVHZDCISA-N 0 1 378.563 3.452 10 0 GGAEMN CC[C@@H](Cc1cccc(Br)c1)C(=O)NC1(c2nn[nH]n2)CCCC1 ZINC000467323713 566642438 /nfs/dbraw/zinc/64/24/38/566642438.db2.gz SXNSVMYMTQIRJC-ZDUSSCGKSA-N 0 1 392.301 3.117 10 0 GGAEMN COc1cc(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)cnc1OC ZINC000629316042 566642681 /nfs/dbraw/zinc/64/26/81/566642681.db2.gz SBTDLFQYYYVZKC-UHFFFAOYSA-N 0 1 376.356 3.004 10 0 GGAEMN COc1ncc(S(=O)(=O)Nc2cccc(C3CCOCC3)c2)cc1Cl ZINC000629325523 566643884 /nfs/dbraw/zinc/64/38/84/566643884.db2.gz KGKAGPQQDVJGSB-UHFFFAOYSA-N 0 1 382.869 3.438 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC[C@@]2(CC2(F)F)C1 ZINC000653003762 566644168 /nfs/dbraw/zinc/64/41/68/566644168.db2.gz DHGLESHTOCCYLU-OAHLLOKOSA-N 0 1 383.192 3.162 10 0 GGAEMN CCc1ccncc1NS(=O)(=O)c1c(OC)cccc1OC(F)(F)F ZINC000629352147 566649738 /nfs/dbraw/zinc/64/97/38/566649738.db2.gz PKBYWJOEWITHBB-UHFFFAOYSA-N 0 1 376.356 3.352 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccc(C(F)(F)F)cn1)c1ccc(F)cc1 ZINC000629350462 566649812 /nfs/dbraw/zinc/64/98/12/566649812.db2.gz PSCDBBUMOJLOBI-CYBMUJFWSA-N 0 1 378.347 3.369 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCCCCN1CCOCC1 ZINC000450256253 566651449 /nfs/dbraw/zinc/65/14/49/566651449.db2.gz PIGMYPBMKIRHKT-UHFFFAOYSA-N 0 1 382.224 3.387 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)[C@@H]2CCC[C@@H]21 ZINC000629373931 566652191 /nfs/dbraw/zinc/65/21/91/566652191.db2.gz QFMCHYWFMDKALG-DSJMHWKBSA-N 0 1 388.291 3.308 10 0 GGAEMN Cn1cc([C@H](NCC(=O)Nc2ccccc2Br)C(C)(C)C)cn1 ZINC000540478988 566653240 /nfs/dbraw/zinc/65/32/40/566653240.db2.gz QTAVCCLNBLXVLZ-INIZCTEOSA-N 0 1 379.302 3.498 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)[C@H]2CCC[C@@H]21 ZINC000629372742 566653271 /nfs/dbraw/zinc/65/32/71/566653271.db2.gz GSINYRHNFMCHGX-NHIYQJMISA-N 0 1 388.291 3.308 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(c(Br)c2)OCO3)[C@@H]2CCC[C@H]21 ZINC000629372005 566653367 /nfs/dbraw/zinc/65/33/67/566653367.db2.gz AQSBGOSIEFTBSE-OUCADQQQSA-N 0 1 382.254 3.253 10 0 GGAEMN COc1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)c(F)c1 ZINC000467571750 566653617 /nfs/dbraw/zinc/65/36/17/566653617.db2.gz YTWBPKSODBDNOD-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN CCN1CCN(CC(=O)Nc2cc(C)ccc2SCC(F)(F)F)CC1 ZINC000467556903 566653826 /nfs/dbraw/zinc/65/38/26/566653826.db2.gz ZPCPDMDGSJMFRO-UHFFFAOYSA-N 0 1 375.460 3.225 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(C)c(Br)c2)CC1 ZINC000629416051 566654111 /nfs/dbraw/zinc/65/41/11/566654111.db2.gz BEAGRHZUCSZZJN-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCOC(=O)c1csc(N[C@H]2CCN(c3cc(Cl)ccc3OC)C2)n1 ZINC000450299511 566654357 /nfs/dbraw/zinc/65/43/57/566654357.db2.gz BBYQQMFJIURXIE-LBPRGKRZSA-N 0 1 381.885 3.095 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccsc2Br)CC1 ZINC000629415609 566654522 /nfs/dbraw/zinc/65/45/22/566654522.db2.gz YYGYTPGBRYRVGR-UHFFFAOYSA-N 0 1 387.343 3.228 10 0 GGAEMN Cc1cccc(NC(=O)c2cccc(N3CCN(C)CC3)n2)c1Br ZINC000487194277 566654943 /nfs/dbraw/zinc/65/49/43/566654943.db2.gz WZYOQQUTDUZALV-UHFFFAOYSA-N 0 1 389.297 3.157 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cccc(C)c2Br)CC1 ZINC000629417689 566655152 /nfs/dbraw/zinc/65/51/52/566655152.db2.gz JJBKNFXHLSGIDI-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN O=C([C@@H]1CCCN(Cc2cccc(I)c2)C1)N1CCCC1 ZINC000579987410 566655134 /nfs/dbraw/zinc/65/51/34/566655134.db2.gz WASQJWKXUBYFSV-OAHLLOKOSA-N 0 1 398.288 3.126 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(Br)cc2F)CC1 ZINC000629420446 566655364 /nfs/dbraw/zinc/65/53/64/566655364.db2.gz WNOQTZVRFFDWGX-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN COCc1cnc(CN[C@H]2CCN(c3cccc(Br)c3)C2)s1 ZINC000487199888 566655419 /nfs/dbraw/zinc/65/54/19/566655419.db2.gz JAVKJBJYDUUPAH-ZDUSSCGKSA-N 0 1 382.327 3.421 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cccc(F)c2Br)CC1 ZINC000629415372 566655393 /nfs/dbraw/zinc/65/53/93/566655393.db2.gz SLFXPVXHOKOXPU-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN O=C([C@H]1CCCN(Cc2cccc(I)c2)C1)N1CCCC1 ZINC000579987409 566655440 /nfs/dbraw/zinc/65/54/40/566655440.db2.gz WASQJWKXUBYFSV-HNNXBMFYSA-N 0 1 398.288 3.126 10 0 GGAEMN Fc1cc(CNCc2ccnc(N3CCOCC3)c2)ccc1Br ZINC000675640075 566657336 /nfs/dbraw/zinc/65/73/36/566657336.db2.gz NHRHCJZVNZQOID-UHFFFAOYSA-N 0 1 380.261 3.110 10 0 GGAEMN CCOc1c(Cl)cc(NC(=O)N2CCN([C@@H](CC)CO)CC2)cc1Cl ZINC000467766100 566663523 /nfs/dbraw/zinc/66/35/23/566663523.db2.gz BQVGIFONVNIONI-ZDUSSCGKSA-N 0 1 390.311 3.313 10 0 GGAEMN CCOC(=O)c1ccc(CN2CCC(n3cc(Br)cn3)CC2)nc1 ZINC000450389045 566665232 /nfs/dbraw/zinc/66/52/32/566665232.db2.gz JAZWWTSWPROTGR-UHFFFAOYSA-N 0 1 393.285 3.054 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@H](CCO)c2cc(Cl)cc(Cl)c2)cn1 ZINC000629585653 566667697 /nfs/dbraw/zinc/66/76/97/566667697.db2.gz BXWDDPNUIZRABT-QGZVFWFLSA-N 0 1 382.291 3.304 10 0 GGAEMN Cc1ccc2nc(CNC(=O)C(=O)Nc3ccc(Cl)cc3Cl)[nH]c2c1 ZINC000467824259 566670394 /nfs/dbraw/zinc/67/03/94/566670394.db2.gz SNGAZPNXEZMFEP-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN CCN(C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CCC1 ZINC000607416242 566670989 /nfs/dbraw/zinc/67/09/89/566670989.db2.gz YNUKNYCIRRMCOG-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN CCN(C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCC1 ZINC000607416242 566670994 /nfs/dbraw/zinc/67/09/94/566670994.db2.gz YNUKNYCIRRMCOG-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN O[C@@H](CNCc1cc(F)c(Br)cc1F)COCc1ccccc1 ZINC000629597846 566671016 /nfs/dbraw/zinc/67/10/16/566671016.db2.gz POPRMIKAVNQHIL-AWEZNQCLSA-N 0 1 386.236 3.395 10 0 GGAEMN CC(C)n1cc(C(C)(C)NC(=O)c2cc(Br)cc3nc[nH]c32)nn1 ZINC000580180862 566671264 /nfs/dbraw/zinc/67/12/64/566671264.db2.gz VRSVZTRLPIQFIT-UHFFFAOYSA-N 0 1 391.273 3.163 10 0 GGAEMN O[C@@H](CNCc1cc(F)c(Br)cc1F)COCc1cccs1 ZINC000629598303 566671313 /nfs/dbraw/zinc/67/13/13/566671313.db2.gz VYZMUYMTHDSGDD-NSHDSACASA-N 0 1 392.265 3.456 10 0 GGAEMN C[C@@H]1CN(c2ncc(Br)cc2C(F)(F)F)CCN1CC(C)(C)O ZINC000450473747 566674643 /nfs/dbraw/zinc/67/46/43/566674643.db2.gz NYEQHXJOPXNFDJ-SNVBAGLBSA-N 0 1 396.251 3.144 10 0 GGAEMN Cc1nnc(SCCC(=O)NCCc2c[nH]c3cc(F)c(Cl)cc23)[nH]1 ZINC000629622453 566675712 /nfs/dbraw/zinc/67/57/12/566675712.db2.gz BBYNGBOVWKNBQW-UHFFFAOYSA-N 0 1 381.864 3.228 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)c2c(Cl)cc(F)cc2Br)n[nH]1 ZINC000450486872 566676326 /nfs/dbraw/zinc/67/63/26/566676326.db2.gz QVZRSQMEQXNAJI-LURJTMIESA-N 0 1 375.629 3.413 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)c2c(Cl)cc(F)cc2Br)n[nH]1 ZINC000450486875 566676548 /nfs/dbraw/zinc/67/65/48/566676548.db2.gz QVZRSQMEQXNAJI-ZCFIWIBFSA-N 0 1 375.629 3.413 10 0 GGAEMN COc1ccc(Br)c(CC(=O)Nc2cnn(-c3ccncc3)c2)c1 ZINC000676111130 566676609 /nfs/dbraw/zinc/67/66/09/566676609.db2.gz NUFSHAQMKJMBCY-UHFFFAOYSA-N 0 1 387.237 3.220 10 0 GGAEMN CCN1CCC[C@H](NC(=O)CCCC(=O)c2ccc(Br)cc2)C1 ZINC000487533744 566678186 /nfs/dbraw/zinc/67/81/86/566678186.db2.gz ISVHSCIONHGHSC-INIZCTEOSA-N 0 1 381.314 3.403 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC[C@H](C)Oc2ccc(Br)cc2)n[nH]1 ZINC000487556925 566679147 /nfs/dbraw/zinc/67/91/47/566679147.db2.gz JPCYQUMAAGLHGH-AAEUAGOBSA-N 0 1 395.301 3.178 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC[C@H](C)Oc2cccc(Br)c2)n[nH]1 ZINC000487546038 566679253 /nfs/dbraw/zinc/67/92/53/566679253.db2.gz ZTZJYOVKYYNOBR-YPMHNXCESA-N 0 1 395.301 3.178 10 0 GGAEMN Cn1ncc(Br)c1CN[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000487555905 566680471 /nfs/dbraw/zinc/68/04/71/566680471.db2.gz HIJUUUJXQICYLH-GOEBONIOSA-N 0 1 383.721 3.371 10 0 GGAEMN COc1ccccc1[C@H](CNCc1c(Br)cnn1C)OC(C)C ZINC000487575747 566681631 /nfs/dbraw/zinc/68/16/31/566681631.db2.gz VCGUZYSDIGLUGJ-KRWDZBQOSA-N 0 1 382.302 3.447 10 0 GGAEMN CCN1CCN(CC(=O)N[C@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000468092972 566682370 /nfs/dbraw/zinc/68/23/70/566682370.db2.gz AQGZPGZXDSMPFG-IBGZPJMESA-N 0 1 394.357 3.044 10 0 GGAEMN C[C@H](CC(=O)N1CCN([C@H]2CCC[C@H]2O)CC1)c1ccc(Br)cc1 ZINC000676252019 566682498 /nfs/dbraw/zinc/68/24/98/566682498.db2.gz WAURRCIVBIJHTE-FHLIZLRMSA-N 0 1 395.341 3.000 10 0 GGAEMN C[C@H](CC(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccc(Br)cc1 ZINC000676252022 566682767 /nfs/dbraw/zinc/68/27/67/566682767.db2.gz WAURRCIVBIJHTE-ZTFGCOKTSA-N 0 1 395.341 3.000 10 0 GGAEMN Cn1cc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)c(C(F)(F)F)n1 ZINC000580315757 566683328 /nfs/dbraw/zinc/68/33/28/566683328.db2.gz KJDIDGYSAGKFIQ-LLVKDONJSA-N 0 1 398.212 3.275 10 0 GGAEMN C[C@H](CC(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccc(Br)cc1 ZINC000676252021 566683777 /nfs/dbraw/zinc/68/37/77/566683777.db2.gz WAURRCIVBIJHTE-OLMNPRSZSA-N 0 1 395.341 3.000 10 0 GGAEMN CCc1nc(CNc2cnn(-c3ccc(C)c(Cl)c3)c(=O)c2Cl)n[nH]1 ZINC000450557153 566684040 /nfs/dbraw/zinc/68/40/40/566684040.db2.gz VLTHOJQFCWDTTN-UHFFFAOYSA-N 0 1 379.251 3.140 10 0 GGAEMN CCc1nc(CNc2cc(C(=O)OC)nc3ccc(Br)cc32)n[nH]1 ZINC000450560150 566684097 /nfs/dbraw/zinc/68/40/97/566684097.db2.gz YTGVCIRRHFTENF-UHFFFAOYSA-N 0 1 390.241 3.077 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@@H]2NCCc3ccccc32)cc1Br ZINC000580329737 566684615 /nfs/dbraw/zinc/68/46/15/566684615.db2.gz LECHJDHVRLZHBN-GOSISDBHSA-N 0 1 388.309 3.336 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2c(O)cccc2F)cnn1-c1ccc(Cl)cc1 ZINC000608004756 566688672 /nfs/dbraw/zinc/68/86/72/566688672.db2.gz RXLQUTJWYZGDHD-UHFFFAOYSA-N 0 1 381.816 3.480 10 0 GGAEMN CC[C@]1(C)CCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000468242434 566693204 /nfs/dbraw/zinc/69/32/04/566693204.db2.gz VMPNUXABSHNSOB-OAHLLOKOSA-N 0 1 383.233 3.430 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cc(COc3ccc(Cl)cc3Cl)on2)C1 ZINC000676424402 566693741 /nfs/dbraw/zinc/69/37/41/566693741.db2.gz PCQPXZRJGINATP-LBPRGKRZSA-N 0 1 384.263 3.384 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1CC[C@H](C)[C@@H](C(=O)[O-])C1 ZINC000515176334 566695340 /nfs/dbraw/zinc/69/53/40/566695340.db2.gz JCSIDGGIZRRRGH-SJCJKPOMSA-N 0 1 392.297 3.486 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000515176333 566696153 /nfs/dbraw/zinc/69/61/53/566696153.db2.gz JCSIDGGIZRRRGH-PXAZEXFGSA-N 0 1 392.297 3.486 10 0 GGAEMN FC(F)(F)[C@H](CN[C@@H]1CCCOc2cc(Cl)ccc21)N1CCOCC1 ZINC000515189554 566697223 /nfs/dbraw/zinc/69/72/23/566697223.db2.gz STBOPCXNIWINLN-ZBFHGGJFSA-N 0 1 378.822 3.406 10 0 GGAEMN FC(F)(F)[C@@H](CN[C@H]1CCCOc2cc(Cl)ccc21)N1CCOCC1 ZINC000515189552 566697526 /nfs/dbraw/zinc/69/75/26/566697526.db2.gz STBOPCXNIWINLN-GOEBONIOSA-N 0 1 378.822 3.406 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCc3sc(Br)cc3C2)[nH]1 ZINC000676478040 566698086 /nfs/dbraw/zinc/69/80/86/566698086.db2.gz CVWIMVTZXOAJOU-UHFFFAOYSA-N 0 1 387.328 3.004 10 0 GGAEMN O=C(CN[C@H](CCO)c1ccc(Cl)cc1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000561350414 566698267 /nfs/dbraw/zinc/69/82/67/566698267.db2.gz RMYKJTXPORUIMJ-UKRRQHHQSA-N 0 1 378.822 3.154 10 0 GGAEMN CC(=O)C(C)(C)CCC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000676526850 566700110 /nfs/dbraw/zinc/70/01/10/566700110.db2.gz XFDIKPYMFQUREN-UHFFFAOYSA-N 0 1 393.285 3.246 10 0 GGAEMN CC(=O)C(C)(C)CCC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000676526850 566700119 /nfs/dbraw/zinc/70/01/19/566700119.db2.gz XFDIKPYMFQUREN-UHFFFAOYSA-N 0 1 393.285 3.246 10 0 GGAEMN COC(=O)c1ccc(CNCc2cnc3c(C)cc(Br)cn23)cc1 ZINC000561398561 566701071 /nfs/dbraw/zinc/70/10/71/566701071.db2.gz YMKSUMHHZWPTRP-UHFFFAOYSA-N 0 1 388.265 3.482 10 0 GGAEMN Cc1nnc(N2CCC(N3CCN(c4cccc(Cl)c4)CC3)CC2)s1 ZINC000487992998 566701141 /nfs/dbraw/zinc/70/11/41/566701141.db2.gz ZRLSNEPIQYDPNW-UHFFFAOYSA-N 0 1 377.945 3.291 10 0 GGAEMN O[C@H](Cn1cccn1)CN1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000653882018 566701732 /nfs/dbraw/zinc/70/17/32/566701732.db2.gz ZBMKXSZVNQMZJM-ZDUSSCGKSA-N 0 1 389.714 3.026 10 0 GGAEMN COc1ccc(CN(C)C(=O)c2[nH]nc3ccc(Br)cc32)cn1 ZINC000676666511 566702779 /nfs/dbraw/zinc/70/27/79/566702779.db2.gz SOXKVGCDCKOQTE-UHFFFAOYSA-N 0 1 375.226 3.001 10 0 GGAEMN CCc1[nH]nc(C(=O)N(C)Cc2cnn(-c3ccccc3)c2)c1Br ZINC000468497650 566705190 /nfs/dbraw/zinc/70/51/90/566705190.db2.gz KXMMCMSDTCOLDG-UHFFFAOYSA-N 0 1 388.269 3.193 10 0 GGAEMN OCCN(Cc1cc(Br)cs1)Cc1c[nH]nc1-c1cccnc1 ZINC000426375904 566706112 /nfs/dbraw/zinc/70/61/12/566706112.db2.gz HITVQXAEYSONMN-UHFFFAOYSA-N 0 1 393.310 3.290 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)[C@H]1CCCN1C1CC1 ZINC000426375537 566706501 /nfs/dbraw/zinc/70/65/01/566706501.db2.gz DTZHGXLNTGLFOG-CYBMUJFWSA-N 0 1 378.519 3.383 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCc2ncccc2C1 ZINC000676785538 566708593 /nfs/dbraw/zinc/70/85/93/566708593.db2.gz IAQHXZZODZZIHV-UHFFFAOYSA-N 0 1 383.249 3.433 10 0 GGAEMN CN(CC(=O)Nc1nc2ccc(Br)cc2[nH]1)c1ccc(Cl)cn1 ZINC000608220167 566708755 /nfs/dbraw/zinc/70/87/55/566708755.db2.gz UHLJDOFZJULEHM-UHFFFAOYSA-N 0 1 394.660 3.449 10 0 GGAEMN CCn1cc(S(=O)(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)nc1C ZINC000541308731 566713830 /nfs/dbraw/zinc/71/38/30/566713830.db2.gz OZQRFNXPLQUSML-CYBMUJFWSA-N 0 1 383.342 3.072 10 0 GGAEMN C[N@@H+]1CC[C@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@@H]1c1ccccc1 ZINC000561538273 566716918 /nfs/dbraw/zinc/71/69/18/566716918.db2.gz KOPHVOFFLFZHLR-HOCLYGCPSA-N 0 1 386.851 3.342 10 0 GGAEMN C[N@H+]1CC[C@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@@H]1c1ccccc1 ZINC000561538273 566716924 /nfs/dbraw/zinc/71/69/24/566716924.db2.gz KOPHVOFFLFZHLR-HOCLYGCPSA-N 0 1 386.851 3.342 10 0 GGAEMN CCn1cc(-c2[nH]ncc2C(=O)NCc2cc(F)cc(Br)c2)cn1 ZINC000426621134 566720115 /nfs/dbraw/zinc/72/01/15/566720115.db2.gz TUGWQURBAPWNSH-UHFFFAOYSA-N 0 1 392.232 3.125 10 0 GGAEMN CN(CCc1nnnn1-c1ccccc1)Cc1cc(Br)cs1 ZINC000515544917 566720559 /nfs/dbraw/zinc/72/05/59/566720559.db2.gz FFSABZAMBVBFOX-UHFFFAOYSA-N 0 1 378.299 3.161 10 0 GGAEMN C[C@H]1CN(CC(F)(F)F)CCN(C(=O)c2cccc(Br)c2O)C1 ZINC000654209474 566721302 /nfs/dbraw/zinc/72/13/02/566721302.db2.gz PBLHCVRKDDCDDI-JTQLQIEISA-N 0 1 395.219 3.111 10 0 GGAEMN C[C@@H]1CN(CC(F)(F)F)CCN(C(=O)c2cccc(Br)c2O)C1 ZINC000654209475 566721900 /nfs/dbraw/zinc/72/19/00/566721900.db2.gz PBLHCVRKDDCDDI-SNVBAGLBSA-N 0 1 395.219 3.111 10 0 GGAEMN CCOC(=O)C[C@H](NC(=O)c1[nH]nc(C)c1C)c1cccc(Br)c1 ZINC000541443958 566724604 /nfs/dbraw/zinc/72/46/04/566724604.db2.gz ZNPUNGBQDMOZPL-AWEZNQCLSA-N 0 1 394.269 3.213 10 0 GGAEMN C[C@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@H](C(F)(F)F)O1 ZINC000608605688 566725231 /nfs/dbraw/zinc/72/52/31/566725231.db2.gz UJDVSMXRAZWNLR-CPCISQLKSA-N 0 1 392.175 3.117 10 0 GGAEMN CCOc1cc(Br)c(F)cc1NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000580822087 566726209 /nfs/dbraw/zinc/72/62/09/566726209.db2.gz BKGIWSOKEDVHEG-PHIMTYICSA-N 0 1 386.265 3.345 10 0 GGAEMN C[C@@H](c1ccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)cc1)C(F)(F)F ZINC000450970685 566726501 /nfs/dbraw/zinc/72/65/01/566726501.db2.gz FERFEDSENBUWGT-XJKSGUPXSA-N 0 1 378.460 3.208 10 0 GGAEMN C[C@H](c1ccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)cc1)C(F)(F)F ZINC000450970683 566727220 /nfs/dbraw/zinc/72/72/20/566727220.db2.gz FERFEDSENBUWGT-CJNGLKHVSA-N 0 1 378.460 3.208 10 0 GGAEMN COc1ccc(C[NH2+][C@H](C(=O)[O-])c2cccc(F)c2)c(Br)c1O ZINC000426762729 566727296 /nfs/dbraw/zinc/72/72/96/566727296.db2.gz MUQLFZIXBVOEFN-AWEZNQCLSA-N 0 1 384.201 3.218 10 0 GGAEMN COc1ccc(Br)c(C[NH2+][C@H](C(=O)[O-])c2ccccc2OC)c1 ZINC000426795643 566731008 /nfs/dbraw/zinc/73/10/08/566731008.db2.gz YTGFTJLOFVNSFZ-INIZCTEOSA-N 0 1 380.238 3.382 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)N[C@H]1CCCc2cn[nH]c21 ZINC000488544451 566733786 /nfs/dbraw/zinc/73/37/86/566733786.db2.gz MKCHDKMFRBNBFW-ZDUSSCGKSA-N 0 1 379.258 3.058 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)c1Br ZINC000468845447 566737290 /nfs/dbraw/zinc/73/72/90/566737290.db2.gz DYBZNXUARRFJQL-UHFFFAOYSA-N 0 1 397.704 3.350 10 0 GGAEMN C[C@@](CO)(NCC[S@](=O)c1cc(Cl)ccc1Cl)c1cccc(O)c1 ZINC000451029855 566739115 /nfs/dbraw/zinc/73/91/15/566739115.db2.gz HXVPQHAYANHMCA-XDHUDOTRSA-N 0 1 388.316 3.304 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@@H](C(C)(C)C)[C@@H](O)C1)c1ccc(Br)cc1 ZINC000541625275 566739774 /nfs/dbraw/zinc/73/97/74/566739774.db2.gz NRJTUUMWRRUGBV-XKQJLSEDSA-N 0 1 397.357 3.355 10 0 GGAEMN CCN1CCC[C@H](NC(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000488700163 566740761 /nfs/dbraw/zinc/74/07/61/566740761.db2.gz UKJMRTRYMCMIIA-LBPRGKRZSA-N 0 1 396.260 3.457 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)c2oc3c(cc(Br)cc3C)c2C)n1 ZINC000426996992 566742149 /nfs/dbraw/zinc/74/21/49/566742149.db2.gz HCKJFSTWXIHSFF-UHFFFAOYSA-N 0 1 377.242 3.211 10 0 GGAEMN O=C(NCc1n[nH]c([C@H]2CCCO2)n1)N[C@H]1CCCc2sc(Cl)cc21 ZINC000654571389 566742479 /nfs/dbraw/zinc/74/24/79/566742479.db2.gz YHJBBGXLGRVADP-WDEREUQCSA-N 0 1 381.889 3.248 10 0 GGAEMN C[C@H]1[C@@H](CO)CCN1CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000488718201 566743057 /nfs/dbraw/zinc/74/30/57/566743057.db2.gz LXIAZFIBOQZQIN-VHSXEESVSA-N 0 1 395.219 3.109 10 0 GGAEMN O=C(c1c(F)cncc1Br)N1CCCN(Cc2ccccc2)CC1 ZINC000630622025 566743964 /nfs/dbraw/zinc/74/39/64/566743964.db2.gz HLDMCSQCXZEOGJ-UHFFFAOYSA-N 0 1 392.272 3.331 10 0 GGAEMN C[C@H](CNS(=O)(=O)c1cc(F)c(Br)cc1F)c1ccncc1 ZINC000677421193 566745393 /nfs/dbraw/zinc/74/53/93/566745393.db2.gz NAVDGHCRHNPNBE-SECBINFHSA-N 0 1 391.237 3.204 10 0 GGAEMN Brc1cccc(OCCN2CCC(Oc3cnccn3)CC2)c1 ZINC000488786289 566747624 /nfs/dbraw/zinc/74/76/24/566747624.db2.gz OQFQEKZIBIHCPM-UHFFFAOYSA-N 0 1 378.270 3.161 10 0 GGAEMN CCS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc3nc(C)sc3c2)cc1 ZINC000427114700 566748284 /nfs/dbraw/zinc/74/82/84/566748284.db2.gz QQUZTYDDEGWEHE-UHFFFAOYSA-N 0 1 396.515 3.199 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2cc(Cl)cc(C)c2Br)c1 ZINC000451084637 566752721 /nfs/dbraw/zinc/75/27/21/566752721.db2.gz KBLLTFKTIKGKAI-UHFFFAOYSA-N 0 1 378.679 3.428 10 0 GGAEMN COc1cc(Br)c(NC(=O)c2ccc(CN(C)C)nc2)cc1OC ZINC000630808887 566752783 /nfs/dbraw/zinc/75/27/83/566752783.db2.gz XNYCMSVFKLQDOP-UHFFFAOYSA-N 0 1 394.269 3.175 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)CCCCc2ccc(Br)cc2)CC1 ZINC000677581974 566755059 /nfs/dbraw/zinc/75/50/59/566755059.db2.gz OBEPNYMOCRQWFN-GOSISDBHSA-N 0 1 397.357 3.077 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)CCCCc2ccc(Br)cc2)CC1 ZINC000677581975 566755169 /nfs/dbraw/zinc/75/51/69/566755169.db2.gz OBEPNYMOCRQWFN-SFHVURJKSA-N 0 1 397.357 3.077 10 0 GGAEMN CC(C)c1nc([C@@H](C)NS(=O)(=O)Cc2ccc(Cl)cc2Cl)n[nH]1 ZINC000541862818 566756261 /nfs/dbraw/zinc/75/62/61/566756261.db2.gz APCLDWAMWSQFBD-SECBINFHSA-N 0 1 377.297 3.416 10 0 GGAEMN O=C(Nc1nc2ccc(F)cc2[nH]1)c1cc2c(c(Br)c1)OCO2 ZINC000488920490 566756609 /nfs/dbraw/zinc/75/66/09/566756609.db2.gz QXSXHPDIZATEIB-UHFFFAOYSA-N 0 1 378.157 3.446 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1ccc(I)cc1 ZINC000581204817 566757612 /nfs/dbraw/zinc/75/76/12/566757612.db2.gz BMNPZLYUNZCJCG-OAHLLOKOSA-N 0 1 386.277 3.172 10 0 GGAEMN COCCOc1ccccc1NS(=O)(=O)c1ccc2nc(C)sc2c1 ZINC000427198966 566757730 /nfs/dbraw/zinc/75/77/30/566757730.db2.gz RNCVRPHPKVMZFT-UHFFFAOYSA-N 0 1 378.475 3.431 10 0 GGAEMN Cc1cc(C)n([C@H](C)C(=O)Nc2nc(-c3ccccc3Br)n[nH]2)n1 ZINC000516364159 566759851 /nfs/dbraw/zinc/75/98/51/566759851.db2.gz FEBGZOSSEYVEOJ-LLVKDONJSA-N 0 1 389.257 3.247 10 0 GGAEMN CCc1[nH]nc(C(=O)N(C)Cc2cc(OC)cc(OC)c2)c1Br ZINC000469106718 566761992 /nfs/dbraw/zinc/76/19/92/566761992.db2.gz UBDDWALFAWJCQQ-UHFFFAOYSA-N 0 1 382.258 3.024 10 0 GGAEMN O=C(Nc1nn2cnnc2s1)c1sc(-c2ccccc2)nc1C(F)F ZINC000677795269 566764085 /nfs/dbraw/zinc/76/40/85/566764085.db2.gz LNLNJFDNCPDMGX-UHFFFAOYSA-N 0 1 378.389 3.499 10 0 GGAEMN CN(C)CCN(Cc1cccc(Cl)c1)S(=O)(=O)C[C@@H]1CCCC1(F)F ZINC000451133009 566764772 /nfs/dbraw/zinc/76/47/72/566764772.db2.gz YEEYHGDHYHDDKY-HNNXBMFYSA-N 0 1 394.915 3.469 10 0 GGAEMN COCCN1CCC[C@H](NC(=O)c2oc3ccccc3c2Br)C1 ZINC000630943138 566765599 /nfs/dbraw/zinc/76/55/99/566765599.db2.gz OBIOTWGZSWEVIX-LBPRGKRZSA-N 0 1 381.270 3.036 10 0 GGAEMN CCOC(=O)CCN(CC1CC1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000609494061 566766921 /nfs/dbraw/zinc/76/69/21/566766921.db2.gz VOWOYLBSLQRPNL-UHFFFAOYSA-N 0 1 394.269 3.131 10 0 GGAEMN COC[C@@H](NS(=O)(=O)c1cc(C(F)(F)F)ccc1O)c1ccccc1 ZINC000451161039 566767409 /nfs/dbraw/zinc/76/74/09/566767409.db2.gz JAFUCJQSFPEFIM-CYBMUJFWSA-N 0 1 375.368 3.077 10 0 GGAEMN Brc1ccc(-c2n[nH]c(SC[C@@H]3CCc4ncnn43)n2)cc1 ZINC000631005383 566770019 /nfs/dbraw/zinc/77/00/19/566770019.db2.gz QKFKZZGCHMPPFH-NSHDSACASA-N 0 1 377.271 3.105 10 0 GGAEMN C[C@H](NCC(=O)Nc1nc2c(s1)CCCC2)c1ccc([S@](C)=O)cc1 ZINC000542053771 566771869 /nfs/dbraw/zinc/77/18/69/566771869.db2.gz RGTXQWWAIMAYCB-VDBVYFBLSA-N 0 1 377.535 3.049 10 0 GGAEMN Clc1cc(Br)cnc1CN[C@H]1CCCN(c2ncccn2)C1 ZINC000631044391 566774855 /nfs/dbraw/zinc/77/48/55/566774855.db2.gz QCSXJDNMGXWYCS-LBPRGKRZSA-N 0 1 382.693 3.046 10 0 GGAEMN Ic1cccc(C[C@H]2CCN(Cc3cnns3)C2)c1 ZINC000451195676 566775350 /nfs/dbraw/zinc/77/53/50/566775350.db2.gz UQCLBOPNUUMRQH-GFCCVEGCSA-N 0 1 385.274 3.207 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CCC1)N1CCOC[C@H]1C1CC1 ZINC000677998241 566775625 /nfs/dbraw/zinc/77/56/25/566775625.db2.gz BIZADBRTJSFPMJ-KRWDZBQOSA-N 0 1 393.325 3.055 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CCC1)N1CCOC[C@@H]1C1CC1 ZINC000677998242 566775881 /nfs/dbraw/zinc/77/58/81/566775881.db2.gz BIZADBRTJSFPMJ-QGZVFWFLSA-N 0 1 393.325 3.055 10 0 GGAEMN Clc1cc(Br)cnc1CNCCCOCC1CCOCC1 ZINC000631077093 566776196 /nfs/dbraw/zinc/77/61/96/566776196.db2.gz RIQGFCLVQVBDHI-UHFFFAOYSA-N 0 1 377.710 3.420 10 0 GGAEMN COc1cncc(CNCc2cc(Br)c(OC)c(OC)c2)c1C ZINC000631064035 566776537 /nfs/dbraw/zinc/77/65/37/566776537.db2.gz LJYOJBDFMCAIBY-UHFFFAOYSA-N 0 1 381.270 3.468 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)C(=O)c2ccc(Br)cc2)n[nH]1 ZINC000489262995 566776964 /nfs/dbraw/zinc/77/69/64/566776964.db2.gz VTIVFKNSWIMGEG-UWVGGRQHSA-N 0 1 379.258 3.141 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)N(CCO)Cc1cc(Br)cs1 ZINC000427541166 566777958 /nfs/dbraw/zinc/77/79/58/566777958.db2.gz OVLKARKLCBSZPI-UHFFFAOYSA-N 0 1 386.315 3.300 10 0 GGAEMN CCN1CCN(CC(=O)Nc2nc(-c3cccc(Cl)c3)c(C)s2)CC1 ZINC000562297718 566778447 /nfs/dbraw/zinc/77/84/47/566778447.db2.gz QRACKWZSVGPYBP-UHFFFAOYSA-N 0 1 378.929 3.348 10 0 GGAEMN C[C@H]1C[C@@H](N[C@@H]2CCCN(Cc3nccn3C)C2=O)c2ccsc2S1 ZINC000542156985 566778429 /nfs/dbraw/zinc/77/84/29/566778429.db2.gz IZPADBVYRHOWPW-NWANDNLSSA-N 0 1 376.551 3.188 10 0 GGAEMN COCCc1ncc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000631103535 566779379 /nfs/dbraw/zinc/77/93/79/566779379.db2.gz IVFNNPVDDOOBAE-CRAIPNDOSA-N 0 1 379.913 3.047 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@@H](Cc1ccccc1)C(N)=O ZINC000469284169 566779421 /nfs/dbraw/zinc/77/94/21/566779421.db2.gz UCUQXVBRWRENDM-WBMJQRKESA-N 0 1 377.282 3.205 10 0 GGAEMN CCOC(=O)C[C@H](NC(=O)c1[nH]nc(C)c1C)c1ccc(Br)cc1 ZINC000609661825 566780349 /nfs/dbraw/zinc/78/03/49/566780349.db2.gz GAUOIWBZALQQNV-AWEZNQCLSA-N 0 1 394.269 3.213 10 0 GGAEMN O=S(=O)(Cc1cccc(C(F)(F)F)c1)Nc1cc([C@H]2CCCO2)[nH]n1 ZINC000581463693 566780327 /nfs/dbraw/zinc/78/03/27/566780327.db2.gz DKHYNMUBMNHNGF-CYBMUJFWSA-N 0 1 375.372 3.222 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@H]2CCCC2(F)F)[C@H]1c1cccs1 ZINC000451246270 566781018 /nfs/dbraw/zinc/78/10/18/566781018.db2.gz VOJGKDFXVBUAOX-FMKPAKJESA-N 0 1 392.537 3.486 10 0 GGAEMN Cc1cc(N2CCC[C@@H](NCc3ncc(Br)cc3Cl)C2)n(C)n1 ZINC000631122178 566782158 /nfs/dbraw/zinc/78/21/58/566782158.db2.gz XQTWREPKCLLNHW-CYBMUJFWSA-N 0 1 398.736 3.298 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)NCc1ccn(C2CCCC2)n1 ZINC000562359378 566782940 /nfs/dbraw/zinc/78/29/40/566782940.db2.gz PGSCHKIPURZEHO-CYBMUJFWSA-N 0 1 379.302 3.101 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)N[C@@H]2CCc3cc(Br)ccc32)n[nH]1 ZINC000655143814 566783083 /nfs/dbraw/zinc/78/30/83/566783083.db2.gz ZQGBLKDNJJZIOP-CYBMUJFWSA-N 0 1 392.301 3.351 10 0 GGAEMN Brc1ccc([C@H]2C[C@H](NCc3cn(C[C@@H]4CCOC4)nn3)C2)cc1 ZINC000631139571 566785352 /nfs/dbraw/zinc/78/53/52/566785352.db2.gz ODHHGIKSDURGMM-QRTARXTBSA-N 0 1 391.313 3.113 10 0 GGAEMN Clc1cc(Br)ccc1CCNCc1cn(C[C@H]2CCOC2)nn1 ZINC000631145123 566785580 /nfs/dbraw/zinc/78/55/80/566785580.db2.gz CNAFSDUFOFBDEO-GFCCVEGCSA-N 0 1 399.720 3.063 10 0 GGAEMN O=C(N[C@@H](C1CC1)[C@H]1CCCCO1)c1n[nH]c2ccc(Br)cc21 ZINC000655222835 566787177 /nfs/dbraw/zinc/78/71/77/566787177.db2.gz MNQSOFJIVPPXIB-CABCVRRESA-N 0 1 378.270 3.403 10 0 GGAEMN CC(C)(CNCc1ncc(Br)cc1Cl)[C@@]1(O)CCCOC1 ZINC000631176392 566787673 /nfs/dbraw/zinc/78/76/73/566787673.db2.gz CDLVLDWBTLBBKW-OAHLLOKOSA-N 0 1 377.710 3.155 10 0 GGAEMN Cc1ccc([C@@H](CN2CCOCC2)NCc2cncc(Br)c2)cc1 ZINC000542256415 566788486 /nfs/dbraw/zinc/78/84/86/566788486.db2.gz NPAJNLDYACZGKF-LJQANCHMSA-N 0 1 390.325 3.316 10 0 GGAEMN C[C@H](CC(=O)NCc1n[nH]c([C@H]2CCCO2)n1)c1ccc(Br)cc1 ZINC000655231071 566788807 /nfs/dbraw/zinc/78/88/07/566788807.db2.gz IJTUFIRDHFPNBR-BXUZGUMPSA-N 0 1 393.285 3.229 10 0 GGAEMN NS(=O)(=O)c1cc(CNCc2ccccc2CC(F)(F)F)ccc1Cl ZINC000631186379 566789080 /nfs/dbraw/zinc/78/90/80/566789080.db2.gz VKNUAQKXELMFJA-UHFFFAOYSA-N 0 1 392.830 3.382 10 0 GGAEMN C[C@@H](NC(=O)N(C)Cc1cc(C(C)(C)C)[nH]n1)c1ncc(Br)cn1 ZINC000562408270 566790343 /nfs/dbraw/zinc/79/03/43/566790343.db2.gz BORXSPNXHYMTAO-SNVBAGLBSA-N 0 1 395.305 3.162 10 0 GGAEMN O=C(CSCc1ccc(Cl)cc1Cl)NC1(c2nn[nH]n2)CCCC1 ZINC000609836486 566790628 /nfs/dbraw/zinc/79/06/28/566790628.db2.gz CTQRJCUGGOBADS-UHFFFAOYSA-N 0 1 386.308 3.325 10 0 GGAEMN Clc1ccc(Br)c(CNCc2n[nH]c(C3CCOCC3)n2)c1 ZINC000631214309 566790855 /nfs/dbraw/zinc/79/08/55/566790855.db2.gz UONMFGAUVKGENC-UHFFFAOYSA-N 0 1 385.693 3.404 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)NCc1n[nH]c(C2CC2)n1 ZINC000581593468 566791203 /nfs/dbraw/zinc/79/12/03/566791203.db2.gz ZIUVTDKFIWKBNS-SECBINFHSA-N 0 1 394.273 3.014 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)NCc1n[nH]c(C2CC2)n1 ZINC000581593469 566791377 /nfs/dbraw/zinc/79/13/77/566791377.db2.gz ZIUVTDKFIWKBNS-VIFPVBQESA-N 0 1 394.273 3.014 10 0 GGAEMN CCc1nc([C@H]2CCCCN2C(=O)c2cccc(Br)c2O)no1 ZINC000678311666 566792837 /nfs/dbraw/zinc/79/28/37/566792837.db2.gz BYPIGPPPYGFUBM-GFCCVEGCSA-N 0 1 380.242 3.468 10 0 GGAEMN C[C@@H](Cc1ccc(F)cc1Br)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631214748 566793422 /nfs/dbraw/zinc/79/34/22/566793422.db2.gz XNEMQNHWKMEGNL-NSHDSACASA-N 0 1 397.292 3.321 10 0 GGAEMN C[C@H](CNCc1ncc(Br)s1)c1ccc(S(C)(=O)=O)cc1 ZINC000631268109 566795111 /nfs/dbraw/zinc/79/51/11/566795111.db2.gz AIMFGXQCKHCXSG-SNVBAGLBSA-N 0 1 389.340 3.202 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)c1ccc2[nH]nnc2c1 ZINC000427785649 566797422 /nfs/dbraw/zinc/79/74/22/566797422.db2.gz DVJPLCZHHMETST-UHFFFAOYSA-N 0 1 395.282 3.071 10 0 GGAEMN Brc1cc(CN[C@H]2CCCn3nccc32)cc2c1OCCCO2 ZINC000631302066 566798270 /nfs/dbraw/zinc/79/82/70/566798270.db2.gz VAWJZWJIPJMBMB-AWEZNQCLSA-N 0 1 378.270 3.432 10 0 GGAEMN Cc1nc([C@H]2CCN(c3ncc(Br)cc3C(F)(F)F)C2)n[nH]1 ZINC000631303181 566798418 /nfs/dbraw/zinc/79/84/18/566798418.db2.gz FSTHPAKGVOKYLX-QMMMGPOBSA-N 0 1 376.180 3.283 10 0 GGAEMN Cc1nnc([C@H]2CCN(c3ncc(Br)cc3C(F)(F)F)C2)[nH]1 ZINC000631303181 566798423 /nfs/dbraw/zinc/79/84/23/566798423.db2.gz FSTHPAKGVOKYLX-QMMMGPOBSA-N 0 1 376.180 3.283 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)c2c(F)cncc2Br)ccc1F ZINC000631314242 566798728 /nfs/dbraw/zinc/79/87/28/566798728.db2.gz HBZSGZGOJJANNY-UHFFFAOYSA-N 0 1 384.224 3.114 10 0 GGAEMN CCN(CC)Cc1ccc(C(=O)N[C@H](CO)c2cccc(Br)c2)o1 ZINC000678402474 566799349 /nfs/dbraw/zinc/79/93/49/566799349.db2.gz XTECDLVVSMCZNI-MRXNPFEDSA-N 0 1 395.297 3.347 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCN(CC2CCOCC2)CC1 ZINC000631385622 566800155 /nfs/dbraw/zinc/80/01/55/566800155.db2.gz YFJRNMHBXAEPNZ-UHFFFAOYSA-N 0 1 387.343 3.003 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)CN1[C@H](C)CC[C@@H]1C ZINC000427807423 566800252 /nfs/dbraw/zinc/80/02/52/566800252.db2.gz ULLBSHPYKJVZLI-BETUJISGSA-N 0 1 389.359 3.358 10 0 GGAEMN Cc1nc(-c2cc3c(s2)CCN(C(=O)N[C@@H]2CCCN(C)C2)C3)cs1 ZINC000678508001 566803621 /nfs/dbraw/zinc/80/36/21/566803621.db2.gz WLQSHECSMJUEMM-CQSZACIVSA-N 0 1 376.551 3.342 10 0 GGAEMN COc1c(C)cccc1CNC(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000655490741 566804361 /nfs/dbraw/zinc/80/43/61/566804361.db2.gz OLZKQOYFHDBAPJ-SFHVURJKSA-N 0 1 377.282 3.256 10 0 GGAEMN C[C@@](N)(C(=O)N1CCOc2cccc(Br)c2C1)c1ccccc1 ZINC000655503029 566804497 /nfs/dbraw/zinc/80/44/97/566804497.db2.gz BBHRXXKCIJPUSU-SFHVURJKSA-N 0 1 375.266 3.044 10 0 GGAEMN Cc1c2cc(Br)cc(C)c2oc1C(=O)N(C)C[C@H](C)c1nn[nH]n1 ZINC000427916468 566804763 /nfs/dbraw/zinc/80/47/63/566804763.db2.gz RVMKNIJATOYUDT-VIFPVBQESA-N 0 1 392.257 3.201 10 0 GGAEMN Brc1cc2ncnc(NCc3n[nH]c(C4CCOCC4)n3)c2s1 ZINC000631458795 566805222 /nfs/dbraw/zinc/80/52/22/566805222.db2.gz LZJFKOJEGQPFKU-UHFFFAOYSA-N 0 1 395.286 3.078 10 0 GGAEMN C[C@@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)c(F)c1 ZINC000678595288 566805483 /nfs/dbraw/zinc/80/54/83/566805483.db2.gz UQRLIVLAFODZCD-BDJLRTHQSA-N 0 1 385.277 3.019 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCc2cc(F)c(F)cc2Br)cn1 ZINC000517106577 566806185 /nfs/dbraw/zinc/80/61/85/566806185.db2.gz KDDCKGRQIFUTNP-UHFFFAOYSA-N 0 1 384.224 3.114 10 0 GGAEMN CC(C)(C(=O)Nc1nccn1Cc1ccc(Br)cc1)c1cnc[nH]1 ZINC000469701106 566807854 /nfs/dbraw/zinc/80/78/54/566807854.db2.gz CWWVYMMOWZMBBI-UHFFFAOYSA-N 0 1 388.269 3.333 10 0 GGAEMN O=C(c1ccc(Br)cc1)N1CCN(CC[C@H]2CCCCO2)CC1 ZINC000542520235 566808319 /nfs/dbraw/zinc/80/83/19/566808319.db2.gz WYADPHMTQSCADH-QGZVFWFLSA-N 0 1 381.314 3.166 10 0 GGAEMN CC(C)c1nc(CC2CCN(C(=O)c3ncc(Br)s3)CC2)n[nH]1 ZINC000631536536 566808628 /nfs/dbraw/zinc/80/86/28/566808628.db2.gz BFMPMVWWQITOJV-UHFFFAOYSA-N 0 1 398.330 3.242 10 0 GGAEMN CC(C)c1nnc(CC2CCN(C(=O)c3ncc(Br)s3)CC2)[nH]1 ZINC000631536536 566808632 /nfs/dbraw/zinc/80/86/32/566808632.db2.gz BFMPMVWWQITOJV-UHFFFAOYSA-N 0 1 398.330 3.242 10 0 GGAEMN O=S(=O)(c1ccc(Cl)s1)N1CCCN(CC[C@@H]2CCCCO2)CC1 ZINC000542519332 566808776 /nfs/dbraw/zinc/80/87/76/566808776.db2.gz AULLZNWIFCTDAC-AWEZNQCLSA-N 0 1 392.974 3.057 10 0 GGAEMN CC(C)C[C@@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cccs1 ZINC000542554859 566810504 /nfs/dbraw/zinc/81/05/04/566810504.db2.gz GJIVRKZFYXABAB-MRXNPFEDSA-N 0 1 380.535 3.467 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccc2ncccc2c1 ZINC000610191750 566813348 /nfs/dbraw/zinc/81/33/48/566813348.db2.gz DCCXINVBTUFQLA-UHFFFAOYSA-N 0 1 376.821 3.476 10 0 GGAEMN CN(C1CCN(C)CC1)S(=O)(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 ZINC000631636345 566813653 /nfs/dbraw/zinc/81/36/53/566813653.db2.gz DLDMFIWJAGQNHK-UHFFFAOYSA-N 0 1 386.386 3.055 10 0 GGAEMN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CC(N(C)C)C1 ZINC000542642511 566815380 /nfs/dbraw/zinc/81/53/80/566815380.db2.gz OMAOMMMCTSMZPC-UHFFFAOYSA-N 0 1 376.682 3.279 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451415699 566816315 /nfs/dbraw/zinc/81/63/15/566816315.db2.gz FTGRPVHAUBZMDI-BBWFWOEESA-N 0 1 382.298 3.361 10 0 GGAEMN COc1ccc([C@H](C)NCc2n[nH]c(C3CCOCC3)n2)c(Br)c1 ZINC000631691729 566816796 /nfs/dbraw/zinc/81/67/96/566816796.db2.gz AYOUEZOULNJNDE-NSHDSACASA-N 0 1 395.301 3.321 10 0 GGAEMN C[C@@H](NCc1n[nH]c(C2CCOCC2)n1)c1ccc(Br)cc1F ZINC000631693105 566817016 /nfs/dbraw/zinc/81/70/16/566817016.db2.gz IQEBDCNGCLGVTL-SNVBAGLBSA-N 0 1 383.265 3.451 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)NCCN2CCCC[C@@H]2C)cc1Cl ZINC000517284455 566817457 /nfs/dbraw/zinc/81/74/57/566817457.db2.gz DBGVJPBERJTZCM-NSHDSACASA-N 0 1 381.325 3.155 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)n[nH]1 ZINC000517273557 566817679 /nfs/dbraw/zinc/81/76/79/566817679.db2.gz MHYFZXLCAKSMML-CIISACIHSA-N 0 1 377.286 3.267 10 0 GGAEMN Fc1cc(Br)cc2c1CC[C@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631695537 566818205 /nfs/dbraw/zinc/81/82/05/566818205.db2.gz HFBIDAQOAWHEAC-OAHLLOKOSA-N 0 1 395.276 3.377 10 0 GGAEMN C[C@@H](NCc1n[nH]c(C2CCOCC2)n1)c1cc(Br)ccc1F ZINC000631694393 566818221 /nfs/dbraw/zinc/81/82/21/566818221.db2.gz AQSMMDMFVLPTQT-SNVBAGLBSA-N 0 1 383.265 3.451 10 0 GGAEMN Fc1ccc2c(c1Br)CC[C@@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631694930 566818262 /nfs/dbraw/zinc/81/82/62/566818262.db2.gz FFVWZWLFZSRDIV-AWEZNQCLSA-N 0 1 395.276 3.377 10 0 GGAEMN COc1cc(C)nc(CNCCC(=O)Nc2ccc(Br)cc2)c1 ZINC000542692477 566818833 /nfs/dbraw/zinc/81/88/33/566818833.db2.gz SANNVSSHNQVFOE-UHFFFAOYSA-N 0 1 378.270 3.280 10 0 GGAEMN CS(=O)(=O)c1cccc([C@@H](N[C@@H]2CCC[C@H]2O)c2ccc(Cl)cc2)c1 ZINC000562738187 566819250 /nfs/dbraw/zinc/81/92/50/566819250.db2.gz GOHJYDHMVGNEJQ-QRVBRYPASA-N 0 1 379.909 3.336 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)C(=O)Nc1cccc(Cl)c1Cl ZINC000678792075 566819516 /nfs/dbraw/zinc/81/95/16/566819516.db2.gz NYEYBDUTRBAGQV-UHFFFAOYSA-N 0 1 376.203 3.151 10 0 GGAEMN O=S(=O)(c1cc(C(F)(F)F)ccc1O)N1CC[C@H](CC(F)(F)F)C1 ZINC000451454094 566820820 /nfs/dbraw/zinc/82/08/20/566820820.db2.gz AWKOXGBUYMXFMV-MRVPVSSYSA-N 0 1 377.306 3.374 10 0 GGAEMN COC(=O)Cc1ccc(S(=O)(=O)Nc2cc(Cl)cc(Cl)c2O)cc1 ZINC000542723283 566820887 /nfs/dbraw/zinc/82/08/87/566820887.db2.gz IDDBYPJECVKJPH-UHFFFAOYSA-N 0 1 390.244 3.215 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC[C@H]1C1CC1 ZINC000610292243 566822484 /nfs/dbraw/zinc/82/24/84/566822484.db2.gz YKXCPQBDOYSKDL-ZDUSSCGKSA-N 0 1 381.217 3.182 10 0 GGAEMN C[C@H]1C[C@@H](NC(=O)c2c(F)cncc2Br)CN1Cc1ccccc1 ZINC000631768064 566823830 /nfs/dbraw/zinc/82/38/30/566823830.db2.gz ASIXJSOEGDTPCW-GXTWGEPZSA-N 0 1 392.272 3.376 10 0 GGAEMN Cc1nnc(CN2CCN(CC/C=C\c3ccc(Br)cc3)CC2)[nH]1 ZINC000678891372 566824370 /nfs/dbraw/zinc/82/43/70/566824370.db2.gz PAQRJSUDYYZTMO-RQOWECAXSA-N 0 1 390.329 3.097 10 0 GGAEMN CCOC(=O)[C@@H](CNC(=O)c1cccc(Br)c1O)c1ccccc1 ZINC000610354681 566827201 /nfs/dbraw/zinc/82/72/01/566827201.db2.gz LGVQJHTUIMRXBJ-AWEZNQCLSA-N 0 1 392.249 3.231 10 0 GGAEMN CN(C(=O)c1c(F)cncc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000631818266 566828370 /nfs/dbraw/zinc/82/83/70/566828370.db2.gz HFYHEQYRLUDQQH-AWEZNQCLSA-N 0 1 392.272 3.330 10 0 GGAEMN CC[C@H](N[C@@H]1CCCn2nccc21)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000631809373 566828963 /nfs/dbraw/zinc/82/89/63/566828963.db2.gz ICEUXKSALOVCBL-LSDHHAIUSA-N 0 1 382.917 3.020 10 0 GGAEMN COc1ccc(F)cc1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000428271503 566829157 /nfs/dbraw/zinc/82/91/57/566829157.db2.gz FXBMZPZDVHAUGM-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN O=S(=O)(N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccc(F)cc1Cl ZINC000655661838 566830406 /nfs/dbraw/zinc/83/04/06/566830406.db2.gz JHQAWNUIGOOZLB-JOYOIKCWSA-N 0 1 375.771 3.257 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)N[C@H](C[C@H]1CCCO1)C(F)(F)F ZINC000655662881 566831698 /nfs/dbraw/zinc/83/16/98/566831698.db2.gz XRKAUJDTQQHHLW-ZWNOBZJWSA-N 0 1 387.807 3.127 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000582115674 566831985 /nfs/dbraw/zinc/83/19/85/566831985.db2.gz NXKQXCBECSBIBG-ILXRZTDVSA-N 0 1 388.327 3.215 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1ccccc1C(F)(F)F ZINC000655663904 566832394 /nfs/dbraw/zinc/83/23/94/566832394.db2.gz OPHFWXKCFJWQTK-SKDRFNHKSA-N 0 1 391.333 3.484 10 0 GGAEMN CC[C@H](NS(=O)(=O)c1cc(Br)c(F)cc1OC)C(F)(F)F ZINC000517587708 566834041 /nfs/dbraw/zinc/83/40/41/566834041.db2.gz FVDYTLOJRPETGY-JTQLQIEISA-N 0 1 394.184 3.216 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)N[C@@H]1CCCN2CCCC[C@H]12 ZINC000655669137 566834150 /nfs/dbraw/zinc/83/41/50/566834150.db2.gz XLYLAFZQFWADEK-VXGBXAGGSA-N 0 1 383.366 3.491 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)N[C@@H]1CCCN2CCCC[C@@H]12 ZINC000655669126 566834333 /nfs/dbraw/zinc/83/43/33/566834333.db2.gz XLYLAFZQFWADEK-NEPJUHHUSA-N 0 1 383.366 3.491 10 0 GGAEMN C[C@H](C(=O)Nc1cc(I)ccc1O)N1CCCCCC1 ZINC000610486135 566834503 /nfs/dbraw/zinc/83/45/03/566834503.db2.gz MVSVXQIFHIIHSH-LLVKDONJSA-N 0 1 388.249 3.200 10 0 GGAEMN CCCN(C)[C@H](CNS(=O)(=O)[C@@H]1CCO[C@H](C)C1)c1ccc(Cl)cc1 ZINC000451540689 566835285 /nfs/dbraw/zinc/83/52/85/566835285.db2.gz ZMTWKFTXJKZJTK-ZTFGCOKTSA-N 0 1 388.961 3.210 10 0 GGAEMN CCCN(C)[C@H](CNS(=O)(=O)[C@H]1CCO[C@H](C)C1)c1ccc(Cl)cc1 ZINC000451540687 566835967 /nfs/dbraw/zinc/83/59/67/566835967.db2.gz ZMTWKFTXJKZJTK-FHLIZLRMSA-N 0 1 388.961 3.210 10 0 GGAEMN C[C@@H](C(=O)Nc1cc(I)ccc1O)N1[C@H](C)CC[C@H]1C ZINC000610490762 566836232 /nfs/dbraw/zinc/83/62/32/566836232.db2.gz IEDWKVHYDSWELO-MXWKQRLJSA-N 0 1 388.249 3.197 10 0 GGAEMN CCCN1CCC[C@@H]1C(=O)Nc1cc(Br)c(F)c(C(=O)OC)c1 ZINC000469999926 566836415 /nfs/dbraw/zinc/83/64/15/566836415.db2.gz NLIYVHKNBRDXEY-CYBMUJFWSA-N 0 1 387.249 3.188 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cnc3c(c2)CCCC3)cc1Cl ZINC000542933512 566839513 /nfs/dbraw/zinc/83/95/13/566839513.db2.gz QBZPEATXTRJNPF-UHFFFAOYSA-N 0 1 380.853 3.201 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@H]2CCC2(F)F)[C@H]1c1cccs1 ZINC000632027622 566841963 /nfs/dbraw/zinc/84/19/63/566841963.db2.gz IZXQJWORZQEVIF-NFAWXSAZSA-N 0 1 378.510 3.096 10 0 GGAEMN Brc1ccn2cc(CN3CCN(Cc4ccccc4)CC3)nc2c1 ZINC000517726306 566843132 /nfs/dbraw/zinc/84/31/32/566843132.db2.gz HFWQSFQQDPDQHC-UHFFFAOYSA-N 0 1 385.309 3.415 10 0 GGAEMN C[C@H]1C[C@@H](NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)CCN1C ZINC000632030406 566843821 /nfs/dbraw/zinc/84/38/21/566843821.db2.gz RLUSNHAEPVNNTJ-JQWIXIFHSA-N 0 1 386.386 3.102 10 0 GGAEMN COc1cc(Br)ccc1CCC(=O)N[C@H](C)Cc1cc(C)[nH]n1 ZINC000543004512 566845603 /nfs/dbraw/zinc/84/56/03/566845603.db2.gz VDHZEOASZHFDQD-LLVKDONJSA-N 0 1 380.286 3.169 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000679302714 566846582 /nfs/dbraw/zinc/84/65/82/566846582.db2.gz FVSBXSWXMKLYQI-NSHDSACASA-N 0 1 382.233 3.067 10 0 GGAEMN C[C@H](Cc1ccsc1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 ZINC000543056869 566848777 /nfs/dbraw/zinc/84/87/77/566848777.db2.gz BAXMVLRFPMVPLF-OAHLLOKOSA-N 0 1 382.526 3.215 10 0 GGAEMN Brc1ccc2c(c1)[C@H](NCc1n[nH]c([C@@H]3CCCO3)n1)CCCO2 ZINC000655796923 566849418 /nfs/dbraw/zinc/84/94/18/566849418.db2.gz KWSAEYZVGINMEU-HIFRSBDPSA-N 0 1 393.285 3.422 10 0 GGAEMN OCCCOC1CCN(Cc2ccc(Br)c3cccnc23)CC1 ZINC000679342548 566850015 /nfs/dbraw/zinc/85/00/15/566850015.db2.gz ULIWCWRWIGIAOE-UHFFFAOYSA-N 0 1 379.298 3.361 10 0 GGAEMN Cn1nnnc1CCN[C@H](c1ccc(Br)cc1)c1ccccc1F ZINC000679352704 566851015 /nfs/dbraw/zinc/85/10/15/566851015.db2.gz VBWPHNAYQKAHEM-QGZVFWFLSA-N 0 1 390.260 3.033 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@H](c2ccc(Br)cc2)[C@@H]2CCCO2)CC1=O ZINC000679354700 566851070 /nfs/dbraw/zinc/85/10/70/566851070.db2.gz YMIUROXHQZHZLZ-XGIOVGQOSA-N 0 1 393.325 3.268 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@@H](c2ccc(Br)cc2)[C@@H]2CCCO2)CC1=O ZINC000679354708 566851550 /nfs/dbraw/zinc/85/15/50/566851550.db2.gz YMIUROXHQZHZLZ-ZXBXUNHQSA-N 0 1 393.325 3.268 10 0 GGAEMN Cn1nnnc1CCN[C@H](c1ccccc1)c1cc(Br)ccc1F ZINC000679351099 566851821 /nfs/dbraw/zinc/85/18/21/566851821.db2.gz JARIMUACKAIJRJ-QGZVFWFLSA-N 0 1 390.260 3.033 10 0 GGAEMN Cn1nnnc1CCN[C@@H](c1ccccc1)c1ccc(Br)cc1F ZINC000679351691 566851943 /nfs/dbraw/zinc/85/19/43/566851943.db2.gz NLDIHMHBJXOWIH-KRWDZBQOSA-N 0 1 390.260 3.033 10 0 GGAEMN CC[C@@H](CNC(=O)[C@H](C)CN1CCOCC1)Cc1cccc(Br)c1 ZINC000543111779 566852432 /nfs/dbraw/zinc/85/24/32/566852432.db2.gz IATVENKCOUFFRH-HZPDHXFCSA-N 0 1 397.357 3.102 10 0 GGAEMN CC[C@H](CNC(=O)[C@@H](C)CN1CCOCC1)Cc1cccc(Br)c1 ZINC000543111777 566852677 /nfs/dbraw/zinc/85/26/77/566852677.db2.gz IATVENKCOUFFRH-HOTGVXAUSA-N 0 1 397.357 3.102 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@@H]1F ZINC000679380314 566853445 /nfs/dbraw/zinc/85/34/45/566853445.db2.gz GMLFGBLGMCPYSS-GWCFXTLKSA-N 0 1 396.264 3.124 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@@H]1F ZINC000679380314 566853447 /nfs/dbraw/zinc/85/34/47/566853447.db2.gz GMLFGBLGMCPYSS-GWCFXTLKSA-N 0 1 396.264 3.124 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@H]1F ZINC000679380315 566853808 /nfs/dbraw/zinc/85/38/08/566853808.db2.gz GMLFGBLGMCPYSS-GXFFZTMASA-N 0 1 396.264 3.124 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@H]1F ZINC000679380315 566853814 /nfs/dbraw/zinc/85/38/14/566853814.db2.gz GMLFGBLGMCPYSS-GXFFZTMASA-N 0 1 396.264 3.124 10 0 GGAEMN O=S1(=O)C[C@H](CN[C@@H]2CCSc3c(F)cccc32)Oc2ccccc21 ZINC000563126243 566855966 /nfs/dbraw/zinc/85/59/66/566855966.db2.gz RYIARLZEUICXAK-SWLSCSKDSA-N 0 1 379.478 3.187 10 0 GGAEMN CN1CC[C@@H](NC(=O)c2c(F)cncc2Br)[C@H]1c1ccccc1 ZINC000632159626 566856199 /nfs/dbraw/zinc/85/61/99/566856199.db2.gz JAVUZJJZALQDIC-GDBMZVCRSA-N 0 1 378.245 3.158 10 0 GGAEMN O=S1(=O)C[C@@H](CN[C@@H]2CCSc3c(F)cccc32)Oc2ccccc21 ZINC000563126240 566856511 /nfs/dbraw/zinc/85/65/11/566856511.db2.gz RYIARLZEUICXAK-IUODEOHRSA-N 0 1 379.478 3.187 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)C(=O)Nc1cc(Cl)ccc1Cl ZINC000679511036 566859403 /nfs/dbraw/zinc/85/94/03/566859403.db2.gz MRJWIGMJGUPTMN-UHFFFAOYSA-N 0 1 376.203 3.151 10 0 GGAEMN O[C@H](COC[C@H]1CCCO1)CN1CCC[C@@H]1c1ccc(Br)s1 ZINC000543176821 566859775 /nfs/dbraw/zinc/85/97/75/566859775.db2.gz MIXSCPBMMBXNPN-BFHYXJOUSA-N 0 1 390.343 3.204 10 0 GGAEMN O=C(CCc1nn[nH]n1)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1 ZINC000632198335 566860421 /nfs/dbraw/zinc/86/04/21/566860421.db2.gz AIZAGVMGXLAPCT-UHFFFAOYSA-N 0 1 384.145 3.019 10 0 GGAEMN C[C@H]([N-]S(=O)(=O)c1onc(C2CC2)c1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000632197028 566860453 /nfs/dbraw/zinc/86/04/53/566860453.db2.gz KJBKQMXINYFZPE-WCQYABFASA-N 0 1 387.933 3.137 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCCSCC1)c1cccc(C(F)(F)F)c1 ZINC000470291525 566861676 /nfs/dbraw/zinc/86/16/76/566861676.db2.gz ZLLIOAORPLGPAT-HNNXBMFYSA-N 0 1 375.460 3.457 10 0 GGAEMN CC(C)[C@@H](C)NC(=O)C1CCN(C(=O)c2cccc(Br)c2O)CC1 ZINC000518030394 566861984 /nfs/dbraw/zinc/86/19/84/566861984.db2.gz MZGUYOHYHZQDOK-GFCCVEGCSA-N 0 1 397.313 3.168 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1cccc(OC(F)(F)F)c1 ZINC000518089255 566864629 /nfs/dbraw/zinc/86/46/29/566864629.db2.gz FHLZPISFLRXQQV-STQMWFEESA-N 0 1 380.432 3.126 10 0 GGAEMN Cc1cc(OC[C@@H](O)CN2CCSC[C@H]2CCO)c(C(C)C)cc1Cl ZINC000470367199 566868178 /nfs/dbraw/zinc/86/81/78/566868178.db2.gz MIDZVVYJCROKGN-CVEARBPZSA-N 0 1 387.973 3.311 10 0 GGAEMN O=c1[nH]cc(C(F)(F)F)cc1NS(=O)(=O)c1cccnc1C(F)(F)F ZINC000582510494 566869456 /nfs/dbraw/zinc/86/94/56/566869456.db2.gz WOWHQMFVTAXEFF-UHFFFAOYSA-N 0 1 387.261 3.021 10 0 GGAEMN Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000582520031 566870483 /nfs/dbraw/zinc/87/04/83/566870483.db2.gz WJKQFCJEEOYXGC-ZDUSSCGKSA-N 0 1 377.286 3.146 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@H]([C@@H]3CCOC3)C2)nn1 ZINC000582518117 566870548 /nfs/dbraw/zinc/87/05/48/566870548.db2.gz ILQATHSFCREFQX-LSDHHAIUSA-N 0 1 391.313 3.278 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)nn1 ZINC000582518116 566870764 /nfs/dbraw/zinc/87/07/64/566870764.db2.gz ILQATHSFCREFQX-HUUCEWRRSA-N 0 1 391.313 3.278 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289664 566872830 /nfs/dbraw/zinc/87/28/30/566872830.db2.gz OCRKUDPRDJWHAO-WDEREUQCSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289664 566872838 /nfs/dbraw/zinc/87/28/38/566872838.db2.gz OCRKUDPRDJWHAO-WDEREUQCSA-N 0 1 394.212 3.115 10 0 GGAEMN CCn1nccc1CC[N@@H+]1C[C@@H](c2ccc(Br)cc2)[C@H](C(=O)[O-])C1 ZINC000563289297 566873023 /nfs/dbraw/zinc/87/30/23/566873023.db2.gz RBPGLMRVBBOZAK-DLBZAZTESA-N 0 1 392.297 3.008 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289661 566873095 /nfs/dbraw/zinc/87/30/95/566873095.db2.gz OCRKUDPRDJWHAO-GHMZBOCLSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289661 566873096 /nfs/dbraw/zinc/87/30/96/566873096.db2.gz OCRKUDPRDJWHAO-GHMZBOCLSA-N 0 1 394.212 3.115 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Nc2cc(C)cc(I)c2)n[nH]1 ZINC000490664904 566874724 /nfs/dbraw/zinc/87/47/24/566874724.db2.gz XMZQJMKBNCTXCB-JTQLQIEISA-N 0 1 398.248 3.384 10 0 GGAEMN COC[C@H]1CN(CCCC(=O)Nc2c(C)cc(Br)cc2C)CCO1 ZINC000679819368 566875274 /nfs/dbraw/zinc/87/52/74/566875274.db2.gz NSLLCQGRMUJIIO-MRXNPFEDSA-N 0 1 399.329 3.132 10 0 GGAEMN O=C(NC1(C(=O)Nc2ccccc2)CC1)c1n[nH]c2ccc(Br)cc21 ZINC000428761008 566876346 /nfs/dbraw/zinc/87/63/46/566876346.db2.gz BQDBMPLJVCDWSZ-UHFFFAOYSA-N 0 1 399.248 3.227 10 0 GGAEMN O=C(NCc1cccc(Br)c1Cl)N[C@@H]1CCc2nc[nH]c2C1 ZINC000563341097 566876579 /nfs/dbraw/zinc/87/65/79/566876579.db2.gz VQMUKZROJGTBGL-SNVBAGLBSA-N 0 1 383.677 3.182 10 0 GGAEMN CC(C)(NS(=O)(=O)c1onc(C2CC2)c1Cl)c1cc(C(F)(F)F)on1 ZINC000632361597 566876995 /nfs/dbraw/zinc/87/69/95/566876995.db2.gz FWNHSPFAMXEJOT-UHFFFAOYSA-N 0 1 399.778 3.426 10 0 GGAEMN NC(=O)c1ncc(Br)cc1NC[C@@H](c1ccco1)N1CCCCC1 ZINC000543398911 566878547 /nfs/dbraw/zinc/87/85/47/566878547.db2.gz RIIZNBSXSVVEBV-AWEZNQCLSA-N 0 1 393.285 3.175 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)[C@@H](C)Cc1cnc[nH]1 ZINC000563376366 566879984 /nfs/dbraw/zinc/87/99/84/566879984.db2.gz ITRIGYZLENTXFJ-JTQLQIEISA-N 0 1 377.491 3.358 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@H]1c1ccc(Br)s1 ZINC000582635806 566880143 /nfs/dbraw/zinc/88/01/43/566880143.db2.gz ZBOVGDUXSVSWHB-LBPRGKRZSA-N 0 1 395.388 3.319 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)[C@H](C)Cc1cnc[nH]1 ZINC000563376367 566880187 /nfs/dbraw/zinc/88/01/87/566880187.db2.gz ITRIGYZLENTXFJ-SNVBAGLBSA-N 0 1 377.491 3.358 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCc1n[nH]c([C@@H]2CCCO2)n1 ZINC000656208001 566884211 /nfs/dbraw/zinc/88/42/11/566884211.db2.gz KGKRXQQFCBKXHP-VIFPVBQESA-N 0 1 392.179 3.445 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCc1n[nH]c([C@H]2CCCO2)n1 ZINC000656207999 566884286 /nfs/dbraw/zinc/88/42/86/566884286.db2.gz KGKRXQQFCBKXHP-SECBINFHSA-N 0 1 392.179 3.445 10 0 GGAEMN O=c1[nH]cc(S(=O)(=O)N2CCCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)s1 ZINC000632433650 566885362 /nfs/dbraw/zinc/88/53/62/566885362.db2.gz ZSHPOBCUPQXJOU-GFCCVEGCSA-N 0 1 398.897 3.294 10 0 GGAEMN Fc1cc(CNCc2ccc(C(F)(F)F)s2)cnc1N1CCOCC1 ZINC000428874939 566886513 /nfs/dbraw/zinc/88/65/13/566886513.db2.gz BURILNAMBKIVRS-UHFFFAOYSA-N 0 1 375.391 3.427 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1CCOc1ccc(Cl)cc1Br ZINC000518471733 566886598 /nfs/dbraw/zinc/88/65/98/566886598.db2.gz VRXNICWVUJJIFV-GFCCVEGCSA-N 0 1 375.694 3.211 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1c(F)cncc1F ZINC000563467670 566887586 /nfs/dbraw/zinc/88/75/86/566887586.db2.gz CKCDAVXWNRLCQH-SSDOTTSWSA-N 0 1 381.180 3.490 10 0 GGAEMN CN(C)[C@H](CN1C(=O)N[C@@H](Cc2cccc(Cl)c2)C1=O)c1cccs1 ZINC000518742398 566900097 /nfs/dbraw/zinc/90/00/97/566900097.db2.gz UMEZNCYGSKLPSS-LSDHHAIUSA-N 0 1 377.897 3.167 10 0 GGAEMN O[C@@H]([C@H]1CCN(CCOc2cc(F)cc(Br)c2)C1)C(F)(F)F ZINC000451886872 566901167 /nfs/dbraw/zinc/90/11/67/566901167.db2.gz JFJMNKIJVPJRQQ-ZANVPECISA-N 0 1 386.183 3.212 10 0 GGAEMN CCOC(=O)C[C@H](O)CN1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000611238009 566903284 /nfs/dbraw/zinc/90/32/84/566903284.db2.gz WXYZFGDIJNXGEB-JSGCOSHPSA-N 0 1 376.280 3.151 10 0 GGAEMN Cc1cc(SCC(=O)N2CCN3CCC2CC3)c(C)cc1Br ZINC000470775711 566903395 /nfs/dbraw/zinc/90/33/95/566903395.db2.gz ZZUACGXTIDMIJI-UHFFFAOYSA-N 0 1 383.355 3.465 10 0 GGAEMN O=C1C[C@@H](N2CCC[C@H](CCF)C2)C(=O)N1c1ccc(Br)cc1 ZINC000656477137 566903511 /nfs/dbraw/zinc/90/35/11/566903511.db2.gz HCUSTNXHQKTBHM-IUODEOHRSA-N 0 1 383.261 3.153 10 0 GGAEMN C[C@@](N)(C(=O)NC[C@@H]1CC12CCSCC2)c1ccc(Br)cc1 ZINC000582903630 566903795 /nfs/dbraw/zinc/90/37/95/566903795.db2.gz LKTCSYNBXRCFLK-BBRMVZONSA-N 0 1 383.355 3.273 10 0 GGAEMN Clc1cnc(OCCNCc2cnnn2Cc2ccccc2)c(Cl)c1 ZINC000491396963 566904044 /nfs/dbraw/zinc/90/40/44/566904044.db2.gz ASMARQWUFHGOFD-UHFFFAOYSA-N 0 1 378.263 3.197 10 0 GGAEMN COc1cc(NC(=O)NC[C@@H](c2cccs2)N(C)C)ncc1Br ZINC000680367941 566903937 /nfs/dbraw/zinc/90/39/37/566903937.db2.gz CSURBARNFXVRBR-NSHDSACASA-N 0 1 399.314 3.339 10 0 GGAEMN C[C@H](NC(=O)CN1CCC[C@]2(CCOC2)C1)c1ccc(Br)cc1 ZINC000451907581 566904435 /nfs/dbraw/zinc/90/44/35/566904435.db2.gz XIDZPEXOSMVDJI-KSSFIOAISA-N 0 1 381.314 3.129 10 0 GGAEMN CCOc1cc(CN[C@]2(CO)CCc3ccccc32)cc(Br)c1O ZINC000656509569 566906125 /nfs/dbraw/zinc/90/61/25/566906125.db2.gz JSJHLKHMFIJMNY-IBGZPJMESA-N 0 1 392.293 3.477 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cccc(Br)c2Cl)CCN1C ZINC000563676569 566907285 /nfs/dbraw/zinc/90/72/85/566907285.db2.gz IQXGRQFSQSFXBP-QWRGUYRKSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@]1(c2cccc(Br)c2)C[C@H]1C(=O)NC1(c2nnc[nH]2)CCC1 ZINC000632709294 566908600 /nfs/dbraw/zinc/90/86/00/566908600.db2.gz OJUJGXDSXYXGJG-BBRMVZONSA-N 0 1 375.270 3.040 10 0 GGAEMN C[C@@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NC1(c2nnc[nH]2)CCC1 ZINC000632709295 566909055 /nfs/dbraw/zinc/90/90/55/566909055.db2.gz OJUJGXDSXYXGJG-CJNGLKHVSA-N 0 1 375.270 3.040 10 0 GGAEMN C[C@H](NCC(=O)N1CCC[C@H](C(F)(F)F)C1)[C@H]1OCCc2sccc21 ZINC000429120730 566909584 /nfs/dbraw/zinc/90/95/84/566909584.db2.gz IHSMDALHSSHIRX-MQIPJXDCSA-N 0 1 376.444 3.141 10 0 GGAEMN CC[C@@H]1CC[C@H](C)N(CC(=O)NCC(=O)Nc2ccccc2Br)C1 ZINC000451960018 566915344 /nfs/dbraw/zinc/91/53/44/566915344.db2.gz ZFPQDEFCOBYUJQ-UONOGXRCSA-N 0 1 396.329 3.014 10 0 GGAEMN C[C@H](C(=O)[O-])[C@H]([NH2+]Cc1cn(C2CCC2)nn1)c1ccc(Br)cc1 ZINC000656567586 566917518 /nfs/dbraw/zinc/91/75/18/566917518.db2.gz VXUYJBFTDYXKQE-ZBEGNZNMSA-N 0 1 393.285 3.317 10 0 GGAEMN NS(=O)(=O)c1ccc(CN[C@H]2CCc3ccc(F)cc32)cc1Br ZINC000583071742 566918142 /nfs/dbraw/zinc/91/81/42/566918142.db2.gz SGODTMSGNBEMOD-HNNXBMFYSA-N 0 1 399.285 3.013 10 0 GGAEMN NS(=O)(=O)c1ccc(CN[C@@H]2CCc3ccc(F)cc32)cc1Br ZINC000583071743 566918400 /nfs/dbraw/zinc/91/84/00/566918400.db2.gz SGODTMSGNBEMOD-OAHLLOKOSA-N 0 1 399.285 3.013 10 0 GGAEMN O=C(c1oc2ccccc2c1Br)N1CCC(c2n[nH]c(=O)o2)CC1 ZINC000632881054 566920776 /nfs/dbraw/zinc/92/07/76/566920776.db2.gz NTUWJZWSZBVXHN-UHFFFAOYSA-N 0 1 392.209 3.304 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1cc2cc(C)cc(Br)c2o1 ZINC000543912032 566921991 /nfs/dbraw/zinc/92/19/91/566921991.db2.gz CMTZUJVFNVPWLZ-AWEZNQCLSA-N 0 1 395.297 3.344 10 0 GGAEMN O=C(Cc1noc2ccc(Br)cc12)Nc1nc(C2CCC2)n[nH]1 ZINC000583140237 566923542 /nfs/dbraw/zinc/92/35/42/566923542.db2.gz UZEVCHLXOTWTHH-UHFFFAOYSA-N 0 1 376.214 3.157 10 0 GGAEMN O=C(Cc1noc2ccc(Br)cc12)Nc1n[nH]c(C2CCC2)n1 ZINC000583140237 566923548 /nfs/dbraw/zinc/92/35/48/566923548.db2.gz UZEVCHLXOTWTHH-UHFFFAOYSA-N 0 1 376.214 3.157 10 0 GGAEMN COC(=O)c1cc(C)ccc1S(=O)(=O)Nc1ccc(C(C)=O)c(Cl)c1 ZINC000543951747 566925323 /nfs/dbraw/zinc/92/53/23/566925323.db2.gz MLSKQUDRULTHPV-UHFFFAOYSA-N 0 1 381.837 3.438 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccc(OC(F)(F)F)cc1O)C1CCCC1 ZINC000656627469 566926113 /nfs/dbraw/zinc/92/61/13/566926113.db2.gz BJIUOAPAIYMRPX-AWEZNQCLSA-N 0 1 383.388 3.238 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccc(OC(F)(F)F)cc1O)C1CCCC1 ZINC000656627470 566926447 /nfs/dbraw/zinc/92/64/47/566926447.db2.gz BJIUOAPAIYMRPX-CQSZACIVSA-N 0 1 383.388 3.238 10 0 GGAEMN Fc1ccc2c(c1)C[C@H](NCc1cn3ccc(Br)cc3n1)CO2 ZINC000519236307 566927705 /nfs/dbraw/zinc/92/77/05/566927705.db2.gz STZRXVDCBVDXHM-AWEZNQCLSA-N 0 1 376.229 3.329 10 0 GGAEMN O=C(c1cc(-c2ccoc2)[nH]n1)N(CCO)Cc1cc(Br)cs1 ZINC000519275138 566928908 /nfs/dbraw/zinc/92/89/08/566928908.db2.gz GGAZBWISPFHQJW-UHFFFAOYSA-N 0 1 396.266 3.128 10 0 GGAEMN COC(=O)COc1cccc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)c1 ZINC000471109015 566929088 /nfs/dbraw/zinc/92/90/88/566929088.db2.gz UPXVBCNDGMWIKR-UHFFFAOYSA-N 0 1 387.816 3.140 10 0 GGAEMN COc1cccc(OC)c1S(=O)(=O)Nc1cnc(C(F)(F)F)c(C)c1 ZINC000656637017 566930262 /nfs/dbraw/zinc/93/02/62/566930262.db2.gz AUHLVICIOBHJKU-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN COc1ncccc1NS(=O)(=O)c1cccc(Br)c1Cl ZINC000563980859 566933228 /nfs/dbraw/zinc/93/32/28/566933228.db2.gz OYCOMSBLIVZUTI-UHFFFAOYSA-N 0 1 377.647 3.307 10 0 GGAEMN O=C(NCc1cn2cc(Cl)ccc2n1)c1cccc(Br)c1O ZINC000519333649 566934587 /nfs/dbraw/zinc/93/45/87/566934587.db2.gz FFYOPOPJEHIFLY-UHFFFAOYSA-N 0 1 380.629 3.386 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2[C@H]3Cc4c(cccc4Br)[C@@H]23)n[nH]1 ZINC000633130307 566935713 /nfs/dbraw/zinc/93/57/13/566935713.db2.gz HYINXIQLWNJZBR-ZLHYMXRASA-N 0 1 389.297 3.049 10 0 GGAEMN O[C@H](CNCc1cnc(C(F)(F)F)nc1)COc1c(Cl)cccc1Cl ZINC000656703087 566936237 /nfs/dbraw/zinc/93/62/37/566936237.db2.gz ALZUHAIDWOZHKY-SNVBAGLBSA-N 0 1 396.196 3.332 10 0 GGAEMN CN(CCCc1nc(-c2cccs2)no1)[C@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000471228139 566938067 /nfs/dbraw/zinc/93/80/67/566938067.db2.gz VACGXEHOGLTFEC-ZFWWWQNUSA-N 0 1 383.539 3.018 10 0 GGAEMN CN(C)[C@H](CNC(=O)C1(C(F)(F)F)CCOCC1)c1ccc(Cl)cc1 ZINC000611799562 566939901 /nfs/dbraw/zinc/93/99/01/566939901.db2.gz QAPQBZAQHLKLAA-CQSZACIVSA-N 0 1 378.822 3.418 10 0 GGAEMN COCc1cncc(C(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000680927838 566942453 /nfs/dbraw/zinc/94/24/53/566942453.db2.gz SCCHAIIZVNZVBF-UHFFFAOYSA-N 0 1 388.225 3.028 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(C)=O)c(Cl)c2)cc1C ZINC000611914633 566943659 /nfs/dbraw/zinc/94/36/59/566943659.db2.gz VEPOGJJNMLWRES-UHFFFAOYSA-N 0 1 381.837 3.438 10 0 GGAEMN Cc1ccc(Br)c(NS(=O)(=O)c2cccc3c2OCCCO3)n1 ZINC000656739581 566944547 /nfs/dbraw/zinc/94/45/47/566944547.db2.gz WKIPTAHIVVANGU-UHFFFAOYSA-N 0 1 399.266 3.115 10 0 GGAEMN Cc1nn(C(C)C)c(C)c1S(=O)(=O)Nc1nc(C)ccc1Br ZINC000656739322 566944570 /nfs/dbraw/zinc/94/45/70/566944570.db2.gz JSNFVZDTPZHJMD-UHFFFAOYSA-N 0 1 387.303 3.348 10 0 GGAEMN CN(Cc1ccccc1)[C@H]1CCN(S(=O)(=O)c2c(F)cccc2Cl)C1 ZINC000680975827 566945042 /nfs/dbraw/zinc/94/50/42/566945042.db2.gz OVBMPDNEBCTXID-HNNXBMFYSA-N 0 1 382.888 3.374 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NCCN(C)Cc1ccc(F)cc1 ZINC000611970429 566946858 /nfs/dbraw/zinc/94/68/58/566946858.db2.gz ALIDOBZXZNSSNZ-UHFFFAOYSA-N 0 1 380.261 3.153 10 0 GGAEMN Brc1ccc2c(c1)C=C(CN1CC[C@H](Nc3ncccn3)C1)CO2 ZINC000583382302 566946795 /nfs/dbraw/zinc/94/67/95/566946795.db2.gz ULXMHCQWESNBCI-INIZCTEOSA-N 0 1 387.281 3.201 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](C)CCc1ccc(Br)cc1 ZINC000564131352 566947952 /nfs/dbraw/zinc/94/79/52/566947952.db2.gz DUSNYUZZFHSFET-AWEZNQCLSA-N 0 1 391.375 3.031 10 0 GGAEMN CO[C@H](C[N@H+]1Cc2cccc(Br)c2C[C@H]1C(=O)[O-])C1CCCC1 ZINC000656757003 566948289 /nfs/dbraw/zinc/94/82/89/566948289.db2.gz QKCISZICUYMPAD-DLBZAZTESA-N 0 1 382.298 3.466 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](CCOc2ccc(Br)cc2)C1 ZINC000656757697 566948510 /nfs/dbraw/zinc/94/85/10/566948510.db2.gz ABJLBHLUAHWNPB-MNOVXSKESA-N 0 1 396.203 3.413 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1cccc(Cl)c1Br ZINC000493571785 566951242 /nfs/dbraw/zinc/95/12/42/566951242.db2.gz IMXOOUZZFSDJSO-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN O=C(Nc1cccc([C@@H]2CNC(=O)C2)c1)c1ccc(Br)c(O)c1 ZINC000493567561 566951326 /nfs/dbraw/zinc/95/13/26/566951326.db2.gz ULKVWGPSESKSPV-LBPRGKRZSA-N 0 1 375.222 3.011 10 0 GGAEMN COC1CCN(CCNC(=O)c2coc3c2cc(Br)cc3C)CC1 ZINC000681195735 566959108 /nfs/dbraw/zinc/95/91/08/566959108.db2.gz ZBOGLBBWQSRKCC-UHFFFAOYSA-N 0 1 395.297 3.344 10 0 GGAEMN C[C@@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C[C@@H](C)S1 ZINC000544391298 566959442 /nfs/dbraw/zinc/95/94/42/566959442.db2.gz STSZRALYDBSPJX-NXEZZACHSA-N 0 1 381.295 3.257 10 0 GGAEMN C[C@H]1SCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)[C@@H]1C ZINC000544389678 566960002 /nfs/dbraw/zinc/96/00/02/566960002.db2.gz ATCSQXCVYHZQRA-NXEZZACHSA-N 0 1 381.295 3.257 10 0 GGAEMN Cc1ncc(NS(=O)(=O)c2cccc(Br)c2F)c(C2CC2)n1 ZINC000583528675 566960341 /nfs/dbraw/zinc/96/03/41/566960341.db2.gz GJUIXIFXZPPNFB-UHFFFAOYSA-N 0 1 386.246 3.365 10 0 GGAEMN CCN1CCC(N(C)S(=O)(=O)c2cc(Cl)cc(Br)c2)CC1 ZINC000656869407 566961087 /nfs/dbraw/zinc/96/10/87/566961087.db2.gz CALMBKNTZZCGSJ-UHFFFAOYSA-N 0 1 395.750 3.207 10 0 GGAEMN C[C@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Br)c1nnc[nH]1 ZINC000493923882 566962354 /nfs/dbraw/zinc/96/23/54/566962354.db2.gz AHDQIRDMZHEQLG-LURJTMIESA-N 0 1 378.152 3.469 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000656873782 566962525 /nfs/dbraw/zinc/96/25/25/566962525.db2.gz MZERRBOUMYBLTM-HOCLYGCPSA-N 0 1 378.460 3.159 10 0 GGAEMN C[C@H]1CN(C(=O)c2cc(Br)c(F)cc2[O-])CC[N@H+](C2CCC2)C1 ZINC000452326539 566962908 /nfs/dbraw/zinc/96/29/08/566962908.db2.gz LSUUVGVXYYQJPJ-LLVKDONJSA-N 0 1 385.277 3.240 10 0 GGAEMN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000612303487 566963054 /nfs/dbraw/zinc/96/30/54/566963054.db2.gz HUUZAQMKFISLPO-HTRCEHHLSA-N 0 1 395.194 3.218 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000656881548 566964615 /nfs/dbraw/zinc/96/46/15/566964615.db2.gz XKBUWEFTQDAHCG-ZDUSSCGKSA-N 0 1 384.439 3.108 10 0 GGAEMN N=c1[nH]oc2cc(CNC(=O)[C@H]3[C@@H]4c5ccc(Br)cc5C[C@H]34)ccc12 ZINC000633466383 566964800 /nfs/dbraw/zinc/96/48/00/566964800.db2.gz UDBFMKSMWOSIJK-USXIJHARSA-N 0 1 398.260 3.205 10 0 GGAEMN O=C(c1cc(Br)ccc1F)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633524637 566967196 /nfs/dbraw/zinc/96/71/96/566967196.db2.gz NDNFLVRJUZYTSH-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)C(=O)c1ccc(F)cc1 ZINC000544523091 566968298 /nfs/dbraw/zinc/96/82/98/566968298.db2.gz OOQAGQLQHSDRML-UHFFFAOYSA-N 0 1 389.184 3.195 10 0 GGAEMN Cc1ccc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)c(Br)c1 ZINC000633527427 566968541 /nfs/dbraw/zinc/96/85/41/566968541.db2.gz UNVTZLUCLMQVOE-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN Cc1cccc(CN(CCN(C)C)S(=O)(=O)C[C@H](C)CC(F)(F)F)c1 ZINC000656895441 566968765 /nfs/dbraw/zinc/96/87/65/566968765.db2.gz VLEXOXXQUYCWKU-OAHLLOKOSA-N 0 1 380.476 3.277 10 0 GGAEMN Cc1cc(Br)c(C(=O)N2CCc3nc[nH]c3C23CCOCC3)s1 ZINC000633528066 566968833 /nfs/dbraw/zinc/96/88/33/566968833.db2.gz NCAJDRODICSVFI-UHFFFAOYSA-N 0 1 396.310 3.246 10 0 GGAEMN O=C(c1cccc(Br)c1F)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633527180 566968897 /nfs/dbraw/zinc/96/88/97/566968897.db2.gz LMQPZCVWECZIOQ-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN CSc1ccc(Cl)c(C(=O)N2CCc3nc[nH]c3C23CCOCC3)c1 ZINC000633525216 566969368 /nfs/dbraw/zinc/96/93/68/566969368.db2.gz XGYFAWBNQCKHMQ-UHFFFAOYSA-N 0 1 377.897 3.489 10 0 GGAEMN Cc1ncc(C(=O)N2CC[C@@H](Cc3cccc(I)c3)C2)[nH]1 ZINC000452366160 566969963 /nfs/dbraw/zinc/96/99/63/566969963.db2.gz IHPIWUICDPEGMK-ZDUSSCGKSA-N 0 1 395.244 3.028 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000656904664 566970915 /nfs/dbraw/zinc/97/09/15/566970915.db2.gz KSFCJWUTFLDCBI-ZBFHGGJFSA-N 0 1 378.460 3.159 10 0 GGAEMN O=C(NC[C@H]1CCCCN1CCO)c1sc2ccccc2c1Br ZINC000452380644 566971886 /nfs/dbraw/zinc/97/18/86/566971886.db2.gz SYYJUPBBGPTNJU-GFCCVEGCSA-N 0 1 397.338 3.240 10 0 GGAEMN COc1cc(Cl)c(Br)cc1C(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000429985009 566973284 /nfs/dbraw/zinc/97/32/84/566973284.db2.gz JKSYHMUWJKUDGG-CQSZACIVSA-N 0 1 387.705 3.277 10 0 GGAEMN C[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@H](C(F)(F)F)O1 ZINC000681405285 566973624 /nfs/dbraw/zinc/97/36/24/566973624.db2.gz WRWAFDHBUCFTCZ-QPUJVOFHSA-N 0 1 378.192 3.477 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1 ZINC000656921274 566973676 /nfs/dbraw/zinc/97/36/76/566973676.db2.gz MALFMWMAMCWIJT-GOEBONIOSA-N 0 1 378.460 3.111 10 0 GGAEMN Cc1ccnc(NC(=O)CN(C)Cc2nc3ccc(Br)cc3[nH]2)c1 ZINC000681402289 566973755 /nfs/dbraw/zinc/97/37/55/566973755.db2.gz CEGWXIVDYUSPCA-UHFFFAOYSA-N 0 1 388.269 3.099 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1 ZINC000656921272 566973780 /nfs/dbraw/zinc/97/37/80/566973780.db2.gz MALFMWMAMCWIJT-GDBMZVCRSA-N 0 1 378.460 3.111 10 0 GGAEMN Cc1cc(I)cc(NC(=O)N[C@H]2CCc3nc[nH]c3C2)c1 ZINC000583722547 566976024 /nfs/dbraw/zinc/97/60/24/566976024.db2.gz CWKJJCGNWHVTOC-NSHDSACASA-N 0 1 396.232 3.002 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)c[nH]2)C[C@H]1C(=O)[O-] ZINC000564453039 566976289 /nfs/dbraw/zinc/97/62/89/566976289.db2.gz LWXFJBMHVGQUAH-BXUZGUMPSA-N 0 1 378.270 3.382 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000656936234 566978185 /nfs/dbraw/zinc/97/81/85/566978185.db2.gz XRJHXPPAJHGFHV-HOCLYGCPSA-N 0 1 378.460 3.111 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000656936233 566978834 /nfs/dbraw/zinc/97/88/34/566978834.db2.gz XRJHXPPAJHGFHV-GOEBONIOSA-N 0 1 378.460 3.111 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc(OC)nc2C(F)(F)F)c(C)c1 ZINC000681548003 566982907 /nfs/dbraw/zinc/98/29/07/566982907.db2.gz AOBLXRBDNSEYDN-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3nc(C4CC4)ncc3Br)[nH]c21 ZINC000494285651 566983336 /nfs/dbraw/zinc/98/33/36/566983336.db2.gz RRYUFUSEGPTQDR-UHFFFAOYSA-N 0 1 386.253 3.231 10 0 GGAEMN O=C(Nc1nnc(C(F)(F)C(F)(F)F)s1)c1scc2c1OCCO2 ZINC000633731989 566985259 /nfs/dbraw/zinc/98/52/59/566985259.db2.gz ZZRYTXYIPWRNSA-UHFFFAOYSA-N 0 1 387.311 3.277 10 0 GGAEMN CCN1CCN(c2nnc(-c3ccccc3Br)n2CC2CC2)CC1 ZINC000612621023 566986031 /nfs/dbraw/zinc/98/60/31/566986031.db2.gz QGHRIWMNYCUKOT-UHFFFAOYSA-N 0 1 390.329 3.260 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNC(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1 ZINC000471920560 566987035 /nfs/dbraw/zinc/98/70/35/566987035.db2.gz UEOULNLZSCGOAY-CHWSQXEVSA-N 0 1 387.933 3.128 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000656992306 566992328 /nfs/dbraw/zinc/99/23/28/566992328.db2.gz BHXMEUHQVXEQKJ-IJEWVQPXSA-N 0 1 378.460 3.157 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2c(C)cccc2SC)cc1 ZINC000471991099 566993801 /nfs/dbraw/zinc/99/38/01/566993801.db2.gz GUOPOQBKSNIWDD-UHFFFAOYSA-N 0 1 385.532 3.311 10 0 GGAEMN CCc1ncc(CNC[C@@H](O)COc2ccc(Cl)cc2Br)o1 ZINC000583989868 567000833 /nfs/dbraw/zinc/00/08/33/567000833.db2.gz UCVDLEQBHUUKBU-LLVKDONJSA-N 0 1 389.677 3.182 10 0 GGAEMN C[C@@H](Sc1ccc(Br)cc1)C(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000520372175 567001312 /nfs/dbraw/zinc/00/13/12/567001312.db2.gz DSJICVLFMWKDTM-MLGOLLRUSA-N 0 1 383.355 3.482 10 0 GGAEMN COC(=O)C(C)(C)N1CCN(CC/C=C\c2ccc(Br)cc2)CC1 ZINC000494470480 567003000 /nfs/dbraw/zinc/00/30/00/567003000.db2.gz FPCHUWWQGBHFTM-XQRVVYSFSA-N 0 1 395.341 3.422 10 0 GGAEMN C[C@H](NC[C@@H]1CS(=O)(=O)c2ccccc2O1)c1cccc(Br)c1 ZINC000520406506 567003240 /nfs/dbraw/zinc/00/32/40/567003240.db2.gz JECBWYHEFMSVAW-SWLSCSKDSA-N 0 1 396.306 3.335 10 0 GGAEMN C[C@@H]1C[C@@]2(CCO1)CN(CCOc1cccc(Br)c1)C[C@@H](C)O2 ZINC000430278061 567003306 /nfs/dbraw/zinc/00/33/06/567003306.db2.gz HQLDGHZCLYAGJY-RKVPGOIHSA-N 0 1 384.314 3.486 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cccc(Br)c1F ZINC000430277774 567003971 /nfs/dbraw/zinc/00/39/71/567003971.db2.gz GYVAYQZNKXYJPB-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000452670517 567004617 /nfs/dbraw/zinc/00/46/17/567004617.db2.gz YOIJINUYZPNEKJ-GLQYFDAESA-N 0 1 378.270 3.091 10 0 GGAEMN CC(C)OCC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000472176571 567006692 /nfs/dbraw/zinc/00/66/92/567006692.db2.gz UUOXNUGXRVMQSZ-KRWDZBQOSA-N 0 1 389.367 3.330 10 0 GGAEMN C[C@@H](NC[C@H]1CS(=O)(=O)c2ccccc21)c1ccc(Br)cn1 ZINC000584035581 567007008 /nfs/dbraw/zinc/00/70/08/567007008.db2.gz LPSGHAWJNQYOHW-NEPJUHHUSA-N 0 1 381.295 3.066 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1cccc(Br)c1Cl ZINC000633988920 567008434 /nfs/dbraw/zinc/00/84/34/567008434.db2.gz CQHAHVGFMCORED-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1cc(Cl)cc(Br)c1 ZINC000633990436 567008916 /nfs/dbraw/zinc/00/89/16/567008916.db2.gz PVXICDYWQOELLI-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN Cc1cc(C(=O)NCc2n[nH]c(C3CCOCC3)n2)c(C)cc1Br ZINC000633990349 567008949 /nfs/dbraw/zinc/00/89/49/567008949.db2.gz NFUYGUKHRIZCQH-UHFFFAOYSA-N 0 1 393.285 3.008 10 0 GGAEMN Cc1ccc(C(=O)NCc2n[nH]c(C3CCOCC3)n2)c(C)c1Br ZINC000633990358 567009027 /nfs/dbraw/zinc/00/90/27/567009027.db2.gz NMGBPPRVCBNVJJ-UHFFFAOYSA-N 0 1 393.285 3.008 10 0 GGAEMN Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2nc([C@@H](N)CC(C)C)no2)s1 ZINC000564798574 567009585 /nfs/dbraw/zinc/00/95/85/567009585.db2.gz XZOVHOCUFPPJDF-STQMWFEESA-N 0 1 384.527 3.011 10 0 GGAEMN O=C(CCSc1ccc(Cl)cc1)NCc1n[nH]c(C2CCOCC2)n1 ZINC000634010523 567010244 /nfs/dbraw/zinc/01/02/44/567010244.db2.gz WRLLPGUOELEUEM-UHFFFAOYSA-N 0 1 380.901 3.151 10 0 GGAEMN O[C@H](CNCc1cn2cc(Cl)ccc2n1)COCc1ccccc1Cl ZINC000564845389 567013357 /nfs/dbraw/zinc/01/33/57/567013357.db2.gz XCMWBLKEWSQRJW-MRXNPFEDSA-N 0 1 380.275 3.308 10 0 GGAEMN CC(C)Cn1ccnc1CNCCC(=O)Nc1cccc(Br)c1 ZINC000564855337 567014637 /nfs/dbraw/zinc/01/46/37/567014637.db2.gz WGEUMXXHDNAQKU-UHFFFAOYSA-N 0 1 379.302 3.420 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@H](C)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000494655683 567014722 /nfs/dbraw/zinc/01/47/22/567014722.db2.gz LJDAZHNTBBDJHX-ZWNOBZJWSA-N 0 1 379.482 3.456 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000494657703 567014879 /nfs/dbraw/zinc/01/48/79/567014879.db2.gz VERLPFCYXVCNDJ-SMDDNHRTSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000494657702 567015327 /nfs/dbraw/zinc/01/53/27/567015327.db2.gz VERLPFCYXVCNDJ-RISCZKNCSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@H](C)C(=O)Nc1cccc(Br)c1 ZINC000494657700 567015382 /nfs/dbraw/zinc/01/53/82/567015382.db2.gz VERLPFCYXVCNDJ-BXUZGUMPSA-N 0 1 383.311 3.469 10 0 GGAEMN C[C@@H](O)C[C@@H]1CCCCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000584130042 567015924 /nfs/dbraw/zinc/01/59/24/567015924.db2.gz DYKNXCPHBDPMQV-YPMHNXCESA-N 0 1 380.286 3.481 10 0 GGAEMN CC(C)c1nc(CNC(=O)c2c(Cl)cc(F)cc2Br)n[nH]1 ZINC000452806215 567019579 /nfs/dbraw/zinc/01/95/79/567019579.db2.gz AYBHRVZSKGXQKV-UHFFFAOYSA-N 0 1 375.629 3.413 10 0 GGAEMN CC1=CCN(CCNC(=O)N(C)Cc2cc(Br)ccc2F)CC1 ZINC000545150730 567021665 /nfs/dbraw/zinc/02/16/65/567021665.db2.gz RAMVRXVLQVBJHR-UHFFFAOYSA-N 0 1 384.293 3.382 10 0 GGAEMN CCn1c2cc(Br)ccc2nc1NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613225702 567022831 /nfs/dbraw/zinc/02/28/31/567022831.db2.gz KGVZACFBJNHMMD-JTQLQIEISA-N 0 1 388.269 3.285 10 0 GGAEMN CCN(CCc1nccs1)C(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000564935251 567023071 /nfs/dbraw/zinc/02/30/71/567023071.db2.gz UTUGXIKVOVMQEJ-INIZCTEOSA-N 0 1 382.327 3.171 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000520779913 567023640 /nfs/dbraw/zinc/02/36/40/567023640.db2.gz ZHJVLPYPWHKUTR-VXGBXAGGSA-N 0 1 396.887 3.483 10 0 GGAEMN C[C@H]1C[C@H](Nc2ncnc3cccc(I)c32)C[N@H+]1C1CC1 ZINC000545163193 567024201 /nfs/dbraw/zinc/02/42/01/567024201.db2.gz AWMRTOJVSVECBC-QWRGUYRKSA-N 0 1 394.260 3.272 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613245293 567024938 /nfs/dbraw/zinc/02/49/38/567024938.db2.gz FUOYYGSHDPLFGO-NDGTYSDOSA-N 0 1 392.297 3.170 10 0 GGAEMN O=c1n2ccccc2nn1CCN1CC=C(c2cccc(Br)c2)CC1 ZINC000545171172 567025333 /nfs/dbraw/zinc/02/53/33/567025333.db2.gz LTEKJEZCGMTVBQ-UHFFFAOYSA-N 0 1 399.292 3.048 10 0 GGAEMN CCS(=O)(=O)N1CCC([C@@H](C)N(C)Cc2nc(C(C)(C)C)cs2)CC1 ZINC000584255803 567025956 /nfs/dbraw/zinc/02/59/56/567025956.db2.gz XWFQDBOAIAWVFY-CQSZACIVSA-N 0 1 387.615 3.323 10 0 GGAEMN C[C@]1(CNS(=O)(=O)c2cc(Br)c(F)cc2F)CC1(F)F ZINC000657155120 567026683 /nfs/dbraw/zinc/02/66/83/567026683.db2.gz GJJYELILQKDQMJ-SNVBAGLBSA-N 0 1 376.169 3.051 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N(C)Cc2ccc(Br)c(F)c2)n[nH]1 ZINC000494830012 567027372 /nfs/dbraw/zinc/02/73/72/567027372.db2.gz RVOIBEMQJQBFQS-SNVBAGLBSA-N 0 1 383.265 3.392 10 0 GGAEMN Cc1cccc(CN2CC[C@H](NC(=O)c3nscc3Br)C2)c1 ZINC000634274433 567027882 /nfs/dbraw/zinc/02/78/82/567027882.db2.gz IIVNKVQESBNUOQ-ZDUSSCGKSA-N 0 1 380.311 3.218 10 0 GGAEMN C[C@H](NCc1cccs1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430690884 567028814 /nfs/dbraw/zinc/02/88/14/567028814.db2.gz JJEUJBMBCWWFJP-VIFPVBQESA-N 0 1 375.313 3.009 10 0 GGAEMN COc1nc(N2CCN([C@@H]3CCc4ccccc43)CC2)ncc1Br ZINC000682071744 567028985 /nfs/dbraw/zinc/02/89/85/567028985.db2.gz FUVZIRMIANTKQU-MRXNPFEDSA-N 0 1 389.297 3.057 10 0 GGAEMN O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)[C@@H]1CCc2[nH]cnc2C1 ZINC000613306263 567030136 /nfs/dbraw/zinc/03/01/36/567030136.db2.gz YNBBMDGVERBNEN-NEPJUHHUSA-N 0 1 379.291 3.217 10 0 GGAEMN C[C@@H](NCc1cccc(F)c1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430702800 567030881 /nfs/dbraw/zinc/03/08/81/567030881.db2.gz ZYOPPJZIAVYLLB-SNVBAGLBSA-N 0 1 387.274 3.086 10 0 GGAEMN CN(C)[C@H](CNc1cc(Br)cnc1C(N)=O)c1ccccc1Cl ZINC000472502347 567030899 /nfs/dbraw/zinc/03/08/99/567030899.db2.gz PTPMUPBCMXZKSD-CQSZACIVSA-N 0 1 397.704 3.311 10 0 GGAEMN C[C@@H](NCc1ccsc1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430724488 567031173 /nfs/dbraw/zinc/03/11/73/567031173.db2.gz RDTAXWOODZKGCD-SECBINFHSA-N 0 1 375.313 3.009 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc2c(ccc(F)c2Br)[nH]1 ZINC000584298754 567031207 /nfs/dbraw/zinc/03/12/07/567031207.db2.gz JGTKIKZFCVJQAI-MRVPVSSYSA-N 0 1 377.217 3.080 10 0 GGAEMN CC(C)(C)OC(=O)[C@@H]1CCCN(C(=O)c2cccc(Br)c2O)C1 ZINC000545254998 567033479 /nfs/dbraw/zinc/03/34/79/567033479.db2.gz AVMKKZHOJYODFV-LLVKDONJSA-N 0 1 384.270 3.349 10 0 GGAEMN Cn1cc(C[C@@H]2CCC[C@H]2NS(=O)(=O)c2c(Cl)ccc(F)c2F)cn1 ZINC000657180133 567033568 /nfs/dbraw/zinc/03/35/68/567033568.db2.gz ZTWYMTTTYCXCNA-SMDDNHRTSA-N 0 1 389.855 3.041 10 0 GGAEMN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC[C@@H](c2ccncn2)C1 ZINC000613380585 567034595 /nfs/dbraw/zinc/03/45/95/567034595.db2.gz IORDOYXLTDVDLW-ZIAGYGMSSA-N 0 1 382.291 3.403 10 0 GGAEMN O[C@H](COc1ccc(Cl)c(Cl)c1)CN1CCC[C@H](c2ccncn2)C1 ZINC000613380928 567035395 /nfs/dbraw/zinc/03/53/95/567035395.db2.gz RCAVZCNJBPMQFQ-KBPBESRZSA-N 0 1 382.291 3.403 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](O)[C@H]2CCCC[C@@H]21 ZINC000634492700 567036034 /nfs/dbraw/zinc/03/60/34/567036034.db2.gz KHIPWHLJWWYEMW-CQDKDKBSSA-N 0 1 378.270 3.091 10 0 GGAEMN CC1(C)NC(=O)CC[C@@H]1NCc1ccc(Cl)cc1I ZINC000494976094 567035873 /nfs/dbraw/zinc/03/58/73/567035873.db2.gz FSBHMEXKHHYIQU-LBPRGKRZSA-N 0 1 392.668 3.091 10 0 GGAEMN C[C@@H]1CCCN1S(=O)(=O)Nc1cc(-c2ccc(Br)s2)n[nH]1 ZINC000545314184 567038173 /nfs/dbraw/zinc/03/81/73/567038173.db2.gz OYRMPGNHCBFZGS-MRVPVSSYSA-N 0 1 391.316 3.042 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)NC[C@@H](c1ccco1)N1CCCC1 ZINC000430889957 567038558 /nfs/dbraw/zinc/03/85/58/567038558.db2.gz QNFPIDHOLHZKHP-HNNXBMFYSA-N 0 1 393.281 3.244 10 0 GGAEMN CN(Cc1ccccc1)C[C@H](N)c1nc(-c2ccc(Br)o2)no1 ZINC000634555094 567038822 /nfs/dbraw/zinc/03/88/22/567038822.db2.gz ZZJJROVSNQVGQQ-LBPRGKRZSA-N 0 1 377.242 3.224 10 0 GGAEMN CO[C@H](CSc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCOC1 ZINC000657233018 567039862 /nfs/dbraw/zinc/03/98/62/567039862.db2.gz PRLAXTXKGGODQQ-DGCLKSJQSA-N 0 1 384.299 3.378 10 0 GGAEMN NC(=O)[C@@H](NCC1([C@H]2CCCCO2)CCC1)c1ccc(Br)cc1 ZINC000634579286 567039821 /nfs/dbraw/zinc/03/98/21/567039821.db2.gz BMDYLLNIEHQFOV-CVEARBPZSA-N 0 1 381.314 3.305 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2c(Br)ccc(F)c2C1 ZINC000613493182 567041113 /nfs/dbraw/zinc/04/11/13/567041113.db2.gz SFDQUAKXSWGKGI-JTQLQIEISA-N 0 1 378.245 3.001 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SC[C@@H](O)C[C@](C)(O)C2CC2)n1 ZINC000634638996 567042276 /nfs/dbraw/zinc/04/22/76/567042276.db2.gz ZWRIYZFDGAOBLN-SJCJKPOMSA-N 0 1 383.901 3.138 10 0 GGAEMN O=c1c2c([n-]n1-c1cncc(Br)c1)CC[N@H+](Cc1ccccc1)C2 ZINC000634620495 567042893 /nfs/dbraw/zinc/04/28/93/567042893.db2.gz GFPCPQAHPURSAL-MRXNPFEDSA-N 0 1 385.265 3.069 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SC[C@@H](O)C[C@@](C)(O)C2CC2)n1 ZINC000634638998 567042968 /nfs/dbraw/zinc/04/29/68/567042968.db2.gz ZWRIYZFDGAOBLN-YVEFUNNKSA-N 0 1 383.901 3.138 10 0 GGAEMN CCCOc1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cn1 ZINC000521135890 567043163 /nfs/dbraw/zinc/04/31/63/567043163.db2.gz YKZTWIIYYICYKE-UHFFFAOYSA-N 0 1 389.253 3.439 10 0 GGAEMN O[C@@H](CNCc1cnc(C(F)(F)F)nc1)COc1cc(Cl)cc(Cl)c1 ZINC000634649007 567044760 /nfs/dbraw/zinc/04/47/60/567044760.db2.gz DMXMPRQKCLKVLK-LBPRGKRZSA-N 0 1 396.196 3.332 10 0 GGAEMN COc1cccc([C@H](CNCc2c(F)cncc2Br)N(C)C)c1 ZINC000657285402 567044806 /nfs/dbraw/zinc/04/48/06/567044806.db2.gz CADBXDLETIXBON-KRWDZBQOSA-N 0 1 382.277 3.384 10 0 GGAEMN Cc1oc(C[N@@H+](C)C[C@@H](O)COc2c(Cl)cccc2Cl)cc1C(=O)[O-] ZINC000584475669 567045548 /nfs/dbraw/zinc/04/55/48/567045548.db2.gz UKBCHDCJIAZBHY-LLVKDONJSA-N 0 1 388.247 3.465 10 0 GGAEMN CCSc1cccc(F)c1NS(=O)(=O)c1c(C(F)(F)F)cnn1C ZINC000634657911 567045848 /nfs/dbraw/zinc/04/58/48/567045848.db2.gz HKOGBBOWRZCRQF-UHFFFAOYSA-N 0 1 383.392 3.491 10 0 GGAEMN CCCCn1cc(S(=O)(=O)Nc2nccc(C)c2Br)c(C)n1 ZINC000634659126 567047077 /nfs/dbraw/zinc/04/70/77/567047077.db2.gz XKDVVIUAISSVFD-UHFFFAOYSA-N 0 1 387.303 3.258 10 0 GGAEMN Brc1ccc(N2CC[C@H](NCc3cn(C4CCC4)nn3)C2)cc1 ZINC000657354984 567049741 /nfs/dbraw/zinc/04/97/41/567049741.db2.gz XYRFKJMUYHIVJI-AWEZNQCLSA-N 0 1 376.302 3.134 10 0 GGAEMN COc1cc(CNCc2c(C(F)(F)F)cnn2C)cc(Br)c1O ZINC000657343984 567049892 /nfs/dbraw/zinc/04/98/92/567049892.db2.gz FTDJMPLRQAUFOH-UHFFFAOYSA-N 0 1 394.191 3.205 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1CC[C@@H](OC)C[C@@H]1C(=O)[O-] ZINC000565255445 567051599 /nfs/dbraw/zinc/05/15/99/567051599.db2.gz SBFJGPWTYIGTAR-HUUCEWRRSA-N 0 1 386.286 3.302 10 0 GGAEMN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccsc1 ZINC000453068383 567051653 /nfs/dbraw/zinc/05/16/53/567051653.db2.gz AURNDAHXDXOMIZ-OAHLLOKOSA-N 0 1 386.564 3.071 10 0 GGAEMN Brc1ccccc1N1CC[C@H](NCc2cn(C3CCC3)nn2)C1 ZINC000657356755 567051940 /nfs/dbraw/zinc/05/19/40/567051940.db2.gz NNPXWNFOPRWAPL-ZDUSSCGKSA-N 0 1 376.302 3.134 10 0 GGAEMN O[C@@H](CN[C@H](c1ccsc1)c1ccc(Cl)cc1)CC1(O)CCOCC1 ZINC000634700927 567053249 /nfs/dbraw/zinc/05/32/49/567053249.db2.gz HRIPCVKTDNKCLQ-MSOLQXFVSA-N 0 1 381.925 3.373 10 0 GGAEMN CC(C)n1ccnc1CNCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000657389826 567054119 /nfs/dbraw/zinc/05/41/19/567054119.db2.gz PDBJVQTZHYXXCE-UHFFFAOYSA-N 0 1 375.274 3.301 10 0 GGAEMN CC(C)n1ccnc1CNCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000657389826 567054121 /nfs/dbraw/zinc/05/41/21/567054121.db2.gz PDBJVQTZHYXXCE-UHFFFAOYSA-N 0 1 375.274 3.301 10 0 GGAEMN Cc1ccc2c([n-]cc(C(=O)N(C)Cc3ccc(Br)o3)c2=O)[nH+]1 ZINC000613674259 567055270 /nfs/dbraw/zinc/05/52/70/567055270.db2.gz CXIBFZVKNJNWPZ-UHFFFAOYSA-N 0 1 376.210 3.272 10 0 GGAEMN C[S@](=O)c1cccc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)c1 ZINC000613705007 567056759 /nfs/dbraw/zinc/05/67/59/567056759.db2.gz CLWRFCZPYRGABK-BZQUYTCOSA-N 0 1 376.547 3.128 10 0 GGAEMN CN1CCC[C@H](CNC(=O)c2cccc([S@@](C)=O)c2)[C@H]1c1cccs1 ZINC000613711006 567057227 /nfs/dbraw/zinc/05/72/27/567057227.db2.gz XXVWPTOCNLNVQK-HYGPGOAJSA-N 0 1 376.547 3.298 10 0 GGAEMN OC[C@]1(CNCc2c(F)cncc2Br)C[C@H]1c1ccc(F)cc1 ZINC000657449206 567057831 /nfs/dbraw/zinc/05/78/31/567057831.db2.gz QZWBETNMJMKCRR-WMLDXEAASA-N 0 1 383.236 3.378 10 0 GGAEMN OC[C@@]1(CNCc2c(F)cncc2Br)C[C@H]1c1ccc(F)cc1 ZINC000657449207 567058437 /nfs/dbraw/zinc/05/84/37/567058437.db2.gz QZWBETNMJMKCRR-YOEHRIQHSA-N 0 1 383.236 3.378 10 0 GGAEMN O[C@H]1CC[N@@H+](Cc2cccc(NCc3c(F)cncc3Br)c2)C1 ZINC000657471884 567060154 /nfs/dbraw/zinc/06/01/54/567060154.db2.gz CSSFLUDAJLSBJY-AWEZNQCLSA-N 0 1 380.261 3.162 10 0 GGAEMN Cc1c(Br)cccc1C[C@H](CO)CNCc1cn(C2CCC2)nn1 ZINC000657485847 567060388 /nfs/dbraw/zinc/06/03/88/567060388.db2.gz SIFPFIDGNWFIFD-AWEZNQCLSA-N 0 1 393.329 3.015 10 0 GGAEMN C[C@H]1CCN(CC(=O)Nc2ccc(CCn3cc(Br)cn3)cc2)C1 ZINC000584730999 567064630 /nfs/dbraw/zinc/06/46/30/567064630.db2.gz VUTZXSJFKGFEON-AWEZNQCLSA-N 0 1 391.313 3.169 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccccc1Br)N1CCN(CC2CC2)CC1 ZINC000431190459 567065734 /nfs/dbraw/zinc/06/57/34/567065734.db2.gz BANWJOWRDNNBFO-DOTOQJQBSA-N 0 1 378.314 3.042 10 0 GGAEMN CC(C)(C)[N@@H+]1CC[C@H]1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000657527640 567065637 /nfs/dbraw/zinc/06/56/37/567065637.db2.gz WYQNAEMLVDBUJO-KRWDZBQOSA-N 0 1 396.373 3.248 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613864978 567067446 /nfs/dbraw/zinc/06/74/46/567067446.db2.gz BQRNMMXUBJJNEU-GHMZBOCLSA-N 0 1 378.270 3.163 10 0 GGAEMN CSc1n[nH]c(NC(=O)c2cc(CNC(=O)C(C)(C)C)ccc2Cl)n1 ZINC000565435805 567067814 /nfs/dbraw/zinc/06/78/14/567067814.db2.gz GHIRKNUYCWACSE-UHFFFAOYSA-N 0 1 381.889 3.095 10 0 GGAEMN COc1ccc(CNCc2ccc(CNC(C)=O)cc2)c(Br)c1 ZINC000657545002 567068024 /nfs/dbraw/zinc/06/80/24/567068024.db2.gz VMLGXMCFNVTNKX-UHFFFAOYSA-N 0 1 377.282 3.384 10 0 GGAEMN COc1cc(CNCc2cnc(C(F)(F)F)nc2)cc(Br)c1O ZINC000657550206 567068761 /nfs/dbraw/zinc/06/87/61/567068761.db2.gz MEFIDGABNXQAAK-UHFFFAOYSA-N 0 1 392.175 3.262 10 0 GGAEMN CS(=O)(=O)CC1(CCNCc2csc(COc3ccccc3)n2)CC1 ZINC000657547364 567069013 /nfs/dbraw/zinc/06/90/13/567069013.db2.gz FVQHDBPWOVUPNB-UHFFFAOYSA-N 0 1 380.535 3.027 10 0 GGAEMN O=C(NCc1cc(Cl)ccc1Br)N[C@H]1CCc2nc[nH]c2C1 ZINC000521617322 567069248 /nfs/dbraw/zinc/06/92/48/567069248.db2.gz BBCMFQXFLITZDC-NSHDSACASA-N 0 1 383.677 3.182 10 0 GGAEMN Cc1ccc2nc(NC(=O)c3ccc(Cl)c(NS(C)(=O)=O)c3)[nH]c2c1 ZINC000584771801 567069396 /nfs/dbraw/zinc/06/93/96/567069396.db2.gz FRZHODUNJZKHPI-UHFFFAOYSA-N 0 1 378.841 3.149 10 0 GGAEMN CCn1c(-c2ccccc2Br)nnc1N1CCN(C(C)C)CC1 ZINC000584791816 567070094 /nfs/dbraw/zinc/07/00/94/567070094.db2.gz GVXZZUNPXAJRHM-UHFFFAOYSA-N 0 1 378.318 3.258 10 0 GGAEMN COc1cc(CN(C)C(=O)c2cccc(Br)c2O)cc(OC)c1 ZINC000521646093 567070309 /nfs/dbraw/zinc/07/03/09/567070309.db2.gz LYZJOVJPTKSMMR-UHFFFAOYSA-N 0 1 380.238 3.444 10 0 GGAEMN OC[C@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1cccnc1 ZINC000584803077 567072624 /nfs/dbraw/zinc/07/26/24/567072624.db2.gz ZRDRDKMJLWSXMV-HNNXBMFYSA-N 0 1 387.281 3.100 10 0 GGAEMN COCc1nc(CNCc2cc(Br)cc(C(F)(F)F)c2)n[nH]1 ZINC000657608367 567073857 /nfs/dbraw/zinc/07/38/57/567073857.db2.gz WHSHZIDULWQBTM-UHFFFAOYSA-N 0 1 379.180 3.022 10 0 GGAEMN COCc1nc(CNCc2ccc(-c3ccc(Br)cc3)o2)n[nH]1 ZINC000657604246 567074155 /nfs/dbraw/zinc/07/41/55/567074155.db2.gz BGRYZKXBEDRXGA-UHFFFAOYSA-N 0 1 377.242 3.263 10 0 GGAEMN Cc1cc(Br)cc2c(=O)c(-c3noc([C@@H]4CC[N@H+](C)C4)n3)c[n-]c12 ZINC000545762601 567074300 /nfs/dbraw/zinc/07/43/00/567074300.db2.gz BLXRMHPWESQUFR-SNVBAGLBSA-N 0 1 389.253 3.068 10 0 GGAEMN Cc1ccc(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c(C)c1Br ZINC000682856457 567075735 /nfs/dbraw/zinc/07/57/35/567075735.db2.gz PNYWMCMWKNOOJN-KBPBESRZSA-N 0 1 383.330 3.295 10 0 GGAEMN O=C(Nc1ccc2nc(N3CCOCC3)[nH]c2c1)c1coc(Br)c1 ZINC000614041336 567078759 /nfs/dbraw/zinc/07/87/59/567078759.db2.gz HIEQFALLGFDJOT-UHFFFAOYSA-N 0 1 391.225 3.007 10 0 GGAEMN C[C@H]1CC[C@H](NCC2=Cc3cc(Cl)cc(Cl)c3OC2)CS1(=O)=O ZINC000657640065 567080573 /nfs/dbraw/zinc/08/05/73/567080573.db2.gz WXMAUPAYWPWEAR-HZMBPMFUSA-N 0 1 376.305 3.325 10 0 GGAEMN CN(C)c1ncc(CN[C@@H]2CSCc3ccc(Br)cc32)cn1 ZINC000657641534 567080651 /nfs/dbraw/zinc/08/06/51/567080651.db2.gz FRHZKJMXNOMVFX-OAHLLOKOSA-N 0 1 379.327 3.383 10 0 GGAEMN COCCn1cc(CN[C@@H]2CSCc3ccc(Br)cc32)cn1 ZINC000657642146 567080861 /nfs/dbraw/zinc/08/08/61/567080861.db2.gz VJJDDIQNRXOXAA-MRXNPFEDSA-N 0 1 382.327 3.370 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000545862994 567081187 /nfs/dbraw/zinc/08/11/87/567081187.db2.gz KPDKZQGHZRZBSQ-UHFFFAOYSA-N 0 1 399.276 3.373 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)NCCN1CC=C(C)CC1 ZINC000545862994 567081198 /nfs/dbraw/zinc/08/11/98/567081198.db2.gz KPDKZQGHZRZBSQ-UHFFFAOYSA-N 0 1 399.276 3.373 10 0 GGAEMN CC1=CC[N@@H+](CCNC(=O)N(C)CCc2ccc(Br)cc2)CC1 ZINC000545859056 567081415 /nfs/dbraw/zinc/08/14/15/567081415.db2.gz PCAIFTZXAQUFIJ-UHFFFAOYSA-N 0 1 380.330 3.285 10 0 GGAEMN CC1=CCN(CCNC(=O)N(C)CCc2ccc(Br)cc2)CC1 ZINC000545859056 567081423 /nfs/dbraw/zinc/08/14/23/567081423.db2.gz PCAIFTZXAQUFIJ-UHFFFAOYSA-N 0 1 380.330 3.285 10 0 GGAEMN Cc1noc(C)c1CO[C@H]1CCN(C(=O)c2cccc(Br)c2O)C1 ZINC000545865974 567081899 /nfs/dbraw/zinc/08/18/99/567081899.db2.gz PRNHCVJJAPHZGB-LBPRGKRZSA-N 0 1 395.253 3.191 10 0 GGAEMN CC1=CC[N@@H+](CCNC(=O)N[C@H]2CCc3c2cccc3Br)CC1 ZINC000545858676 567081989 /nfs/dbraw/zinc/08/19/89/567081989.db2.gz KMMMZYDJOICFEN-KRWDZBQOSA-N 0 1 378.314 3.388 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@H]2CCc3c2cccc3Br)CC1 ZINC000545858676 567081994 /nfs/dbraw/zinc/08/19/94/567081994.db2.gz KMMMZYDJOICFEN-KRWDZBQOSA-N 0 1 378.314 3.388 10 0 GGAEMN COc1cc(Br)ccc1CNCC1(S(C)(=O)=O)CCCCC1 ZINC000657656339 567082565 /nfs/dbraw/zinc/08/25/65/567082565.db2.gz KQGYBKPBOAWVQA-UHFFFAOYSA-N 0 1 390.343 3.295 10 0 GGAEMN CC1=CCN(CCNC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)CC1 ZINC000545869351 567083230 /nfs/dbraw/zinc/08/32/30/567083230.db2.gz HWKGXNMQOWFXPN-UHFFFAOYSA-N 0 1 390.281 3.085 10 0 GGAEMN OC(CNCc1c(Br)cncc1Br)(C1CC1)C1CC1 ZINC000657699441 567085824 /nfs/dbraw/zinc/08/58/24/567085824.db2.gz IPVIOCFIJYSQPC-UHFFFAOYSA-N 0 1 390.119 3.247 10 0 GGAEMN COC(=O)[C@@H](Sc1nc(-c2ccc(OC)c(Br)c2)n[nH]1)C1CC1 ZINC000473524675 567085907 /nfs/dbraw/zinc/08/59/07/567085907.db2.gz PIJGGMLFBWDSCB-LBPRGKRZSA-N 0 1 398.282 3.287 10 0 GGAEMN COC(=O)[C@H](Sc1nc(-c2ccc(OC)c(Br)c2)n[nH]1)C1CC1 ZINC000473524673 567086613 /nfs/dbraw/zinc/08/66/13/567086613.db2.gz PIJGGMLFBWDSCB-GFCCVEGCSA-N 0 1 398.282 3.287 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000635245555 567087092 /nfs/dbraw/zinc/08/70/92/567087092.db2.gz MLCBRBBPPMHMSY-CHWSQXEVSA-N 0 1 385.265 3.342 10 0 GGAEMN Cc1cncc(CCNCc2c(Br)cncc2Br)n1 ZINC000657713222 567087305 /nfs/dbraw/zinc/08/73/05/567087305.db2.gz NILFTRUVNMSHGX-UHFFFAOYSA-N 0 1 386.091 3.037 10 0 GGAEMN Cc1cncc(CCNCc2ncc(Br)cc2Br)n1 ZINC000657712985 567087483 /nfs/dbraw/zinc/08/74/83/567087483.db2.gz IGRDTQKMIDJRLN-UHFFFAOYSA-N 0 1 386.091 3.037 10 0 GGAEMN OC[C@]1(NCc2ccc(Br)o2)CCCN(Cc2ccccc2)C1 ZINC000682943370 567087513 /nfs/dbraw/zinc/08/75/13/567087513.db2.gz UWMCBXAFQGLPTH-SFHVURJKSA-N 0 1 379.298 3.159 10 0 GGAEMN CN(C)[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1ccsc1 ZINC000521967851 567089616 /nfs/dbraw/zinc/08/96/16/567089616.db2.gz GUTPTWJYCZEOHY-CQSZACIVSA-N 0 1 393.310 3.420 10 0 GGAEMN O=C(N[C@@H]1CSc2ccc(Br)cc21)[C@@H]1CCc2[nH]cnc2C1 ZINC000614150838 567089759 /nfs/dbraw/zinc/08/97/59/567089759.db2.gz SQNYUGQXMDJDMJ-YMTOWFKASA-N 0 1 378.295 3.240 10 0 GGAEMN C[C@@]1(CNC(=O)c2n[nH]c3ccc(Br)cc32)CCO[C@@H]1C1CC1 ZINC000545953763 567091677 /nfs/dbraw/zinc/09/16/77/567091677.db2.gz SEDAZAKEGQNGHU-WBVHZDCISA-N 0 1 378.270 3.260 10 0 GGAEMN CCS(=O)(=O)C1(CNCC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000657758059 567092815 /nfs/dbraw/zinc/09/28/15/567092815.db2.gz WYSWUXUGIFIDHM-UHFFFAOYSA-N 0 1 376.305 3.326 10 0 GGAEMN CC(C)OC(=O)CC[C@@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000473623014 567093456 /nfs/dbraw/zinc/09/34/56/567093456.db2.gz OAEMKFAYKGIPRP-SNVBAGLBSA-N 0 1 382.258 3.176 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1 ZINC000473624499 567093668 /nfs/dbraw/zinc/09/36/68/567093668.db2.gz AXJPPVNMSZOUOX-XHDPSFHLSA-N 0 1 378.245 3.335 10 0 GGAEMN COc1cc(Br)c(CNCC2(O)CCC(F)(F)CC2)c(OC)c1 ZINC000657777391 567095201 /nfs/dbraw/zinc/09/52/01/567095201.db2.gz OMWVFKHYVFZOQV-UHFFFAOYSA-N 0 1 394.256 3.496 10 0 GGAEMN O=C(c1cc(=O)c2cc(Br)ccc2[nH]1)N1CCOc2ccccc21 ZINC000522148419 567101344 /nfs/dbraw/zinc/10/13/44/567101344.db2.gz OMPCQUHCLYMQDA-UHFFFAOYSA-N 0 1 385.217 3.330 10 0 GGAEMN CCOC(=O)COc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C)cc1 ZINC000522166737 567103772 /nfs/dbraw/zinc/10/37/72/567103772.db2.gz NDVPUVCSKYOXLV-UHFFFAOYSA-N 0 1 383.853 3.391 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)s[n-]1 ZINC000473825570 567104514 /nfs/dbraw/zinc/10/45/14/567104514.db2.gz CIPDWVVEAZATKT-CHWSQXEVSA-N 0 1 379.555 3.381 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)s[n-]1 ZINC000473825572 567105369 /nfs/dbraw/zinc/10/53/69/567105369.db2.gz CIPDWVVEAZATKT-QWHCGFSZSA-N 0 1 379.555 3.381 10 0 GGAEMN C[C@@H](NCCNS(=O)(=O)c1ccc(Cl)s1)c1cc2cnccc2o1 ZINC000657929159 567105643 /nfs/dbraw/zinc/10/56/43/567105643.db2.gz CSTFJZYJIXSHQM-SNVBAGLBSA-N 0 1 385.898 3.172 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)s[n-]1 ZINC000473845458 567106272 /nfs/dbraw/zinc/10/62/72/567106272.db2.gz WWHMEXJEQYQAEW-YPMHNXCESA-N 0 1 379.555 3.239 10 0 GGAEMN O=C(N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)[C@H]1CCc2[nH]cnc2C1 ZINC000614358928 567106803 /nfs/dbraw/zinc/10/68/03/567106803.db2.gz AYPIQFQZFJKTTF-AVGNSLFASA-N 0 1 392.272 3.479 10 0 GGAEMN C[N@@H+](CCCNC(=O)Cc1ccc(Br)cc1O)C1CCCCC1 ZINC000431789500 567106998 /nfs/dbraw/zinc/10/69/98/567106998.db2.gz RZBHMXNOHAQJPS-UHFFFAOYSA-N 0 1 383.330 3.468 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)C[C@@H](C)c2ccc(Br)cc2)C1 ZINC000431785165 567107432 /nfs/dbraw/zinc/10/74/32/567107432.db2.gz MVNWLVMITZQIDD-QAPCUYQASA-N 0 1 397.357 3.416 10 0 GGAEMN Cc1cc(S(=O)(=O)NCCN[C@H](C)c2cc3cnccc3o2)c(C)s1 ZINC000657930296 567107528 /nfs/dbraw/zinc/10/75/28/567107528.db2.gz MSKWUADBEWDYNY-GFCCVEGCSA-N 0 1 379.507 3.135 10 0 GGAEMN Cc1ncc(C(=O)N2CCC[C@@H]2c2ccccc2I)[nH]1 ZINC000522243012 567108780 /nfs/dbraw/zinc/10/87/80/567108780.db2.gz HPLARTJHUQCCIW-CQSZACIVSA-N 0 1 381.217 3.300 10 0 GGAEMN O=C1CCCN1CCCN1CCC[C@H]1c1ccccc1I ZINC000522245703 567108811 /nfs/dbraw/zinc/10/88/11/567108811.db2.gz XAUNNOOGBFCEBZ-INIZCTEOSA-N 0 1 398.288 3.441 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1cnccc1N(C)C ZINC000546134997 567109211 /nfs/dbraw/zinc/10/92/11/567109211.db2.gz MEXJGBBBWDPFRG-SJKOYZFVSA-N 0 1 392.297 3.416 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC[C@H](N3CCOCC3)CC2)c(Br)c1 ZINC000614431792 567110017 /nfs/dbraw/zinc/11/00/17/567110017.db2.gz FZGXMDRIJHHHFR-KRWDZBQOSA-N 0 1 395.341 3.013 10 0 GGAEMN O=C(c1c(Cl)cc(F)cc1Cl)N1CCN(CC2CCOCC2)CC1 ZINC000431845114 567112147 /nfs/dbraw/zinc/11/21/47/567112147.db2.gz NZHNAPMJYWLXOZ-UHFFFAOYSA-N 0 1 375.271 3.317 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)C(C)(C)c2cccc(Br)c2)C[C@@H](C)O1 ZINC000588081083 567112252 /nfs/dbraw/zinc/11/22/52/567112252.db2.gz JOXQXJGKUAFTJC-HUUCEWRRSA-N 0 1 397.357 3.342 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635810296 567113736 /nfs/dbraw/zinc/11/37/36/567113736.db2.gz RUOLSBUUDGUEKJ-ZIAGYGMSSA-N 0 1 378.270 3.033 10 0 GGAEMN COCc1csc(NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)n1 ZINC000522439260 567117192 /nfs/dbraw/zinc/11/71/92/567117192.db2.gz MZHDYAKOPRUHGT-UHFFFAOYSA-N 0 1 382.385 3.031 10 0 GGAEMN Cc1c([C@@H](C)N[C@H](CO)C2CCC2)nnn1-c1cccc(Br)c1 ZINC000658086705 567120283 /nfs/dbraw/zinc/12/02/83/567120283.db2.gz FAPAUUYVCHGNNX-BDJLRTHQSA-N 0 1 379.302 3.150 10 0 GGAEMN C[C@@H]1C[C@@H](NC2CCN(Cc3ccccc3Br)CC2)c2ncnn21 ZINC000658100270 567122311 /nfs/dbraw/zinc/12/23/11/567122311.db2.gz GPXBQUVYWLNWRZ-CXAGYDPISA-N 0 1 390.329 3.301 10 0 GGAEMN Cc1ccncc1CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000658122234 567124322 /nfs/dbraw/zinc/12/43/22/567124322.db2.gz FFDJLVKUUQVALP-MRXNPFEDSA-N 0 1 395.322 3.203 10 0 GGAEMN CC1=CCN(CCNCc2ncc(Br)cc2Br)CC1 ZINC000473997885 567124927 /nfs/dbraw/zinc/12/49/27/567124927.db2.gz YYDNVHVOPSZWMB-UHFFFAOYSA-N 0 1 389.135 3.348 10 0 GGAEMN COCc1n[nH]c(CN[C@H]2CCCc3c4cc(Br)ccc4[nH]c32)n1 ZINC000658157993 567126482 /nfs/dbraw/zinc/12/64/82/567126482.db2.gz WTIDKEOKJFAAEX-AWEZNQCLSA-N 0 1 390.285 3.362 10 0 GGAEMN COCc1nnc(C[NH2+][C@H]2c3cc(Br)ccc3SC[C@H]2C)[n-]1 ZINC000658157736 567126945 /nfs/dbraw/zinc/12/69/45/567126945.db2.gz CWDJFHBGSKZFAA-RFAUZJTJSA-N 0 1 383.315 3.286 10 0 GGAEMN CCS(=O)(=O)C[C@H](C)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000658186146 567128167 /nfs/dbraw/zinc/12/81/67/567128167.db2.gz BTHFNHNAHZAPQX-IINYFYTJSA-N 0 1 378.357 3.150 10 0 GGAEMN C[C@H](NC[C@H]1CCC[C@@H](C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658216152 567129137 /nfs/dbraw/zinc/12/91/37/567129137.db2.gz PRJMEEQAUZMCHE-OUAUKWLOSA-N 0 1 381.325 3.249 10 0 GGAEMN O=C(N[C@H]1CCc2cc(O)ccc2C1)c1n[nH]c2ccc(Br)cc21 ZINC000683507809 567129740 /nfs/dbraw/zinc/12/97/40/567129740.db2.gz SRVLWYYYFPRZDU-ZDUSSCGKSA-N 0 1 386.249 3.318 10 0 GGAEMN O=C(NCCc1csc(N2CCCC2)n1)c1cccc(Br)c1O ZINC000522760844 567129771 /nfs/dbraw/zinc/12/97/71/567129771.db2.gz ISAOGMCKYZFHRR-UHFFFAOYSA-N 0 1 396.310 3.184 10 0 GGAEMN C[C@@]1(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1(F)F ZINC000658216874 567130149 /nfs/dbraw/zinc/13/01/49/567130149.db2.gz DBTIWWYXTURDOW-YPMHNXCESA-N 0 1 380.254 3.303 10 0 GGAEMN Cc1c([C@H](C)N[C@@H]2C[C@H](O)C23CCC3)nnn1-c1cccc(Br)c1 ZINC000658257445 567131436 /nfs/dbraw/zinc/13/14/36/567131436.db2.gz XXEGCJTUQJJGSZ-XZJROXQQSA-N 0 1 391.313 3.292 10 0 GGAEMN Cc1c([C@H](C)N[C@H]2C[C@H](O)C23CCC3)nnn1-c1cccc(Br)c1 ZINC000658257444 567131625 /nfs/dbraw/zinc/13/16/25/567131625.db2.gz XXEGCJTUQJJGSZ-UVBJJODRSA-N 0 1 391.313 3.292 10 0 GGAEMN Cc1nc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)sc1C ZINC000683545722 567131659 /nfs/dbraw/zinc/13/16/59/567131659.db2.gz NWODVCPMKWBEOJ-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN Cc1nc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)sc1C ZINC000683545722 567131667 /nfs/dbraw/zinc/13/16/67/567131667.db2.gz NWODVCPMKWBEOJ-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000636181381 567131851 /nfs/dbraw/zinc/13/18/51/567131851.db2.gz FGJWQWUNKYKBIO-NFAWXSAZSA-N 0 1 378.295 3.380 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1(C(F)(F)F)CC1 ZINC000588652039 567132141 /nfs/dbraw/zinc/13/21/41/567132141.db2.gz CXFYJDLTDKJRBD-UHFFFAOYSA-N 0 1 389.175 3.193 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1(C(F)(F)F)CC1 ZINC000588652039 567132145 /nfs/dbraw/zinc/13/21/45/567132145.db2.gz CXFYJDLTDKJRBD-UHFFFAOYSA-N 0 1 389.175 3.193 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cccc2n[nH]cc21 ZINC000588653293 567132387 /nfs/dbraw/zinc/13/23/87/567132387.db2.gz SYOPEXWOAANADF-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccc2n[nH]cc21 ZINC000588653293 567132390 /nfs/dbraw/zinc/13/23/90/567132390.db2.gz SYOPEXWOAANADF-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3cccc(Br)c3C)[nH]c21 ZINC000497933427 567132654 /nfs/dbraw/zinc/13/26/54/567132654.db2.gz HZNVEIAVFCWIMQ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN O=C1N(CCN[C@@H]2CCc3c2c(Br)ccc3F)C[C@@H]2CCCCN12 ZINC000658303684 567133069 /nfs/dbraw/zinc/13/30/69/567133069.db2.gz CNOCYPLWNCVGAU-BLLLJJGKSA-N 0 1 396.304 3.455 10 0 GGAEMN NC(=O)c1csc(=NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)[nH]1 ZINC000432138379 567133010 /nfs/dbraw/zinc/13/30/10/567133010.db2.gz LDJMLLCTNLSOFQ-UHFFFAOYSA-N 0 1 385.320 3.047 10 0 GGAEMN CC1(C)CN(C(=O)[C@@H]2CCCc3n[nH]nc32)c2ccc(Br)cc21 ZINC000614708677 567133816 /nfs/dbraw/zinc/13/38/16/567133816.db2.gz AFGDRZGLYJDAOB-LLVKDONJSA-N 0 1 375.270 3.312 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@@H]2CCCOc3c(Br)cccc32)CC1 ZINC000658299253 567134140 /nfs/dbraw/zinc/13/41/40/567134140.db2.gz NTTAXGRZHPBRDP-CQSZACIVSA-N 0 1 388.327 3.220 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000658298156 567134503 /nfs/dbraw/zinc/13/45/03/567134503.db2.gz DEFKULYATRGUPS-AWEZNQCLSA-N 0 1 376.291 3.132 10 0 GGAEMN O=C1N(CCN[C@H]2CCc3c2c(Br)ccc3F)C[C@H]2CCCCN12 ZINC000658303693 567134521 /nfs/dbraw/zinc/13/45/21/567134521.db2.gz CNOCYPLWNCVGAU-WBMJQRKESA-N 0 1 396.304 3.455 10 0 GGAEMN C[C@H](NC(=O)[C@@](C)(N)c1ccc(Br)cc1)[C@@H]1COc2ccccc21 ZINC000566190888 567135275 /nfs/dbraw/zinc/13/52/75/567135275.db2.gz KYYHVHINBMCXMZ-UVIMBBFXSA-N 0 1 389.293 3.304 10 0 GGAEMN C[C@H](NC(=O)[C@@](C)(N)c1ccc(Br)cc1)[C@H]1COc2ccccc21 ZINC000566190886 567135507 /nfs/dbraw/zinc/13/55/07/567135507.db2.gz KYYHVHINBMCXMZ-MOFZMDFASA-N 0 1 389.293 3.304 10 0 GGAEMN O=S1(=O)CC[C@H](NCCc2nsc3ccccc23)c2cc(F)ccc21 ZINC000658319254 567136192 /nfs/dbraw/zinc/13/61/92/567136192.db2.gz YKDCDCKVPPXCDV-HNNXBMFYSA-N 0 1 376.478 3.486 10 0 GGAEMN O=S1(=O)CC[C@@H](NCCc2nsc3ccccc23)c2cc(F)ccc21 ZINC000658319255 567136407 /nfs/dbraw/zinc/13/64/07/567136407.db2.gz YKDCDCKVPPXCDV-OAHLLOKOSA-N 0 1 376.478 3.486 10 0 GGAEMN COc1ccc([C@H](C)NCCN2C[C@@H]3CCCCN3C2=O)c(Br)c1 ZINC000658307741 567136547 /nfs/dbraw/zinc/13/65/47/567136547.db2.gz WBTOBHNHHLYQJO-KBPBESRZSA-N 0 1 396.329 3.398 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)CC1 ZINC000546565763 567137354 /nfs/dbraw/zinc/13/73/54/567137354.db2.gz HZDBKRLWMSLMFL-SJORKVTESA-N 0 1 378.314 3.256 10 0 GGAEMN C[C@@H](Sc1ccc(Br)cc1)C(=O)NC1(c2nn[n-]n2)CCCC1 ZINC000522931634 567137820 /nfs/dbraw/zinc/13/78/20/567137820.db2.gz WVESDDSXZZJYRJ-SNVBAGLBSA-N 0 1 396.314 3.029 10 0 GGAEMN C[C@@H](Sc1ccc(Br)cc1)C(=O)NC1(c2nn[nH]n2)CCCC1 ZINC000522931634 567137827 /nfs/dbraw/zinc/13/78/27/567137827.db2.gz WVESDDSXZZJYRJ-SNVBAGLBSA-N 0 1 396.314 3.029 10 0 GGAEMN C[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@@H]1C(=O)[O-] ZINC000566221311 567138516 /nfs/dbraw/zinc/13/85/16/567138516.db2.gz NOQLYWALGMBXDR-KOLCDFICSA-N 0 1 389.677 3.084 10 0 GGAEMN C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@@H]1C(=O)[O-] ZINC000566221311 567138519 /nfs/dbraw/zinc/13/85/19/567138519.db2.gz NOQLYWALGMBXDR-KOLCDFICSA-N 0 1 389.677 3.084 10 0 GGAEMN O=C(C1CCC1)N1CCN(CCNCc2csc(Cl)c2Cl)CC1 ZINC000432231236 567138774 /nfs/dbraw/zinc/13/87/74/567138774.db2.gz HAFBHOCKSUHXSG-UHFFFAOYSA-N 0 1 376.353 3.089 10 0 GGAEMN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000474150694 567140467 /nfs/dbraw/zinc/14/04/67/567140467.db2.gz BIRBOSIGSYACBZ-MWLCHTKSSA-N 0 1 395.219 3.434 10 0 GGAEMN Cc1ccc(I)c(C(=O)N2CCN(C)C[C@@H]2C(C)C)c1 ZINC000523132581 567145019 /nfs/dbraw/zinc/14/50/19/567145019.db2.gz JNQAOYSDYVAKMV-OAHLLOKOSA-N 0 1 386.277 3.012 10 0 GGAEMN COc1cc(Br)c(Cl)cc1C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000566282948 567145166 /nfs/dbraw/zinc/14/51/66/567145166.db2.gz JLCIGLAISKXMMZ-QMMMGPOBSA-N 0 1 384.661 3.122 10 0 GGAEMN CCOC(=O)COc1cccc(NS(=O)(=O)c2cc(C)ccc2Cl)c1 ZINC000498031841 567145405 /nfs/dbraw/zinc/14/54/05/567145405.db2.gz BTZBIXGHWUMZIK-UHFFFAOYSA-N 0 1 383.853 3.391 10 0 GGAEMN O=C(NCCc1c[nH]c2cccc(Br)c12)[C@H]1CCc2[nH]cnc2C1 ZINC000614980385 567150650 /nfs/dbraw/zinc/15/06/50/567150650.db2.gz BVAIDFYFPMQHLM-NSHDSACASA-N 0 1 387.281 3.117 10 0 GGAEMN CC[C@H](CO)N1CCN(Cc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000474267236 567153923 /nfs/dbraw/zinc/15/39/23/567153923.db2.gz PGPLTXGKTBAXEL-CQSZACIVSA-N 0 1 395.263 3.356 10 0 GGAEMN CCOc1cc(Br)c(F)cc1NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000615064566 567155955 /nfs/dbraw/zinc/15/59/55/567155955.db2.gz CTVKNGLIXLIUSR-VIFPVBQESA-N 0 1 382.233 3.454 10 0 GGAEMN CCOc1cc(Br)c(F)cc1NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000615064565 567156102 /nfs/dbraw/zinc/15/61/02/567156102.db2.gz CTVKNGLIXLIUSR-SECBINFHSA-N 0 1 382.233 3.454 10 0 GGAEMN C[C@H]1COCCN1C1CCN(C(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000615087008 567156868 /nfs/dbraw/zinc/15/68/68/567156868.db2.gz QQODFNIOGFQMAF-NSHDSACASA-N 0 1 375.271 3.458 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)ccc1NC(N)=O ZINC000474296873 567157067 /nfs/dbraw/zinc/15/70/67/567157067.db2.gz YYUYGBSDYLGDPY-UHFFFAOYSA-N 0 1 387.820 3.088 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cccc(F)c1Br ZINC000498208373 567158533 /nfs/dbraw/zinc/15/85/33/567158533.db2.gz QZRXUNMHILLMLZ-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN O=C(NCCN1CCCOCC1)c1cc(Br)cc2ccccc21 ZINC000474318416 567158852 /nfs/dbraw/zinc/15/88/52/567158852.db2.gz ZDPPRHINLHGQCU-UHFFFAOYSA-N 0 1 377.282 3.054 10 0 GGAEMN CN(C)c1ccncc1C(=O)N(C)CCOc1ccc(Br)cc1 ZINC000546784143 567159474 /nfs/dbraw/zinc/15/94/74/567159474.db2.gz RGGFUPXONANMAN-UHFFFAOYSA-N 0 1 378.270 3.061 10 0 GGAEMN C[C@@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)[C@H](C)[C@H](C)O1 ZINC000474330803 567159694 /nfs/dbraw/zinc/15/96/94/567159694.db2.gz LBCPSCIEQZPCTH-UTUOFQBUSA-N 0 1 378.270 3.477 10 0 GGAEMN C[C@H](CNC(=O)c1cnccc1N(C)C)Oc1cccc(Br)c1 ZINC000546791553 567160056 /nfs/dbraw/zinc/16/00/56/567160056.db2.gz VKOICMDALCFETK-GFCCVEGCSA-N 0 1 378.270 3.107 10 0 GGAEMN CSc1ccccc1S(=O)(=O)Nc1ccc(C(N)=O)c(OC(C)C)c1 ZINC000432460275 567161327 /nfs/dbraw/zinc/16/13/27/567161327.db2.gz LTALQYRSYAWSMN-UHFFFAOYSA-N 0 1 380.491 3.095 10 0 GGAEMN COc1ccc(Br)cc1CN(C)C(=O)c1cnccc1N(C)C ZINC000546828962 567162630 /nfs/dbraw/zinc/16/26/30/567162630.db2.gz BOXXWGKKBXHWGH-UHFFFAOYSA-N 0 1 378.270 3.191 10 0 GGAEMN Cc1ccnc(NS(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)c1Br ZINC000566491146 567162913 /nfs/dbraw/zinc/16/29/13/567162913.db2.gz OESLJZCUBDDDCO-JTQLQIEISA-N 0 1 385.287 3.047 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1cccc(F)c1I ZINC000546856787 567165241 /nfs/dbraw/zinc/16/52/41/567165241.db2.gz GLEHZMXIXHCBPZ-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1cccc(F)c1I ZINC000546856787 567165246 /nfs/dbraw/zinc/16/52/46/567165246.db2.gz GLEHZMXIXHCBPZ-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN CCc1nc(CNC(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)n[nH]1 ZINC000454385696 567169806 /nfs/dbraw/zinc/16/98/06/567169806.db2.gz RURQGBMTSXDOFB-UHFFFAOYSA-N 0 1 377.754 3.283 10 0 GGAEMN CN1CCN([C@H](CNCc2ncc(C(F)(F)F)s2)c2cccs2)CC1 ZINC000566598625 567171350 /nfs/dbraw/zinc/17/13/50/567171350.db2.gz DZGWXLCAAIUENW-GFCCVEGCSA-N 0 1 390.500 3.302 10 0 GGAEMN CN1CCN([C@@H](CNCc2ncc(C(F)(F)F)s2)c2cccs2)CC1 ZINC000566598626 567171585 /nfs/dbraw/zinc/17/15/85/567171585.db2.gz DZGWXLCAAIUENW-LBPRGKRZSA-N 0 1 390.500 3.302 10 0 GGAEMN C[C@H]1CC[C@@H](CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000474446352 567172739 /nfs/dbraw/zinc/17/27/39/567172739.db2.gz BFMXTUAHBNZYIG-NWDGAFQWSA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@H]1CC[C@@H](CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000474446352 567172746 /nfs/dbraw/zinc/17/27/46/567172746.db2.gz BFMXTUAHBNZYIG-NWDGAFQWSA-N 0 1 392.301 3.470 10 0 GGAEMN CN1CC[C@H](NC(=O)c2cn3ccc(Br)cc3n2)[C@H]1c1ccccc1 ZINC000566635555 567174385 /nfs/dbraw/zinc/17/43/85/567174385.db2.gz GREPLGCNHIULDW-MAUKXSAKSA-N 0 1 399.292 3.272 10 0 GGAEMN CSc1cc(Br)ccc1C(=O)N1CCOC[C@@H]1[C@@H]1CCC[N@H+]1C ZINC000615274786 567175405 /nfs/dbraw/zinc/17/54/05/567175405.db2.gz KEHXJHFNWOCKJG-LSDHHAIUSA-N 0 1 399.354 3.106 10 0 GGAEMN CSc1cc(Br)ccc1C(=O)N1CCOC[C@H]1[C@@H]1CCC[N@H+]1C ZINC000615274784 567175826 /nfs/dbraw/zinc/17/58/26/567175826.db2.gz KEHXJHFNWOCKJG-GJZGRUSLSA-N 0 1 399.354 3.106 10 0 GGAEMN Cc1ccccc1C(=O)NCC(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000474533860 567177557 /nfs/dbraw/zinc/17/75/57/567177557.db2.gz BRMUETFPQIBYSF-UHFFFAOYSA-N 0 1 387.237 3.002 10 0 GGAEMN CCN1CC[C@H]2OCCN(C(=O)c3c(Cl)cccc3Br)[C@H]2C1 ZINC000615350539 567180170 /nfs/dbraw/zinc/18/01/70/567180170.db2.gz XVYDMQPNAVAJEF-UONOGXRCSA-N 0 1 387.705 3.038 10 0 GGAEMN O=C(NC[C@H]1COc2ccccc2O1)c1cn[nH]c1-c1ccc(Cl)s1 ZINC000474593560 567180989 /nfs/dbraw/zinc/18/09/89/567180989.db2.gz CDUIVZIAFWZMRF-JTQLQIEISA-N 0 1 375.837 3.361 10 0 GGAEMN O[C@H](CNCc1cn(-c2ccc(Cl)cc2Cl)nn1)Cc1ccccc1 ZINC000566700846 567181374 /nfs/dbraw/zinc/18/13/74/567181374.db2.gz GCSGVRICSNYKMT-INIZCTEOSA-N 0 1 377.275 3.267 10 0 GGAEMN Cc1ccnc(-c2nc(-c3nc(-c4cccc(Br)c4)n[nH]3)no2)n1 ZINC000566704335 567181835 /nfs/dbraw/zinc/18/18/35/567181835.db2.gz BVJWNXKNLKDXKG-UHFFFAOYSA-N 0 1 384.197 3.050 10 0 GGAEMN O=C(NCCc1ccc(Br)cc1Cl)[C@H]1CCc2[nH]cnc2C1 ZINC000615406102 567183279 /nfs/dbraw/zinc/18/32/79/567183279.db2.gz MJXIHLUMBKIINW-NSHDSACASA-N 0 1 382.689 3.289 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC[C@H](Nc3cccc(Br)c3)C2)C1 ZINC000684135018 567183685 /nfs/dbraw/zinc/18/36/85/567183685.db2.gz NDYMKVCBBIURAH-SJORKVTESA-N 0 1 395.345 3.129 10 0 GGAEMN O=C(Nc1nc(CC(F)(F)F)cs1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000615410917 567183938 /nfs/dbraw/zinc/18/39/38/567183938.db2.gz QKIYUGYJGOWPTF-IUCAKERBSA-N 0 1 392.321 3.170 10 0 GGAEMN COC(=O)c1c(C)c(NS(=O)(=O)c2ccc(Cl)cc2OC)ccc1F ZINC000589556597 567183983 /nfs/dbraw/zinc/18/39/83/567183983.db2.gz ZZTYHBXIADSJAZ-UHFFFAOYSA-N 0 1 387.816 3.384 10 0 GGAEMN C[C@@H](NC[C@@H](O)COc1ccccc1Br)c1cn2ccccc2n1 ZINC000566746834 567186405 /nfs/dbraw/zinc/18/64/05/567186405.db2.gz AXKOAELMGLXIRK-ZIAGYGMSSA-N 0 1 390.281 3.187 10 0 GGAEMN COC(=O)c1cccc(Br)c1CN1CCC[C@H]([C@H]2CCOC2)C1 ZINC000432776546 567190749 /nfs/dbraw/zinc/19/07/49/567190749.db2.gz PBVPFOJLGLHQAR-KBPBESRZSA-N 0 1 382.298 3.484 10 0 GGAEMN Cn1cc(Br)c(CN2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)n1 ZINC000432784354 567191166 /nfs/dbraw/zinc/19/11/66/567191166.db2.gz NZTVEAKDMHCAAI-HNNXBMFYSA-N 0 1 387.285 3.305 10 0 GGAEMN Cn1cc(Br)c(CN2CCC[C@H]2c2nc(-c3ccccc3)n[nH]2)n1 ZINC000432784354 567191170 /nfs/dbraw/zinc/19/11/70/567191170.db2.gz NZTVEAKDMHCAAI-HNNXBMFYSA-N 0 1 387.285 3.305 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1csc(-c2ccc(Cl)s2)n1 ZINC000566820782 567192514 /nfs/dbraw/zinc/19/25/14/567192514.db2.gz LFEOLQPMZUILFC-UHFFFAOYSA-N 0 1 380.886 3.237 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3c(F)ccc(Br)c3C2)n[nH]1 ZINC000454673497 567193530 /nfs/dbraw/zinc/19/35/30/567193530.db2.gz AZHYTLCUOQVJOD-SNVBAGLBSA-N 0 1 395.276 3.319 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000659250337 567193931 /nfs/dbraw/zinc/19/39/31/567193931.db2.gz KFJNHSFYUSMVAY-ROUUACIJSA-N 0 1 391.309 3.407 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1c[nH]c2ncc(Br)cc12 ZINC000684272164 567194506 /nfs/dbraw/zinc/19/45/06/567194506.db2.gz LQTWGZPZNIXQKV-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN COCc1c(Br)cccc1NC(=O)NCCN1CC=C(C)CC1 ZINC000547282499 567196653 /nfs/dbraw/zinc/19/66/53/567196653.db2.gz ONONOGQTSJSKSZ-UHFFFAOYSA-N 0 1 382.302 3.369 10 0 GGAEMN CCOc1ccc(Br)cc1CN(C(=O)[C@@H](N)COC(C)C)C1CC1 ZINC000659259898 567196698 /nfs/dbraw/zinc/19/66/98/567196698.db2.gz AQCYCRVOLZVUER-INIZCTEOSA-N 0 1 399.329 3.091 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC/C=C/c2ccc(Br)cc2)n[nH]1 ZINC000454707886 567197644 /nfs/dbraw/zinc/19/76/44/567197644.db2.gz MAACFLWSWJWBRZ-AAOUONPWSA-N 0 1 377.286 3.424 10 0 GGAEMN COc1cc(NC(=O)NCCN2CC=C(C)CC2)cc(OC)c1Br ZINC000547292135 567199005 /nfs/dbraw/zinc/19/90/05/567199005.db2.gz URLDJBRTZGOOLT-UHFFFAOYSA-N 0 1 398.301 3.240 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NCc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000524417452 567199087 /nfs/dbraw/zinc/19/90/87/567199087.db2.gz RKMIDQUTIUTOCO-UHFFFAOYSA-N 0 1 395.257 3.294 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NCc1n[nH]c(-c2ccc(F)cc2)n1 ZINC000524417452 567199092 /nfs/dbraw/zinc/19/90/92/567199092.db2.gz RKMIDQUTIUTOCO-UHFFFAOYSA-N 0 1 395.257 3.294 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)Nc1ncc(Cc2ccc(Br)cc2)s1 ZINC000659283990 567200106 /nfs/dbraw/zinc/20/01/06/567200106.db2.gz FCDBCFYJDATQJG-AWEZNQCLSA-N 0 1 398.326 3.187 10 0 GGAEMN Cc1c([C@@H](C)NCC2=CCOCC2)nnn1-c1cccc(Br)c1 ZINC000566897284 567201731 /nfs/dbraw/zinc/20/17/31/567201731.db2.gz VMEOSLUADSKSOR-GFCCVEGCSA-N 0 1 377.286 3.336 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000566921110 567202473 /nfs/dbraw/zinc/20/24/73/567202473.db2.gz WQOFUMSECURKQI-MZGVZZPPSA-N 0 1 388.291 3.451 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000566921113 567203134 /nfs/dbraw/zinc/20/31/34/567203134.db2.gz WQOFUMSECURKQI-ZCDTZLGTSA-N 0 1 388.291 3.451 10 0 GGAEMN CCC(=O)N1CSC[C@@H]1C(=O)N(C)[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000615816700 567207608 /nfs/dbraw/zinc/20/76/08/567207608.db2.gz OSEXRLFQNHNIBI-IINYFYTJSA-N 0 1 380.901 3.047 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1csc(-c2cccc(Cl)c2)n1 ZINC000590122577 567208966 /nfs/dbraw/zinc/20/89/66/567208966.db2.gz OYGPAXMXKHVWEY-HNNXBMFYSA-N 0 1 379.913 3.304 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000590119004 567209680 /nfs/dbraw/zinc/20/96/80/567209680.db2.gz GNYDJYDCMSNZIU-HNNXBMFYSA-N 0 1 379.913 3.304 10 0 GGAEMN O=C(N[C@@H]1CCc2c1ccc(F)c2Br)[C@@H]1CCc2[nH]cnc2C1 ZINC000615870998 567210724 /nfs/dbraw/zinc/21/07/24/567210724.db2.gz IGLFMJKQUCXZOZ-NOZJJQNGSA-N 0 1 378.245 3.220 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)N[C@H](c2cc(F)ccc2F)C(F)F)s1 ZINC000432966977 567211420 /nfs/dbraw/zinc/21/14/20/567211420.db2.gz NWRHIJWXFZRJJH-GFCCVEGCSA-N 0 1 397.371 3.098 10 0 GGAEMN CN1CCC[C@H]1C(=O)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000474961702 567214348 /nfs/dbraw/zinc/21/43/48/567214348.db2.gz HRHFROXOFAUWSB-ROUUACIJSA-N 0 1 388.309 3.338 10 0 GGAEMN C[C@H](NCC1CCN(C(=O)C(C)(C)C)CC1)c1ncc(Br)cn1 ZINC000432997282 567214544 /nfs/dbraw/zinc/21/45/44/567214544.db2.gz KYVVSQJEFQELPQ-LBPRGKRZSA-N 0 1 383.334 3.174 10 0 GGAEMN COCc1nc(C(=O)Nc2nnc(SCc3ccc(F)cc3)s2)co1 ZINC000547512214 567215201 /nfs/dbraw/zinc/21/52/01/567215201.db2.gz UADHFPPVZFNBKK-UHFFFAOYSA-N 0 1 380.426 3.356 10 0 GGAEMN COc1cccc(S(=O)(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)c1 ZINC000684579055 567217600 /nfs/dbraw/zinc/21/76/00/567217600.db2.gz DIAGVMDEYRYIIZ-KDOFPFPSSA-N 0 1 380.535 3.118 10 0 GGAEMN COc1cccc(S(=O)(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c1 ZINC000684579056 567218018 /nfs/dbraw/zinc/21/80/18/567218018.db2.gz DIAGVMDEYRYIIZ-KSSFIOAISA-N 0 1 380.535 3.118 10 0 GGAEMN C[C@H](c1cccc(Cl)c1F)N(C)CCOc1ccc(S(N)(=O)=O)cc1 ZINC000433063038 567219337 /nfs/dbraw/zinc/21/93/37/567219337.db2.gz WIIXHILBECUGID-GFCCVEGCSA-N 0 1 386.876 3.198 10 0 GGAEMN Cc1[n-][nH]c(=NC(=O)C2(C)CC[NH+](Cc3ccccc3)CC2)c1Br ZINC000616008436 567220745 /nfs/dbraw/zinc/22/07/45/567220745.db2.gz GGSUBISVKXGCGT-UHFFFAOYSA-N 0 1 391.313 3.143 10 0 GGAEMN CC1(C)CN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C[C@]2(CCOC2)O1 ZINC000684626816 567222701 /nfs/dbraw/zinc/22/27/01/567222701.db2.gz BAXOGRATLADCDU-ACJLOTCBSA-N 0 1 390.307 3.003 10 0 GGAEMN CC1(C)CN(C[C@H](O)COc2cc(Cl)ccc2Cl)C[C@]2(CCOC2)O1 ZINC000684627200 567223460 /nfs/dbraw/zinc/22/34/60/567223460.db2.gz RDDZLDKQNAKJLV-KSSFIOAISA-N 0 1 390.307 3.003 10 0 GGAEMN CC1(C)CN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C[C@]2(CCOC2)O1 ZINC000684626822 567224011 /nfs/dbraw/zinc/22/40/11/567224011.db2.gz BAXOGRATLADCDU-UGSOOPFHSA-N 0 1 390.307 3.003 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC(C2CC2)CC1 ZINC000590426310 567225237 /nfs/dbraw/zinc/22/52/37/567225237.db2.gz QXVQOXDNGFVPFQ-UHFFFAOYSA-N 0 1 395.244 3.430 10 0 GGAEMN CO[C@@H]1CN(Cc2ccc(Br)cc2N2CCOCC2)CC[C@H]1C ZINC000475127659 567227709 /nfs/dbraw/zinc/22/77/09/567227709.db2.gz DEGWVSDTPWPFTH-RDTXWAMCSA-N 0 1 383.330 3.143 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(C(=O)c3cc(Cl)cc(Cl)c3)CC2)n[nH]1 ZINC000659821778 567227794 /nfs/dbraw/zinc/22/77/94/567227794.db2.gz OMVJUCGNXBLEOA-NSHDSACASA-N 0 1 382.295 3.193 10 0 GGAEMN COc1cc(Br)c(CNCC2(CO)CC3(CCC3)C2)c(OC)c1 ZINC000433186924 567229823 /nfs/dbraw/zinc/22/98/23/567229823.db2.gz HHLPCMZLBGMDOK-UHFFFAOYSA-N 0 1 384.314 3.499 10 0 GGAEMN CCc1nc([C@@H](C)N(C)CC(=O)Nc2ccc(Br)cc2C)n[nH]1 ZINC000659832829 567230843 /nfs/dbraw/zinc/23/08/43/567230843.db2.gz BUYKZZNIGQMADQ-LLVKDONJSA-N 0 1 380.290 3.070 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCC[C@@H]1c1ccc(Br)cn1 ZINC000616197334 567231815 /nfs/dbraw/zinc/23/18/15/567231815.db2.gz QMMMSYBNJSBSNT-MEDUHNTESA-N 0 1 375.270 3.036 10 0 GGAEMN Cn1cc(I)c(CN[C@H]2CCCc3ccccc3C2)n1 ZINC000590661362 567236408 /nfs/dbraw/zinc/23/64/08/567236408.db2.gz ZBQWPVOSEUDGGM-AWEZNQCLSA-N 0 1 381.261 3.062 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cccc(Br)c2OC)[C@H]1n1cccn1 ZINC000567372126 567240020 /nfs/dbraw/zinc/24/00/20/567240020.db2.gz XFCPTPYNAZOOCG-ARFHVFGLSA-N 0 1 380.286 3.163 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC(c3cccc(Br)c3)CC2)C1 ZINC000684888478 567243053 /nfs/dbraw/zinc/24/30/53/567243053.db2.gz CVSNPKTYDBACJK-KRWDZBQOSA-N 0 1 380.330 3.432 10 0 GGAEMN CC(C)(CO)[C@H](NCC(=O)Nc1nc2c(s1)CCCC2)c1cccs1 ZINC000567401735 567243714 /nfs/dbraw/zinc/24/37/14/567243714.db2.gz WSSVEBSPEBKTTM-MRXNPFEDSA-N 0 1 379.551 3.371 10 0 GGAEMN C[C@H]1[C@@H](C(F)(F)F)CCN1Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000547771104 567244821 /nfs/dbraw/zinc/24/48/21/567244821.db2.gz QZNBEPGZAPCQPH-CABZTGNLSA-N 0 1 390.203 3.230 10 0 GGAEMN O=S(=O)(Cc1ccccc1C(F)(F)F)Nc1cc([C@@H]2CCCO2)[nH]n1 ZINC000567418982 567245020 /nfs/dbraw/zinc/24/50/20/567245020.db2.gz UQKLULDGVDTBCY-ZDUSSCGKSA-N 0 1 375.372 3.222 10 0 GGAEMN NC(=O)[C@H](NCc1cnc(-c2ccccc2)[nH]1)c1cccc(Br)c1 ZINC000475444686 567249837 /nfs/dbraw/zinc/24/98/37/567249837.db2.gz YIPUFMHDGXHCDV-MRXNPFEDSA-N 0 1 385.265 3.155 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCN(c2cc(Cl)ccc2Cl)CC1 ZINC000616522515 567251190 /nfs/dbraw/zinc/25/11/90/567251190.db2.gz CJTKCLNCGWCSGI-GFCCVEGCSA-N 0 1 379.291 3.170 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1n[nH]c([C@@H]2CCCO2)n1 ZINC000616694212 567252263 /nfs/dbraw/zinc/25/22/63/567252263.db2.gz CXOKNOKANQLXIG-ZANVPECISA-N 0 1 385.251 3.047 10 0 GGAEMN CC(C)(C)OC(=O)CSCC(=O)Nc1nc(-c2ccc(Cl)cc2)n[nH]1 ZINC000525493999 567252260 /nfs/dbraw/zinc/25/22/60/567252260.db2.gz ZHYKKVVGCOQXAA-UHFFFAOYSA-N 0 1 382.873 3.139 10 0 GGAEMN Cc1ncc(NS(=O)(=O)c2cc3c(c(Cl)c2)O[C@@H](C)C3)c(C2CC2)n1 ZINC000685006585 567252879 /nfs/dbraw/zinc/25/28/79/567252879.db2.gz CNHPPZBLVIMGKQ-VIFPVBQESA-N 0 1 379.869 3.440 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)NCCCCN1CCOCC1 ZINC000433569616 567259036 /nfs/dbraw/zinc/25/90/36/567259036.db2.gz RYSBJLJJGGNSPQ-UHFFFAOYSA-N 0 1 398.345 3.011 10 0 GGAEMN Cc1c(Br)c2ccccc2n1CC(=O)N1CCN(C2CCC2)CC1 ZINC000499641376 567263043 /nfs/dbraw/zinc/26/30/43/567263043.db2.gz OAKVOOLHAHMIOQ-UHFFFAOYSA-N 0 1 390.325 3.409 10 0 GGAEMN C[C@H]1C[C@@H]1CNS(=O)(=O)c1scc(Br)c1Br ZINC000433639831 567265120 /nfs/dbraw/zinc/26/51/20/567265120.db2.gz OICYXYCRQTUFGR-NTSWFWBYSA-N 0 1 389.134 3.207 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CC[C@@H](C2CCC2)C1 ZINC000591125575 567265974 /nfs/dbraw/zinc/26/59/74/567265974.db2.gz CIPRLPGCTGIDHA-LLVKDONJSA-N 0 1 395.244 3.430 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@@H]1CC12CCCC2 ZINC000567667543 567266061 /nfs/dbraw/zinc/26/60/61/567266061.db2.gz BBFVEFIFHSAEIC-CYBMUJFWSA-N 0 1 390.285 3.366 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@@H]1CC12CCCC2 ZINC000567667543 567266069 /nfs/dbraw/zinc/26/60/69/567266069.db2.gz BBFVEFIFHSAEIC-CYBMUJFWSA-N 0 1 390.285 3.366 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CC[C@H](C2CCC2)C1 ZINC000591125576 567266515 /nfs/dbraw/zinc/26/65/15/567266515.db2.gz CIPRLPGCTGIDHA-NSHDSACASA-N 0 1 395.244 3.430 10 0 GGAEMN COc1cc(Cl)ccc1[C@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000567733538 567272257 /nfs/dbraw/zinc/27/22/57/567272257.db2.gz IQEAHAHRIMBHLB-JSGCOSHPSA-N 0 1 381.881 3.234 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617006878 567275779 /nfs/dbraw/zinc/27/57/79/567275779.db2.gz HQQUXBPMVWLMPV-AWEZNQCLSA-N 0 1 397.313 3.020 10 0 GGAEMN CC(C)(C)N1CC[C@@H]1CNC(=O)C1(c2cccc(Br)c2)CC(=O)C1 ZINC000617009221 567276170 /nfs/dbraw/zinc/27/61/70/567276170.db2.gz UVMVIJFLGVGCAQ-OAHLLOKOSA-N 0 1 393.325 3.039 10 0 GGAEMN Cc1sc2ncnc(SCC(=O)NC[C@H]3CCN3C(C)(C)C)c2c1C ZINC000617020383 567276374 /nfs/dbraw/zinc/27/63/74/567276374.db2.gz AJORPPQLXWPLHW-CYBMUJFWSA-N 0 1 378.567 3.389 10 0 GGAEMN C[C@@H](CNS(=O)(=O)c1ccc2ncsc2c1)N(C)Cc1ccccc1 ZINC000475794398 567276760 /nfs/dbraw/zinc/27/67/60/567276760.db2.gz ZYZPORZAFLOQLM-AWEZNQCLSA-N 0 1 375.519 3.095 10 0 GGAEMN CCN1CCCN(C(=O)CSCc2ccc(Br)cc2F)CC1 ZINC000499868059 567280181 /nfs/dbraw/zinc/28/01/81/567280181.db2.gz RGBICAVOJLNNRD-UHFFFAOYSA-N 0 1 389.334 3.376 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(CCNC(=O)Nc2ccc(Br)cc2)n1 ZINC000567852083 567282656 /nfs/dbraw/zinc/28/26/56/567282656.db2.gz OFURKDPKCPYLPR-CYBMUJFWSA-N 0 1 396.289 3.242 10 0 GGAEMN CC(C)C[C@H](N)c1noc(CCNC(=O)Nc2ccc(Br)cc2)n1 ZINC000567852084 567283326 /nfs/dbraw/zinc/28/33/26/567283326.db2.gz OFURKDPKCPYLPR-ZDUSSCGKSA-N 0 1 396.289 3.242 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N1CCSC[C@H]1c1nccs1)C2 ZINC000526014134 567283871 /nfs/dbraw/zinc/28/38/71/567283871.db2.gz WOHMVCOYAZFPGQ-WFASDCNBSA-N 0 1 376.551 3.411 10 0 GGAEMN C[C@@H]1CCCCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000475883892 567284844 /nfs/dbraw/zinc/28/48/44/567284844.db2.gz PGMFZFYKJRKRBL-SNVBAGLBSA-N 0 1 383.233 3.430 10 0 GGAEMN C[C@@H](NC[C@@H]1CS(=O)(=O)c2ccccc2O1)c1ccc(Br)cc1 ZINC000567858089 567284881 /nfs/dbraw/zinc/28/48/81/567284881.db2.gz VBFSWRAACXXSHN-IUODEOHRSA-N 0 1 396.306 3.335 10 0 GGAEMN CC(C)[C@@H]1C[C@@H]1C(=O)Nc1cc(Br)ccc1N1CCN(C)CC1 ZINC000475890936 567285953 /nfs/dbraw/zinc/28/59/53/567285953.db2.gz DQOQBTOLPRNNIM-GJZGRUSLSA-N 0 1 380.330 3.432 10 0 GGAEMN NS(=O)(=O)c1ccc(CN(Cc2cccc(Br)c2)CC2CC2)o1 ZINC000639096098 567287248 /nfs/dbraw/zinc/28/72/48/567287248.db2.gz AJYXNXHUMRPIFW-UHFFFAOYSA-N 0 1 399.310 3.102 10 0 GGAEMN CCc1nc([C@@H](C)N2CCO[C@H](c3ccc(F)c(Br)c3)C2)n[nH]1 ZINC000660312503 567287541 /nfs/dbraw/zinc/28/75/41/567287541.db2.gz HAUYKUGKEAYZBF-YGRLFVJLSA-N 0 1 383.265 3.403 10 0 GGAEMN CN(C(=O)c1cc2sc(N3CCCC3)nc2s1)[C@@H]1CCN(C2CC2)C1 ZINC000475933717 567288987 /nfs/dbraw/zinc/28/89/87/567288987.db2.gz OSYBLINSPNEGCZ-CYBMUJFWSA-N 0 1 376.551 3.267 10 0 GGAEMN CN(C(=O)c1cc(F)c(Br)cc1Cl)[C@@H]1CN2CCC1CC2 ZINC000475932998 567289223 /nfs/dbraw/zinc/28/92/23/567289223.db2.gz QREHWDOKXOKNOS-CQSZACIVSA-N 0 1 375.669 3.408 10 0 GGAEMN O=C(NCc1ccc2c(c1)OCCO2)c1cc(Br)cc2nc[nH]c21 ZINC000500004468 567290492 /nfs/dbraw/zinc/29/04/92/567290492.db2.gz BOIKZSXXFOXRKQ-UHFFFAOYSA-N 0 1 388.221 3.027 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@H](c2ccc(F)cc2)N(C)C)c1Br ZINC000526095502 567291837 /nfs/dbraw/zinc/29/18/37/567291837.db2.gz WHHUIHGSPRXVLM-OAHLLOKOSA-N 0 1 395.276 3.138 10 0 GGAEMN C[C@@H]1C[N@H+](CCCNC(=O)[C@@H]2CCc3cc(Br)ccc32)C[C@H](C)O1 ZINC000567945150 567292026 /nfs/dbraw/zinc/29/20/26/567292026.db2.gz IMKIEIFWWNNHDA-QWQRMKEZSA-N 0 1 395.341 3.094 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)[C@@H]2CCc3cc(Br)ccc32)C[C@H](C)O1 ZINC000567945150 567292031 /nfs/dbraw/zinc/29/20/31/567292031.db2.gz IMKIEIFWWNNHDA-QWQRMKEZSA-N 0 1 395.341 3.094 10 0 GGAEMN COc1ccc(OCCNC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000500014414 567292094 /nfs/dbraw/zinc/29/20/94/567292094.db2.gz ALOFKIHZEXHERR-UHFFFAOYSA-N 0 1 390.237 3.143 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N1CC[C@H]1c1ccc(Br)cc1 ZINC000660402669 567292622 /nfs/dbraw/zinc/29/26/22/567292622.db2.gz JCCMSJGJBKYVGA-KRWDZBQOSA-N 0 1 396.329 3.018 10 0 GGAEMN O=C(Nc1ccn(-c2ccncc2)n1)c1cc(F)c(Br)cc1Cl ZINC000476040604 567293474 /nfs/dbraw/zinc/29/34/74/567293474.db2.gz DPRZKJHOTJYOED-UHFFFAOYSA-N 0 1 395.619 3.497 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@@H](c1nccs1)C(F)(F)F)c1ccsc1 ZINC000455664997 567294408 /nfs/dbraw/zinc/29/44/08/567294408.db2.gz USPWVUZBZKGRBE-QWRGUYRKSA-N 0 1 378.445 3.410 10 0 GGAEMN CC[C@H](C)[C@@H](C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000591769622 567295310 /nfs/dbraw/zinc/29/53/10/567295310.db2.gz BTEVJMUCSFDGRR-WDEREUQCSA-N 0 1 380.290 3.468 10 0 GGAEMN CC[C@H](C)[C@@H](C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000591769622 567295315 /nfs/dbraw/zinc/29/53/15/567295315.db2.gz BTEVJMUCSFDGRR-WDEREUQCSA-N 0 1 380.290 3.468 10 0 GGAEMN C[C@@H](CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000591769680 567295376 /nfs/dbraw/zinc/29/53/76/567295376.db2.gz HRILZIRYMSWSSL-JTQLQIEISA-N 0 1 378.274 3.080 10 0 GGAEMN C[C@@H](CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000591769680 567295380 /nfs/dbraw/zinc/29/53/80/567295380.db2.gz HRILZIRYMSWSSL-JTQLQIEISA-N 0 1 378.274 3.080 10 0 GGAEMN Cc1cc(C(C)(C)C(=O)N[C@@H]2CCc3nc[nH]c3C2)ccc1Br ZINC000685790796 567297279 /nfs/dbraw/zinc/29/72/79/567297279.db2.gz KGVBQBCCRXGFDV-CYBMUJFWSA-N 0 1 376.298 3.432 10 0 GGAEMN CO[C@@H](CN(CCNC(C)=O)Cc1ccc(Br)s1)C1CCC1 ZINC000660483157 567298716 /nfs/dbraw/zinc/29/87/16/567298716.db2.gz MDXDAYXLBNTXDW-HNNXBMFYSA-N 0 1 389.359 3.264 10 0 GGAEMN Clc1cc(Br)cnc1CN1CCC[C@@H](N2CCOCC2)CC1 ZINC000660474514 567299552 /nfs/dbraw/zinc/29/95/52/567299552.db2.gz JJPSGXSQSGDUJO-CQSZACIVSA-N 0 1 388.737 3.184 10 0 GGAEMN Cc1cc2c(o1)c(C(=O)N1CCC[C@H](c3nn[nH]n3)C1)ccc2Br ZINC000526946965 567300055 /nfs/dbraw/zinc/30/00/55/567300055.db2.gz DFJYTMIACGWMBR-JTQLQIEISA-N 0 1 390.241 3.037 10 0 GGAEMN C[C@@H]1CCN(C(=O)c2[nH]nc3ccc(I)cc32)C[C@@H]1C ZINC000500165657 567304243 /nfs/dbraw/zinc/30/42/43/567304243.db2.gz CTNCQGRTHINSLR-ZJUUUORDSA-N 0 1 383.233 3.286 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(Oc3ccc(Br)cc3)nc2)C1 ZINC000617415854 567305756 /nfs/dbraw/zinc/30/57/56/567305756.db2.gz RWFXHRRDJAEPDP-OAHLLOKOSA-N 0 1 390.281 3.460 10 0 GGAEMN C[C@@]1(C2CC2)CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)CCO1 ZINC000617398510 567306041 /nfs/dbraw/zinc/30/60/41/567306041.db2.gz IHZPWEXRNVCXMT-SFHVURJKSA-N 0 1 390.281 3.480 10 0 GGAEMN C[C@]1(C2CC2)CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CCO1 ZINC000617402355 567306138 /nfs/dbraw/zinc/30/61/38/567306138.db2.gz HBJDPGCZRJGDEV-GOSISDBHSA-N 0 1 390.281 3.480 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(COc3ccc(Br)cc3)o2)C1 ZINC000617415495 567306578 /nfs/dbraw/zinc/30/65/78/567306578.db2.gz DNZXGLVPUSRWBI-AWEZNQCLSA-N 0 1 393.281 3.445 10 0 GGAEMN CCN(CCSC)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000591964572 567306513 /nfs/dbraw/zinc/30/65/13/567306513.db2.gz DZMXHPUJVCHGLE-UHFFFAOYSA-N 0 1 398.330 3.129 10 0 GGAEMN CCN(CCSC)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000591964572 567306519 /nfs/dbraw/zinc/30/65/19/567306519.db2.gz DZMXHPUJVCHGLE-UHFFFAOYSA-N 0 1 398.330 3.129 10 0 GGAEMN Cc1nn(-c2ccc(C(=O)N[C@@H]3CCCN(C)C3)cc2)c(C)c1Br ZINC000617414829 567306601 /nfs/dbraw/zinc/30/66/01/567306601.db2.gz RQJWVJPKTDTKEK-OAHLLOKOSA-N 0 1 391.313 3.076 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(Oc3cccc(Br)c3)nc2)C1 ZINC000617414159 567306660 /nfs/dbraw/zinc/30/66/60/567306660.db2.gz AYKQLGISHKYLIF-OAHLLOKOSA-N 0 1 390.281 3.460 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)Nc2cc(Br)cnc2C)n[nH]1 ZINC000455827681 567309927 /nfs/dbraw/zinc/30/99/27/567309927.db2.gz RBUAPDTUSNOYLM-ZDUSSCGKSA-N 0 1 379.262 3.338 10 0 GGAEMN Cc1sc2nc(C)nc(SCC(=O)N3CCN4CCC3CC4)c2c1C ZINC000527059000 567309934 /nfs/dbraw/zinc/30/99/34/567309934.db2.gz FZZJDVGVERXKFL-UHFFFAOYSA-N 0 1 376.551 3.015 10 0 GGAEMN Cn1cc2c(n1)CCC[C@@H]2NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000527066539 567311189 /nfs/dbraw/zinc/31/11/89/567311189.db2.gz ITSQTZCIINILBI-AWEZNQCLSA-N 0 1 387.285 3.135 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@H](C)N2CCCCCC2)ccc1Br ZINC000548380898 567312241 /nfs/dbraw/zinc/31/22/41/567312241.db2.gz LOBFGUJQBALAIT-LBPRGKRZSA-N 0 1 383.286 3.439 10 0 GGAEMN Cc1ccc(-c2[nH][nH]c(=NC(=O)C(=O)c3ccc(Br)cc3)c2C)o1 ZINC000434500693 567312422 /nfs/dbraw/zinc/31/24/22/567312422.db2.gz CNLMZRXKMLWDRG-UHFFFAOYSA-N 0 1 388.221 3.292 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccc(Br)cc2)[C@@H]1SC ZINC000592165935 567317453 /nfs/dbraw/zinc/31/74/53/567317453.db2.gz CGFDUJNGGDIMAP-QZKOUSHUSA-N 0 1 387.343 3.275 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccc(Br)cc2)[C@@H]1SC ZINC000592165933 567317773 /nfs/dbraw/zinc/31/77/73/567317773.db2.gz CGFDUJNGGDIMAP-QOWREQOWSA-N 0 1 387.343 3.275 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(OC(F)(F)F)cc2)[C@@H]1SC ZINC000592165981 567317956 /nfs/dbraw/zinc/31/79/56/567317956.db2.gz DNKPZLFVLZTRED-NFAWXSAZSA-N 0 1 378.416 3.022 10 0 GGAEMN CC[C@@H](CNC(=O)N(C)CC1CN(C)C1)Cc1cccc(Br)c1 ZINC000660694301 567319140 /nfs/dbraw/zinc/31/91/40/567319140.db2.gz ADSBILFXNFMPCC-CQSZACIVSA-N 0 1 382.346 3.221 10 0 GGAEMN Cc1nc2ccc(COc3ccc(Cl)cc3S(=O)(=O)N(C)C)cc2[nH]1 ZINC000434646938 567319256 /nfs/dbraw/zinc/31/92/56/567319256.db2.gz ROTMCYPFLBXGCV-UHFFFAOYSA-N 0 1 379.869 3.354 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2cc(I)c(C)cc2C)n[nH]1 ZINC000476376992 567319335 /nfs/dbraw/zinc/31/93/35/567319335.db2.gz JSSOHBPWPNEGQR-NSHDSACASA-N 0 1 397.260 3.301 10 0 GGAEMN CC[C@H](CNC(=O)N(C)CC1CN(C)C1)Cc1cccc(Br)c1 ZINC000660694300 567319419 /nfs/dbraw/zinc/31/94/19/567319419.db2.gz ADSBILFXNFMPCC-AWEZNQCLSA-N 0 1 382.346 3.221 10 0 GGAEMN Cc1cc(CNC(=O)NCC2(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000660716464 567320212 /nfs/dbraw/zinc/32/02/12/567320212.db2.gz VMYVDEDYNRUCSN-UHFFFAOYSA-N 0 1 377.286 3.303 10 0 GGAEMN Cc1cc(CNC(=O)N[C@H]2CSCc3ccc(Br)cc32)n[nH]1 ZINC000660711632 567320355 /nfs/dbraw/zinc/32/03/55/567320355.db2.gz AYYCORFZVRRFHH-AWEZNQCLSA-N 0 1 381.299 3.268 10 0 GGAEMN CCN(C(=O)c1nc(C)n(-c2c(Cl)cccc2Cl)n1)[C@H]1CCN(C)C1 ZINC000617556550 567321588 /nfs/dbraw/zinc/32/15/88/567321588.db2.gz SKRFBWXEFCHEFE-LBPRGKRZSA-N 0 1 382.295 3.049 10 0 GGAEMN CCN(C(=O)c1coc(-c2ccc(Br)cc2F)n1)[C@@H]1CCN(C)C1 ZINC000617552228 567321608 /nfs/dbraw/zinc/32/16/08/567321608.db2.gz JYEOFEIMAAHQRF-GFCCVEGCSA-N 0 1 396.260 3.409 10 0 GGAEMN CCN(C(=O)CCCC(=O)c1ccc(Br)cc1)[C@H]1CCN(C)C1 ZINC000617551258 567322098 /nfs/dbraw/zinc/32/20/98/567322098.db2.gz OEFMBGNNDFIIFF-INIZCTEOSA-N 0 1 381.314 3.355 10 0 GGAEMN CCN(C(=O)c1cc(-c2ccc(Br)cc2)no1)[C@@H]1CCN(C)C1 ZINC000617562225 567323203 /nfs/dbraw/zinc/32/32/03/567323203.db2.gz DIGGSKYWBGCJAK-CQSZACIVSA-N 0 1 378.270 3.270 10 0 GGAEMN CCN(C(=O)c1cc(-c2cccc(Br)c2)no1)[C@@H]1CCN(C)C1 ZINC000617562125 567324059 /nfs/dbraw/zinc/32/40/59/567324059.db2.gz BEHWOENUBCQQIB-CQSZACIVSA-N 0 1 378.270 3.270 10 0 GGAEMN COc1ncc(Br)cc1CN(C)C1CCN(CC(F)(F)F)CC1 ZINC000660756700 567324255 /nfs/dbraw/zinc/32/42/55/567324255.db2.gz YSCHDLJYRDFCSN-UHFFFAOYSA-N 0 1 396.251 3.311 10 0 GGAEMN COc1cnc(NS(=O)(=O)c2ccc3cc(Br)ccc3c2)nc1 ZINC000500469738 567324759 /nfs/dbraw/zinc/32/47/59/567324759.db2.gz LKCCHWFWNHIIJZ-UHFFFAOYSA-N 0 1 394.250 3.202 10 0 GGAEMN Brc1ccc2nc(CN3CCC[C@H](n4ccnn4)CC3)oc2c1 ZINC000639824077 567326152 /nfs/dbraw/zinc/32/61/52/567326152.db2.gz GKNVPZQLASJXAB-ZDUSSCGKSA-N 0 1 376.258 3.409 10 0 GGAEMN Cc1cc(C)c(C(=O)N2[C@H](C)CN(C)C[C@H]2C)cc1I ZINC000476470193 567326414 /nfs/dbraw/zinc/32/64/14/567326414.db2.gz IOFRFCAAERDHAH-CHWSQXEVSA-N 0 1 386.277 3.073 10 0 GGAEMN CNS(=O)(=O)c1ccc(CNC(C)(C)c2cc(Cl)ccc2OC)cc1 ZINC000660862471 567331419 /nfs/dbraw/zinc/33/14/19/567331419.db2.gz RLFQPRCBQCXNEQ-UHFFFAOYSA-N 0 1 382.913 3.282 10 0 GGAEMN COc1ncncc1CNCCSCCOc1cccc(Br)c1 ZINC000592363276 567332018 /nfs/dbraw/zinc/33/20/18/567332018.db2.gz OXMCPOMIEUPPEM-UHFFFAOYSA-N 0 1 398.326 3.150 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](CCOc2ccc(Cl)cc2Br)C1 ZINC000568521643 567335164 /nfs/dbraw/zinc/33/51/64/567335164.db2.gz JWRYWHRVRCESMF-NWDGAFQWSA-N 0 1 392.677 3.045 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCOc3cc(Br)ccc3C2)n[nH]1 ZINC000660930244 567335558 /nfs/dbraw/zinc/33/55/58/567335558.db2.gz LQVFPEVLSUBWMI-NSHDSACASA-N 0 1 393.285 3.016 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCN(c2ccc(Cl)cc2Cl)CC1 ZINC000617789515 567336090 /nfs/dbraw/zinc/33/60/90/567336090.db2.gz LFEKIMIBINPOEE-GFCCVEGCSA-N 0 1 379.291 3.170 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000568582449 567340498 /nfs/dbraw/zinc/34/04/98/567340498.db2.gz SBXPXRHIFYJCMR-UKRRQHHQSA-N 0 1 376.913 3.497 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000568582450 567340775 /nfs/dbraw/zinc/34/07/75/567340775.db2.gz SBXPXRHIFYJCMR-ZFWWWQNUSA-N 0 1 376.913 3.497 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc(O)c(OC)cc2Br)[C@@H]1SC ZINC000592529556 567343339 /nfs/dbraw/zinc/34/33/39/567343339.db2.gz PWVXIEWRIDBTME-DFBGVHRSSA-N 0 1 376.316 3.162 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3ccc(F)c(Br)c3C2)n[nH]1 ZINC000527594329 567345201 /nfs/dbraw/zinc/34/52/01/567345201.db2.gz JUWMKCBGPIUBJJ-JTQLQIEISA-N 0 1 395.276 3.319 10 0 GGAEMN COCc1nc(CNC(=O)c2sc3ccc(Br)cc3c2C)n[nH]1 ZINC000617934910 567346676 /nfs/dbraw/zinc/34/66/76/567346676.db2.gz LPEJASDHDTXESP-UHFFFAOYSA-N 0 1 395.282 3.167 10 0 GGAEMN COCc1nnc(CNC(=O)c2sc3ccc(Br)cc3c2C)[nH]1 ZINC000617934910 567346680 /nfs/dbraw/zinc/34/66/80/567346680.db2.gz LPEJASDHDTXESP-UHFFFAOYSA-N 0 1 395.282 3.167 10 0 GGAEMN CC(C)(C(=O)N1CCO[C@@H](c2ccc(Br)cc2)C1)c1c[nH]cn1 ZINC000548741681 567346875 /nfs/dbraw/zinc/34/68/75/567346875.db2.gz HOMNEUPGCXKHQP-CQSZACIVSA-N 0 1 378.270 3.050 10 0 GGAEMN Cc1nc(S(=O)(=O)N(CCN(C)C)Cc2cccc(Cl)c2)sc1C ZINC000435214950 567349866 /nfs/dbraw/zinc/34/98/66/567349866.db2.gz GPYIANRMCBFMLW-UHFFFAOYSA-N 0 1 387.958 3.166 10 0 GGAEMN O=C(N[C@@H](Cc1nc[nH]n1)c1ccccc1)c1csc(Br)c1 ZINC000476815138 567350430 /nfs/dbraw/zinc/35/04/30/567350430.db2.gz BWEOERASCKQHDX-LBPRGKRZSA-N 0 1 377.267 3.343 10 0 GGAEMN O=C(Cc1ccc(Br)s1)N[C@@H](Cc1nc[nH]n1)c1ccccc1 ZINC000476820808 567350527 /nfs/dbraw/zinc/35/05/27/567350527.db2.gz JONMIJNCEOGKDU-ZDUSSCGKSA-N 0 1 391.294 3.271 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCc2ccc(F)c(Br)c2C1 ZINC000527627266 567351307 /nfs/dbraw/zinc/35/13/07/567351307.db2.gz DDEXEVJCOTXOIE-UHFFFAOYSA-N 0 1 378.245 3.248 10 0 GGAEMN CC(C)c1ncc2c(n1)CCN(C(=O)c1cccc(Br)c1O)C2 ZINC000527627773 567351561 /nfs/dbraw/zinc/35/15/61/567351561.db2.gz RVQXCBUJAPIWGE-UHFFFAOYSA-N 0 1 376.254 3.267 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCc2ccc(F)c(Br)c2C1 ZINC000527627889 567352145 /nfs/dbraw/zinc/35/21/45/567352145.db2.gz IRSOAXQEEYBDRC-NSHDSACASA-N 0 1 378.245 3.316 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCOC[C@H]1CC(F)F)c1ccc(Cl)cc1 ZINC000548815023 567352365 /nfs/dbraw/zinc/35/23/65/567352365.db2.gz JKDPSWNYGWFUFR-HUUCEWRRSA-N 0 1 375.847 3.008 10 0 GGAEMN Brc1ccc(-c2nc(CN3CC[C@H](Cn4ccnn4)C3)co2)cc1 ZINC000661142458 567353027 /nfs/dbraw/zinc/35/30/27/567353027.db2.gz BEQWNQSXPIGNQM-ZDUSSCGKSA-N 0 1 388.269 3.218 10 0 GGAEMN Clc1ccc(-c2nnc(CN3CC[C@@H](Cn4ccnn4)C3)o2)c(Cl)c1 ZINC000661145934 567353404 /nfs/dbraw/zinc/35/34/04/567353404.db2.gz WCIWMTZVMWVTCV-LLVKDONJSA-N 0 1 379.251 3.157 10 0 GGAEMN CC(C)Oc1cc(Cl)c(CNCCC(=O)N2CCOCC2)cc1Cl ZINC000527644729 567355195 /nfs/dbraw/zinc/35/51/95/567355195.db2.gz SJTHYZAACAFCTP-UHFFFAOYSA-N 0 1 375.296 3.119 10 0 GGAEMN C[C@@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)C[C@@H](C)C1=O ZINC000618094600 567355461 /nfs/dbraw/zinc/35/54/61/567355461.db2.gz LEKLQCJGUGHIDH-GHMZBOCLSA-N 0 1 376.254 3.136 10 0 GGAEMN CC[N@H+]1CCC[C@H]1CNC(=O)NCc1ccc(Br)c(F)c1F ZINC000527653475 567355896 /nfs/dbraw/zinc/35/58/96/567355896.db2.gz UKKQPQPCGXIZOE-NSHDSACASA-N 0 1 376.245 3.011 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)C[C@@H](C)C1=O ZINC000618091436 567356047 /nfs/dbraw/zinc/35/60/47/567356047.db2.gz HIRPTNBYCOAQON-GHMZBOCLSA-N 0 1 376.254 3.136 10 0 GGAEMN CC(C)Oc1cc(Cl)c(C[NH2+]CCC(=O)N2CC[NH+](C)CC2)cc1Cl ZINC000527654665 567356525 /nfs/dbraw/zinc/35/65/25/567356525.db2.gz VAGZDXYOJKYWNB-UHFFFAOYSA-N 0 1 388.339 3.034 10 0 GGAEMN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2c(F)ccc(Br)c2F)C1 ZINC000661218539 567357721 /nfs/dbraw/zinc/35/77/21/567357721.db2.gz ZQWZCLUFNLDHOW-UEKVPHQBSA-N 0 1 378.257 3.383 10 0 GGAEMN O=C(COc1ccsc1)Nc1nc(-c2ccccc2Br)n[nH]1 ZINC000548888278 567358679 /nfs/dbraw/zinc/35/86/79/567358679.db2.gz YOBRIOBMYYILIP-UHFFFAOYSA-N 0 1 379.239 3.313 10 0 GGAEMN CC(=O)N1CCc2c1cccc2NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000548888435 567358714 /nfs/dbraw/zinc/35/87/14/567358714.db2.gz UYWODTJJLXJXHI-UHFFFAOYSA-N 0 1 399.248 3.487 10 0 GGAEMN COCCN1CC[C@H](NC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@H]2C)C1 ZINC000435417716 567361222 /nfs/dbraw/zinc/36/12/22/567361222.db2.gz NBZPFGBPPOQRMW-DOMZBBRYSA-N 0 1 386.323 3.343 10 0 GGAEMN COCCN1CC[C@H](NC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)C1 ZINC000435417719 567361628 /nfs/dbraw/zinc/36/16/28/567361628.db2.gz NBZPFGBPPOQRMW-WFASDCNBSA-N 0 1 386.323 3.343 10 0 GGAEMN COc1cccc([C@H](CNC(=O)[C@@H]2C[C@@]2(C)Br)N2CCCC2)c1 ZINC000527686961 567361881 /nfs/dbraw/zinc/36/18/81/567361881.db2.gz YEEYOWGEFKODNW-XYJFISCASA-N 0 1 381.314 3.122 10 0 GGAEMN C[C@@H](CCc1ccc(I)cc1)CC(=O)NCc1cnc[nH]1 ZINC000592767510 567361895 /nfs/dbraw/zinc/36/18/95/567361895.db2.gz YIKRIPGXXJUHJR-LBPRGKRZSA-N 0 1 397.260 3.290 10 0 GGAEMN COc1cccc([C@H](CNC(=O)[C@H]2C[C@]2(C)Br)N2CCCC2)c1 ZINC000527686959 567362048 /nfs/dbraw/zinc/36/20/48/567362048.db2.gz YEEYOWGEFKODNW-RYRKJORJSA-N 0 1 381.314 3.122 10 0 GGAEMN COc1ccccc1[C@H](CNC(=O)[C@H]1C[C@]1(C)Br)N1CCCC1 ZINC000527682970 567362068 /nfs/dbraw/zinc/36/20/68/567362068.db2.gz MQOMTCDTGKVRTL-VKJFTORMSA-N 0 1 381.314 3.122 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@H]1C ZINC000501077396 567362313 /nfs/dbraw/zinc/36/23/13/567362313.db2.gz URHMDGKZXFXZIP-VXGBXAGGSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@H]1C ZINC000501077396 567362318 /nfs/dbraw/zinc/36/23/18/567362318.db2.gz URHMDGKZXFXZIP-VXGBXAGGSA-N 0 1 392.301 3.422 10 0 GGAEMN O[C@H](CN1CCOCC1)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000476995604 567363943 /nfs/dbraw/zinc/36/39/43/567363943.db2.gz MUUOBLAMZLTNDG-SFHVURJKSA-N 0 1 385.335 3.166 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(Br)c(F)c2F)[C@@H]1n1cccn1 ZINC000527711870 567366769 /nfs/dbraw/zinc/36/67/69/567366769.db2.gz BOSWBZPLBKQLNZ-IOASZLSFSA-N 0 1 386.240 3.432 10 0 GGAEMN CCOC(=O)c1csc(CSc2nc(-c3ccc(OC)cc3)n[nH]2)n1 ZINC000549010617 567367552 /nfs/dbraw/zinc/36/75/52/567367552.db2.gz SMUNNPWRIQZFLF-UHFFFAOYSA-N 0 1 376.463 3.406 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCC[C@](O)(C2CC2)C1 ZINC000618286605 567367867 /nfs/dbraw/zinc/36/78/67/567367867.db2.gz QRGKRTYUBZFWBB-GOSISDBHSA-N 0 1 390.281 3.216 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCC[C@@](O)(C2CC2)C1 ZINC000618286606 567368031 /nfs/dbraw/zinc/36/80/31/567368031.db2.gz QRGKRTYUBZFWBB-SFHVURJKSA-N 0 1 390.281 3.216 10 0 GGAEMN COC(=O)CC1(NCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000568986371 567370802 /nfs/dbraw/zinc/37/08/02/567370802.db2.gz AVSCVSGMECDHOB-OAHLLOKOSA-N 0 1 385.291 3.342 10 0 GGAEMN CO[C@]1(CO)CCCN([C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000661396914 567371474 /nfs/dbraw/zinc/37/14/74/567371474.db2.gz UFLPFVXLGKRSKX-FHSNZYRGSA-N 0 1 389.323 3.032 10 0 GGAEMN O[C@@H](CNCc1csc(-c2cccc(Br)c2)n1)[C@@H]1CCCO1 ZINC000527760850 567371935 /nfs/dbraw/zinc/37/19/35/567371935.db2.gz SYTAKXLYNWUYEQ-GJZGRUSLSA-N 0 1 383.311 3.202 10 0 GGAEMN O[C@H](CNCc1csc(-c2cccc(Br)c2)n1)[C@@H]1CCCO1 ZINC000527760845 567371983 /nfs/dbraw/zinc/37/19/83/567371983.db2.gz SYTAKXLYNWUYEQ-CABCVRRESA-N 0 1 383.311 3.202 10 0 GGAEMN FC(F)(F)[C@H](CNCc1cccc(I)c1)n1cccn1 ZINC000527741487 567372005 /nfs/dbraw/zinc/37/20/05/567372005.db2.gz CTTWCJNZHHDSQO-LBPRGKRZSA-N 0 1 395.166 3.381 10 0 GGAEMN COc1cc(CNC[C@@H](n2cccn2)C(F)(F)F)cc(Br)c1O ZINC000527744176 567372088 /nfs/dbraw/zinc/37/20/88/567372088.db2.gz OTILHBRZKXPISZ-GFCCVEGCSA-N 0 1 394.191 3.253 10 0 GGAEMN COc1ccc(CN2CC[C@H]2CNCc2ncc(Br)s2)cc1 ZINC000527773876 567373208 /nfs/dbraw/zinc/37/32/08/567373208.db2.gz OIDFGRNZFYLTBE-ZDUSSCGKSA-N 0 1 382.327 3.278 10 0 GGAEMN CN1C(=O)c2ccccc2[C@@H]1CNCc1cc2c(cc1Br)OCO2 ZINC000527804536 567375274 /nfs/dbraw/zinc/37/52/74/567375274.db2.gz DYNPRPULECGKNS-HNNXBMFYSA-N 0 1 389.249 3.094 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3ncccc3Br)cccc21 ZINC000477155097 567376416 /nfs/dbraw/zinc/37/64/16/567376416.db2.gz XFSJDTQIXYDRPL-AWEZNQCLSA-N 0 1 376.254 3.482 10 0 GGAEMN CC1=C[C@@H](C)CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000569062837 567377093 /nfs/dbraw/zinc/37/70/93/567377093.db2.gz KLABUOJFAVRGGL-LLVKDONJSA-N 0 1 390.285 3.342 10 0 GGAEMN CC1=C[C@@H](C)CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000569062837 567377098 /nfs/dbraw/zinc/37/70/98/567377098.db2.gz KLABUOJFAVRGGL-LLVKDONJSA-N 0 1 390.285 3.342 10 0 GGAEMN COc1cc(Br)c(CNCC(C)(C)C(=O)N2CCCC2)c(OC)c1 ZINC000527813234 567377101 /nfs/dbraw/zinc/37/71/01/567377101.db2.gz RZWMSTCPCXYSPW-UHFFFAOYSA-N 0 1 399.329 3.205 10 0 GGAEMN C[C@H](Cc1cnc[nH]1)C(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000618360397 567377608 /nfs/dbraw/zinc/37/76/08/567377608.db2.gz QLHVYUIKRHBBAI-BMIGLBTASA-N 0 1 380.311 3.455 10 0 GGAEMN CN(C(=O)CCCC(=O)c1ccc(Br)cc1)[C@@H]1CCN(C2CC2)C1 ZINC000501288889 567378042 /nfs/dbraw/zinc/37/80/42/567378042.db2.gz NYEJIEIISHITIW-QGZVFWFLSA-N 0 1 393.325 3.497 10 0 GGAEMN C[C@@H](Cc1cnc[nH]1)C(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000618360398 567378365 /nfs/dbraw/zinc/37/83/65/567378365.db2.gz QLHVYUIKRHBBAI-BONVTDFDSA-N 0 1 380.311 3.455 10 0 GGAEMN C[C@H]1CC[N@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@H]1C(=O)[O-] ZINC000569101786 567379613 /nfs/dbraw/zinc/37/96/13/567379613.db2.gz DKAPPXGEERJGPU-DTWKUNHWSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@H]1C(=O)[O-] ZINC000569101786 567379619 /nfs/dbraw/zinc/37/96/19/567379619.db2.gz DKAPPXGEERJGPU-DTWKUNHWSA-N 0 1 386.271 3.103 10 0 GGAEMN Cc1nnc(SCC(=O)N[C@H]2CSCc3ccc(Br)cc32)[nH]1 ZINC000618362127 567380362 /nfs/dbraw/zinc/38/03/62/567380362.db2.gz ZZDCZVNGDODXRC-LBPRGKRZSA-N 0 1 399.339 3.072 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N[C@H]2CSCc3ccc(Br)cc32)n1 ZINC000618362127 567380366 /nfs/dbraw/zinc/38/03/66/567380366.db2.gz ZZDCZVNGDODXRC-LBPRGKRZSA-N 0 1 399.339 3.072 10 0 GGAEMN O=S1(=O)C[C@H](CN[C@@H]2CCc3cc(F)c(Cl)cc32)Oc2ccccc21 ZINC000527907732 567383148 /nfs/dbraw/zinc/38/31/48/567383148.db2.gz BEGOXGWVBDPEBJ-BLLLJJGKSA-N 0 1 381.856 3.291 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@@H]3C[C@@]3(C)Br)cc2)C[C@H](C)O1 ZINC000527907724 567383602 /nfs/dbraw/zinc/38/36/02/567383602.db2.gz BUGSRLJCKDXOHL-BDEJMISXSA-N 0 1 395.341 3.086 10 0 GGAEMN C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N=c1cc(-c2nccn2C)[nH][nH]1 ZINC000435712387 567384293 /nfs/dbraw/zinc/38/42/93/567384293.db2.gz ATZJEMODGHADRK-JTQLQIEISA-N 0 1 378.263 3.356 10 0 GGAEMN COc1ccccc1CCNC(=O)CNCc1ccc(Br)c(F)c1 ZINC000435747323 567387490 /nfs/dbraw/zinc/38/74/90/567387490.db2.gz GXSLOCCMCJEULR-UHFFFAOYSA-N 0 1 395.272 3.045 10 0 GGAEMN CC[C@@H](C)N1CCN(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)CC1 ZINC000456529560 567387758 /nfs/dbraw/zinc/38/77/58/567387758.db2.gz LRVYSARSUUEZNK-GFCCVEGCSA-N 0 1 392.297 3.259 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1 ZINC000477339735 567389739 /nfs/dbraw/zinc/38/97/39/567389739.db2.gz PCGKOCJYBKMAPM-JTQLQIEISA-N 0 1 381.274 3.119 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)N[C@H](C)c1n[nH]c(C(C)C)n1 ZINC000477339736 567389881 /nfs/dbraw/zinc/38/98/81/567389881.db2.gz PCGKOCJYBKMAPM-SNVBAGLBSA-N 0 1 381.274 3.119 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)c2[nH]nc3ccc(Br)cc32)n[nH]1 ZINC000477343732 567390181 /nfs/dbraw/zinc/39/01/81/567390181.db2.gz ZNESVFWFDCCLPU-QMMMGPOBSA-N 0 1 377.246 3.058 10 0 GGAEMN CN(C)C(=O)c1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000501492383 567393156 /nfs/dbraw/zinc/39/31/56/567393156.db2.gz UERXMJZJEANNPA-UHFFFAOYSA-N 0 1 387.237 3.280 10 0 GGAEMN Brc1cc(CNc2cnccc2-n2cccn2)cc2c1OCCO2 ZINC000569290722 567393781 /nfs/dbraw/zinc/39/37/81/567393781.db2.gz BAHMHZHDIVHJKM-UHFFFAOYSA-N 0 1 387.237 3.413 10 0 GGAEMN c1csc(C[N@@H+]2CCC[C@H](CN=c3[n-]nc(C4CCOCC4)s3)C2)c1 ZINC000549487357 567394087 /nfs/dbraw/zinc/39/40/87/567394087.db2.gz SNOZOKJNSHGKHQ-CQSZACIVSA-N 0 1 378.567 3.240 10 0 GGAEMN O=C(NCc1cnn(-c2ccccc2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000501514951 567394377 /nfs/dbraw/zinc/39/43/77/567394377.db2.gz MIZMZUBVNWBXLD-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN CN(C)C(=O)c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000501522444 567394590 /nfs/dbraw/zinc/39/45/90/567394590.db2.gz JNCRTMYXYWZVAZ-UHFFFAOYSA-N 0 1 387.237 3.280 10 0 GGAEMN Cc1nc(C)c(C(=O)N2CC3(CCOCC3)c3ccc(Br)cc32)[nH]1 ZINC000640791728 567395067 /nfs/dbraw/zinc/39/50/67/567395067.db2.gz JSQMKGDZMNFPBL-UHFFFAOYSA-N 0 1 390.281 3.498 10 0 GGAEMN CN(CC(=O)NCC1(Cc2ccc(Br)cc2)CC1)[C@@H]1CCSC1 ZINC000618537088 567396347 /nfs/dbraw/zinc/39/63/47/567396347.db2.gz CPLDAUKYWKBOFF-MRXNPFEDSA-N 0 1 397.382 3.325 10 0 GGAEMN CO[C@H]1C[C@H](N(C)C(=O)c2[nH]nc3ccc(Br)cc32)C12CCC2 ZINC000456638895 567396915 /nfs/dbraw/zinc/39/69/15/567396915.db2.gz NWGHEALWTNIMCW-KBPBESRZSA-N 0 1 378.270 3.355 10 0 GGAEMN O=C(Nc1ccn(-c2ccccc2)n1)c1cc(Br)cc2nc[nH]c21 ZINC000501559957 567397300 /nfs/dbraw/zinc/39/73/00/567397300.db2.gz GZFVEMPCEFHAEH-UHFFFAOYSA-N 0 1 382.221 3.185 10 0 GGAEMN Cc1nnc(SCC(=O)NCC2(Cc3ccc(Br)cc3)CC2)[nH]1 ZINC000618539062 567397907 /nfs/dbraw/zinc/39/79/07/567397907.db2.gz OMLANMZOIRNKQN-UHFFFAOYSA-N 0 1 395.326 3.107 10 0 GGAEMN Cc1n[nH]c(SCC(=O)NCC2(Cc3ccc(Br)cc3)CC2)n1 ZINC000618539062 567397917 /nfs/dbraw/zinc/39/79/17/567397917.db2.gz OMLANMZOIRNKQN-UHFFFAOYSA-N 0 1 395.326 3.107 10 0 GGAEMN O=C(NCC1(Cc2ccc(Br)cc2)CC1)[C@@H]1CCc2[nH]cnc2C1 ZINC000618538330 567398381 /nfs/dbraw/zinc/39/83/81/567398381.db2.gz KKGJNJZORACQIS-CQSZACIVSA-N 0 1 388.309 3.416 10 0 GGAEMN COc1cc2nccc(N3CC[C@H]4CC[C@@H](C3)[S@]4=O)c2cc1Br ZINC000528218441 567402056 /nfs/dbraw/zinc/40/20/56/567402056.db2.gz GDBMJBDKAZZNBE-WCBZVUCDSA-N 0 1 395.322 3.496 10 0 GGAEMN CN(C)C(=O)N(C)[C@@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1 ZINC000662006827 567403112 /nfs/dbraw/zinc/40/31/12/567403112.db2.gz DAEAQWSUVZFXSE-MRXNPFEDSA-N 0 1 396.329 3.100 10 0 GGAEMN CCn1cc(-c2[nH]ncc2C(=O)NCc2sc(C)cc2Br)cn1 ZINC000618644232 567403759 /nfs/dbraw/zinc/40/37/59/567403759.db2.gz ATTMLMFFFOPCBK-UHFFFAOYSA-N 0 1 394.298 3.356 10 0 GGAEMN Cc1cc(Br)c(C(=O)N=c2cc(-c3nccn3C)[nH][nH]2)cc1Cl ZINC000501801950 567406112 /nfs/dbraw/zinc/40/61/12/567406112.db2.gz WAIQZMMMCQNTHN-UHFFFAOYSA-N 0 1 394.660 3.209 10 0 GGAEMN COCCN(Cc1ccc(I)c(Cl)c1)[C@H]1CCOC1 ZINC000436116661 567406357 /nfs/dbraw/zinc/40/63/57/567406357.db2.gz WHLDXEGEVQUFKN-LBPRGKRZSA-N 0 1 395.668 3.182 10 0 GGAEMN C[C@H](CNC(=O)c1ccc(CN(C)C)nc1)Oc1ccccc1Br ZINC000549738200 567407020 /nfs/dbraw/zinc/40/70/20/567407020.db2.gz NAWJXOJQZGQLLM-CYBMUJFWSA-N 0 1 392.297 3.103 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)c2cccc3cccc(Br)c32)[nH][nH]1 ZINC000501817625 567407130 /nfs/dbraw/zinc/40/71/30/567407130.db2.gz DVAXQKLUDSMRDU-UHFFFAOYSA-N 0 1 396.248 3.400 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2CCC3(COC3)C2)C1=O ZINC000662073366 567408286 /nfs/dbraw/zinc/40/82/86/567408286.db2.gz MFBUMPLVZWOVTA-MRXNPFEDSA-N 0 1 393.325 3.284 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN([C@H](C)C(=O)Nc2cccc(Br)c2)C1 ZINC000662118044 567413212 /nfs/dbraw/zinc/41/32/12/567413212.db2.gz NXKAPNFBDAXUIX-KGLIPLIRSA-N 0 1 396.329 3.013 10 0 GGAEMN CCCc1cc(C(=O)N2CCOC[C@@H]2c2cccc(Br)c2)n[nH]1 ZINC000618776012 567414424 /nfs/dbraw/zinc/41/44/24/567414424.db2.gz MHOCDLXUCVUBKJ-MRXNPFEDSA-N 0 1 378.270 3.338 10 0 GGAEMN CC(=O)c1[nH]c(CCN2CCOc3cc(Br)ccc3C2)nc1C ZINC000662198577 567416271 /nfs/dbraw/zinc/41/62/71/567416271.db2.gz JEMJAROPPMOHDH-UHFFFAOYSA-N 0 1 378.270 3.120 10 0 GGAEMN O=C1[C@H](NCc2cc(Cl)cc(C(F)(F)F)c2)CCN1C1CCOCC1 ZINC000436295682 567417739 /nfs/dbraw/zinc/41/77/39/567417739.db2.gz QBFHGWFQIMYLHT-OAHLLOKOSA-N 0 1 376.806 3.228 10 0 GGAEMN FC(F)(F)C[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCO1 ZINC000662229495 567419011 /nfs/dbraw/zinc/41/90/11/567419011.db2.gz UPNVSMWLEHHCHI-JTQLQIEISA-N 0 1 378.192 3.479 10 0 GGAEMN Cc1ccncc1CN(C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000477898291 567424779 /nfs/dbraw/zinc/42/47/79/567424779.db2.gz ZXOZUXHPEUZZAK-UHFFFAOYSA-N 0 1 386.249 3.266 10 0 GGAEMN CC(C)N1CCN(C(=O)N[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000618952138 567426055 /nfs/dbraw/zinc/42/60/55/567426055.db2.gz RRYMKBGWEKQZFU-HNNXBMFYSA-N 0 1 382.302 3.008 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000550111070 567427935 /nfs/dbraw/zinc/42/79/35/567427935.db2.gz ZLIFIGDBXBLFOR-KBPBESRZSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550111070 567427936 /nfs/dbraw/zinc/42/79/36/567427936.db2.gz ZLIFIGDBXBLFOR-KBPBESRZSA-N 0 1 393.285 3.056 10 0 GGAEMN Fc1c(Br)ccc(CN2CCC[C@H](CN3CCOCC3)C2)c1F ZINC000528485085 567428918 /nfs/dbraw/zinc/42/89/18/567428918.db2.gz CKZXSGFSWBCSKP-CYBMUJFWSA-N 0 1 389.284 3.272 10 0 GGAEMN Cn1cc([C@H]2N(C(=O)c3[nH]nc4ccc(Br)cc43)CC2(C)C)cn1 ZINC000569754527 567429843 /nfs/dbraw/zinc/42/98/43/567429843.db2.gz BPVYUPBPXUIZQZ-OAHLLOKOSA-N 0 1 388.269 3.282 10 0 GGAEMN Cn1cc([C@@H]2N(C(=O)c3[nH]nc4ccc(Br)cc43)CC2(C)C)cn1 ZINC000569754526 567430225 /nfs/dbraw/zinc/43/02/25/567430225.db2.gz BPVYUPBPXUIZQZ-HNNXBMFYSA-N 0 1 388.269 3.282 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000528497787 567430353 /nfs/dbraw/zinc/43/03/53/567430353.db2.gz RYAAYDFYGLCMFX-YOEHRIQHSA-N 0 1 387.362 3.090 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCC2(c3ccccc3Br)CC2)cn1 ZINC000550157798 567431070 /nfs/dbraw/zinc/43/10/70/567431070.db2.gz IMFVFXVUYVRDBU-UHFFFAOYSA-N 0 1 388.309 3.367 10 0 GGAEMN C[N@@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2[O-])[C@H]1c1ccccc1 ZINC000436524733 567431127 /nfs/dbraw/zinc/43/11/27/567431127.db2.gz KJKBJQGNVUORHO-DOTOQJQBSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2[O-])[C@H]1c1ccccc1 ZINC000436524733 567431132 /nfs/dbraw/zinc/43/11/32/567431132.db2.gz KJKBJQGNVUORHO-DOTOQJQBSA-N 0 1 375.266 3.330 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc(F)ccc1O ZINC000436530876 567431688 /nfs/dbraw/zinc/43/16/88/567431688.db2.gz CVSVUQGTQJWQMN-UHFFFAOYSA-N 0 1 391.200 3.009 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc(F)ccc1O ZINC000436530876 567431693 /nfs/dbraw/zinc/43/16/93/567431693.db2.gz CVSVUQGTQJWQMN-UHFFFAOYSA-N 0 1 391.200 3.009 10 0 GGAEMN Cc1cc([C@@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)nn1C ZINC000502409793 567432038 /nfs/dbraw/zinc/43/20/38/567432038.db2.gz YIGUHFDPWDYNDR-LLVKDONJSA-N 0 1 375.274 3.127 10 0 GGAEMN Cc1cc([C@@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)nn1C ZINC000502409793 567432043 /nfs/dbraw/zinc/43/20/43/567432043.db2.gz YIGUHFDPWDYNDR-LLVKDONJSA-N 0 1 375.274 3.127 10 0 GGAEMN Cc1cc([C@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)nn1C ZINC000502409794 567432138 /nfs/dbraw/zinc/43/21/38/567432138.db2.gz YIGUHFDPWDYNDR-NSHDSACASA-N 0 1 375.274 3.127 10 0 GGAEMN Cc1cc([C@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)nn1C ZINC000502409794 567432142 /nfs/dbraw/zinc/43/21/42/567432142.db2.gz YIGUHFDPWDYNDR-NSHDSACASA-N 0 1 375.274 3.127 10 0 GGAEMN C[N@@H+]1CC[C@@H](NC(=O)c2cc(Br)ccc2[O-])[C@H]1c1ccccc1 ZINC000436524312 567432252 /nfs/dbraw/zinc/43/22/52/567432252.db2.gz GOMWKQRISGKBCR-NVXWUHKLSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2cc(Br)ccc2[O-])[C@H]1c1ccccc1 ZINC000436524312 567432257 /nfs/dbraw/zinc/43/22/57/567432257.db2.gz GOMWKQRISGKBCR-NVXWUHKLSA-N 0 1 375.266 3.330 10 0 GGAEMN C[C@@H](NCCN(C)S(=O)(=O)c1cccs1)c1cnn(C2CCCC2)c1 ZINC000502411000 567432373 /nfs/dbraw/zinc/43/23/73/567432373.db2.gz ZPFQRXMVJVMFAZ-CQSZACIVSA-N 0 1 382.555 3.031 10 0 GGAEMN O[C@@H](COc1cc(F)ccc1Br)CN1CCc2ccccc2C1 ZINC000550177520 567432888 /nfs/dbraw/zinc/43/28/88/567432888.db2.gz ZHXDDLDKZVFQCY-MRXNPFEDSA-N 0 1 380.257 3.386 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550209204 567433987 /nfs/dbraw/zinc/43/39/87/567433987.db2.gz GXWZSLRXXIBMSK-STQMWFEESA-N 0 1 379.258 3.378 10 0 GGAEMN C[C@@H]1CCN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)C[C@H](C)O1 ZINC000619123666 567435449 /nfs/dbraw/zinc/43/54/49/567435449.db2.gz LHYATMHQQAYZPJ-NEPJUHHUSA-N 0 1 378.270 3.479 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1 ZINC000528546343 567436089 /nfs/dbraw/zinc/43/60/89/567436089.db2.gz DCNCLOWSLCQIGA-CQSZACIVSA-N 0 1 387.343 3.053 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)NC[C@H]2CCN2C2CCCC2)c1 ZINC000528546343 567436093 /nfs/dbraw/zinc/43/60/93/567436093.db2.gz DCNCLOWSLCQIGA-CQSZACIVSA-N 0 1 387.343 3.053 10 0 GGAEMN Cc1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c(Br)c1 ZINC000528547197 567436179 /nfs/dbraw/zinc/43/61/79/567436179.db2.gz NWULUFMJNFKYQK-AWEZNQCLSA-N 0 1 387.343 3.053 10 0 GGAEMN Cc1ccc(S(=O)(=O)NC[C@@H]2CCN2C2CCCC2)c(Br)c1 ZINC000528547197 567436184 /nfs/dbraw/zinc/43/61/84/567436184.db2.gz NWULUFMJNFKYQK-AWEZNQCLSA-N 0 1 387.343 3.053 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)c2cc(C(C)(C)N)no2)cc1Br ZINC000662455285 567438634 /nfs/dbraw/zinc/43/86/34/567438634.db2.gz XLXCJCPZIMOGPQ-SECBINFHSA-N 0 1 382.258 3.131 10 0 GGAEMN O=C(Nc1cccc([C@@H]2CNC(=O)C2)c1)c1ccc(Br)cc1O ZINC000436605697 567438889 /nfs/dbraw/zinc/43/88/89/567438889.db2.gz PVFBRGFYRINYNM-NSHDSACASA-N 0 1 375.222 3.011 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCCC(F)(F)C1 ZINC000593789698 567440802 /nfs/dbraw/zinc/44/08/02/567440802.db2.gz SOJKYHNIYBYCER-UHFFFAOYSA-N 0 1 391.159 3.039 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC(C)(C)c2ccc(Br)cc2)on1 ZINC000662507765 567443208 /nfs/dbraw/zinc/44/32/08/567443208.db2.gz QQJQRLVPWVHQRY-UHFFFAOYSA-N 0 1 380.286 3.339 10 0 GGAEMN OC[C@@H]1CCC2(CCOCC2)CN1Cc1nc2ccc(Br)cc2o1 ZINC000528645837 567444424 /nfs/dbraw/zinc/44/44/24/567444424.db2.gz QGJGKJCQHUZAJR-AWEZNQCLSA-N 0 1 395.297 3.344 10 0 GGAEMN COc1ccc(CN2CC3(CCOCC3)CC[C@H]2CO)c(Br)c1 ZINC000528636897 567444892 /nfs/dbraw/zinc/44/48/92/567444892.db2.gz FLKMZBSLIYFART-HNNXBMFYSA-N 0 1 384.314 3.211 10 0 GGAEMN COc1ccc(CN2CC3(CCOCC3)CC[C@@H]2CO)c(Br)c1 ZINC000528636901 567445176 /nfs/dbraw/zinc/44/51/76/567445176.db2.gz FLKMZBSLIYFART-OAHLLOKOSA-N 0 1 384.314 3.211 10 0 GGAEMN CC(C)c1n[nH]c(C(N)=O)c1NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000457168814 567445445 /nfs/dbraw/zinc/44/54/45/567445445.db2.gz NYOZCBQJXUZXHV-QMMMGPOBSA-N 0 1 385.251 3.345 10 0 GGAEMN CSc1c(C(=O)NC[C@H](c2cccs2)N2CCC(C)CC2)cnn1C ZINC000478283629 567445719 /nfs/dbraw/zinc/44/57/19/567445719.db2.gz OAXFWJMFOIQMOZ-OAHLLOKOSA-N 0 1 378.567 3.407 10 0 GGAEMN CCN(CC1CCC1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000478279970 567446067 /nfs/dbraw/zinc/44/60/67/567446067.db2.gz MGZUZLMTIVGTKA-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN Cc1cc(C2CCN(C(=O)c3sc4c(c3Br)CNC4)CC2)n[nH]1 ZINC000662543610 567447901 /nfs/dbraw/zinc/44/79/01/567447901.db2.gz WXYKUYZBDOHNGE-UHFFFAOYSA-N 0 1 395.326 3.165 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CC[C@@H](c3cc(C)c(Cl)cc3O)C2)[nH]1 ZINC000619375142 567448114 /nfs/dbraw/zinc/44/81/14/567448114.db2.gz SSNWMKKQEISYAZ-GFCCVEGCSA-N 0 1 380.901 3.279 10 0 GGAEMN CCc1sc(C(=O)N2CCO[C@@H]3CCN(CC)C[C@@H]32)cc1Br ZINC000502749121 567448227 /nfs/dbraw/zinc/44/82/27/567448227.db2.gz MNBOJRDAJGUNDF-QWHCGFSZSA-N 0 1 387.343 3.008 10 0 GGAEMN CO[C@H]1CCC[C@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000550471284 567449188 /nfs/dbraw/zinc/44/91/88/567449188.db2.gz HFDIBLOVNRMPMC-JSGCOSHPSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@H]1CCC[C@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000550471284 567449193 /nfs/dbraw/zinc/44/91/93/567449193.db2.gz HFDIBLOVNRMPMC-JSGCOSHPSA-N 0 1 393.285 3.056 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NC(C)(C)Cc2ccc(Br)cc2)on1 ZINC000662572951 567449988 /nfs/dbraw/zinc/44/99/88/567449988.db2.gz PDZCFCMQIRUPRH-UHFFFAOYSA-N 0 1 380.286 3.382 10 0 GGAEMN CN(C)C[C@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000528766518 567452818 /nfs/dbraw/zinc/45/28/18/567452818.db2.gz NLFAIIFPJLPOKJ-KBPBESRZSA-N 0 1 398.256 3.349 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000594030825 567454023 /nfs/dbraw/zinc/45/40/23/567454023.db2.gz SFEVGRUNKPHOIF-RYUDHWBXSA-N 0 1 382.423 3.386 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662644090 567454658 /nfs/dbraw/zinc/45/46/58/567454658.db2.gz VFSAJHPXOKUYNS-SECBINFHSA-N 0 1 384.249 3.131 10 0 GGAEMN Cc1cc(C(=O)N2CCN(C(=O)c3cc(Cl)ccc3Cl)[C@H](C)C2)n[nH]1 ZINC000457295417 567455342 /nfs/dbraw/zinc/45/53/42/567455342.db2.gz UHYAFXLXSHXKTM-LLVKDONJSA-N 0 1 381.263 3.012 10 0 GGAEMN O=C(CCCN1CC[C@H]2CC[C@@H](C1)[S@@]2=O)c1ccc(Br)cc1 ZINC000528788024 567456643 /nfs/dbraw/zinc/45/66/43/567456643.db2.gz KFAJONZTHDUPDG-ZMPRRUGASA-N 0 1 384.339 3.397 10 0 GGAEMN O=S(=O)(NCC(F)(F)C(F)F)c1cccc(Br)c1Cl ZINC000570135130 567461463 /nfs/dbraw/zinc/46/14/63/567461463.db2.gz INORJNKPKQKRDO-UHFFFAOYSA-N 0 1 384.576 3.281 10 0 GGAEMN COCC[C@@H](Cc1ccco1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000502846437 567458010 /nfs/dbraw/zinc/45/80/10/567458010.db2.gz SIONGWFWIZALLI-LBPRGKRZSA-N 0 1 392.253 3.296 10 0 GGAEMN CC(C)CN(Cc1cnn(C)c1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000457338370 567459472 /nfs/dbraw/zinc/45/94/72/567459472.db2.gz DYIDEMNUMSNYEO-UHFFFAOYSA-N 0 1 390.285 3.357 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC(C)(C)c2ccccc2Br)on1 ZINC000662803728 567462279 /nfs/dbraw/zinc/46/22/79/567462279.db2.gz UAGFWWDCEHOJBN-UHFFFAOYSA-N 0 1 380.286 3.339 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)c1cc(C(C)(C)N)no1 ZINC000662799416 567462656 /nfs/dbraw/zinc/46/26/56/567462656.db2.gz KSOIBZULVKODAP-UHFFFAOYSA-N 0 1 396.285 3.002 10 0 GGAEMN Cc1cc(NC(=O)N2CCC(C)(N3CCOCC3)CC2)ccc1Br ZINC000528858972 567462704 /nfs/dbraw/zinc/46/27/04/567462704.db2.gz QWSRMVZGHANJTP-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)on1 ZINC000662797342 567462995 /nfs/dbraw/zinc/46/29/95/567462995.db2.gz YCSMOMUMJIIZPO-LLVKDONJSA-N 0 1 383.279 3.184 10 0 GGAEMN O=C(NCCOc1ccc(F)cc1F)c1cc(Br)cc2nc[nH]c21 ZINC000502996496 567463225 /nfs/dbraw/zinc/46/32/25/567463225.db2.gz DCAFDWFDTXQVLM-UHFFFAOYSA-N 0 1 396.191 3.412 10 0 GGAEMN CCN(CC(=O)NCc1ccc(I)cc1Cl)C1CC1 ZINC000478515820 567463423 /nfs/dbraw/zinc/46/34/23/567463423.db2.gz IKSSABHANNZTOY-UHFFFAOYSA-N 0 1 392.668 3.045 10 0 GGAEMN COC[C@@](C)(NC(=O)c1cc(Br)cc2nc[nH]c21)C(F)(F)F ZINC000502982487 567463768 /nfs/dbraw/zinc/46/37/68/567463768.db2.gz MVDGNYPFEOBPMX-GFCCVEGCSA-N 0 1 380.164 3.023 10 0 GGAEMN C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(Br)cc(Cl)c1[O-] ZINC000436911380 567463941 /nfs/dbraw/zinc/46/39/41/567463941.db2.gz QGDJTZOYEDTOER-SNVBAGLBSA-N 0 1 375.694 3.412 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N(Cc2csc(Br)c2)C2CC2)on1 ZINC000662824269 567464328 /nfs/dbraw/zinc/46/43/28/567464328.db2.gz WBFYFPYKHKAOMC-UHFFFAOYSA-N 0 1 384.299 3.497 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)N1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000528898927 567466896 /nfs/dbraw/zinc/46/68/96/567466896.db2.gz BAZAEGPLYXKZTG-IGCXYCKISA-N 0 1 375.270 3.309 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)n[nH]1 ZINC000528898927 567466903 /nfs/dbraw/zinc/46/69/03/567466903.db2.gz BAZAEGPLYXKZTG-IGCXYCKISA-N 0 1 375.270 3.309 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC2(Cc3ccc(Br)cc3)CC2)on1 ZINC000662873317 567467230 /nfs/dbraw/zinc/46/72/30/567467230.db2.gz MARSVWXTGSHPGR-UHFFFAOYSA-N 0 1 392.297 3.384 10 0 GGAEMN O=C(NCc1nc(-c2ccccc2)no1)c1cc(Br)cc2nc[nH]c21 ZINC000503079424 567468134 /nfs/dbraw/zinc/46/81/34/567468134.db2.gz VQFSACLACXTMBV-UHFFFAOYSA-N 0 1 398.220 3.305 10 0 GGAEMN C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1ccc2c(c1)CC(=O)N2 ZINC000503138893 567469614 /nfs/dbraw/zinc/46/96/14/567469614.db2.gz HTAAVFFKYDDRFP-VIFPVBQESA-N 0 1 399.248 3.311 10 0 GGAEMN CCOC(=O)C1CCC(NC(=O)c2cc(Br)cc3nc[nH]c32)CC1 ZINC000503126831 567469966 /nfs/dbraw/zinc/46/99/66/567469966.db2.gz OLFGRNKKQAURQB-UHFFFAOYSA-N 0 1 394.269 3.177 10 0 GGAEMN O=C(Nc1nnc(C(F)(F)F)s1)c1cc(Br)cc2nc[nH]c21 ZINC000503168247 567470994 /nfs/dbraw/zinc/47/09/94/567470994.db2.gz GYYIRCFGVAIMEU-UHFFFAOYSA-N 0 1 392.160 3.448 10 0 GGAEMN Cn1nnc2ccc(C(=O)Nc3cc(Br)cc(Cl)c3O)cc21 ZINC000436985864 567472024 /nfs/dbraw/zinc/47/20/24/567472024.db2.gz IKRSPRZUXZYWGT-UHFFFAOYSA-N 0 1 381.617 3.342 10 0 GGAEMN Cc1cc(Br)ccc1S(=O)(=O)Nc1cnc(CC2CC2)nc1 ZINC000551037630 567473911 /nfs/dbraw/zinc/47/39/11/567473911.db2.gz VFDFYJOMLDARNM-UHFFFAOYSA-N 0 1 382.283 3.301 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)N1CCC[C@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000528977733 567474301 /nfs/dbraw/zinc/47/43/01/567474301.db2.gz BTTCBQSIUBEALP-DEYYWGMASA-N 0 1 389.297 3.351 10 0 GGAEMN COC(=O)c1[nH]c(C)cc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000619724077 567475355 /nfs/dbraw/zinc/47/53/55/567475355.db2.gz JBQWPILREWJYTP-UHFFFAOYSA-N 0 1 377.198 3.001 10 0 GGAEMN COC(=O)c1cc(Cl)cc(S(=O)(=O)NCC(C)(C)C(F)(F)F)c1F ZINC000594462650 567477819 /nfs/dbraw/zinc/47/78/19/567477819.db2.gz OJYOVOLKRXLCPD-UHFFFAOYSA-N 0 1 391.770 3.133 10 0 GGAEMN CN1CCN(C(=O)c2cc(Br)cc3nc[nH]c32)c2ccccc2C1 ZINC000503325175 567479929 /nfs/dbraw/zinc/47/99/29/567479929.db2.gz SGAKMJULACQDBO-UHFFFAOYSA-N 0 1 385.265 3.418 10 0 GGAEMN O=C(NCCCCNc1ccccn1)c1cc(Br)cc2nc[nH]c21 ZINC000503295953 567480115 /nfs/dbraw/zinc/48/01/15/567480115.db2.gz ILIOFDRBLJLAJX-UHFFFAOYSA-N 0 1 388.269 3.343 10 0 GGAEMN COC(=O)c1csc(S(=O)(=O)N[C@@H](c2ccc(C)o2)C(F)(F)F)c1 ZINC000594481269 567480729 /nfs/dbraw/zinc/48/07/29/567480729.db2.gz KTRSVRBYEVUDKQ-NSHDSACASA-N 0 1 383.369 3.018 10 0 GGAEMN Cn1ncc2c1CC(C)(C)CN(C(=O)c1cccc(Br)c1O)C2 ZINC000663208598 567481738 /nfs/dbraw/zinc/48/17/38/567481738.db2.gz KKIOBUYRMBOIPE-UHFFFAOYSA-N 0 1 378.270 3.113 10 0 GGAEMN NC(=O)[C@H](NC1CCC(OC(F)F)CC1)c1ccc(Br)cc1F ZINC000642707708 567485377 /nfs/dbraw/zinc/48/53/77/567485377.db2.gz JALPAMJTVWEVAD-SRHKJQAYSA-N 0 1 395.219 3.255 10 0 GGAEMN O=C(NCc1cnc[nH]1)c1cccnc1Oc1ccc(F)cc1Br ZINC000478825366 567485935 /nfs/dbraw/zinc/48/59/35/567485935.db2.gz IFTMQPRVAUYMEY-UHFFFAOYSA-N 0 1 391.200 3.429 10 0 GGAEMN O=C(NCc1ccccc1-n1cccn1)c1cc(Br)cc2nc[nH]c21 ZINC000503482732 567488669 /nfs/dbraw/zinc/48/86/69/567488669.db2.gz MRTNQLXZHMLNGX-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN Cc1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)nn1-c1ccccc1 ZINC000503505879 567490143 /nfs/dbraw/zinc/49/01/43/567490143.db2.gz AEICFOVNCSYKRH-UHFFFAOYSA-N 0 1 396.248 3.494 10 0 GGAEMN COCCOc1ccc(S(=O)(=O)Nc2cc(Cl)c(Cl)cn2)cc1 ZINC000437310496 567491180 /nfs/dbraw/zinc/49/11/80/567491180.db2.gz SKDVAPIKYDOYOU-UHFFFAOYSA-N 0 1 377.249 3.214 10 0 GGAEMN O=C(N[C@@H](CO)c1c(F)cccc1F)c1cc(Br)cc2nc[nH]c21 ZINC000503516508 567491148 /nfs/dbraw/zinc/49/11/48/567491148.db2.gz BCYQAMPYWHKCJQ-ZDUSSCGKSA-N 0 1 396.191 3.067 10 0 GGAEMN O=S(=O)(Nc1cc(Cl)c(Cl)cn1)c1ccc2c(c1)OCCCO2 ZINC000437317172 567491281 /nfs/dbraw/zinc/49/12/81/567491281.db2.gz ZCHCXDHUIPPXRQ-UHFFFAOYSA-N 0 1 375.233 3.351 10 0 GGAEMN COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503516925 567491309 /nfs/dbraw/zinc/49/13/09/567491309.db2.gz CQMZNIXKNZRTFV-SJCJKPOMSA-N 0 1 394.269 3.177 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)Cc2c(F)ccc(Br)c2F)n[nH]1 ZINC000503520001 567491408 /nfs/dbraw/zinc/49/14/08/567491408.db2.gz YZTYSHKGEMYKSW-MRVPVSSYSA-N 0 1 387.228 3.389 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3cc(Br)cc4[nH]cnc43)[nH]c21 ZINC000503529865 567491515 /nfs/dbraw/zinc/49/15/15/567491515.db2.gz VVEYTYLMLKAYGM-UHFFFAOYSA-N 0 1 384.237 3.440 10 0 GGAEMN COC(=O)c1cc(CNC[C@H](O)COc2cccc(Cl)c2Cl)c(C)o1 ZINC000594616669 567492265 /nfs/dbraw/zinc/49/22/65/567492265.db2.gz WECVDIIHJFHQAH-LBPRGKRZSA-N 0 1 388.247 3.211 10 0 GGAEMN CCCC1(c2noc(CNS(=O)(=O)c3ccc(Cl)s3)n2)CCC1 ZINC000643135880 567493336 /nfs/dbraw/zinc/49/33/36/567493336.db2.gz UIBSKXJNCYWSJY-UHFFFAOYSA-N 0 1 375.903 3.485 10 0 GGAEMN CCc1ccc([C@H](COC)N[C@@H](C)Cn2cc(Br)ccc2=O)o1 ZINC000551282876 567493509 /nfs/dbraw/zinc/49/35/09/567493509.db2.gz GJCKCITUZDSRAK-WFASDCNBSA-N 0 1 383.286 3.132 10 0 GGAEMN CC[C@H](Cn1cncn1)NCc1cc(Br)ccc1Br ZINC000551283920 567493520 /nfs/dbraw/zinc/49/35/20/567493520.db2.gz BTDMXJUCOXDNCV-GFCCVEGCSA-N 0 1 388.107 3.372 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2ccc(OC(F)F)c(F)c2)nc1C ZINC000663301915 567494126 /nfs/dbraw/zinc/49/41/26/567494126.db2.gz SVJSMTMBMLOVSW-UHFFFAOYSA-N 0 1 376.356 3.330 10 0 GGAEMN Cc1csc(C2(N[C@@H](C)Cn3cc(Br)ccc3=O)CCC2)n1 ZINC000551294253 567494701 /nfs/dbraw/zinc/49/47/01/567494701.db2.gz NWFYTYXNEAEPAD-NSHDSACASA-N 0 1 382.327 3.433 10 0 GGAEMN CN1C(=O)N([C@H]2CCc3nc[nH]c3C2)C(=O)[C@H]1c1cccc(Cl)c1Cl ZINC000663318759 567496498 /nfs/dbraw/zinc/49/64/98/567496498.db2.gz MQSSWMBSSIARNX-BJOHPYRUSA-N 0 1 379.247 3.209 10 0 GGAEMN NC(=O)c1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1Cl ZINC000503639807 567497572 /nfs/dbraw/zinc/49/75/72/567497572.db2.gz OYRWQJWEFAZLHY-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN COC(=O)CCS(=O)(=O)Nc1cc(C(F)(F)F)c(Cl)cc1SC ZINC000594700535 567499958 /nfs/dbraw/zinc/49/99/58/567499958.db2.gz HUFCHMAEBQJOKG-UHFFFAOYSA-N 0 1 391.820 3.386 10 0 GGAEMN O=C(NCCOc1ncccc1Cl)c1cc(Br)cc2nc[nH]c21 ZINC000503686794 567501069 /nfs/dbraw/zinc/50/10/69/567501069.db2.gz WOQMQVZZGFSTTF-UHFFFAOYSA-N 0 1 395.644 3.183 10 0 GGAEMN C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)[C@@H](O)Cc1ccccc1 ZINC000503694412 567502017 /nfs/dbraw/zinc/50/20/17/567502017.db2.gz GXNYXLHSWFYMRI-ZBEGNZNMSA-N 0 1 388.265 3.047 10 0 GGAEMN O[C@H](CNCc1cc(Cl)ccc1I)CC(F)(F)F ZINC000594718274 567502036 /nfs/dbraw/zinc/50/20/36/567502036.db2.gz MUMUNTMREQEEJU-VIFPVBQESA-N 0 1 393.574 3.348 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)[C@H](O)Cc1ccccc1 ZINC000503694406 567502273 /nfs/dbraw/zinc/50/22/73/567502273.db2.gz GXNYXLHSWFYMRI-BDJLRTHQSA-N 0 1 388.265 3.047 10 0 GGAEMN O=C(Nc1cccc(-n2ccnn2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503692358 567502416 /nfs/dbraw/zinc/50/24/16/567502416.db2.gz MIZHYGQTNPGALJ-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1cc2c(cc1Br)OCO2 ZINC000551421963 567504249 /nfs/dbraw/zinc/50/42/49/567504249.db2.gz MIYBFKWIWXPEMI-ZDUSSCGKSA-N 0 1 383.286 3.059 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2cccc(Cl)c2C)c(N(C)C)c1 ZINC000479116693 567505027 /nfs/dbraw/zinc/50/50/27/567505027.db2.gz VASXRLQGIITMOS-UHFFFAOYSA-N 0 1 382.869 3.302 10 0 GGAEMN O=C(NCc1ccc(Cl)cc1Cl)N1CCC[C@@H](N2CCOCC2)CC1 ZINC000663411517 567505542 /nfs/dbraw/zinc/50/55/42/567505542.db2.gz QIEGSXNACHXFQI-MRXNPFEDSA-N 0 1 386.323 3.390 10 0 GGAEMN O=C(NCc1ccc(Cl)cc1Cl)N1CCC[C@H](N2CCOCC2)CC1 ZINC000663411516 567505559 /nfs/dbraw/zinc/50/55/59/567505559.db2.gz QIEGSXNACHXFQI-INIZCTEOSA-N 0 1 386.323 3.390 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cc3c[nH]nc3cc2C)cc1Cl ZINC000479133457 567506526 /nfs/dbraw/zinc/50/65/26/567506526.db2.gz XUSJWZYAJDDLEJ-UHFFFAOYSA-N 0 1 379.825 3.112 10 0 GGAEMN C[C@@H]1CN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C[C@H](C)N1C ZINC000457952185 567508004 /nfs/dbraw/zinc/50/80/04/567508004.db2.gz ZCDCXKPGOMQZGL-TYNCELHUSA-N 0 1 382.302 3.007 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)cc3cccnc32)C1 ZINC000570730033 567508051 /nfs/dbraw/zinc/50/80/51/567508051.db2.gz WRSMKSNBVGMAPZ-LSDHHAIUSA-N 0 1 379.254 3.061 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)cc3cccnc32)C1 ZINC000570730031 567508575 /nfs/dbraw/zinc/50/85/75/567508575.db2.gz WRSMKSNBVGMAPZ-GJZGRUSLSA-N 0 1 379.254 3.061 10 0 GGAEMN NC(=O)c1cccc(NS(=O)(=O)c2cccc(Br)c2Cl)c1 ZINC000551467561 567508731 /nfs/dbraw/zinc/50/87/31/567508731.db2.gz HOKMCYRZTOYRKV-UHFFFAOYSA-N 0 1 389.658 3.002 10 0 GGAEMN COCc1nc(CN[C@@H]2CCCSc3ccc(Br)cc32)n[nH]1 ZINC000663450749 567510545 /nfs/dbraw/zinc/51/05/45/567510545.db2.gz BKSQCUXILHBMKD-GFCCVEGCSA-N 0 1 383.315 3.430 10 0 GGAEMN COCc1nnc(C[NH2+][C@@H]2CCCSc3ccc(Br)cc32)[n-]1 ZINC000663450749 567510548 /nfs/dbraw/zinc/51/05/48/567510548.db2.gz BKSQCUXILHBMKD-GFCCVEGCSA-N 0 1 383.315 3.430 10 0 GGAEMN O=C(NCC1(O)CCC(F)(F)CC1)c1cn[nH]c1-c1ccc(Cl)s1 ZINC000620321118 567511362 /nfs/dbraw/zinc/51/13/62/567511362.db2.gz QNNCNGBIURIPLP-UHFFFAOYSA-N 0 1 375.828 3.462 10 0 GGAEMN CCN(CC)CC(=O)Nc1cccc(NC(=O)[C@H]2C[C@@]2(C)Br)c1 ZINC000529395430 567512782 /nfs/dbraw/zinc/51/27/82/567512782.db2.gz TVELSWFTYOSFEQ-RHSMWYFYSA-N 0 1 382.302 3.079 10 0 GGAEMN CC(C)N1CCC[C@@H](NS(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000551510657 567512892 /nfs/dbraw/zinc/51/28/92/567512892.db2.gz IJTMXHIQKCXKJL-LLVKDONJSA-N 0 1 395.750 3.254 10 0 GGAEMN CCN(CC)CC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@@]2(C)Br)c1 ZINC000529395431 567512967 /nfs/dbraw/zinc/51/29/67/567512967.db2.gz TVELSWFTYOSFEQ-WMLDXEAASA-N 0 1 382.302 3.079 10 0 GGAEMN CCN(CC)[C@H](CNS(=O)(=O)CC1CC1)c1ccc(C(F)(F)F)cc1 ZINC000479173403 567512957 /nfs/dbraw/zinc/51/29/57/567512957.db2.gz SJUKTGIOSMPYRS-MRXNPFEDSA-N 0 1 378.460 3.418 10 0 GGAEMN CCN(CC)CC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@]2(C)Br)c1 ZINC000529395432 567513142 /nfs/dbraw/zinc/51/31/42/567513142.db2.gz TVELSWFTYOSFEQ-YOEHRIQHSA-N 0 1 382.302 3.079 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)c2c[nH]c3cccc(Br)c23)n[nH]1 ZINC000458018421 567513985 /nfs/dbraw/zinc/51/39/85/567513985.db2.gz HDBDUUAUNGYGFQ-UHFFFAOYSA-N 0 1 376.258 3.276 10 0 GGAEMN CCC[C@H](C)[C@@H](CO)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000570807557 567514794 /nfs/dbraw/zinc/51/47/94/567514794.db2.gz XBZOWNPEEMDICL-NILFDRSVSA-N 0 1 390.343 3.054 10 0 GGAEMN CCC[C@H](C)[C@H](CO)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000570807556 567515603 /nfs/dbraw/zinc/51/56/03/567515603.db2.gz XBZOWNPEEMDICL-GLQYFDAESA-N 0 1 390.343 3.054 10 0 GGAEMN CCOc1ncccc1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503987451 567515826 /nfs/dbraw/zinc/51/58/26/567515826.db2.gz RRIIJEMDVQTWAV-UHFFFAOYSA-N 0 1 375.226 3.049 10 0 GGAEMN CC(=O)Nc1cccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503974716 567515865 /nfs/dbraw/zinc/51/58/65/567515865.db2.gz QVPYOTRZGLYDRJ-UHFFFAOYSA-N 0 1 387.237 3.214 10 0 GGAEMN CC[C@H](Cc1ccc(Br)cc1)NC(=O)CCSc1nnc(C)[nH]1 ZINC000620339423 567516128 /nfs/dbraw/zinc/51/61/28/567516128.db2.gz HHPUQCFBLIZCLW-CQSZACIVSA-N 0 1 397.342 3.495 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000663678594 567520792 /nfs/dbraw/zinc/52/07/92/567520792.db2.gz MXKOMEZYTHUSRR-GHMZBOCLSA-N 0 1 375.357 3.099 10 0 GGAEMN COC[C@]1(C(=O)[O-])CCC[N@@H+]1Cc1ccc(Br)c2cccnc12 ZINC000643878438 567522656 /nfs/dbraw/zinc/52/26/56/567522656.db2.gz UDPCZEDVGYTCBQ-KRWDZBQOSA-N 0 1 379.254 3.063 10 0 GGAEMN COC[C@]1(C(=O)[O-])CCC[N@H+]1Cc1ccc(Br)c2cccnc12 ZINC000643878438 567522662 /nfs/dbraw/zinc/52/26/62/567522662.db2.gz UDPCZEDVGYTCBQ-KRWDZBQOSA-N 0 1 379.254 3.063 10 0 GGAEMN COc1ccc([C@@H](C)NC[C@H]2CS(=O)(=O)c3ccccc3O2)cc1Cl ZINC000570964010 567527296 /nfs/dbraw/zinc/52/72/96/567527296.db2.gz BOVJAKGMGJVWLE-OCCSQVGLSA-N 0 1 381.881 3.234 10 0 GGAEMN CO[C@H](CNCc1cc(Cl)ccc1I)[C@@H]1CCOC1 ZINC000594954430 567528384 /nfs/dbraw/zinc/52/83/84/567528384.db2.gz ZSUDIGVYWKKROF-QMTHXVAHSA-N 0 1 395.668 3.086 10 0 GGAEMN C[S@](=O)[C@@H]1CCC[C@@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000594959643 567528455 /nfs/dbraw/zinc/52/84/55/567528455.db2.gz GFXZQLGFISMSTF-XYWAVCLCSA-N 0 1 387.336 3.353 10 0 GGAEMN C[C@@H](N(C)C(=O)c1[nH]nc2ccc(I)cc21)C1(C)CC1 ZINC000438464296 567532145 /nfs/dbraw/zinc/53/21/45/567532145.db2.gz GOKULGSBILOTRL-SECBINFHSA-N 0 1 383.233 3.428 10 0 GGAEMN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000551779835 567533909 /nfs/dbraw/zinc/53/39/09/567533909.db2.gz XXDNCBOJTDIBOA-LBPRGKRZSA-N 0 1 387.281 3.178 10 0 GGAEMN COCc1cnc(CNCCc2ccc(I)cc2)s1 ZINC000594996901 567533927 /nfs/dbraw/zinc/53/39/27/567533927.db2.gz PKJNVWLYNUOMNR-UHFFFAOYSA-N 0 1 388.274 3.226 10 0 GGAEMN Cc1nn(C(C)C)cc1CNc1nc2ccc(I)cc2[nH]1 ZINC000594999249 567534053 /nfs/dbraw/zinc/53/40/53/567534053.db2.gz BAYQSEVKVKBWDQ-UHFFFAOYSA-N 0 1 395.248 3.287 10 0 GGAEMN CS(=O)(=O)[C@@H]1CCC[C@H](NCc2cc(F)c(Br)cc2F)C1 ZINC000529661412 567538000 /nfs/dbraw/zinc/53/80/00/567538000.db2.gz CMAVIPRZTPAALL-WDEREUQCSA-N 0 1 382.270 3.173 10 0 GGAEMN CC[C@H](Cn1cncn1)NCc1cc(Cl)ccc1I ZINC000595056516 567538599 /nfs/dbraw/zinc/53/85/99/567538599.db2.gz KLRDSUFYYGMNEW-GFCCVEGCSA-N 0 1 390.656 3.105 10 0 GGAEMN O=S(=O)(Nc1ccc(OCC(F)(F)F)nc1)c1ccc2ncsc2c1 ZINC000479480045 567538959 /nfs/dbraw/zinc/53/89/59/567538959.db2.gz LDOMBMZHQYEYFK-UHFFFAOYSA-N 0 1 389.380 3.433 10 0 GGAEMN CN(CC(=O)N(C)[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCSC1 ZINC000438636748 567539376 /nfs/dbraw/zinc/53/93/76/567539376.db2.gz LNAAHNDUOOTRLB-UKRRQHHQSA-N 0 1 399.354 3.168 10 0 GGAEMN CC[C@@H](Cn1cncn1)NCc1cc(Cl)ccc1I ZINC000595056517 567539508 /nfs/dbraw/zinc/53/95/08/567539508.db2.gz KLRDSUFYYGMNEW-LBPRGKRZSA-N 0 1 390.656 3.105 10 0 GGAEMN COCc1nc(CNC(=O)NCC(C)(C)c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000663877565 567539561 /nfs/dbraw/zinc/53/95/61/567539561.db2.gz ZUXSPQVERHBQOT-UHFFFAOYSA-N 0 1 386.283 3.035 10 0 GGAEMN COCc1nnc(CNC(=O)NCC(C)(C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000663877565 567539568 /nfs/dbraw/zinc/53/95/68/567539568.db2.gz ZUXSPQVERHBQOT-UHFFFAOYSA-N 0 1 386.283 3.035 10 0 GGAEMN COc1cc2ccnc(N(C)CCn3cc(Br)cn3)c2cc1OC ZINC000663916794 567541313 /nfs/dbraw/zinc/54/13/13/567541313.db2.gz YCBSKXLBSKPLAT-UHFFFAOYSA-N 0 1 391.269 3.347 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc3occ(C)c3c2)cc1 ZINC000479546505 567543270 /nfs/dbraw/zinc/54/32/70/567543270.db2.gz QGWIKZKTXDAOKM-UHFFFAOYSA-N 0 1 379.459 3.336 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cc(F)c(OC)cc2C)c(Cl)c1 ZINC000479547811 567543957 /nfs/dbraw/zinc/54/39/57/567543957.db2.gz YFHKWPBHDZCWDC-UHFFFAOYSA-N 0 1 387.816 3.384 10 0 GGAEMN CC(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C(N)=O)c(Cl)c2)cc1 ZINC000438795145 567546137 /nfs/dbraw/zinc/54/61/37/567546137.db2.gz OFQXGYVHHXIXLH-UHFFFAOYSA-N 0 1 380.853 3.078 10 0 GGAEMN C[C@]1(F)CCCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000458426032 567546112 /nfs/dbraw/zinc/54/61/12/567546112.db2.gz MSUADAGOOUOFBK-INIZCTEOSA-N 0 1 396.264 3.268 10 0 GGAEMN C[C@]1(F)CCCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000458426032 567546119 /nfs/dbraw/zinc/54/61/19/567546119.db2.gz MSUADAGOOUOFBK-INIZCTEOSA-N 0 1 396.264 3.268 10 0 GGAEMN CC(C)[C@@H]1CN(C(=O)c2s[n-]c(=O)c2Cl)CC[N@H+]1Cc1ccccc1 ZINC000529801725 567547280 /nfs/dbraw/zinc/54/72/80/567547280.db2.gz CYGYYRDXZLJYGT-AWEZNQCLSA-N 0 1 379.913 3.485 10 0 GGAEMN CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(Cl)cc2Cl)cc1 ZINC000571236225 567547879 /nfs/dbraw/zinc/54/78/79/567547879.db2.gz ANNRYDIJMQGGOG-INIZCTEOSA-N 0 1 383.275 3.481 10 0 GGAEMN CN(C)S(=O)(=O)[C@H]1CCCN(Cc2ccc(-c3ccccc3F)s2)C1 ZINC000571245936 567548147 /nfs/dbraw/zinc/54/81/47/567548147.db2.gz DUBXWQMSMXVTJX-HNNXBMFYSA-N 0 1 382.526 3.410 10 0 GGAEMN CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(Cl)cc2Cl)cc1 ZINC000571236226 567548331 /nfs/dbraw/zinc/54/83/31/567548331.db2.gz ANNRYDIJMQGGOG-MRXNPFEDSA-N 0 1 383.275 3.481 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000620946811 567551732 /nfs/dbraw/zinc/55/17/32/567551732.db2.gz PNUJXAFNROYKKM-HDICACEKSA-N 0 1 390.281 3.358 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N(C)Cc2ccc(F)cc2Br)n[nH]1 ZINC000479682574 567552487 /nfs/dbraw/zinc/55/24/87/567552487.db2.gz FWXGONMCGLYVPR-SNVBAGLBSA-N 0 1 383.265 3.392 10 0 GGAEMN COC[C@@H](CN1CCC[C@H]1c1ccccc1I)OC ZINC000595326229 567554399 /nfs/dbraw/zinc/55/43/99/567554399.db2.gz YQJMDIVZDQWOTA-DOMZBBRYSA-N 0 1 375.250 3.090 10 0 GGAEMN Cc1sc(C(=O)N2CCC(C)(N3CCOCC3)CC2)cc1Br ZINC000529908719 567554672 /nfs/dbraw/zinc/55/46/72/567554672.db2.gz JSHSPCKUOLSDKD-UHFFFAOYSA-N 0 1 387.343 3.146 10 0 GGAEMN Cc1cc(C(=O)N2CCC(C)(N3CCOCC3)CC2)ccc1Br ZINC000529910606 567554712 /nfs/dbraw/zinc/55/47/12/567554712.db2.gz FNNLSMAEOYMISX-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN Cc1ccc(Br)c(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1 ZINC000529913432 567554758 /nfs/dbraw/zinc/55/47/58/567554758.db2.gz IACKIJMFMWLREI-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN O[C@@H](CNCc1ccc(Cl)o1)COc1cc(F)cc(Br)c1 ZINC000644519210 567555081 /nfs/dbraw/zinc/55/50/81/567555081.db2.gz HMJBSXACENIISL-NSHDSACASA-N 0 1 378.625 3.364 10 0 GGAEMN O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCN([C@H]2CCC[C@H]2O)CC1 ZINC000644521619 567555261 /nfs/dbraw/zinc/55/52/61/567555261.db2.gz BHGZRBRLVAAWEQ-QLFBSQMISA-N 0 1 383.945 3.020 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)c2cc(Br)cc3[nH]cnc32)n[nH]1 ZINC000505079457 567557762 /nfs/dbraw/zinc/55/77/62/567557762.db2.gz FVWSKJZQKHGZGK-DTWKUNHWSA-N 0 1 391.273 3.448 10 0 GGAEMN CC(C)[C@@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000664203671 567558120 /nfs/dbraw/zinc/55/81/20/567558120.db2.gz YZOVYDWKHPXXJD-OAHLLOKOSA-N 0 1 392.301 3.468 10 0 GGAEMN CC(C)[C@@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000664203671 567558124 /nfs/dbraw/zinc/55/81/24/567558124.db2.gz YZOVYDWKHPXXJD-OAHLLOKOSA-N 0 1 392.301 3.468 10 0 GGAEMN CN1CC[C@@H](CNC(=O)N2C[C@@H]3C[C@H]2CS3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000458628111 567560301 /nfs/dbraw/zinc/56/03/01/567560301.db2.gz WFWSMIUKRZPUBG-AYMQEEERSA-N 0 1 383.920 3.371 10 0 GGAEMN C[C@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@](C)(C(F)F)O1 ZINC000621129697 567561905 /nfs/dbraw/zinc/56/19/05/567561905.db2.gz NPBXZPDAIDHBKP-AYVTZFPOSA-N 0 1 388.212 3.210 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCO[C@@](C)(C(F)F)C1)c1ccc(Cl)cc1 ZINC000664291841 567561936 /nfs/dbraw/zinc/56/19/36/567561936.db2.gz JIRVJEUUJJKHCD-WMLDXEAASA-N 0 1 375.847 3.008 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031411 567562451 /nfs/dbraw/zinc/56/24/51/567562451.db2.gz IKLNZILZZVMENS-SJCJKPOMSA-N 0 1 381.307 3.241 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1c(Cl)cnn1C)c1ccc(Cl)c(Cl)c1 ZINC000530034313 567563547 /nfs/dbraw/zinc/56/35/47/567563547.db2.gz UUCMMHSFJKUIOF-CYBMUJFWSA-N 0 1 375.687 3.413 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccc(Cl)c(Cl)c1 ZINC000530032550 567563616 /nfs/dbraw/zinc/56/36/16/567563616.db2.gz IUXLFRMIGPTCMZ-JJRVBVJISA-N 0 1 381.307 3.250 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1ccnn1CC(F)F)c1ccc(Cl)c(Cl)c1 ZINC000530033680 567563653 /nfs/dbraw/zinc/56/36/53/567563653.db2.gz QFKNWXLYCPECAE-CYBMUJFWSA-N 0 1 391.249 3.488 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@H]1CCC[C@@H](C(N)=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000530032770 567563664 /nfs/dbraw/zinc/56/36/64/567563664.db2.gz JVZSGKMXQLURFB-WWGRRREGSA-N 0 1 386.323 3.004 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1ncn(C(C)(C)C)n1)c1ccc(Cl)c(Cl)c1 ZINC000530034311 567563957 /nfs/dbraw/zinc/56/39/57/567563957.db2.gz UTOWTWMPMCUBFB-AWEZNQCLSA-N 0 1 384.311 3.373 10 0 GGAEMN O[C@@H](CNCc1ccc(Cl)cn1)COc1cc(F)cc(Br)c1 ZINC000644615959 567564268 /nfs/dbraw/zinc/56/42/68/567564268.db2.gz ZSTRUFDGUBUGLB-AWEZNQCLSA-N 0 1 389.652 3.166 10 0 GGAEMN Cn1nc(CNC[C@H](O)COc2c(Cl)cccc2Cl)c2ccccc21 ZINC000644622655 567564533 /nfs/dbraw/zinc/56/45/33/567564533.db2.gz HUSKJDUXFPEIOQ-LBPRGKRZSA-N 0 1 380.275 3.410 10 0 GGAEMN C[C@H](CN1CCN(C)CC1)NC(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000571526826 567569120 /nfs/dbraw/zinc/56/91/20/567569120.db2.gz AISHUMAIGJWDLA-SNVBAGLBSA-N 0 1 379.719 3.404 10 0 GGAEMN CSc1c(C(=O)Nc2ccc(CN3CCSCC3)cc2C)cnn1C ZINC000479929397 567569079 /nfs/dbraw/zinc/56/90/79/567569079.db2.gz WFIIPRGBUMPMDT-UHFFFAOYSA-N 0 1 376.551 3.252 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccccc1NC(=O)c1cccs1)C1CC1 ZINC000571524335 567569210 /nfs/dbraw/zinc/56/92/10/567569210.db2.gz WLMMWPLGHIKUDT-OAHLLOKOSA-N 0 1 380.491 3.167 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)N[C@H](Cc1nc[nH]n1)c1ccccc1 ZINC000439195572 567570216 /nfs/dbraw/zinc/57/02/16/567570216.db2.gz AVGBODFQRMFTTM-OAHLLOKOSA-N 0 1 376.869 3.029 10 0 GGAEMN COC(=O)[C@@H]1CN(Cc2nc(C)oc2C)C[C@H]1c1ccc(Br)cc1 ZINC000595548697 567570521 /nfs/dbraw/zinc/57/05/21/567570521.db2.gz FBJFVGTTZZAIQB-JKSUJKDBSA-N 0 1 393.281 3.443 10 0 GGAEMN COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(CCSc2cccc(OC)c2)C1 ZINC000595624914 567575453 /nfs/dbraw/zinc/57/54/53/567575453.db2.gz MEINJCDIZOSMPA-OLZOCXBDSA-N 0 1 377.428 3.461 10 0 GGAEMN CCn1nc(C)cc1NS(=O)(=O)c1cc(Cl)ccc1O[C@H](C)COC ZINC000530158575 567577745 /nfs/dbraw/zinc/57/77/45/567577745.db2.gz UVQVBETVDGXPJI-GFCCVEGCSA-N 0 1 387.889 3.079 10 0 GGAEMN O=C([O-])[C@@H]1c2ccoc2CC[N@@H+]1CCOc1cc(F)cc(Br)c1 ZINC000530163757 567577801 /nfs/dbraw/zinc/57/78/01/567577801.db2.gz FZUKVNIAHMFAMY-HNNXBMFYSA-N 0 1 384.201 3.244 10 0 GGAEMN CCn1nc(C)cc1NS(=O)(=O)c1cc(Cl)ccc1O[C@@H](C)COC ZINC000530158576 567578197 /nfs/dbraw/zinc/57/81/97/567578197.db2.gz UVQVBETVDGXPJI-LBPRGKRZSA-N 0 1 387.889 3.079 10 0 GGAEMN Cc1ccc(OC(F)F)c([C@H](C)NC[C@@H]2CCCCN2S(C)(=O)=O)c1 ZINC000552338440 567578687 /nfs/dbraw/zinc/57/86/87/567578687.db2.gz FSEHMGLXRSMWPM-KBPBESRZSA-N 0 1 376.469 3.061 10 0 GGAEMN FC(F)(F)[C@H](CN[C@@H]1CCCOc2ccc(Cl)cc21)N1CCOCC1 ZINC000552338566 567578781 /nfs/dbraw/zinc/57/87/81/567578781.db2.gz HYHSCAWOXKVHAF-ZBFHGGJFSA-N 0 1 378.822 3.406 10 0 GGAEMN O=C([O-])[C@H]1c2ccoc2CC[N@@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000530169716 567579580 /nfs/dbraw/zinc/57/95/80/567579580.db2.gz RRHAJYZLWPBFBX-ZUZCIYMTSA-N 0 1 386.231 3.010 10 0 GGAEMN O=C([O-])[C@H]1c2ccoc2CC[N@@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000530171140 567579703 /nfs/dbraw/zinc/57/97/03/567579703.db2.gz WITOHVHUQCQSRO-BDJLRTHQSA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)[N@@H+]1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000530180117 567579885 /nfs/dbraw/zinc/57/98/85/567579885.db2.gz RPOZLSQZEOEAJL-OPDFLTKYSA-N 0 1 376.280 3.307 10 0 GGAEMN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1nc(-c2ccccc2)cs1 ZINC000552340454 567579980 /nfs/dbraw/zinc/57/99/80/567579980.db2.gz VICJRXLQVYBZLO-HOCLYGCPSA-N 0 1 379.551 3.275 10 0 GGAEMN O=C([O-])[C@H]1c2ccoc2CC[N@@H+]1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000530170626 567579991 /nfs/dbraw/zinc/57/99/91/567579991.db2.gz UJPAXUOPXTXUJP-BDJLRTHQSA-N 0 1 386.231 3.010 10 0 GGAEMN NC(=O)c1c(F)cc(Br)cc1NC[C@@H]1CCN1Cc1ccccc1 ZINC000664631422 567580085 /nfs/dbraw/zinc/58/00/85/567580085.db2.gz KTHCMEZGJFLXOG-AWEZNQCLSA-N 0 1 392.272 3.374 10 0 GGAEMN C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)[N@@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000530180102 567580178 /nfs/dbraw/zinc/58/01/78/567580178.db2.gz RHNWGUHZYOOVGG-OPDFLTKYSA-N 0 1 376.280 3.307 10 0 GGAEMN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cc(Cl)ccc1OC(F)F ZINC000552340023 567580528 /nfs/dbraw/zinc/58/05/28/567580528.db2.gz JFDMUGLEJKAPCQ-YPMHNXCESA-N 0 1 396.887 3.406 10 0 GGAEMN CN(C)c1ncc(CN(C)CCOc2ccc(Cl)cc2Br)cn1 ZINC000505501928 567580627 /nfs/dbraw/zinc/58/06/27/567580627.db2.gz ASQJTKWAGHGGGG-UHFFFAOYSA-N 0 1 399.720 3.469 10 0 GGAEMN CCc1nc(CNC(=O)N2CCC[C@H]2c2ccc(Br)cc2)n[nH]1 ZINC000458878955 567581832 /nfs/dbraw/zinc/58/18/32/567581832.db2.gz VDASPPWQHZMKNA-ZDUSSCGKSA-N 0 1 378.274 3.176 10 0 GGAEMN C[C@@H](CC(=O)Nc1nc(-c2ccccc2Br)n[nH]1)[C@H]1CCCO1 ZINC000621413709 567582771 /nfs/dbraw/zinc/58/27/71/567582771.db2.gz SJYLCSLVYDICOK-GXFFZTMASA-N 0 1 379.258 3.378 10 0 GGAEMN CC(=O)N[C@H](C)c1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2F)s1 ZINC000644851246 567583781 /nfs/dbraw/zinc/58/37/81/567583781.db2.gz DQXNLVTYIMOGJJ-SSDOTTSWSA-N 0 1 378.397 3.163 10 0 GGAEMN COCCN(Cc1nc2ccc(Br)cc2[nH]1)Cc1ccccn1 ZINC000571710970 567584053 /nfs/dbraw/zinc/58/40/53/567584053.db2.gz QPEKXRBTTZWUQO-UHFFFAOYSA-N 0 1 375.270 3.369 10 0 GGAEMN COc1ccc(-c2n[nH]c(CNC(=O)c3csc(Br)c3)n2)cc1 ZINC000505554504 567584123 /nfs/dbraw/zinc/58/41/23/567584123.db2.gz ZECCBDDKMOKSEE-UHFFFAOYSA-N 0 1 393.266 3.234 10 0 GGAEMN COc1ccc(-c2nc(CNC(=O)c3csc(Br)c3)n[nH]2)cc1 ZINC000505554504 567584124 /nfs/dbraw/zinc/58/41/24/567584124.db2.gz ZECCBDDKMOKSEE-UHFFFAOYSA-N 0 1 393.266 3.234 10 0 GGAEMN O=S(=O)(CCN[C@@H]1C[C@H]1c1ccsc1)c1cccc(Br)c1 ZINC000530242005 567585661 /nfs/dbraw/zinc/58/56/61/567585661.db2.gz GCCZUPSQLDLBDW-LSDHHAIUSA-N 0 1 386.336 3.430 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)C2(c3cc(F)cc(Br)c3)CC2)n[nH]1 ZINC000552389703 567586143 /nfs/dbraw/zinc/58/61/43/567586143.db2.gz QJYSPEGUGXEISI-SNVBAGLBSA-N 0 1 380.261 3.399 10 0 GGAEMN Cc1csc([C@H](C)NC[C@H](O)COc2cc(F)cc(Br)c2)n1 ZINC000439451092 567586448 /nfs/dbraw/zinc/58/64/48/567586448.db2.gz LIQYFQBKERBHNI-GWCFXTLKSA-N 0 1 389.290 3.444 10 0 GGAEMN CC1CC(CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000621467551 567586562 /nfs/dbraw/zinc/58/65/62/567586562.db2.gz FZWMBOHORFSCMS-UHFFFAOYSA-N 0 1 378.274 3.080 10 0 GGAEMN CC1CC(CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000621467551 567586566 /nfs/dbraw/zinc/58/65/66/567586566.db2.gz FZWMBOHORFSCMS-UHFFFAOYSA-N 0 1 378.274 3.080 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)NCc1n[nH]c(C(C)C)n1 ZINC000458922146 567586908 /nfs/dbraw/zinc/58/69/08/567586908.db2.gz KUMQXMPXDVIXGB-UHFFFAOYSA-N 0 1 380.290 3.341 10 0 GGAEMN O=C(NCC(F)(F)c1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000621456463 567587263 /nfs/dbraw/zinc/58/72/63/567587263.db2.gz IEPWYENHCUNQQV-LBPRGKRZSA-N 0 1 399.239 3.121 10 0 GGAEMN O=C(NCC(F)(F)c1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000621456462 567587494 /nfs/dbraw/zinc/58/74/94/567587494.db2.gz IEPWYENHCUNQQV-GFCCVEGCSA-N 0 1 399.239 3.121 10 0 GGAEMN Cc1cn2cc([N-]S(=O)(=O)c3cccc(Br)c3F)ccc2[nH+]1 ZINC000571796168 567589342 /nfs/dbraw/zinc/58/93/42/567589342.db2.gz FJOKAPDDSMRLFL-UHFFFAOYSA-N 0 1 384.230 3.345 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000571811449 567590649 /nfs/dbraw/zinc/59/06/49/567590649.db2.gz XUFRQPTXRYVRRB-RKLWJJNISA-N 0 1 388.291 3.451 10 0 GGAEMN CCSCCCNC(=O)c1n[nH]c2ccc(I)cc21 ZINC000505691415 567591651 /nfs/dbraw/zinc/59/16/51/567591651.db2.gz FZKQWZFINONLTO-UHFFFAOYSA-N 0 1 389.262 3.041 10 0 GGAEMN CCc1nc([C@@H](C)N2Cc3sc(C(=O)OC)c(Br)c3C2)n[nH]1 ZINC000595906220 567591626 /nfs/dbraw/zinc/59/16/26/567591626.db2.gz ZJVHLMCXKFVXCU-SSDOTTSWSA-N 0 1 385.287 3.055 10 0 GGAEMN Cc1ccc(NC(=O)c2cc(C(C)(C)N)no2)cc1I ZINC000595929106 567593025 /nfs/dbraw/zinc/59/30/25/567593025.db2.gz KUWSZXGZMAHJOO-UHFFFAOYSA-N 0 1 385.205 3.034 10 0 GGAEMN COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Cl)cc2Cl)cc1 ZINC000552684602 567602451 /nfs/dbraw/zinc/60/24/51/567602451.db2.gz YOFBHUYCPSJXKG-OAHLLOKOSA-N 0 1 384.259 3.310 10 0 GGAEMN Brc1ccc(N2CCN(CCc3ccc4c(c3)CCO4)CC2)nc1 ZINC000439814615 567604658 /nfs/dbraw/zinc/60/46/58/567604658.db2.gz BBBLOIRQEHXNJY-UHFFFAOYSA-N 0 1 388.309 3.144 10 0 GGAEMN O=C(NC1(C(=O)Nc2ccccc2)CC1)c1cc(Br)cc2nc[nH]c21 ZINC000505973471 567604887 /nfs/dbraw/zinc/60/48/87/567604887.db2.gz JYDIBEWSYLGBBR-UHFFFAOYSA-N 0 1 399.248 3.227 10 0 GGAEMN Cc1cc(C(=O)N2CCC[C@H]2c2ccccc2I)n[nH]1 ZINC000505964671 567605207 /nfs/dbraw/zinc/60/52/07/567605207.db2.gz POTONSXMACLTKM-AWEZNQCLSA-N 0 1 381.217 3.300 10 0 GGAEMN CCN(CC)[C@@H](C(=O)N[C@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552732418 567605716 /nfs/dbraw/zinc/60/57/16/567605716.db2.gz WZPORVHPQUWNDX-CZUORRHYSA-N 0 1 391.313 3.499 10 0 GGAEMN CN(C(=O)[C@@H]1CCCc2[nH]ncc21)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000480443126 567605827 /nfs/dbraw/zinc/60/58/27/567605827.db2.gz SGLGJDUHHJMZER-YKJXYISPSA-N 0 1 380.275 3.253 10 0 GGAEMN CC1(C)CCC[C@](O)(CNC(=O)c2cc(Br)cc3nc[nH]c32)C1 ZINC000506015286 567606246 /nfs/dbraw/zinc/60/62/46/567606246.db2.gz RIRGONQPRCMZBE-QGZVFWFLSA-N 0 1 380.286 3.387 10 0 GGAEMN Cc1nn(C)c(CNC[C@H](C(=O)OC(C)(C)C)C2CCC2)c1Br ZINC000596062089 567606880 /nfs/dbraw/zinc/60/68/80/567606880.db2.gz FARBIWCWWFAKMW-ZDUSSCGKSA-N 0 1 386.334 3.339 10 0 GGAEMN OC[C@@H](CNCc1ncc(Br)s1)Cc1ccc(F)c(F)c1 ZINC000480467447 567607643 /nfs/dbraw/zinc/60/76/43/567607643.db2.gz HSTLCUIBBBAMLX-SNVBAGLBSA-N 0 1 377.254 3.125 10 0 GGAEMN COC1CCN(CCN[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621754975 567608019 /nfs/dbraw/zinc/60/80/19/567608019.db2.gz QFGIOMACWHUJEB-OAHLLOKOSA-N 0 1 377.273 3.456 10 0 GGAEMN COc1cnccc1[C@@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000506037840 567608453 /nfs/dbraw/zinc/60/84/53/567608453.db2.gz JHQGLMVPSGWPPJ-SECBINFHSA-N 0 1 375.226 3.220 10 0 GGAEMN O=S1(=O)CCCN1CCN1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000439950500 567608655 /nfs/dbraw/zinc/60/86/55/567608655.db2.gz OIUFUGTYMUMORQ-INIZCTEOSA-N 0 1 376.444 3.268 10 0 GGAEMN C[C@H](CN[C@@H](c1ccc(Br)cc1)C(F)F)CN1CCOCC1 ZINC000621752957 567608662 /nfs/dbraw/zinc/60/86/62/567608662.db2.gz FQSOVIXOPFPXQP-DOMZBBRYSA-N 0 1 377.273 3.313 10 0 GGAEMN COCCN1CCC[C@H]1CN[C@H](c1ccc(Br)cc1)C(F)F ZINC000621752315 567608882 /nfs/dbraw/zinc/60/88/82/567608882.db2.gz XUXRABSCPDCKHL-LSDHHAIUSA-N 0 1 377.273 3.456 10 0 GGAEMN Nc1nc2c(c(N3CCO[C@@H](c4ccc(Br)cc4)C3)n1)CCCC2 ZINC000645135649 567609087 /nfs/dbraw/zinc/60/90/87/567609087.db2.gz KQIHMTQYSLFBCB-MRXNPFEDSA-N 0 1 389.297 3.108 10 0 GGAEMN Cc1ccc2c(c1Br)CN(C(=O)NCc1n[nH]c(C(C)(C)C)n1)C2 ZINC000665112337 567609056 /nfs/dbraw/zinc/60/90/56/567609056.db2.gz IAUWFAYOMWVFFQ-UHFFFAOYSA-N 0 1 392.301 3.399 10 0 GGAEMN OCCCN1CCC[C@@H](N[C@H](c2ccc(Br)cc2)C(F)F)C1 ZINC000621762404 567610581 /nfs/dbraw/zinc/61/05/81/567610581.db2.gz BLBMZVXTZCAKAB-HUUCEWRRSA-N 0 1 377.273 3.192 10 0 GGAEMN CN(CC(=O)NCc1cccs1)Cc1nc2ccc(Br)cc2[nH]1 ZINC000480555899 567610830 /nfs/dbraw/zinc/61/08/30/567610830.db2.gz OHDXEEAJGPFVCJ-UHFFFAOYSA-N 0 1 393.310 3.135 10 0 GGAEMN O=C([C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)N1CCCC1 ZINC000480535909 567610907 /nfs/dbraw/zinc/61/09/07/567610907.db2.gz AKBWROXDUBPYTM-CYBMUJFWSA-N 0 1 391.313 3.160 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1ccc(F)c(Br)c1 ZINC000645194470 567611873 /nfs/dbraw/zinc/61/18/73/567611873.db2.gz YFQIBRDUMLYPBM-VUCTXSBTSA-N 0 1 399.304 3.409 10 0 GGAEMN O=S(=O)(CCCNCc1cn2cccc(F)c2n1)c1ccc(Cl)cc1 ZINC000645221308 567612910 /nfs/dbraw/zinc/61/29/10/567612910.db2.gz QYKTWORVNWHQQF-UHFFFAOYSA-N 0 1 381.860 3.080 10 0 GGAEMN CC(C)(C(=O)N1CCO[C@@H](c2cccc(Br)c2)C1)c1c[nH]cn1 ZINC000621811253 567613365 /nfs/dbraw/zinc/61/33/65/567613365.db2.gz MQYRPWTYFIEIKQ-CQSZACIVSA-N 0 1 378.270 3.050 10 0 GGAEMN CS[C@@H]1CN(c2nc(C3CC3)ncc2Br)C[C@H]1N1CCCC1 ZINC000596195306 567614189 /nfs/dbraw/zinc/61/41/89/567614189.db2.gz KTSBNQZKRGVYPT-ZIAGYGMSSA-N 0 1 383.359 3.133 10 0 GGAEMN CS[C@@H]1CN(c2nc(C3CC3)ncc2Br)C[C@@H]1N1CCCC1 ZINC000596195304 567614684 /nfs/dbraw/zinc/61/46/84/567614684.db2.gz KTSBNQZKRGVYPT-UONOGXRCSA-N 0 1 383.359 3.133 10 0 GGAEMN O=S(=O)(NCCc1nnc(-c2ccccc2)[nH]1)c1cc(Cl)cc(Cl)c1 ZINC000440071183 567615417 /nfs/dbraw/zinc/61/54/17/567615417.db2.gz AKPAJGHRBAGIDZ-UHFFFAOYSA-N 0 1 397.287 3.300 10 0 GGAEMN C[C@H](c1ccc(Br)cc1)N1CCN(CCc2cncn2C)CC1 ZINC000459337997 567616352 /nfs/dbraw/zinc/61/63/52/567616352.db2.gz KGGRWAXSPAONEJ-OAHLLOKOSA-N 0 1 377.330 3.104 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000645315553 567617490 /nfs/dbraw/zinc/61/74/90/567617490.db2.gz SLSZQUBPYUECCR-SGMGOOAPSA-N 0 1 390.285 3.222 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000645315553 567617495 /nfs/dbraw/zinc/61/74/95/567617495.db2.gz SLSZQUBPYUECCR-SGMGOOAPSA-N 0 1 390.285 3.222 10 0 GGAEMN COc1cc2nccc(NCC(C)(C)[C@@]3(O)CCOC3)c2cc1Br ZINC000645365379 567620475 /nfs/dbraw/zinc/62/04/75/567620475.db2.gz DVBDHLZWXFZPFP-GOSISDBHSA-N 0 1 395.297 3.017 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cccc2cccc(Br)c21 ZINC000506356193 567622201 /nfs/dbraw/zinc/62/22/01/567622201.db2.gz MBMFIGKVGBCDME-UHFFFAOYSA-N 0 1 391.309 3.445 10 0 GGAEMN O=C(Nc1nc(-c2cccs2)ns1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000621947270 567625253 /nfs/dbraw/zinc/62/52/53/567625253.db2.gz QIMMARYELJLPJD-RKDXNWHRSA-N 0 1 393.412 3.189 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)cn1 ZINC000553096366 567626648 /nfs/dbraw/zinc/62/66/48/567626648.db2.gz KYASBQCGCWUDOO-KRWDZBQOSA-N 0 1 382.291 3.304 10 0 GGAEMN CSc1cccc(CSCC(=O)NC[C@@H]2CN(CC(C)C)CCO2)c1 ZINC000596379207 567627772 /nfs/dbraw/zinc/62/77/72/567627772.db2.gz BOLLSLQALNAEIS-QGZVFWFLSA-N 0 1 382.595 3.115 10 0 GGAEMN CC(C)NC(=O)CC[N@H+]1CCC[C@H]1c1ccccc1I ZINC000506474893 567627831 /nfs/dbraw/zinc/62/78/31/567627831.db2.gz QLKLUGSILYXRKM-HNNXBMFYSA-N 0 1 386.277 3.343 10 0 GGAEMN CC(C)NC(=O)CCN1CCC[C@H]1c1ccccc1I ZINC000506474893 567627840 /nfs/dbraw/zinc/62/78/40/567627840.db2.gz QLKLUGSILYXRKM-HNNXBMFYSA-N 0 1 386.277 3.343 10 0 GGAEMN CCOc1cc(CN[C@H](CC)[C@@H](O)C(F)(F)F)cc(Br)c1O ZINC000459466613 567628034 /nfs/dbraw/zinc/62/80/34/567628034.db2.gz YYLIMSZWYFKWEQ-ZWNOBZJWSA-N 0 1 386.208 3.345 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)NCC[N@@H+]1CCCC[C@@H]1C ZINC000506496524 567628817 /nfs/dbraw/zinc/62/88/17/567628817.db2.gz SDNFYJVTTGVHQZ-ZDUSSCGKSA-N 0 1 397.313 3.021 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)NCCN1CCCC[C@@H]1C ZINC000506496524 567628821 /nfs/dbraw/zinc/62/88/21/567628821.db2.gz SDNFYJVTTGVHQZ-ZDUSSCGKSA-N 0 1 397.313 3.021 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NC[C@@H](c1cccc(F)c1)N(C)C ZINC000665536066 567628863 /nfs/dbraw/zinc/62/88/63/567628863.db2.gz HNEKQPGOPRYLOM-INIZCTEOSA-N 0 1 380.261 3.324 10 0 GGAEMN CCOc1cc(CNCc2ccc(NC(C)=O)nc2)cc(Br)c1O ZINC000459512795 567632758 /nfs/dbraw/zinc/63/27/58/567632758.db2.gz ZHOUAVWLWXDLOH-UHFFFAOYSA-N 0 1 394.269 3.197 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N(CCN(C)C)Cc3cccs3)cc2s1 ZINC000572338616 567632836 /nfs/dbraw/zinc/63/28/36/567632836.db2.gz FJEFQOQGBPZEPC-UHFFFAOYSA-N 0 1 395.575 3.419 10 0 GGAEMN CCOc1cc(CNCc2c3c(nn2C)CCCC3)cc(Br)c1O ZINC000459552992 567635212 /nfs/dbraw/zinc/63/52/12/567635212.db2.gz AXFDDYPPMLKVLY-UHFFFAOYSA-N 0 1 394.313 3.456 10 0 GGAEMN Cc1ccsc1[C@H](CO)NC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C ZINC000530994595 567635546 /nfs/dbraw/zinc/63/55/46/567635546.db2.gz MDMKHOKALXWPLI-HOTGVXAUSA-N 0 1 381.929 3.345 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C ZINC000530994594 567636078 /nfs/dbraw/zinc/63/60/78/567636078.db2.gz MDMKHOKALXWPLI-CVEARBPZSA-N 0 1 381.929 3.345 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C ZINC000530994596 567636179 /nfs/dbraw/zinc/63/61/79/567636179.db2.gz MDMKHOKALXWPLI-HZPDHXFCSA-N 0 1 381.929 3.345 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc2ccccn2c1 ZINC000531053706 567638568 /nfs/dbraw/zinc/63/85/68/567638568.db2.gz HZFDTZADGYLZRG-UHFFFAOYSA-N 0 1 396.248 3.417 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc2ccccn2c1 ZINC000531053706 567638571 /nfs/dbraw/zinc/63/85/71/567638571.db2.gz HZFDTZADGYLZRG-UHFFFAOYSA-N 0 1 396.248 3.417 10 0 GGAEMN C[C@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@@H](c1ccccc1)N(C)C ZINC000480895413 567639873 /nfs/dbraw/zinc/63/98/73/567639873.db2.gz IFRNFEVSYWUIOH-UGSOOPFHSA-N 0 1 375.519 3.266 10 0 GGAEMN Cc1cc(C(=O)N2CCN(Cc3cc(Br)ccc3C)[C@H](C)C2)n[nH]1 ZINC000459595724 567640865 /nfs/dbraw/zinc/64/08/65/567640865.db2.gz TUYHFGAZDNSLDG-CQSZACIVSA-N 0 1 391.313 3.136 10 0 GGAEMN O=C1NCCC[C@@H]1NCc1cc(Br)ccc1OCc1ccccc1 ZINC000572471811 567642040 /nfs/dbraw/zinc/64/20/40/567642040.db2.gz OKLNSIVKXWCKFR-KRWDZBQOSA-N 0 1 389.293 3.396 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cccc(OCCF)c2)cc1Cl ZINC000440818493 567645553 /nfs/dbraw/zinc/64/55/53/567645553.db2.gz UIYUOVNPRVLTLX-UHFFFAOYSA-N 0 1 387.816 3.276 10 0 GGAEMN COCCN1CC[C@H](NC(=O)N2CCC[C@@H]2c2ccc(Br)cc2)C1 ZINC000531228836 567648185 /nfs/dbraw/zinc/64/81/85/567648185.db2.gz YDPAKPXCFPYESX-DLBZAZTESA-N 0 1 396.329 3.016 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1ncc(C(F)(F)F)[nH]1 ZINC000506916024 567648743 /nfs/dbraw/zinc/64/87/43/567648743.db2.gz IBOIAEMZWKEWKG-UHFFFAOYSA-N 0 1 378.148 3.381 10 0 GGAEMN Cc1ccc2nc(CNC(=O)C(=O)Nc3cccc(Cl)c3Cl)[nH]c2c1 ZINC000531282942 567651720 /nfs/dbraw/zinc/65/17/20/567651720.db2.gz HOEFYAYVRWLVQA-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN COc1c(Br)cc(Cl)cc1NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000572612765 567653693 /nfs/dbraw/zinc/65/36/93/567653693.db2.gz DJSHKWSVFWIYMJ-PHIMTYICSA-N 0 1 388.693 3.469 10 0 GGAEMN COCc1nc(CNC(=O)N2CCc3c(Cl)cc(Cl)cc3[C@H]2C)n[nH]1 ZINC000666118888 567655387 /nfs/dbraw/zinc/65/53/87/567655387.db2.gz CHMSGHNYZAUEEB-SECBINFHSA-N 0 1 384.267 3.087 10 0 GGAEMN COCc1nnc(CNC(=O)N2CCc3c(Cl)cc(Cl)cc3[C@H]2C)[nH]1 ZINC000666118888 567655392 /nfs/dbraw/zinc/65/53/92/567655392.db2.gz CHMSGHNYZAUEEB-SECBINFHSA-N 0 1 384.267 3.087 10 0 GGAEMN Clc1cc(I)ccc1CNc1ncnc2[nH]cnc21 ZINC000481068151 567656054 /nfs/dbraw/zinc/65/60/54/567656054.db2.gz HFIRMJFUTLPZBG-UHFFFAOYSA-N 0 1 385.596 3.175 10 0 GGAEMN COCc1nc(CNC(=O)N(Cc2c(Cl)cccc2Cl)C2CC2)n[nH]1 ZINC000666115878 567656140 /nfs/dbraw/zinc/65/61/40/567656140.db2.gz OGWHNVKZUMXDOI-UHFFFAOYSA-N 0 1 384.267 3.132 10 0 GGAEMN COCc1nnc(CNC(=O)N(Cc2c(Cl)cccc2Cl)C2CC2)[nH]1 ZINC000666115878 567656147 /nfs/dbraw/zinc/65/61/47/567656147.db2.gz OGWHNVKZUMXDOI-UHFFFAOYSA-N 0 1 384.267 3.132 10 0 GGAEMN O=S(=O)(Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1cncc(Cl)c1 ZINC000507023071 567656175 /nfs/dbraw/zinc/65/61/75/567656175.db2.gz SCYSGBJHZRKEJN-UHFFFAOYSA-N 0 1 375.841 3.198 10 0 GGAEMN Cc1cc(NC(=O)CN2CCC[C@H]([C@H]3CCOC3)C2)ccc1Br ZINC000441201927 567657820 /nfs/dbraw/zinc/65/78/20/567657820.db2.gz QRGYMJBADXLQIY-GJZGRUSLSA-N 0 1 381.314 3.445 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CN1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441284440 567659123 /nfs/dbraw/zinc/65/91/23/567659123.db2.gz XJLYRTTVMGYRCO-CABCVRRESA-N 0 1 381.314 3.445 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CN1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441284448 567659653 /nfs/dbraw/zinc/65/96/53/567659653.db2.gz XJLYRTTVMGYRCO-LSDHHAIUSA-N 0 1 381.314 3.445 10 0 GGAEMN Brc1cc2c(cc1CN1CCC[C@H]([C@@H]3CCOC3)C1)OCCO2 ZINC000441278641 567659764 /nfs/dbraw/zinc/65/97/64/567659764.db2.gz ATOOJKFQBLPDFH-UONOGXRCSA-N 0 1 382.298 3.469 10 0 GGAEMN C[C@@H]1CCNC(=O)[C@@H]1NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000441380528 567662184 /nfs/dbraw/zinc/66/21/84/567662184.db2.gz HJUUZUKKCPICQX-QMTHXVAHSA-N 0 1 380.311 3.187 10 0 GGAEMN Cc1ccccc1[C@@H]1C(=O)NCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000481202982 567662612 /nfs/dbraw/zinc/66/26/12/567662612.db2.gz KKZRLXKPAFUTGF-GOSISDBHSA-N 0 1 399.292 3.307 10 0 GGAEMN C[C@@H]1CCN(CC(=O)Nc2cccc(Oc3ncc(Br)cn3)c2)C1 ZINC000572779287 567664987 /nfs/dbraw/zinc/66/49/87/567664987.db2.gz GVMJZXMDIOQUMA-GFCCVEGCSA-N 0 1 391.269 3.312 10 0 GGAEMN C[C@H](CNS(=O)(=O)c1cc(Br)c(F)cc1F)CC(F)F ZINC000645795673 567669138 /nfs/dbraw/zinc/66/91/38/567669138.db2.gz KGOPVXRIYQUKBE-LURJTMIESA-N 0 1 378.185 3.297 10 0 GGAEMN Cc1cnc(C(=O)Nc2nccn2Cc2ccc(Br)cc2)c(O)c1 ZINC000460112938 567673284 /nfs/dbraw/zinc/67/32/84/567673284.db2.gz PPJXURYBJMWGIO-UHFFFAOYSA-N 0 1 387.237 3.355 10 0 GGAEMN C[C@@](O)(CNC(=O)c1n[nH]c2ccc(Br)cc21)C1CCCCC1 ZINC000481359517 567674227 /nfs/dbraw/zinc/67/42/27/567674227.db2.gz LERDKZZXPQYYFT-QGZVFWFLSA-N 0 1 380.286 3.387 10 0 GGAEMN OCC[C@H]1CSCCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000441897472 567677803 /nfs/dbraw/zinc/67/78/03/567677803.db2.gz FQFILNWKTVHICM-INIZCTEOSA-N 0 1 394.338 3.206 10 0 GGAEMN CC(C)(CNC(=O)[C@@H]1CCc2[nH]cnc2C1)c1ccc(Br)cc1 ZINC000666459030 567678652 /nfs/dbraw/zinc/67/86/52/567678652.db2.gz ORZUYKRPHQFLPS-GFCCVEGCSA-N 0 1 376.298 3.371 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCC(=O)NC2CCCC2)CC1 ZINC000645974315 567686462 /nfs/dbraw/zinc/68/64/62/567686462.db2.gz OIKCIFXJTIEHDM-UHFFFAOYSA-N 0 1 381.314 3.485 10 0 GGAEMN Brc1ccc2ncnc(N[C@H]3CCCC[C@H]3N3CCOCC3)c2c1 ZINC000531911029 567686548 /nfs/dbraw/zinc/68/65/48/567686548.db2.gz JGUPFTONVAWSNR-DLBZAZTESA-N 0 1 391.313 3.448 10 0 GGAEMN COc1ccc(Br)cc1C1(NC[C@H](O)COc2ccccc2)CC1 ZINC000645974864 567686979 /nfs/dbraw/zinc/68/69/79/567686979.db2.gz GFEBTFDDFRICBA-HNNXBMFYSA-N 0 1 392.293 3.476 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCCS(=O)(=O)C(C)C)CC1 ZINC000645974340 567687132 /nfs/dbraw/zinc/68/71/32/567687132.db2.gz RHMORKAZKZYUDB-UHFFFAOYSA-N 0 1 390.343 3.250 10 0 GGAEMN C[C@H]1CN(C)CCN1c1ccc2nnc(-c3cc(Cl)cc(Cl)c3)n2n1 ZINC000597182883 567687199 /nfs/dbraw/zinc/68/71/99/567687199.db2.gz LRFAZPZEEPEBTQ-NSHDSACASA-N 0 1 377.279 3.238 10 0 GGAEMN COc1ccccc1C1(NC[C@@H](O)COc2ccc(Br)cc2)CC1 ZINC000645998417 567688007 /nfs/dbraw/zinc/68/80/07/567688007.db2.gz SLCIFHNLXCUSSB-OAHLLOKOSA-N 0 1 392.293 3.476 10 0 GGAEMN Cc1cc(Br)c(CNC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)s1 ZINC000666640883 567691058 /nfs/dbraw/zinc/69/10/58/567691058.db2.gz YRWDTAAFZNHYPA-JSGCOSHPSA-N 0 1 386.359 3.445 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)c(C(C)=O)c2)c(Cl)c1 ZINC000507639607 567691479 /nfs/dbraw/zinc/69/14/79/567691479.db2.gz XAXPNUQWYLSXDA-UHFFFAOYSA-N 0 1 385.800 3.269 10 0 GGAEMN COc1cccc([C@H](N)C(=O)N2CCc3ccc(F)c(Br)c3C2)c1 ZINC000623232258 567691996 /nfs/dbraw/zinc/69/19/96/567691996.db2.gz BWBBLFIBAKBYQF-KRWDZBQOSA-N 0 1 393.256 3.182 10 0 GGAEMN C[C@@H]1Cc2c[nH]nc2[C@@H](C(=O)N2CCOc3cccc(Br)c3C2)C1 ZINC000623224314 567692310 /nfs/dbraw/zinc/69/23/10/567692310.db2.gz CBFAODOIQGNNLJ-YPMHNXCESA-N 0 1 390.281 3.259 10 0 GGAEMN C[C@H]1Cc2c[nH]nc2[C@H](C(=O)N2CCOc3cc(Br)ccc3C2)C1 ZINC000623226762 567692795 /nfs/dbraw/zinc/69/27/95/567692795.db2.gz LRULRCPFRUOQCY-XHDPSFHLSA-N 0 1 390.281 3.259 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccc(C)cc2Br)C1 ZINC000646112405 567695181 /nfs/dbraw/zinc/69/51/81/567695181.db2.gz ADZUXYRRLBMUGJ-CQSZACIVSA-N 0 1 379.220 3.258 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2cccc(Br)c2C)C1 ZINC000646112543 567695271 /nfs/dbraw/zinc/69/52/71/567695271.db2.gz RKOAQKFQJQGDHM-CQSZACIVSA-N 0 1 379.220 3.258 10 0 GGAEMN CCCCN(Cc1csc(CC(=O)NC)n1)[C@H]1CCc2ncsc2C1 ZINC000646129381 567695549 /nfs/dbraw/zinc/69/55/49/567695549.db2.gz BERFDJDGNDEMSF-AWEZNQCLSA-N 0 1 378.567 3.048 10 0 GGAEMN O=C(CCN1CCc2nccc(Br)c2C1)Nc1ccccc1F ZINC000623285514 567696795 /nfs/dbraw/zinc/69/67/95/567696795.db2.gz KYUFRUAHKHMWDT-UHFFFAOYSA-N 0 1 378.245 3.370 10 0 GGAEMN CCOC(=O)C[C@@H]1C[C@@H](OC)CN1CCCc1ccccc1Br ZINC000481737749 567700247 /nfs/dbraw/zinc/70/02/47/567700247.db2.gz PQOOFNDIVROONA-JKSUJKDBSA-N 0 1 384.314 3.424 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000597522420 567702831 /nfs/dbraw/zinc/70/28/31/567702831.db2.gz JLHOAFNSSZIRDF-JTQLQIEISA-N 0 1 381.217 3.066 10 0 GGAEMN Cc1cc(Br)c(CNCCNC(=O)C2CC2)cc1Br ZINC000623338547 567703338 /nfs/dbraw/zinc/70/33/38/567703338.db2.gz DWOPSNJLTKSVIT-UHFFFAOYSA-N 0 1 390.119 3.136 10 0 GGAEMN Cc1cnc(CCN(C)C(=O)[C@@](C)(N)c2ccc(Br)cc2)s1 ZINC000646268475 567703436 /nfs/dbraw/zinc/70/34/36/567703436.db2.gz COTDEGDWZRAZKH-INIZCTEOSA-N 0 1 382.327 3.089 10 0 GGAEMN Cc1cc(CNCc2ccc(CN3CCOCC3)cc2)ncc1Br ZINC000623341918 567703563 /nfs/dbraw/zinc/70/35/63/567703563.db2.gz YNVOGPXEDGCMBH-UHFFFAOYSA-N 0 1 390.325 3.275 10 0 GGAEMN O=C(NCCNCc1cccc(F)c1OCC(F)(F)F)c1cccs1 ZINC000623360875 567704590 /nfs/dbraw/zinc/70/45/90/567704590.db2.gz CGGZKLOECCTFSH-UHFFFAOYSA-N 0 1 376.375 3.348 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NC[C@@H](c1ccc(F)cc1)N(C)C ZINC000666827743 567705642 /nfs/dbraw/zinc/70/56/42/567705642.db2.gz CFVSPWIFVIDFOF-INIZCTEOSA-N 0 1 380.261 3.324 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NC[C@H](c1ccc(F)cc1)N(C)C ZINC000666827744 567705793 /nfs/dbraw/zinc/70/57/93/567705793.db2.gz CFVSPWIFVIDFOF-MRXNPFEDSA-N 0 1 380.261 3.324 10 0 GGAEMN CC[C@@H]1C[C@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000507807195 567706524 /nfs/dbraw/zinc/70/65/24/567706524.db2.gz UBZUNJZROFNDTD-CRAIPNDOSA-N 0 1 395.341 3.412 10 0 GGAEMN Cn1cc([C@H](NC(=O)c2c(O)cc(Cl)cc2Cl)C2(CO)CCC2)cn1 ZINC000646332479 567706886 /nfs/dbraw/zinc/70/68/86/567706886.db2.gz KWOUERVWRZRYCC-HNNXBMFYSA-N 0 1 384.263 3.066 10 0 GGAEMN Cc1cc(Br)c(CNCCCS(C)(=O)=O)cc1Br ZINC000623401792 567707795 /nfs/dbraw/zinc/70/77/95/567707795.db2.gz ORBUZDJYTYIBBT-UHFFFAOYSA-N 0 1 399.148 3.044 10 0 GGAEMN C[C@H]1CN(CCCNC(=O)NCc2csc(C(F)(F)F)c2)C[C@H](C)O1 ZINC000623403862 567707882 /nfs/dbraw/zinc/70/78/82/567707882.db2.gz JVQQSQVVCNDWAQ-RYUDHWBXSA-N 0 1 379.448 3.065 10 0 GGAEMN CC(C)[C@@H]1CN(C)CCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507809703 567708425 /nfs/dbraw/zinc/70/84/25/567708425.db2.gz SFIIOJAHQQYCFF-HOTGVXAUSA-N 0 1 396.329 3.254 10 0 GGAEMN CC[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccc(Cl)cc1Cl ZINC000554090267 567708463 /nfs/dbraw/zinc/70/84/63/567708463.db2.gz PDCPOOZFKBQNCA-CZUORRHYSA-N 0 1 394.368 3.305 10 0 GGAEMN CSc1ccc(CSCC(=O)NC[C@H]2CN(CC(C)C)CCO2)cc1 ZINC000507821336 567708612 /nfs/dbraw/zinc/70/86/12/567708612.db2.gz NDJLYJJNHBKOHF-KRWDZBQOSA-N 0 1 382.595 3.115 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cc(S(C)(=O)=O)ccc2C)c(Cl)cc1F ZINC000532364633 567711727 /nfs/dbraw/zinc/71/17/27/567711727.db2.gz UAPDMMNFVXGSOX-UHFFFAOYSA-N 0 1 391.873 3.300 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCN2CCC1CC2 ZINC000507874719 567712014 /nfs/dbraw/zinc/71/20/14/567712014.db2.gz LFRHRTGLDHPVCH-NSHDSACASA-N 0 1 387.705 3.176 10 0 GGAEMN CC[C@H](c1ccc(Br)cc1)N1CCN(CCC(=O)NC(C)C)CC1 ZINC000507872434 567712200 /nfs/dbraw/zinc/71/22/00/567712200.db2.gz JLVPCPAPJQKPEE-GOSISDBHSA-N 0 1 396.373 3.433 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)cc1F ZINC000442845998 567712315 /nfs/dbraw/zinc/71/23/15/567712315.db2.gz YHLFLAOJVOPSCU-UHFFFAOYSA-N 0 1 381.303 3.239 10 0 GGAEMN Cc1cc(CN[C@H](C)Cn2ncc3ccccc3c2=O)ncc1Br ZINC000623477289 567713396 /nfs/dbraw/zinc/71/33/96/567713396.db2.gz FDBFJYPZGIIVGK-CYBMUJFWSA-N 0 1 387.281 3.041 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1ccc(OC(F)(F)F)c(Br)c1 ZINC000666960519 567715494 /nfs/dbraw/zinc/71/54/94/567715494.db2.gz KNONTXMGMUSIHR-UHFFFAOYSA-N 0 1 396.207 3.373 10 0 GGAEMN CCCCCc1nnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)s1 ZINC000666969122 567715982 /nfs/dbraw/zinc/71/59/82/567715982.db2.gz GHDHVPQTYCAUHK-WDEREUQCSA-N 0 1 381.420 3.193 10 0 GGAEMN CCCCCc1nnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)s1 ZINC000666969121 567716048 /nfs/dbraw/zinc/71/60/48/567716048.db2.gz GHDHVPQTYCAUHK-QWRGUYRKSA-N 0 1 381.420 3.193 10 0 GGAEMN Cc1cc(CN[C@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)ncc1Br ZINC000623513632 567716991 /nfs/dbraw/zinc/71/69/91/567716991.db2.gz GLIARSRPWKLXEP-KDOFPFPSSA-N 0 1 388.309 3.432 10 0 GGAEMN COCC[C@@H](CO)NCc1cc(Br)c(C)cc1Br ZINC000623513574 567717208 /nfs/dbraw/zinc/71/72/08/567717208.db2.gz DJZKXMYZDFTPGS-NSHDSACASA-N 0 1 381.108 3.007 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@@H]3COCC[C@@H]32)nn1 ZINC000573497211 567718007 /nfs/dbraw/zinc/71/80/07/567718007.db2.gz YHOUGLOXWNHNKZ-CJNGLKHVSA-N 0 1 377.286 3.031 10 0 GGAEMN Cc1nccc(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)n1 ZINC000507950569 567718519 /nfs/dbraw/zinc/71/85/19/567718519.db2.gz LPNBIZDMPYKKGU-UHFFFAOYSA-N 0 1 389.297 3.398 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@@H](CCO)c1ccc(Cl)cc1 ZINC000554284610 567719143 /nfs/dbraw/zinc/71/91/43/567719143.db2.gz WFLGEVVOQSBCLK-HNNXBMFYSA-N 0 1 380.838 3.400 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@H](CCO)c1ccc(Cl)cc1 ZINC000554284611 567719482 /nfs/dbraw/zinc/71/94/82/567719482.db2.gz WFLGEVVOQSBCLK-OAHLLOKOSA-N 0 1 380.838 3.400 10 0 GGAEMN CC(=O)NCC[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000554294483 567720402 /nfs/dbraw/zinc/72/04/02/567720402.db2.gz IQURZIYUOQVBLQ-CYBMUJFWSA-N 0 1 379.302 3.064 10 0 GGAEMN CCOc1c(Br)cc(Br)cc1CN(C)CCCO ZINC000442961752 567720603 /nfs/dbraw/zinc/72/06/03/567720603.db2.gz CQOJTQCTWHEYOS-UHFFFAOYSA-N 0 1 381.108 3.425 10 0 GGAEMN Cc1csc(C(=O)NC[C@H]2CCN2C(C)(C)C)c1I ZINC000597860276 567721120 /nfs/dbraw/zinc/72/11/20/567721120.db2.gz MZKLGUIWGPYQSA-SNVBAGLBSA-N 0 1 392.306 3.264 10 0 GGAEMN Cc1cc(C[C@@H](C)Nc2ncnc3cccc(I)c32)[nH]n1 ZINC000573617318 567726393 /nfs/dbraw/zinc/72/63/93/567726393.db2.gz OHHRVZSSZKGEPS-SECBINFHSA-N 0 1 393.232 3.309 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)NCCCN2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000623638214 567726889 /nfs/dbraw/zinc/72/68/89/567726889.db2.gz YVWYICKHAJITLT-BETUJISGSA-N 0 1 387.293 3.126 10 0 GGAEMN Clc1ccc(Cl)c(CN[C@@H]2CCN(c3ccc4nncn4n3)C2)c1Cl ZINC000623654170 567727676 /nfs/dbraw/zinc/72/76/76/567727676.db2.gz XQXNUMSPSLONAX-SNVBAGLBSA-N 0 1 397.697 3.453 10 0 GGAEMN CC(C)n1ccnc1CN[C@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623644879 567727811 /nfs/dbraw/zinc/72/78/11/567727811.db2.gz DFOWRGJWVXOQAO-GOSISDBHSA-N 0 1 378.314 3.236 10 0 GGAEMN C[C@@H](CCc1cccn1C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000461328856 567728876 /nfs/dbraw/zinc/72/88/76/567728876.db2.gz AWHHJZPQBNNIGS-NSHDSACASA-N 0 1 375.270 3.415 10 0 GGAEMN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@@H]1CCNC1=O ZINC000532705192 567730449 /nfs/dbraw/zinc/73/04/49/567730449.db2.gz ZQGXGGPMNCABFE-TVQRCGJNSA-N 0 1 380.311 3.420 10 0 GGAEMN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@@H]1CCNC1=O ZINC000532705189 567730853 /nfs/dbraw/zinc/73/08/53/567730853.db2.gz ZQGXGGPMNCABFE-NOZJJQNGSA-N 0 1 380.311 3.420 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CCc2cc(F)cc(Br)c2C1 ZINC000623706347 567731878 /nfs/dbraw/zinc/73/18/78/567731878.db2.gz WHHYURBPVIZKBU-UHFFFAOYSA-N 0 1 395.276 3.320 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)NCc1cc(F)c(Br)cc1F ZINC000623706220 567732303 /nfs/dbraw/zinc/73/23/03/567732303.db2.gz PMGHKIZTSOOVFK-UHFFFAOYSA-N 0 1 387.228 3.191 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc3c(ccc(Br)c3C)[nH]2)CC1 ZINC000667195432 567734196 /nfs/dbraw/zinc/73/41/96/567734196.db2.gz YIDHOWOJDCUHQU-UHFFFAOYSA-N 0 1 394.313 3.033 10 0 GGAEMN COc1ccccc1OCCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000554544108 567734461 /nfs/dbraw/zinc/73/44/61/567734461.db2.gz XKJFIPXWCRYQKJ-UHFFFAOYSA-N 0 1 390.237 3.143 10 0 GGAEMN Cn1c2cc(CNCc3cc(Br)cc4c3OCC4)ccc2oc1=O ZINC000623743302 567734975 /nfs/dbraw/zinc/73/49/75/567734975.db2.gz OTOFJGKPHBLRNS-UHFFFAOYSA-N 0 1 389.249 3.119 10 0 GGAEMN O=C(NCCCc1nc[nH]n1)N[C@H]1CCCCc2cc(Br)ccc21 ZINC000667211468 567735439 /nfs/dbraw/zinc/73/54/39/567735439.db2.gz ISIMXDLHRZDCJG-HNNXBMFYSA-N 0 1 392.301 3.267 10 0 GGAEMN C[C@H](NC(=O)N[C@@H]1CCCCc2cc(Br)ccc21)c1nnc[nH]1 ZINC000667213169 567735470 /nfs/dbraw/zinc/73/54/70/567735470.db2.gz MTJONHXJTKNMNI-IINYFYTJSA-N 0 1 378.274 3.395 10 0 GGAEMN O=S(=O)(Nc1ncccc1Br)c1cnccc1C(F)(F)F ZINC000443160216 567736242 /nfs/dbraw/zinc/73/62/42/567736242.db2.gz XLJIYHSYKQZFBH-UHFFFAOYSA-N 0 1 382.161 3.059 10 0 GGAEMN COC(=O)[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C1CCCCC1 ZINC000554569112 567737195 /nfs/dbraw/zinc/73/71/95/567737195.db2.gz HBQDVHXBQGETIX-AWEZNQCLSA-N 0 1 394.269 3.177 10 0 GGAEMN Cc1ccc(CNC[C@@H]2CN(Cc3ccncc3)CCO2)c(Br)c1 ZINC000623781199 567737631 /nfs/dbraw/zinc/73/76/31/567737631.db2.gz JPWGCQWXWXYVPV-GOSISDBHSA-N 0 1 390.325 3.143 10 0 GGAEMN Cc1cc(Br)c(CNC[C@@H]2CN(Cc3ccncc3)CCO2)s1 ZINC000623782029 567737974 /nfs/dbraw/zinc/73/79/74/567737974.db2.gz GNUNTFKVSLXHHS-OAHLLOKOSA-N 0 1 396.354 3.205 10 0 GGAEMN O=C(Nc1ccc(I)cc1F)[C@@H]1CCCc2[nH]ncc21 ZINC000598068271 567738353 /nfs/dbraw/zinc/73/83/53/567738353.db2.gz HNACIEHBCVIRBL-SECBINFHSA-N 0 1 385.180 3.212 10 0 GGAEMN Cc1nc(NS(=O)(=O)Cc2ccccc2Br)cc(C2CC2)n1 ZINC000573837830 567739192 /nfs/dbraw/zinc/73/91/92/567739192.db2.gz ZFGVADWYBVAXQW-UHFFFAOYSA-N 0 1 382.283 3.367 10 0 GGAEMN O=C([C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)N1CCN(C2CCCC2)CC1 ZINC000623821930 567740140 /nfs/dbraw/zinc/74/01/40/567740140.db2.gz MUWZWAHSWFYORM-QXAKKESOSA-N 0 1 389.337 3.422 10 0 GGAEMN CCOc1cc(CN[C@H]2CCN(C3CCC3)C2=O)cc(Br)c1OC ZINC000623840093 567741359 /nfs/dbraw/zinc/74/13/59/567741359.db2.gz NGAIDGQNTSFZAC-HNNXBMFYSA-N 0 1 397.313 3.099 10 0 GGAEMN Cc1ccn([C@@H](C)CC(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000667425858 567746712 /nfs/dbraw/zinc/74/67/12/567746712.db2.gz PEIALIRAMSTCHH-NSHDSACASA-N 0 1 389.257 3.329 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2ccc(Cl)cc2F)[C@@H]1O ZINC000574022985 567750822 /nfs/dbraw/zinc/75/08/22/567750822.db2.gz JBFUQRSVKDVKKY-OCCSQVGLSA-N 0 1 391.873 3.092 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NCC[N@H+](C)C2CCCCC2)s[n-]1 ZINC000443364830 567752334 /nfs/dbraw/zinc/75/23/34/567752334.db2.gz BIPRIXILAFZUBD-UHFFFAOYSA-N 0 1 379.555 3.383 10 0 GGAEMN Fc1cncc(Br)c1CN1CCN(CCc2cccs2)CC1 ZINC000667506760 567754311 /nfs/dbraw/zinc/75/43/11/567754311.db2.gz LZXKBBUMDKUWPS-UHFFFAOYSA-N 0 1 384.318 3.405 10 0 GGAEMN CCOc1cccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)c1 ZINC000443411168 567754613 /nfs/dbraw/zinc/75/46/13/567754613.db2.gz CXBGQQNUBYAHKF-UHFFFAOYSA-N 0 1 377.340 3.490 10 0 GGAEMN O=C1[C@H](NCc2cccc(I)c2)CCN1c1ccccc1 ZINC000574143840 567758284 /nfs/dbraw/zinc/75/82/84/567758284.db2.gz WYKQTXLAAVRPHB-MRXNPFEDSA-N 0 1 392.240 3.186 10 0 GGAEMN C[C@@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)sc1Cl ZINC000624113750 567760690 /nfs/dbraw/zinc/76/06/90/567760690.db2.gz MMNUYVQVTPAVCR-NXEZZACHSA-N 0 1 383.308 3.422 10 0 GGAEMN COc1ncc(S(=O)(=O)Nc2cccc(NC(=O)C(C)C)c2)cc1Cl ZINC000647123860 567761701 /nfs/dbraw/zinc/76/17/01/567761701.db2.gz BKLSCSSDVRLSPW-UHFFFAOYSA-N 0 1 383.857 3.139 10 0 GGAEMN CO[C@@H](CN1CCN(c2ccc(Br)cn2)CC1)c1ccccc1 ZINC000555012940 567762915 /nfs/dbraw/zinc/76/29/15/567762915.db2.gz UXLGAAMSDVREJE-KRWDZBQOSA-N 0 1 376.298 3.354 10 0 GGAEMN Fc1ccc(Br)c2nccc(NCCCCN3CCOCC3)c12 ZINC000443516362 567764321 /nfs/dbraw/zinc/76/43/21/567764321.db2.gz MRPAUTUTJDSWLT-UHFFFAOYSA-N 0 1 382.277 3.083 10 0 GGAEMN CCn1nc2c(cc1=O)CN(Cc1cc3cc(Br)ccc3o1)CC2 ZINC000667677500 567764344 /nfs/dbraw/zinc/76/43/44/567764344.db2.gz TZXLWCAZLUDMMQ-UHFFFAOYSA-N 0 1 388.265 3.330 10 0 GGAEMN CN1CCOC[C@H]1CN[C@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000624176050 567764597 /nfs/dbraw/zinc/76/45/97/567764597.db2.gz BCASRDXXAYTQNL-PBHICJAKSA-N 0 1 383.261 3.191 10 0 GGAEMN CC[C@@H]1CC[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598424837 567764653 /nfs/dbraw/zinc/76/46/53/567764653.db2.gz RAVURUFHVGRQQC-BXKDBHETSA-N 0 1 385.205 3.064 10 0 GGAEMN CC[C@H]1CC[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598424838 567764737 /nfs/dbraw/zinc/76/47/37/567764737.db2.gz RAVURUFHVGRQQC-CABZTGNLSA-N 0 1 385.205 3.064 10 0 GGAEMN C[C@@H](C(=O)Nc1nc2ccc(I)cc2[nH]1)C1CCOCC1 ZINC000598424170 567764828 /nfs/dbraw/zinc/76/48/28/567764828.db2.gz NSCUOVCUIQGLFA-SECBINFHSA-N 0 1 399.232 3.169 10 0 GGAEMN C[C@H](C(=O)Nc1nc2ccc(I)cc2[nH]1)C1CCOCC1 ZINC000598424171 567765261 /nfs/dbraw/zinc/76/52/61/567765261.db2.gz NSCUOVCUIQGLFA-VIFPVBQESA-N 0 1 399.232 3.169 10 0 GGAEMN CSCCCC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598422379 567765435 /nfs/dbraw/zinc/76/54/35/567765435.db2.gz CLZZYIKTHJLKJW-UHFFFAOYSA-N 0 1 375.235 3.249 10 0 GGAEMN O=C(CCC1CCOCC1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598423616 567765455 /nfs/dbraw/zinc/76/54/55/567765455.db2.gz MTMWUOQJHDQCFK-UHFFFAOYSA-N 0 1 399.232 3.313 10 0 GGAEMN COCCN1CCCN(C(=O)C(C)(C)c2ccc(Br)c(C)c2)CC1 ZINC000555050751 567765485 /nfs/dbraw/zinc/76/54/85/567765485.db2.gz QTFCKIGELWPYLH-UHFFFAOYSA-N 0 1 397.357 3.216 10 0 GGAEMN CN1CCOC[C@H]1CN[C@@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000624176051 567765668 /nfs/dbraw/zinc/76/56/68/567765668.db2.gz BCASRDXXAYTQNL-RHSMWYFYSA-N 0 1 383.261 3.191 10 0 GGAEMN CS[C@H](C)CC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598424987 567766017 /nfs/dbraw/zinc/76/60/17/567766017.db2.gz SQWPLLDLJLOYRI-SSDOTTSWSA-N 0 1 375.235 3.248 10 0 GGAEMN C[C@@H]1CC[C@@H](CCC(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598426158 567766051 /nfs/dbraw/zinc/76/60/51/567766051.db2.gz YGDHHTUPZXSIDL-KOLCDFICSA-N 0 1 399.232 3.454 10 0 GGAEMN O=C(Nc1nc2ccc(I)cc2[nH]1)C1(C(F)(F)F)CC1 ZINC000598425486 567766244 /nfs/dbraw/zinc/76/62/44/567766244.db2.gz VFKZWKCBNYPFBL-UHFFFAOYSA-N 0 1 395.122 3.449 10 0 GGAEMN C[C@@H]1CC[C@H](CCC(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598426159 567766309 /nfs/dbraw/zinc/76/63/09/567766309.db2.gz YGDHHTUPZXSIDL-MWLCHTKSSA-N 0 1 399.232 3.454 10 0 GGAEMN O=C(Nc1ccn(-c2ccc(Br)cc2)n1)c1cc(-c2ccoc2)n[nH]1 ZINC000647161268 567766434 /nfs/dbraw/zinc/76/64/34/567766434.db2.gz MPWHCFKAFHUNAI-UHFFFAOYSA-N 0 1 398.220 3.292 10 0 GGAEMN COC1(CC(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1 ZINC000598429609 567767435 /nfs/dbraw/zinc/76/74/35/567767435.db2.gz ZRQJJLVMVROYOV-UHFFFAOYSA-N 0 1 385.205 3.065 10 0 GGAEMN NS(=O)(=O)c1ccc(CN[C@@H]2CCc3c2cccc3Br)c(F)c1 ZINC000647180687 567767492 /nfs/dbraw/zinc/76/74/92/567767492.db2.gz PEYAAYBOLGSKPS-MRXNPFEDSA-N 0 1 399.285 3.013 10 0 GGAEMN C[C@@]1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CC1(F)F ZINC000598428458 567767498 /nfs/dbraw/zinc/76/74/98/567767498.db2.gz PEYGACDXYTWMRQ-NSHDSACASA-N 0 1 377.132 3.151 10 0 GGAEMN COCCC[C@@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428350 567767821 /nfs/dbraw/zinc/76/78/21/567767821.db2.gz NXPPJWDXQIFIPM-SECBINFHSA-N 0 1 387.221 3.169 10 0 GGAEMN NS(=O)(=O)c1ccc(CNC2CC(F)(c3cccc(Cl)c3)C2)c(F)c1 ZINC000647208161 567771708 /nfs/dbraw/zinc/77/17/08/567771708.db2.gz CUNZBXMHAVAZJE-UHFFFAOYSA-N 0 1 386.851 3.244 10 0 GGAEMN CN(C)c1ncc(CN[C@@H](CCO)c2cccc(OC(F)(F)F)c2)s1 ZINC000647236054 567772503 /nfs/dbraw/zinc/77/25/03/567772503.db2.gz QQKMFOTZHNRCSF-AWEZNQCLSA-N 0 1 375.416 3.321 10 0 GGAEMN C[C@@H](C(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)N1CCSCC1 ZINC000533548447 567774317 /nfs/dbraw/zinc/77/43/17/567774317.db2.gz AVPUISCJQPMAKL-BLLLJJGKSA-N 0 1 378.929 3.317 10 0 GGAEMN Cn1ncc2ccc(CNC(=O)c3cc(Br)cc4nc[nH]c43)cc21 ZINC000555230626 567775023 /nfs/dbraw/zinc/77/50/23/567775023.db2.gz MAAYGDCTMCNNQU-UHFFFAOYSA-N 0 1 384.237 3.142 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccc(F)cc1C(F)(F)F)C1CCOCC1 ZINC000647268111 567775454 /nfs/dbraw/zinc/77/54/54/567775454.db2.gz ROAVKPWCQAQUQN-AWEZNQCLSA-N 0 1 385.379 3.028 10 0 GGAEMN CCSc1cccc(F)c1NS(=O)(=O)C[C@H](OC)C1CCOCC1 ZINC000647276445 567776604 /nfs/dbraw/zinc/77/66/04/567776604.db2.gz GQTRIVXBRFUIEV-AWEZNQCLSA-N 0 1 377.503 3.121 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccc(Br)cc3)o2)C1 ZINC000574407392 567776918 /nfs/dbraw/zinc/77/69/18/567776918.db2.gz NQBPYRWWOGMLJN-KBPBESRZSA-N 0 1 395.253 3.168 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccc(Br)cc3)o2)C1 ZINC000574407394 567776944 /nfs/dbraw/zinc/77/69/44/567776944.db2.gz NQBPYRWWOGMLJN-UONOGXRCSA-N 0 1 395.253 3.168 10 0 GGAEMN C[C@@H](NCCNC(=O)c1cccc(Br)c1)c1cc2n(n1)CCCC2 ZINC000647292742 567777485 /nfs/dbraw/zinc/77/74/85/567777485.db2.gz CPPRGALXQLDXFG-CYBMUJFWSA-N 0 1 391.313 3.063 10 0 GGAEMN COC(=O)c1cccc(CS(=O)(=O)N[C@H](C(F)F)C2CCCCC2)c1 ZINC000598628966 567779693 /nfs/dbraw/zinc/77/96/93/567779693.db2.gz VZTZVAGTMZCDQW-HNNXBMFYSA-N 0 1 375.437 3.107 10 0 GGAEMN COC(=O)c1ccc(F)cc1S(=O)(=O)N[C@H](C(F)F)C1CCCCC1 ZINC000598628446 567779750 /nfs/dbraw/zinc/77/97/50/567779750.db2.gz NKVJDYDQLFLXQV-AWEZNQCLSA-N 0 1 379.400 3.105 10 0 GGAEMN Cn1cnc(CCCN[C@H](c2ccco2)c2ccc(Br)cc2)n1 ZINC000647327399 567779907 /nfs/dbraw/zinc/77/99/07/567779907.db2.gz ZZWDXSNBUKDJKO-KRWDZBQOSA-N 0 1 375.270 3.482 10 0 GGAEMN O=S1(=O)CC[C@H](NC[C@H]2CSc3ccccc3O2)c2cc(F)ccc21 ZINC000647314287 567779998 /nfs/dbraw/zinc/77/99/98/567779998.db2.gz BLMIYCOHFMGQLE-ZFWWWQNUSA-N 0 1 379.478 3.187 10 0 GGAEMN CCCN1CCN(c2nnc(-c3cc(Br)c[nH]3)n2CC(C)C)CC1 ZINC000555353857 567780065 /nfs/dbraw/zinc/78/00/65/567780065.db2.gz QILZIBOTIDMCQA-UHFFFAOYSA-N 0 1 395.349 3.224 10 0 GGAEMN O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1n[nH]c2ccc(Br)cc21 ZINC000533656348 567781192 /nfs/dbraw/zinc/78/11/92/567781192.db2.gz PXRGFIRVYLERAP-HFBAOOFYSA-N 0 1 390.281 3.403 10 0 GGAEMN C[C@H]1c2cccn2CCN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000443951176 567781491 /nfs/dbraw/zinc/78/14/91/567781491.db2.gz IZJMUESHAXKQTL-NSHDSACASA-N 0 1 386.249 3.309 10 0 GGAEMN CCn1cnc(S(=O)(=O)N[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1 ZINC000443962676 567782276 /nfs/dbraw/zinc/78/22/76/567782276.db2.gz JHSFEEGCMWPVCR-LBPRGKRZSA-N 0 1 385.770 3.277 10 0 GGAEMN Cc1occc1CN(C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444021616 567785850 /nfs/dbraw/zinc/78/58/50/567785850.db2.gz MKOORVDQWCVQFL-UHFFFAOYSA-N 0 1 375.222 3.464 10 0 GGAEMN COCC[C@H](Cc1cccc(Br)c1)C(=O)N1[C@H](C)CN(C)C[C@@H]1C ZINC000533778585 567786293 /nfs/dbraw/zinc/78/62/93/567786293.db2.gz YJPBXGKVBNZPIU-HLLBOEOZSA-N 0 1 397.357 3.195 10 0 GGAEMN Cc1cc(I)cc(C(=O)N2[C@H](C)CN(C)C[C@H]2C)c1C ZINC000533778676 567786362 /nfs/dbraw/zinc/78/63/62/567786362.db2.gz WVPAPKKMSJBCMY-VXGBXAGGSA-N 0 1 386.277 3.073 10 0 GGAEMN COCC[C@H](Cc1cccc(Br)c1)C(=O)N1[C@@H](C)CN(C)C[C@@H]1C ZINC000533778587 567786548 /nfs/dbraw/zinc/78/65/48/567786548.db2.gz YJPBXGKVBNZPIU-YQQAZPJKSA-N 0 1 397.357 3.195 10 0 GGAEMN COC(=O)c1c(F)ccc(NS(=O)(=O)c2cnc3ccsc3c2)c1C ZINC000574613064 567788237 /nfs/dbraw/zinc/78/82/37/567788237.db2.gz GBFXZXQBJXRQLX-UHFFFAOYSA-N 0 1 380.422 3.331 10 0 GGAEMN O=C(Nc1nc(-c2ccc[nH]2)cs1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000668018341 567789175 /nfs/dbraw/zinc/78/91/75/567789175.db2.gz IOHCTTKRWXODJP-VHSXEESVSA-N 0 1 375.372 3.061 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000668027378 567789806 /nfs/dbraw/zinc/78/98/06/567789806.db2.gz HZBQZMOSKGCPNK-PXAZEXFGSA-N 0 1 380.275 3.422 10 0 GGAEMN CCn1c(CNC(=O)[C@H]2CCCN2C2CC2)nc2cc(Br)ccc21 ZINC000555624422 567792555 /nfs/dbraw/zinc/79/25/55/567792555.db2.gz ZRTLFCAVKIZRCB-MRXNPFEDSA-N 0 1 391.313 3.062 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cc(Br)ccc2OC)[C@@H]1n1cccn1 ZINC000555646345 567793091 /nfs/dbraw/zinc/79/30/91/567793091.db2.gz VLFCRCAKLOXPQY-UAGQMJEPSA-N 0 1 380.286 3.163 10 0 GGAEMN COCCN(Cc1cc(Br)cs1)C(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000555634089 567793111 /nfs/dbraw/zinc/79/31/11/567793111.db2.gz HZWRPEPLRFGORO-CYBMUJFWSA-N 0 1 398.326 3.329 10 0 GGAEMN COc1ccccc1[C@@H](N)CNC(=O)[C@H]1CCc2cc(Br)ccc21 ZINC000647633770 567795070 /nfs/dbraw/zinc/79/50/70/567795070.db2.gz BORSCXPEPJXPKG-RDJZCZTQSA-N 0 1 389.293 3.304 10 0 GGAEMN Brc1cccc(N2CCN(Cc3ccnn3-c3ccncc3)CC2)c1 ZINC000668114709 567796926 /nfs/dbraw/zinc/79/69/26/567796926.db2.gz AQTWQXNUWUCHJI-UHFFFAOYSA-N 0 1 398.308 3.352 10 0 GGAEMN CO[C@H](C)CN(C(=O)c1c[nH]c2ccc(Br)cc2c1=O)C(C)C ZINC000444251903 567799090 /nfs/dbraw/zinc/79/90/90/567799090.db2.gz VPGLQDZMVYECGH-LLVKDONJSA-N 0 1 381.270 3.176 10 0 GGAEMN CC(C)OCCCN(C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444256394 567799296 /nfs/dbraw/zinc/79/92/96/567799296.db2.gz LCUQGVXBHADOMY-UHFFFAOYSA-N 0 1 381.270 3.178 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)c2c(F)cccc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000534083689 567799763 /nfs/dbraw/zinc/79/97/63/567799763.db2.gz IFQAVLFBLOOTFW-HOTGVXAUSA-N 0 1 386.851 3.342 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)[C@@H]2COC(C)(C)C2)c2cccs2)CC1 ZINC000624797027 567800849 /nfs/dbraw/zinc/80/08/49/567800849.db2.gz KZTJHKQYYIMEJR-JKSUJKDBSA-N 0 1 386.583 3.008 10 0 GGAEMN O=C(Nc1nc(-c2ccc3ccccc3n2)n[nH]1)c1ccc(Br)cn1 ZINC000647772062 567801153 /nfs/dbraw/zinc/80/11/53/567801153.db2.gz FMMXTZFQTRJCNJ-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN C[C@](CO)(NC(=O)c1n[nH]c2ccc(Br)cc21)C1CCCCC1 ZINC000444310581 567801292 /nfs/dbraw/zinc/80/12/92/567801292.db2.gz IBKOCWQBJTVOSE-QGZVFWFLSA-N 0 1 380.286 3.387 10 0 GGAEMN C[C@]1(CCCO)CCCN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444355709 567802838 /nfs/dbraw/zinc/80/28/38/567802838.db2.gz HLIYPDLAVPQLBD-GOSISDBHSA-N 0 1 393.281 3.058 10 0 GGAEMN NC(=O)[C@H](NC[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(Br)cc1 ZINC000574949184 567805670 /nfs/dbraw/zinc/80/56/70/567805670.db2.gz MJUFZZRLSAROTC-FGTMMUONSA-N 0 1 389.293 3.485 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@@H]2CCN(c3ccccc3Br)C2=O)n1 ZINC000574988988 567807266 /nfs/dbraw/zinc/80/72/66/567807266.db2.gz ZHVXBAAKXAKHQY-WCQYABFASA-N 0 1 393.285 3.399 10 0 GGAEMN Cc1cc(Br)ccc1CN[C@H](c1cnn(C)c1)C1(CO)CCC1 ZINC000647942868 567807572 /nfs/dbraw/zinc/80/75/72/567807572.db2.gz BRHIMINFQGDZHB-QGZVFWFLSA-N 0 1 378.314 3.485 10 0 GGAEMN Cn1cc([C@@H](NCc2ccc(Br)c(F)c2)C2(CO)CCC2)cn1 ZINC000647944916 567807623 /nfs/dbraw/zinc/80/76/23/567807623.db2.gz PLYOPDUABIWMLR-MRXNPFEDSA-N 0 1 382.277 3.315 10 0 GGAEMN CCOCC[C@@H](O)CN1CCC[C@H]1c1ccccc1I ZINC000444645871 567809507 /nfs/dbraw/zinc/80/95/07/567809507.db2.gz IHZNECXWKKOEGZ-CJNGLKHVSA-N 0 1 389.277 3.216 10 0 GGAEMN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1cc(OC(F)F)ccc1Br ZINC000648002409 567809537 /nfs/dbraw/zinc/80/95/37/567809537.db2.gz UUAJGIREIGUCMG-NXEZZACHSA-N 0 1 377.229 3.136 10 0 GGAEMN CCn1c(CNC[C@@H](O)CC(F)(F)F)nc2cc(Br)ccc21 ZINC000575053706 567810290 /nfs/dbraw/zinc/81/02/90/567810290.db2.gz VPOTUFQMWVLZRC-JTQLQIEISA-N 0 1 380.208 3.222 10 0 GGAEMN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1cc(OC(F)F)ccc1Br ZINC000648002411 567810825 /nfs/dbraw/zinc/81/08/25/567810825.db2.gz UUAJGIREIGUCMG-VHSXEESVSA-N 0 1 377.229 3.136 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@H](C)C(=O)NC(=O)NC(C)(C)C ZINC000444695636 567810869 /nfs/dbraw/zinc/81/08/69/567810869.db2.gz SPAVCPVTUUQEFP-GFCCVEGCSA-N 0 1 384.318 3.202 10 0 GGAEMN C[C@@]1(c2ccccc2)CC[C@H](N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)C1 ZINC000668469876 567811135 /nfs/dbraw/zinc/81/11/35/567811135.db2.gz MMTFVFYVRRZCNA-LUKYLMHMSA-N 0 1 375.456 3.404 10 0 GGAEMN CC1(C)CN(C[C@H](O)COc2c(Cl)cccc2Cl)C[C@@]2(CCOC2)O1 ZINC000575060240 567811200 /nfs/dbraw/zinc/81/12/00/567811200.db2.gz WTSSUXVLNUFOBC-SCLBCKFNSA-N 0 1 390.307 3.003 10 0 GGAEMN C[C@H](C(=O)Nc1nc(-c2ccccc2Br)n[nH]1)C1CCOCC1 ZINC000534432146 567811271 /nfs/dbraw/zinc/81/12/71/567811271.db2.gz ZHYQRSSBPSMAKG-JTQLQIEISA-N 0 1 379.258 3.235 10 0 GGAEMN CCN1CCCN(C(=O)c2c(F)c(F)c(Br)c(F)c2F)CC1 ZINC000668475218 567811768 /nfs/dbraw/zinc/81/17/68/567811768.db2.gz KVHDOLPFHGPOBQ-UHFFFAOYSA-N 0 1 383.183 3.173 10 0 GGAEMN Cc1ccc(Cl)c(OC[C@H](O)CN2CCC[C@H]([C@H](O)C(F)(F)F)C2)c1 ZINC000444727067 567811894 /nfs/dbraw/zinc/81/18/94/567811894.db2.gz PHNOFYWROKMVEN-ZENOOKHLSA-N 0 1 381.822 3.023 10 0 GGAEMN Cc1ccc2nc(NC(=O)CNC(=O)c3cccc(Br)c3)[nH]c2c1 ZINC000575081399 567812068 /nfs/dbraw/zinc/81/20/68/567812068.db2.gz UKVYLTWJQKSIBS-UHFFFAOYSA-N 0 1 387.237 3.002 10 0 GGAEMN C[C@@H](NC(=O)c1cccc(Br)c1O)c1ccc(-n2ccnn2)cc1 ZINC000534493044 567812754 /nfs/dbraw/zinc/81/27/54/567812754.db2.gz KUTXKYCFGLHGII-LLVKDONJSA-N 0 1 387.237 3.226 10 0 GGAEMN CN(C(=O)c1cc(-c2cccc(Br)c2)no1)[C@@H]1CN2CCC1CC2 ZINC000668588213 567814027 /nfs/dbraw/zinc/81/40/27/567814027.db2.gz GAQYCVLGUQTYRC-MRXNPFEDSA-N 0 1 390.281 3.270 10 0 GGAEMN C[C@H](NC(=O)[C@@H](N)c1cccc(Cl)c1)C1CCN(CC(F)(F)F)CC1 ZINC000648172128 567814410 /nfs/dbraw/zinc/81/44/10/567814410.db2.gz KODPGFZCNAGBBA-NHYWBVRUSA-N 0 1 377.838 3.119 10 0 GGAEMN Cc1ccc(-c2n[nH]c(SCc3cc(=O)n4nc(C5CC5)sc4n3)n2)cc1 ZINC000015731887 570223350 /nfs/dbraw/zinc/22/33/50/570223350.db2.gz HQKMJYLHLWJQQF-UHFFFAOYSA-N 0 1 396.501 3.414 10 0 GGAEMN Cc1ccc(CNC(=O)c2cncc(NS(=O)(=O)c3ccc(F)cc3)c2)cc1 ZINC000015778590 570243561 /nfs/dbraw/zinc/24/35/61/570243561.db2.gz MATTYWRPRAHFTG-UHFFFAOYSA-N 0 1 399.447 3.260 10 0 GGAEMN COCCN1CCCN(C(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)CC1 ZINC000048429028 570250759 /nfs/dbraw/zinc/25/07/59/570250759.db2.gz WWRDLHALSAWBTH-LJQANCHMSA-N 0 1 382.504 3.302 10 0 GGAEMN C[C@@H](CC(=O)NCCC1=CCCCC1)CC1=Nc2ccccc2S(=O)(=O)N1 ZINC000015826813 570267910 /nfs/dbraw/zinc/26/79/10/570267910.db2.gz YUUBMEHDHCHPNO-OAHLLOKOSA-N 0 1 389.521 3.432 10 0 GGAEMN O=C(CN1CCC[C@H](C(=O)Nc2ccccc2)C1)NCc1ccccc1Cl ZINC000012882797 570284019 /nfs/dbraw/zinc/28/40/19/570284019.db2.gz DWVZSBHBCXSGGR-KRWDZBQOSA-N 0 1 385.895 3.307 10 0 GGAEMN COc1ccccc1NC(=O)Cc1noc(CN2CC[C@H]3CCCC[C@H]3C2)n1 ZINC000248140698 570287529 /nfs/dbraw/zinc/28/75/29/570287529.db2.gz RPPFJUREURQDAI-CVEARBPZSA-N 0 1 384.480 3.272 10 0 GGAEMN O=C(CCN1CCN(c2ccc(C(F)(F)F)cn2)CC1)Nc1ccccc1F ZINC000012901065 570288124 /nfs/dbraw/zinc/28/81/24/570288124.db2.gz PMLKLTDFOIRHPS-UHFFFAOYSA-N 0 1 396.388 3.390 10 0 GGAEMN Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)Nc1ccc(F)cc1F ZINC000012901851 570288781 /nfs/dbraw/zinc/28/87/81/570288781.db2.gz KJAMQTGUXYCNIK-UHFFFAOYSA-N 0 1 375.350 3.463 10 0 GGAEMN C[C@H](C(=O)N1CCc2ccccc21)N1CCC(C(=O)N2CCCCCC2)CC1 ZINC000012903647 570289127 /nfs/dbraw/zinc/28/91/27/570289127.db2.gz DUXNVSWAUVANQD-GOSISDBHSA-N 0 1 383.536 3.079 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)CCCOc2ccc(C(C)(C)C)cc2)CC1 ZINC000186627328 570306291 /nfs/dbraw/zinc/30/62/91/570306291.db2.gz SLDHDRHGZIMJRC-UHFFFAOYSA-N 0 1 390.524 3.151 10 0 GGAEMN Cc1cc2occ(CC(=O)N3CCC([N@@H+](C)CC(=O)[O-])CC3)c2cc1C(C)C ZINC000186628981 570306721 /nfs/dbraw/zinc/30/67/21/570306721.db2.gz VRBAVZPYJSAXOT-UHFFFAOYSA-N 0 1 386.492 3.415 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2cc(C3CC3)nc3ccccc32)CC1 ZINC000186634890 570307674 /nfs/dbraw/zinc/30/76/74/570307674.db2.gz XVGYGGNWSMHRBD-UHFFFAOYSA-N 0 1 381.476 3.123 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000186636660 570307804 /nfs/dbraw/zinc/30/78/04/570307804.db2.gz SMPOHJSXEOKQCS-UHFFFAOYSA-N 0 1 382.460 3.490 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@@H](C)Oc2cccc(C(C)(C)C)c2)CC1 ZINC000186639707 570308058 /nfs/dbraw/zinc/30/80/58/570308058.db2.gz UHDQWBCJXRWTLI-MRXNPFEDSA-N 0 1 390.524 3.149 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CC1 ZINC000186650726 570309751 /nfs/dbraw/zinc/30/97/51/570309751.db2.gz YMKPDAUNKPQYRD-FVQBIDKESA-N 0 1 398.425 3.206 10 0 GGAEMN COc1ccc2sc(C(=O)N3CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC3)c(C)c2c1 ZINC000186664779 570310901 /nfs/dbraw/zinc/31/09/01/570310901.db2.gz AEKUWOJYMNJJHI-CQSZACIVSA-N 0 1 390.505 3.229 10 0 GGAEMN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N2CCC[C@H]([N@@H+](C)CC(=O)[O-])CC2)c1 ZINC000186667284 570311240 /nfs/dbraw/zinc/31/12/40/570311240.db2.gz OWDPMXRHQWQLDM-MSOLQXFVSA-N 0 1 390.524 3.283 10 0 GGAEMN CCC(=O)Nc1cc(C(=O)[O-])ccc1N1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000032947062 570323910 /nfs/dbraw/zinc/32/39/10/570323910.db2.gz JKQGZLQYKWOOMS-UHFFFAOYSA-N 0 1 385.439 3.195 10 0 GGAEMN Cc1ccccc1CN1CCN([C@H](C)C(=O)Nc2ccc(N(C)C)cc2)CC1 ZINC000022791756 570328181 /nfs/dbraw/zinc/32/81/81/570328181.db2.gz DOJUTIZEWDCVSI-LJQANCHMSA-N 0 1 380.536 3.206 10 0 GGAEMN O=C(CN1CCN(Cc2cccc3ccccc32)CC1)NCc1ccc(F)cc1 ZINC000022803214 570329233 /nfs/dbraw/zinc/32/92/33/570329233.db2.gz VHRWZRIXLLWIAR-UHFFFAOYSA-N 0 1 391.490 3.413 10 0 GGAEMN CCC(=O)N(Cc1c(C)nn(-c2ccccc2)c1N1CCN(CC)CC1)C1CC1 ZINC000034831238 570335397 /nfs/dbraw/zinc/33/53/97/570335397.db2.gz JPZTWUAAAVIBLN-UHFFFAOYSA-N 0 1 395.551 3.224 10 0 GGAEMN CCCC(=O)N(CCC)Cc1c(C)nn(-c2ccccc2)c1N1CCN(C)CC1 ZINC000034831199 570335520 /nfs/dbraw/zinc/33/55/20/570335520.db2.gz NGCZMLOUTBFLKO-UHFFFAOYSA-N 0 1 397.567 3.471 10 0 GGAEMN Cc1cccc(-n2nc(C(=O)N(C)[C@@H]3CCN(C)C3)nc2-c2ccccc2)c1 ZINC000034911000 570340856 /nfs/dbraw/zinc/34/08/56/570340856.db2.gz QWEWYUXAYXMCDO-LJQANCHMSA-N 0 1 375.476 3.019 10 0 GGAEMN Cc1cccc(CN2CCN(Cc3cc(=O)oc4c(C)c(O)ccc34)CC2)c1 ZINC000023084012 570343317 /nfs/dbraw/zinc/34/33/17/570343317.db2.gz QATRJHUUUGCJEU-UHFFFAOYSA-N 0 1 378.472 3.433 10 0 GGAEMN Cc1nc(C)n(C[C@@H]2CCC[N@@H+](C[C@@H]3CO[C@@H](c4ccc(Cl)cc4)O3)C2)n1 ZINC000222028632 570374574 /nfs/dbraw/zinc/37/45/74/570374574.db2.gz GMGJUBWBSBPKGX-NSISKUIASA-N 0 1 390.915 3.375 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)c2ccc3oc(CCCc4ccccc4)nc3c2)n1 ZINC000014971845 570374855 /nfs/dbraw/zinc/37/48/55/570374855.db2.gz CUXBSFHSVRIZQM-UHFFFAOYSA-N 0 1 389.459 3.402 10 0 GGAEMN CC1CCC(NC(=O)[C@H]2CCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)CC1 ZINC000035508235 570379559 /nfs/dbraw/zinc/37/95/59/570379559.db2.gz ALIFSZZOGRCNET-NXYGQSRBSA-N 0 1 395.507 3.019 10 0 GGAEMN CCOc1ccc(NC(=O)NCCc2n[nH]c(Cc3ccc(F)cc3)n2)cc1 ZINC000033062604 570400508 /nfs/dbraw/zinc/40/05/08/570400508.db2.gz JQWSUGKUBDWPCR-UHFFFAOYSA-N 0 1 383.427 3.298 10 0 GGAEMN COc1ccc2c(c1)CCc1c(C(=O)N3CCN(C4CCCCC4)CC3)[nH]nc1-2 ZINC000033265832 570403771 /nfs/dbraw/zinc/40/37/71/570403771.db2.gz HDPXJQJGMVMZHS-UHFFFAOYSA-N 0 1 394.519 3.274 10 0 GGAEMN Cc1cc(C)cc(C(=O)N2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)CC2)c1 ZINC000025222725 570408571 /nfs/dbraw/zinc/40/85/71/570408571.db2.gz XYXLKYSMDGVYOH-UHFFFAOYSA-N 0 1 388.471 3.292 10 0 GGAEMN C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000013011174 570416418 /nfs/dbraw/zinc/41/64/18/570416418.db2.gz QATGPTKAIIEIJL-LJQANCHMSA-N 0 1 395.503 3.036 10 0 GGAEMN C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000026356286 570424756 /nfs/dbraw/zinc/42/47/56/570424756.db2.gz IBROCDRJQGQQIF-QGZVFWFLSA-N 0 1 399.922 3.193 10 0 GGAEMN O=c1c2ccccc2cnn1CN1CCN(Cc2csc3ccccc23)CC1 ZINC000028707366 570463207 /nfs/dbraw/zinc/46/32/07/570463207.db2.gz IQUJLDKTNARPDU-UHFFFAOYSA-N 0 1 390.512 3.387 10 0 GGAEMN CCn1c2ccc(C(=O)Nc3nc(-c4ccc(C)cc4)n[nH]3)cc2nc(C)c1=O ZINC000028855599 570465219 /nfs/dbraw/zinc/46/52/19/570465219.db2.gz VHYBITLNAQMHIM-UHFFFAOYSA-N 0 1 388.431 3.071 10 0 GGAEMN COc1ccc(CCN(C)C(=O)CN(C)[C@@H]2CCc3ccccc32)cc1OC ZINC000029810825 570480227 /nfs/dbraw/zinc/48/02/27/570480227.db2.gz PPJFJYKVYNZGIQ-HXUWFJFHSA-N 0 1 382.504 3.324 10 0 GGAEMN CCOC(=O)C1=C(CN2CCCC[C@@H]2C)N(C)C(=O)N[C@@H]1c1cccc(C)c1 ZINC000035991680 570505639 /nfs/dbraw/zinc/50/56/39/570505639.db2.gz VGZPKLYCEBZRLV-OXJNMPFZSA-N 0 1 385.508 3.383 10 0 GGAEMN CCOC(=O)C1C(CNc2ccc(F)cc2F)=NC(=O)N[C@@H]1c1ccccc1 ZINC000020283313 570518013 /nfs/dbraw/zinc/51/80/13/570518013.db2.gz QIHURDHVQXJMJX-GOSISDBHSA-N 0 1 387.386 3.248 10 0 GGAEMN Cc1cccn2cc(CCNC(=O)c3ccc(CN4CCSCC4)cc3)nc12 ZINC000072309259 570530364 /nfs/dbraw/zinc/53/03/64/570530364.db2.gz XCFMIGVCDXDOGN-UHFFFAOYSA-N 0 1 394.544 3.164 10 0 GGAEMN CCN1CCN(Cc2nc3cc(NC(=O)c4ccccc4C)ccc3n2C)CC1 ZINC000022822154 570554189 /nfs/dbraw/zinc/55/41/89/570554189.db2.gz BZAHBZNUKJDPHJ-UHFFFAOYSA-N 0 1 391.519 3.272 10 0 GGAEMN O=C(NCc1cccc(C(F)(F)F)c1)c1nc[nH]c1C(=O)NC1CCCCC1 ZINC000033003650 570617684 /nfs/dbraw/zinc/61/76/84/570617684.db2.gz YKYJNTWNAYNKNK-UHFFFAOYSA-N 0 1 394.397 3.421 10 0 GGAEMN CC(C)CCNC(=O)c1[nH]cnc1C(=O)NCc1cccc(C(F)(F)F)c1 ZINC000033003925 570618049 /nfs/dbraw/zinc/61/80/49/570618049.db2.gz WAFSGXRENACDPU-UHFFFAOYSA-N 0 1 382.386 3.134 10 0 GGAEMN CCCNC(=O)CCCCn1c(=O)c2[nH]c3ccc(OC)cc3c2[nH]c1=S ZINC000013520183 570638493 /nfs/dbraw/zinc/63/84/93/570638493.db2.gz HBKBWJDCORBYLM-UHFFFAOYSA-N 0 1 388.493 3.245 10 0 GGAEMN Cc1c(C(=O)N(C)C2CCCCC2)sc2ncnc(N3CCN(C)CC3)c12 ZINC000033048196 570698218 /nfs/dbraw/zinc/69/82/18/570698218.db2.gz BLHSZVLZJJXLPA-UHFFFAOYSA-N 0 1 387.553 3.156 10 0 GGAEMN CCCn1c2ccc(NS(=O)(=O)c3cc(Cl)ccc3OC)cc2oc1=O ZINC000033048766 570699694 /nfs/dbraw/zinc/69/96/94/570699694.db2.gz DWJWUBDZKORWPT-UHFFFAOYSA-N 0 1 396.852 3.467 10 0 GGAEMN O=C(C1CCCC1)N1CCN(c2nc(CN3CCCCCC3)cs2)CC1 ZINC000065200319 570726899 /nfs/dbraw/zinc/72/68/99/570726899.db2.gz CUFXYSNXUDJCAY-UHFFFAOYSA-N 0 1 376.570 3.358 10 0 GGAEMN O=C(NC[C@H](c1ccco1)N1CCCC1)c1ccc(N2CCCCC2=O)cc1 ZINC000012984109 570736689 /nfs/dbraw/zinc/73/66/89/570736689.db2.gz QBZHTFMKJQODOI-LJQANCHMSA-N 0 1 381.476 3.363 10 0 GGAEMN Cc1ccc([C@@H](CN2CCOCC2)n2c(=O)c3ccccc3[nH]c2=S)cc1 ZINC000032751242 570791761 /nfs/dbraw/zinc/79/17/61/570791761.db2.gz UWHARHHWMURUCQ-LJQANCHMSA-N 0 1 381.501 3.289 10 0 GGAEMN COC1(c2nc(-c3cnccn3)no2)CCN(Cc2cccc(Cl)c2)CC1 ZINC000583615830 570800801 /nfs/dbraw/zinc/80/08/01/570800801.db2.gz AGJLCCPCDKDQEN-UHFFFAOYSA-N 0 1 385.855 3.318 10 0 GGAEMN C=CCCN1C(=O)NC(=Cc2c(CC)[nH]n(-c3cccc(Cl)c3)c2=O)C1=O ZINC000004354714 570833868 /nfs/dbraw/zinc/83/38/68/570833868.db2.gz SJRSMYFCSWVGIZ-WJDWOHSUSA-N 0 1 386.839 3.263 10 0 GGAEMN C[C@H](c1ccccc1)N1CC[C@@](F)(COC(=O)c2cnc3ccccn3c2=O)C1 ZINC000170595883 570853182 /nfs/dbraw/zinc/85/31/82/570853182.db2.gz USJMGWMYBNHPLP-ZHRRBRCNSA-N 0 1 395.434 3.027 10 0 GGAEMN CCn1c(CN2CCN(CC)CC2)nc2cc(NC(=O)c3ccccc3)ccc21 ZINC000022936169 570857849 /nfs/dbraw/zinc/85/78/49/570857849.db2.gz JXXNPXJRPJFAGU-UHFFFAOYSA-N 0 1 391.519 3.446 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NC(=O)NCCOc2ccc(C)cc2C)c1 ZINC000032865790 570863077 /nfs/dbraw/zinc/86/30/77/570863077.db2.gz SKVVCWAFKVAWSW-UHFFFAOYSA-N 0 1 392.477 3.003 10 0 GGAEMN CC(C)(C)C(=O)COC(=O)c1ccccc1NS(=O)(=O)c1ccccc1 ZINC000012560693 570864555 /nfs/dbraw/zinc/86/45/55/570864555.db2.gz YJHHYPWAWTZAPT-UHFFFAOYSA-N 0 1 375.446 3.259 10 0 GGAEMN O=C(c1ccc(N2CCN(Cc3ccccc3)CC2)nn1)N1CCc2ccccc21 ZINC000033257922 570864623 /nfs/dbraw/zinc/86/46/23/570864623.db2.gz RGFXWAMSPZPKFD-UHFFFAOYSA-N 0 1 399.498 3.002 10 0 GGAEMN O=C(NC[C@@H](c1c(F)cccc1Cl)N1CCCC1)[C@H]1CCCN1C1CC1 ZINC000170615870 570873349 /nfs/dbraw/zinc/87/33/49/570873349.db2.gz ICACSGIKIKKWSI-MSOLQXFVSA-N 0 1 379.907 3.359 10 0 GGAEMN C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[C@H]2CCCC[C@@H]2C1 ZINC000103288631 570880579 /nfs/dbraw/zinc/88/05/79/570880579.db2.gz UUXMTJVRWVBWBJ-MGPQQGTHSA-N 0 1 375.538 3.175 10 0 GGAEMN C[C@H](NC(=O)CSc1nc(N)cc(N)n1)c1ccc(-c2ccccc2)cc1 ZINC000012608504 570889566 /nfs/dbraw/zinc/88/95/66/570889566.db2.gz WIUHTYXYZLWDPN-ZDUSSCGKSA-N 0 1 379.489 3.278 10 0 GGAEMN C[C@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@@H](C)C1 ZINC000104216506 570897677 /nfs/dbraw/zinc/89/76/77/570897677.db2.gz PCJRGBRXXORJRI-ZIAGYGMSSA-N 0 1 385.430 3.223 10 0 GGAEMN Cc1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2cc(-c3ccncc3)[nH]n2)C1 ZINC000085690501 570902998 /nfs/dbraw/zinc/90/29/98/570902998.db2.gz HDIFAYAWEAKLBX-KRWDZBQOSA-N 0 1 389.459 3.271 10 0 GGAEMN COc1cn(CC(=O)Nc2cccc(C)c2C)c(CN2CCC(C)CC2)cc1=O ZINC000017135670 570928592 /nfs/dbraw/zinc/92/85/92/570928592.db2.gz LBTDJPQKGRTXKV-UHFFFAOYSA-N 0 1 397.519 3.344 10 0 GGAEMN Cc1nnc(SCc2noc(CCC(=O)Nc3ccc(C)c(Cl)c3)n2)[nH]1 ZINC000033270782 570947066 /nfs/dbraw/zinc/94/70/66/570947066.db2.gz RADKFECDCDMZLC-UHFFFAOYSA-N 0 1 392.872 3.322 10 0 GGAEMN Cc1n[nH]c(SCc2noc(CCC(=O)Nc3ccc(C)c(Cl)c3)n2)n1 ZINC000033270782 570947070 /nfs/dbraw/zinc/94/70/70/570947070.db2.gz RADKFECDCDMZLC-UHFFFAOYSA-N 0 1 392.872 3.322 10 0 GGAEMN CCOC(=O)c1ccc(OC[C@@H](O)CN2CCc3sccc3[C@H]2C)cc1 ZINC000252444439 570957694 /nfs/dbraw/zinc/95/76/94/570957694.db2.gz BWAJFVFSQPXYEZ-ZBFHGGJFSA-N 0 1 375.490 3.284 10 0 GGAEMN O=C(CN1CCC[C@H]1Cc1cccc(F)c1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000106569486 570965020 /nfs/dbraw/zinc/96/50/20/570965020.db2.gz COYOGQYZBOFXBL-REWPJTCUSA-N 0 1 395.522 3.475 10 0 GGAEMN C[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)CC[N@H+]1CCC(=O)[O-] ZINC000725240448 570974487 /nfs/dbraw/zinc/97/44/87/570974487.db2.gz HCAXGVPGTNTFKJ-INIZCTEOSA-N 0 1 394.471 3.416 10 0 GGAEMN O=C([O-])C[N@H+]1CCC[C@@H](CNC(=O)OCC2c3ccccc3-c3ccccc32)C1 ZINC000725240576 570974967 /nfs/dbraw/zinc/97/49/67/570974967.db2.gz OOCUYEAJEQECMM-INIZCTEOSA-N 0 1 394.471 3.322 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCN1C[C@H](C)O ZINC000108096387 570982843 /nfs/dbraw/zinc/98/28/43/570982843.db2.gz BZHPCWHKQXLQCJ-WMZOPIPTSA-N 0 1 384.480 3.183 10 0 GGAEMN O=C(NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1)C1(c2ccc(F)cc2)CCCC1 ZINC000108143950 570984592 /nfs/dbraw/zinc/98/45/92/570984592.db2.gz XHIDGBOSWSKYDQ-FCHUYYIVSA-N 0 1 396.506 3.389 10 0 GGAEMN Cc1ccc(S(C)(=O)=O)cc1NC(=O)CNCc1ccc(C(C)(C)C)cc1 ZINC000084185781 571007911 /nfs/dbraw/zinc/00/79/11/571007911.db2.gz CEPCYARZJGBAHE-UHFFFAOYSA-N 0 1 388.533 3.424 10 0 GGAEMN Cc1ccc([C@H](C)CCN2CCn3nc(CCC(=O)N4CCCC4)cc3C2)o1 ZINC000091486831 571011142 /nfs/dbraw/zinc/01/11/42/571011142.db2.gz BIGLTDCKJCCOPO-QGZVFWFLSA-N 0 1 384.524 3.349 10 0 GGAEMN O=C(c1cc(-c2ccccc2)[nH]n1)N1CCN(C(=O)c2ccccc2Cl)CC1 ZINC000015680756 571044987 /nfs/dbraw/zinc/04/49/87/571044987.db2.gz DAGMPCHLIKKKCT-UHFFFAOYSA-N 0 1 394.862 3.328 10 0 GGAEMN CSc1nn2c(nc(CN3CCC[C@](C)(c4ccccc4)C3)cc2=O)s1 ZINC000095497748 571074908 /nfs/dbraw/zinc/07/49/08/571074908.db2.gz KAPCVZSJFVNWIL-IBGZPJMESA-N 0 1 386.546 3.427 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)Cc2c(F)ccc(Br)c2F)[nH]n1 ZINC000506999942 650452805 /nfs/dbraw/zinc/45/28/05/650452805.db2.gz FZAJIEMNQUNLGJ-UHFFFAOYSA-N 0 1 396.195 3.032 10 0 GGAEMN CC(C)[NH2+]CC[N-]S(=O)(=O)c1c(Cl)cc(Br)cc1Cl ZINC000054266739 1406672759 /nfs/dbraw/zinc/67/27/59/1406672759.db2.gz MJVPXPZQBCEUGR-UHFFFAOYSA-N 0 1 390.130 3.032 10 0 GGAEMN COc1ccc([C@@H](CNC(=O)N2CCO[C@@H]3CCC[C@@H]32)N2CCCCC2)cc1 ZINC000054541142 1406765406 /nfs/dbraw/zinc/76/54/06/1406765406.db2.gz BQWBHJDVZKWJES-PWRODBHTSA-N 0 1 387.524 3.185 10 0 GGAEMN COc1cccc(CNCc2cccc(NS(C)(=O)=O)c2)c1OC(C)C ZINC000055373377 1406941526 /nfs/dbraw/zinc/94/15/26/1406941526.db2.gz HNLQYUZMHKQQCR-UHFFFAOYSA-N 0 1 378.494 3.144 10 0 GGAEMN COc1ccc(CNCc2cccc(NS(C)(=O)=O)c2)cc1OCC(C)C ZINC000055373361 1406941996 /nfs/dbraw/zinc/94/19/96/1406941996.db2.gz BVZWKWIZGGXFKC-UHFFFAOYSA-N 0 1 392.521 3.391 10 0 GGAEMN COc1cc2ncc(C(=O)c3ccccc3)c(N3CCOCC3)c2cc1OC ZINC000002713571 1398318044 /nfs/dbraw/zinc/31/80/44/1398318044.db2.gz SFDCBXMUZXZXLL-UHFFFAOYSA-N 0 1 378.428 3.320 10 0 GGAEMN Cc1ccc(NC(=S)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)cc1 ZINC000003310287 1398333285 /nfs/dbraw/zinc/33/32/85/1398333285.db2.gz UCMNOBKXGMAZOC-UHFFFAOYSA-N 0 1 399.501 3.395 10 0 GGAEMN CCOC(=O)c1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1 ZINC000006858487 1398568666 /nfs/dbraw/zinc/56/86/66/1398568666.db2.gz SKUCICOGISCWED-UHFFFAOYSA-N 0 1 375.233 3.366 10 0 GGAEMN COc1ccc(C(=O)C2CCN(C[C@@H](O)COc3ccc(C)cc3)CC2)cc1 ZINC000014327859 1399099288 /nfs/dbraw/zinc/09/92/88/1399099288.db2.gz RBXDUQONWMMCNT-HXUWFJFHSA-N 0 1 383.488 3.338 10 0 GGAEMN Cc1ccc(NC(=S)N(CCCN2CCN(C)CC2)Cc2ccco2)cc1 ZINC000020107799 1399341930 /nfs/dbraw/zinc/34/19/30/1399341930.db2.gz YZBHKJJKYFCCJO-UHFFFAOYSA-N 0 1 386.565 3.425 10 0 GGAEMN Cc1ccccc1NC(=S)N(CCCN1CCN(C)CC1)Cc1ccco1 ZINC000020107604 1399342121 /nfs/dbraw/zinc/34/21/21/1399342121.db2.gz XBWFOFNPGIBXPN-UHFFFAOYSA-N 0 1 386.565 3.425 10 0 GGAEMN CCOC(=O)C1=C(CN2CCc3ccccc32)NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020560208 1399348784 /nfs/dbraw/zinc/34/87/84/1399348784.db2.gz METKGMVNWKIDHS-OAQYLSRUSA-N 0 1 391.471 3.229 10 0 GGAEMN CCOC(=O)C1C(CN2C[C@H](C)C[C@@H](C)C2)=NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020560268 1399349612 /nfs/dbraw/zinc/34/96/12/1399349612.db2.gz JOAZBEZPXLZMIT-JXXFODFXSA-N 0 1 385.508 3.144 10 0 GGAEMN CCCn1c(CN2CCN(CC)CC2)nc2cc(NC(=O)c3ccco3)ccc21 ZINC000020678048 1399352309 /nfs/dbraw/zinc/35/23/09/1399352309.db2.gz YINOOWCGWPBRFE-UHFFFAOYSA-N 0 1 395.507 3.429 10 0 GGAEMN COc1ccc(-c2cnc(C)o2)cc1S(=O)(=O)Nc1ccc2c(c1)OCO2 ZINC000021033229 1399361409 /nfs/dbraw/zinc/36/14/09/1399361409.db2.gz FLEZFUPDCQJCHI-UHFFFAOYSA-N 0 1 388.401 3.188 10 0 GGAEMN Cc1[nH]ncc1CNC(=O)CSc1ncnc2c1sc1cccc(F)c12 ZINC000021153405 1399367234 /nfs/dbraw/zinc/36/72/34/1399367234.db2.gz AZDRLWZRRZRHKD-UHFFFAOYSA-N 0 1 387.465 3.424 10 0 GGAEMN CC[C@H](SC1=Nc2ccccc2S(=O)(=O)N1)C(=O)Nc1ccccc1F ZINC000021661405 1399398977 /nfs/dbraw/zinc/39/89/77/1399398977.db2.gz MVZXMQLJYZZSAP-AWEZNQCLSA-N 0 1 393.465 3.446 10 0 GGAEMN CC[C@@H](SC1=Nc2ccccc2S(=O)(=O)N1)C(=O)Nc1ccccc1F ZINC000021661403 1399399090 /nfs/dbraw/zinc/39/90/90/1399399090.db2.gz MVZXMQLJYZZSAP-CQSZACIVSA-N 0 1 393.465 3.446 10 0 GGAEMN CCCN1CCN(c2nc3c(cnn3C)c(NCc3ccc(Cl)cc3)n2)CC1 ZINC000021929288 1399424770 /nfs/dbraw/zinc/42/47/70/1399424770.db2.gz AOWDKSGHPUCIBU-UHFFFAOYSA-N 0 1 399.930 3.161 10 0 GGAEMN CN(C)[C@@H](CNC(=O)/C=C/c1ccc(N2CCCC2=O)cc1)c1cccc(F)c1 ZINC000022312737 1399454536 /nfs/dbraw/zinc/45/45/36/1399454536.db2.gz LCLIKOPIBQIIIQ-BGVYSJOJSA-N 0 1 395.478 3.385 10 0 GGAEMN COc1ccc2c(c1)CC[N@H+](Cc1ccccc1-c1nc(C)c(F)c(=O)[n-]1)C2 ZINC000023214537 1399540363 /nfs/dbraw/zinc/54/03/63/1399540363.db2.gz UYEBDCFMFSOGNS-UHFFFAOYSA-N 0 1 379.435 3.451 10 0 GGAEMN C[N@@H+](Cc1cccc(-c2nc([C@@H]3CCCO3)cc(=O)[n-]2)c1)CC1CCOCC1 ZINC000023619888 1399575074 /nfs/dbraw/zinc/57/50/74/1399575074.db2.gz UPYUNFZEUAUBAN-FQEVSTJZSA-N 0 1 383.492 3.147 10 0 GGAEMN C[N@H+](Cc1cccc(-c2nc([C@@H]3CCCO3)cc(=O)[n-]2)c1)CC1CCOCC1 ZINC000023619888 1399575080 /nfs/dbraw/zinc/57/50/80/1399575080.db2.gz UPYUNFZEUAUBAN-FQEVSTJZSA-N 0 1 383.492 3.147 10 0 GGAEMN O[C@H](COCc1ccccc1)CN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000026780695 1399933162 /nfs/dbraw/zinc/93/31/62/1399933162.db2.gz KBWKNPZMLATSGG-FQEVSTJZSA-N 0 1 394.437 3.405 10 0 GGAEMN COC(=O)c1ccc(C)c(S(=O)(=O)Nc2cc(Cl)ccc2C(=O)OC)c1 ZINC000028197908 1400138805 /nfs/dbraw/zinc/13/88/05/1400138805.db2.gz PUFFGQKUHHIWNN-UHFFFAOYSA-N 0 1 397.836 3.022 10 0 GGAEMN CCOc1cc(CN[C@H](C)C(=O)NCc2ccccc2)ccc1OC(F)F ZINC000056187776 1407246072 /nfs/dbraw/zinc/24/60/72/1407246072.db2.gz DPNVPKUJWDHLRO-CQSZACIVSA-N 0 1 378.419 3.481 10 0 GGAEMN O=C(Nc1cccc(CNCc2ccc(-n3cncn3)c(F)c2)c1)C1CCC1 ZINC000045822658 1404215660 /nfs/dbraw/zinc/21/56/60/1404215660.db2.gz FGHMCLVGNPWJIU-UHFFFAOYSA-N 0 1 379.439 3.435 10 0 GGAEMN CCOc1ccc(OC[C@H](O)CN2CCN(c3cccc(Cl)c3)CC2)cc1 ZINC000046345944 1404375640 /nfs/dbraw/zinc/37/56/40/1404375640.db2.gz GYMMHFNMVCMMRA-LJQANCHMSA-N 0 1 390.911 3.301 10 0 GGAEMN O=C(NCc1cnn(Cc2ccccc2)c1)c1ccc2c(=O)[nH]c(=S)[nH]c2c1 ZINC000047186482 1404738431 /nfs/dbraw/zinc/73/84/31/1404738431.db2.gz AKOCQHQMBFPICP-UHFFFAOYSA-N 0 1 391.456 3.173 10 0 GGAEMN Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(Br)cc1F ZINC000047329264 1404807797 /nfs/dbraw/zinc/80/77/97/1404807797.db2.gz CFCUOSNCUYFIHT-UHFFFAOYSA-N 0 1 382.642 3.084 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)NC[C@H](c2ccco2)N2CCCC2)c(OC)c1 ZINC000047871596 1404978294 /nfs/dbraw/zinc/97/82/94/1404978294.db2.gz FEKRZHIERXMBQN-CRAIPNDOSA-N 0 1 387.480 3.494 10 0 GGAEMN C[C@@H](NCc1cccc2c1OCCCO2)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000048744925 1405278361 /nfs/dbraw/zinc/27/83/61/1405278361.db2.gz BQOKOPGPKHGRDE-MRXNPFEDSA-N 0 1 396.487 3.356 10 0 GGAEMN CN(C)C(=O)COc1cccc(CNCc2cnn(-c3ccc(Cl)cc3)c2)c1 ZINC000048745732 1405279402 /nfs/dbraw/zinc/27/94/02/1405279402.db2.gz BTQAJMNJKQLIIL-UHFFFAOYSA-N 0 1 398.894 3.283 10 0 GGAEMN CN(C)C(=O)COc1cccc(CNCc2ccccc2Br)c1 ZINC000048745643 1405280001 /nfs/dbraw/zinc/28/00/01/1405280001.db2.gz DPDLKCQTTAUOEN-UHFFFAOYSA-N 0 1 377.282 3.206 10 0 GGAEMN COc1cccc(-c2n[nH]cc2CNCc2ccc(OC)c(OC)c2OC)c1 ZINC000048747771 1405281398 /nfs/dbraw/zinc/28/13/98/1405281398.db2.gz CURZBEPDWHOQGY-UHFFFAOYSA-N 0 1 383.448 3.401 10 0 GGAEMN CN(Cc1ccccc1)C(=O)CNCc1ccc(OCc2ccncc2)cc1 ZINC000048777323 1405287667 /nfs/dbraw/zinc/28/76/67/1405287667.db2.gz GHWNZHNBFQZKPQ-UHFFFAOYSA-N 0 1 375.472 3.409 10 0 GGAEMN CN(Cc1ccccc1)C(=O)CNCc1ccccc1OCc1ccccn1 ZINC000048777273 1405288245 /nfs/dbraw/zinc/28/82/45/1405288245.db2.gz BWBKPZPZDRYCBY-UHFFFAOYSA-N 0 1 375.472 3.409 10 0 GGAEMN CCN(CC(=O)NCc1cccs1)C(=O)CN[C@H](C)c1ccc(Cl)cc1 ZINC000057590777 1407661070 /nfs/dbraw/zinc/66/10/70/1407661070.db2.gz AOADLFJXESMTMW-CQSZACIVSA-N 0 1 393.940 3.217 10 0 GGAEMN CC(C)c1ccc(CCNC(=O)NC[C@@H](O)CN2CCc3ccccc3C2)cc1 ZINC000061953981 1408193029 /nfs/dbraw/zinc/19/30/29/1408193029.db2.gz HJNNDQIZZOPHRQ-HSZRJFAPSA-N 0 1 395.547 3.071 10 0 GGAEMN CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccc(-c4ccccc4)nc3)ccc21 ZINC000062545953 1408275847 /nfs/dbraw/zinc/27/58/47/1408275847.db2.gz YWBMQRBWVOBWAG-UHFFFAOYSA-N 0 1 393.468 3.458 10 0 GGAEMN COc1ccc(N)c(NS(=O)(=O)c2ccc(Br)cc2Cl)c1 ZINC000063212803 1408317408 /nfs/dbraw/zinc/31/74/08/1408317408.db2.gz DKRVVASVLUSXQC-UHFFFAOYSA-N 0 1 391.674 3.494 10 0 GGAEMN Cc1nn(-c2ccccc2Cl)c2sc(C(=O)NNC(=O)NC(C)C)cc12 ZINC000063270111 1408327363 /nfs/dbraw/zinc/32/73/63/1408327363.db2.gz FWYJMBIEAKAPEZ-UHFFFAOYSA-N 0 1 391.884 3.401 10 0 GGAEMN COC(=O)c1cccc(OCCN2CCCC[C@H]2CNC(=O)OC(C)(C)C)c1 ZINC000065237111 1408655712 /nfs/dbraw/zinc/65/57/12/1408655712.db2.gz CDUBYNQDPHJTSH-KRWDZBQOSA-N 0 1 392.496 3.231 10 0 GGAEMN COc1ccc(-c2n[nH]cc2CNCc2cccc(C(=O)NC3CC3)c2)cc1 ZINC000065980533 1408766571 /nfs/dbraw/zinc/76/65/71/1408766571.db2.gz GZNWMXHQRIXKOM-UHFFFAOYSA-N 0 1 376.460 3.267 10 0 GGAEMN CC[C@@H](C)NC(=O)[C@@H](C)NCc1cc(Br)c2c(c1)OCCCO2 ZINC000065981738 1408767277 /nfs/dbraw/zinc/76/72/77/1408767277.db2.gz FHVSUQJOVIAHAY-VXGBXAGGSA-N 0 1 385.302 3.003 10 0 GGAEMN C[C@H](N[C@@H](C)c1ccccc1C(F)(F)F)C(=O)NC(=O)NCC(F)(F)F ZINC000066391043 1408828658 /nfs/dbraw/zinc/82/86/58/1408828658.db2.gz BJWLFEYUGZSUER-IUCAKERBSA-N 0 1 385.308 3.133 10 0 GGAEMN CC[C@@H](C)NC(=O)c1cccc(CNCc2ccccc2N2CCOCC2)c1 ZINC000066973311 1408969275 /nfs/dbraw/zinc/96/92/75/1408969275.db2.gz CDTUXOVNXHNNNE-GOSISDBHSA-N 0 1 381.520 3.341 10 0 GGAEMN COc1cc([C@H](C)NCc2cn(-c3ccccc3)nc2C)ccc1OCCO ZINC000067449470 1409121327 /nfs/dbraw/zinc/12/13/27/1409121327.db2.gz DOQGJBCGWDHEOB-INIZCTEOSA-N 0 1 381.476 3.411 10 0 GGAEMN O=C(c1ccc(NS(=O)(=O)c2cccc3ccccc32)cc1)N1CCOCC1 ZINC000176639993 1428387950 /nfs/dbraw/zinc/38/79/50/1428387950.db2.gz JZQKKPGZGQBBMN-UHFFFAOYSA-N 0 1 396.468 3.113 10 0 GGAEMN CCCOc1cc(CNCc2ccc(N3CCO[C@@H](C)C3)nc2)ccc1OC ZINC000067669252 1409203223 /nfs/dbraw/zinc/20/32/23/1409203223.db2.gz HBKHXXORGZUCKM-KRWDZBQOSA-N 0 1 385.508 3.394 10 0 GGAEMN COc1cc(CNCc2ccc(OCC(F)(F)F)nc2)cc(OC)c1OC ZINC000067669890 1409204212 /nfs/dbraw/zinc/20/42/12/1409204212.db2.gz HJBZWHMSHDMJPO-UHFFFAOYSA-N 0 1 386.370 3.338 10 0 GGAEMN CCOc1c(Br)cc(CN[C@@H](C)C(=O)N[C@@H](C)CC)cc1OC ZINC000068366997 1409381372 /nfs/dbraw/zinc/38/13/72/1409381372.db2.gz HKKDXRPZDCWETQ-RYUDHWBXSA-N 0 1 387.318 3.249 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Nc2cc3c(cc2Cl)OCCO3)c2ccccc2)n[nH]1 ZINC000069256639 1409596221 /nfs/dbraw/zinc/59/62/21/1409596221.db2.gz LNTKXOQIOIZRNN-KRWDZBQOSA-N 0 1 399.838 3.449 10 0 GGAEMN FC(F)(F)c1ccc(-c2noc(CN3CCN([C@H]4CCSC4)CC3)n2)cc1 ZINC000079025744 1409951313 /nfs/dbraw/zinc/95/13/13/1409951313.db2.gz CLYPVXSEYYANAD-HNNXBMFYSA-N 0 1 398.454 3.379 10 0 GGAEMN Nc1ccc(S(=O)(=O)Nc2nc3ccc(Br)cc3s2)cc1 ZINC000090599713 1410065957 /nfs/dbraw/zinc/06/59/57/1410065957.db2.gz DODCAGVHCBHWQL-UHFFFAOYSA-N 0 1 384.280 3.442 10 0 GGAEMN O=C(c1ccc(Cl)cc1)N1CCCN(Cc2ccc(-n3cncn3)cc2)CC1 ZINC000092453241 1410158408 /nfs/dbraw/zinc/15/84/08/1410158408.db2.gz WHSVHAXSSXKIQE-UHFFFAOYSA-N 0 1 395.894 3.269 10 0 GGAEMN COc1ccc(CN2CCCN(Cc3cscn3)CC2)cc1OC(F)F ZINC000093016114 1410216274 /nfs/dbraw/zinc/21/62/74/1410216274.db2.gz CGLLJNAVHUPPFR-UHFFFAOYSA-N 0 1 383.464 3.461 10 0 GGAEMN O=C(NC[C@H]1C[C@H](O)CN1Cc1ccccc1)C1(c2ccc(F)cc2)CCCC1 ZINC000095446276 1410311510 /nfs/dbraw/zinc/31/15/10/1410311510.db2.gz XHIDGBOSWSKYDQ-YADHBBJMSA-N 0 1 396.506 3.389 10 0 GGAEMN Cc1ccc(-n2ncc(N3CC[C@H]4CCN(C)C[C@@H]43)c(Cl)c2=O)cc1Cl ZINC000095466026 1410312529 /nfs/dbraw/zinc/31/25/29/1410312529.db2.gz MGOCXZHGDPTDFU-DYVFJYSZSA-N 0 1 393.318 3.378 10 0 GGAEMN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)[C@H]3C[C@@H]3c3nc[nH]n3)CC2)cc1 ZINC000095465163 1410312584 /nfs/dbraw/zinc/31/25/84/1410312584.db2.gz IUXUZYFGODYFFA-OALUTQOASA-N 0 1 380.492 3.228 10 0 GGAEMN Cc1ccc(-n2ncc(N3CC[C@@H]4CCN(C)C[C@@H]43)c(Cl)c2=O)cc1Cl ZINC000095466027 1410312790 /nfs/dbraw/zinc/31/27/90/1410312790.db2.gz MGOCXZHGDPTDFU-GUYCJALGSA-N 0 1 393.318 3.378 10 0 GGAEMN CC[N@H+](CC(=O)NCc1ccc(C(=O)[O-])c(OC)c1)Cc1ccc(Cl)cc1 ZINC000095463937 1410312880 /nfs/dbraw/zinc/31/28/80/1410312880.db2.gz FWNCAVFOOANGOK-UHFFFAOYSA-N 0 1 390.867 3.185 10 0 GGAEMN CC[N@@H+](CC(=O)NCc1ccc(C(=O)[O-])c(OC)c1)Cc1ccc(Cl)cc1 ZINC000095463937 1410312884 /nfs/dbraw/zinc/31/28/84/1410312884.db2.gz FWNCAVFOOANGOK-UHFFFAOYSA-N 0 1 390.867 3.185 10 0 GGAEMN O=C(Nc1cc(F)ccc1-n1cccn1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000095980559 1410318367 /nfs/dbraw/zinc/31/83/67/1410318367.db2.gz OHJXMCQAOVFLPK-CQSZACIVSA-N 0 1 395.442 3.418 10 0 GGAEMN C[C@H](CS(=O)(=O)c1ccccc1)N[C@@H](Cc1nccn1C)c1ccccc1 ZINC000095986459 1410318389 /nfs/dbraw/zinc/31/83/89/1410318389.db2.gz SJRQXUMPXCMFDE-XLIONFOSSA-N 0 1 383.517 3.156 10 0 GGAEMN CCNC(=O)Nc1c[nH]nc1[C@@H]1CCCN(Cc2ccc(OC)c(F)c2)C1 ZINC000096000022 1410320236 /nfs/dbraw/zinc/32/02/36/1410320236.db2.gz JCWHRUVYIVTJKG-CQSZACIVSA-N 0 1 375.448 3.078 10 0 GGAEMN COc1ccc(C(=O)Nc2c[nH]nc2[C@H]2CCCN(Cc3ccccn3)C2)cc1 ZINC000096000190 1410320752 /nfs/dbraw/zinc/32/07/52/1410320752.db2.gz RHNMLVVCBDDTDK-KRWDZBQOSA-N 0 1 391.475 3.445 10 0 GGAEMN Cc1[nH]c(SCCc2c(C)nc3[nH]cnn3c2=O)nc1Cc1ccccc1 ZINC000096010357 1410322222 /nfs/dbraw/zinc/32/22/22/1410322222.db2.gz KGYLOZBJPYHZHP-UHFFFAOYSA-N 0 1 380.477 3.095 10 0 GGAEMN O=C(Nc1ccccc1)N1CCC2(CC1)COCCN(Cc1cccnc1)C2 ZINC000096078193 1410322753 /nfs/dbraw/zinc/32/27/53/1410322753.db2.gz UZQTWQWSRXRUSD-UHFFFAOYSA-N 0 1 380.492 3.228 10 0 GGAEMN COc1ccccc1[C@H](C)N[C@H](C)C(=O)N1CCN(Cc2ccccc2)CC1 ZINC000096178651 1410325225 /nfs/dbraw/zinc/32/52/25/1410325225.db2.gz ILXNTVCVEYRCIO-RBUKOAKNSA-N 0 1 381.520 3.079 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nc(C)no2)cc1 ZINC000096379745 1410329692 /nfs/dbraw/zinc/32/96/92/1410329692.db2.gz ZEUJZNBDFIVIQA-UHFFFAOYSA-N 0 1 376.438 3.189 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2ccc(F)c(F)c2)n1 ZINC000096379802 1410329735 /nfs/dbraw/zinc/32/97/35/1410329735.db2.gz WHYQQXDYGDPGGN-UHFFFAOYSA-N 0 1 382.392 3.323 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(F)cc2)c1-c1nc(C2CC2)no1 ZINC000096379838 1410329779 /nfs/dbraw/zinc/32/97/79/1410329779.db2.gz SXSGSWSAECZHGZ-UHFFFAOYSA-N 0 1 376.413 3.499 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2cc(F)ccc2C)n1 ZINC000096379813 1410329792 /nfs/dbraw/zinc/32/97/92/1410329792.db2.gz VHPATGWYSUGAIS-UHFFFAOYSA-N 0 1 378.429 3.492 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nnc(C)o2)cc1Cl ZINC000096379568 1410329862 /nfs/dbraw/zinc/32/98/62/1410329862.db2.gz FNZWHPWNMOPXNQ-UHFFFAOYSA-N 0 1 396.856 3.453 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nc(C)no2)cc1Cl ZINC000096379762 1410329901 /nfs/dbraw/zinc/32/99/01/1410329901.db2.gz VDUJBLXEGHKNAI-UHFFFAOYSA-N 0 1 396.856 3.453 10 0 GGAEMN COc1ccc(NC(=O)CSc2nc(C=Cc3ccco3)n[nH]2)c(OC)c1 ZINC000096941445 1410338617 /nfs/dbraw/zinc/33/86/17/1410338617.db2.gz WFQZLLKVEQTUDK-VURMDHGXSA-N 0 1 386.433 3.316 10 0 GGAEMN COc1cccc([C@@H](CNC(=O)/C=C\c2cnn(-c3ccccc3)c2)N(C)C)c1 ZINC000096943725 1410338976 /nfs/dbraw/zinc/33/89/76/1410338976.db2.gz QHHDYHAAYOFFCO-OTDUKCBNSA-N 0 1 390.487 3.313 10 0 GGAEMN COc1ccccc1-c1cc(C(=O)N2CCN(c3ncccc3Cl)CC2)n[nH]1 ZINC000097127081 1410353003 /nfs/dbraw/zinc/35/30/03/1410353003.db2.gz SRAYBJMINITOOB-UHFFFAOYSA-N 0 1 397.866 3.096 10 0 GGAEMN CCOC(=O)C1=C(CN[C@H](C)c2ccccc2C)NC(=O)N[C@H]1c1ccco1 ZINC000102683783 1410697961 /nfs/dbraw/zinc/69/79/61/1410697961.db2.gz HHPSPIHRUNJRAB-KUHUBIRLSA-N 0 1 383.448 3.110 10 0 GGAEMN COc1ccc2nc(CN3CCN(C(=O)c4ccccc4Cl)CC3)[nH]c2c1 ZINC000106482967 1411224507 /nfs/dbraw/zinc/22/45/07/1411224507.db2.gz LGJPLHVJKPZQNK-UHFFFAOYSA-N 0 1 384.867 3.183 10 0 GGAEMN CCN1CCN([C@@H]2CCN(C(=O)c3ccc(-c4ccc(F)cc4)s3)C2)CC1 ZINC000106805338 1411304516 /nfs/dbraw/zinc/30/45/16/1411304516.db2.gz PDHDVGDQXLFYRA-GOSISDBHSA-N 0 1 387.524 3.406 10 0 GGAEMN Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1cc(Br)ccc1F ZINC000110590567 1411859244 /nfs/dbraw/zinc/85/92/44/1411859244.db2.gz ATUPGVCLAOXTSU-UHFFFAOYSA-N 0 1 382.642 3.084 10 0 GGAEMN Cc1nn(-c2ccc(F)cc2)c(C)c1CNCC(=O)NCCc1ccccc1 ZINC000111400401 1411942749 /nfs/dbraw/zinc/94/27/49/1411942749.db2.gz AETSKFHHAJROOF-UHFFFAOYSA-N 0 1 380.467 3.077 10 0 GGAEMN COc1cc(CN[C@H]2CCN(c3ccccc3F)C2=O)ccc1OC(F)F ZINC000112366462 1412135434 /nfs/dbraw/zinc/13/54/34/1412135434.db2.gz CTOMSQAIIKNWCV-AWEZNQCLSA-N 0 1 380.366 3.331 10 0 GGAEMN O=C1[C@H](NCc2ccc(OC[C@H]3CCCO3)cc2)CCN1c1ccccc1F ZINC000112366740 1412136268 /nfs/dbraw/zinc/13/62/68/1412136268.db2.gz HJMJFTOLGIXIMF-UYAOXDASSA-N 0 1 384.451 3.279 10 0 GGAEMN CN1CCN(c2cc(CNCc3c(Cl)cccc3OC(F)F)ccn2)CC1 ZINC000112709736 1412200973 /nfs/dbraw/zinc/20/09/73/1412200973.db2.gz BRRZNIDMMDSKOD-UHFFFAOYSA-N 0 1 396.869 3.378 10 0 GGAEMN CNC(=O)c1cccc(CN2CCC(C(=O)NCc3ccc(C)c(F)c3)CC2)c1 ZINC000113929712 1412353747 /nfs/dbraw/zinc/35/37/47/1412353747.db2.gz BHTGAXZLWDQOKL-UHFFFAOYSA-N 0 1 397.494 3.022 10 0 GGAEMN COc1ccc(CCNC(=O)[C@@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1OC ZINC000114745700 1412516233 /nfs/dbraw/zinc/51/62/33/1412516233.db2.gz DJXXWOFNNIAKQF-UONOGXRCSA-N 0 1 392.446 3.380 10 0 GGAEMN COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Sc1nc(-c2ccccn2)n[nH]1 ZINC000117114061 1413001205 /nfs/dbraw/zinc/00/12/05/1413001205.db2.gz CZKTYVZODCLPOG-CHWSQXEVSA-N 0 1 383.477 3.233 10 0 GGAEMN CCCCn1nc(C)c(CNC[C@@H](O)c2cc(OC)cc(OC)c2)c1Cl ZINC000118450784 1413161908 /nfs/dbraw/zinc/16/19/08/1413161908.db2.gz DZRQPCBJBYXGJC-GOSISDBHSA-N 0 1 381.904 3.485 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C)c1ccc(F)cc1 ZINC000119358700 1413423147 /nfs/dbraw/zinc/42/31/47/1413423147.db2.gz DKEKQKIIZWLYFN-KSZLIROESA-N 0 1 393.503 3.238 10 0 GGAEMN CN(C)[C@@H](CNC(=O)C(O)(c1ccccc1)c1ccccc1)c1cccs1 ZINC000119726912 1413546371 /nfs/dbraw/zinc/54/63/71/1413546371.db2.gz DRMXZKISVLOJOV-IBGZPJMESA-N 0 1 380.513 3.403 10 0 GGAEMN CN(C)[C@H](CNC(=O)C(O)(c1ccccc1)c1ccccc1)c1cccs1 ZINC000119727036 1413546683 /nfs/dbraw/zinc/54/66/83/1413546683.db2.gz DRMXZKISVLOJOV-LJQANCHMSA-N 0 1 380.513 3.403 10 0 GGAEMN NC(=O)[C@@H]1CCCN1Cc1cccc(NCc2c(F)cccc2N2CCCC2)c1 ZINC000120069859 1413675415 /nfs/dbraw/zinc/67/54/15/1413675415.db2.gz FOUQMKDMGRJWQL-QFIPXVFZSA-N 0 1 396.510 3.488 10 0 GGAEMN Cc1ccc(-c2n[nH]cc2CNc2cccc(CN3CCC[C@H]3C(N)=O)c2)cc1 ZINC000120122931 1413696249 /nfs/dbraw/zinc/69/62/49/1413696249.db2.gz FZLBUIUALDYHTQ-NRFANRHFSA-N 0 1 389.503 3.447 10 0 GGAEMN CCCOc1ccc(CN[C@@H](C)CS(=O)(=O)c2ccccc2)cc1OC ZINC000122086311 1414359259 /nfs/dbraw/zinc/35/92/59/1414359259.db2.gz ACDZWEVQKXJAHG-INIZCTEOSA-N 0 1 377.506 3.436 10 0 GGAEMN Cc1nn(Cc2ccccc2)c(C)c1CNc1ccc(N2CCN(C)CC2)cn1 ZINC000123243977 1414677287 /nfs/dbraw/zinc/67/72/87/1414677287.db2.gz CJSXFKCJRAPWEN-UHFFFAOYSA-N 0 1 390.535 3.307 10 0 GGAEMN Cc1nn(-c2ccc(F)cc2)c(C)c1CNc1ccc(N2CCN(C)CC2)cn1 ZINC000123245579 1414677360 /nfs/dbraw/zinc/67/73/60/1414677360.db2.gz GWNJFRAJCIUBCP-UHFFFAOYSA-N 0 1 394.498 3.387 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2cnn(-c3ccc(C(F)(F)F)cc3)c2)[nH]1 ZINC000125085509 1415106368 /nfs/dbraw/zinc/10/63/68/1415106368.db2.gz BRBMRIYCMWAYHX-UHFFFAOYSA-N 0 1 396.398 3.439 10 0 GGAEMN Cc1cc2cc(CNC[C@H](O)CS(=O)(=O)c3cccs3)oc2cc1C ZINC000129336846 1416193492 /nfs/dbraw/zinc/19/34/92/1416193492.db2.gz AWLQTTJUSOKCRX-HNNXBMFYSA-N 0 1 379.503 3.036 10 0 GGAEMN Cc1nccn1CCC[N@H+](C)[C@@H](C)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000130703697 1416429151 /nfs/dbraw/zinc/42/91/51/1416429151.db2.gz FRMUIVODFVBGMN-AWEZNQCLSA-N 0 1 380.895 3.353 10 0 GGAEMN Cc1ccccc1[C@@H](C)NC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO ZINC000130856331 1416469536 /nfs/dbraw/zinc/46/95/36/1416469536.db2.gz AFLJNAYPGXJDHB-UZKOGDIHSA-N 0 1 381.520 3.238 10 0 GGAEMN Cn1nc(-c2ccccc2)c(CNc2ccc(N3CCN(C)CC3)cn2)c1Cl ZINC000131542665 1416573868 /nfs/dbraw/zinc/57/38/68/1416573868.db2.gz BWYMWSFTMWZLEF-UHFFFAOYSA-N 0 1 396.926 3.499 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCCCC[C@@H]2C[C@H](O)c2ccccc2)[nH]1 ZINC000131705190 1416600428 /nfs/dbraw/zinc/60/04/28/1416600428.db2.gz DGBFOINVIXOHIK-MSOLQXFVSA-N 0 1 388.537 3.490 10 0 GGAEMN CCOC(=O)COc1cccc(NC(=O)[C@@H]2CCCN2Cc2ccccc2)c1 ZINC000138519072 1417422364 /nfs/dbraw/zinc/42/23/64/1417422364.db2.gz CRFSBGHBICETHU-FQEVSTJZSA-N 0 1 382.460 3.232 10 0 GGAEMN Cc1ccc(CNCc2ccc(-n3cncn3)c(C)c2)c(O[C@H]2CCOC2)c1 ZINC000150758930 1417801369 /nfs/dbraw/zinc/80/13/69/1417801369.db2.gz FEFAMLZVASBBRF-FQEVSTJZSA-N 0 1 378.476 3.342 10 0 GGAEMN COc1ccc(CN[C@H]2CCN(c3ccccc3OC)C2=O)cc1OC(F)F ZINC000151537985 1418017467 /nfs/dbraw/zinc/01/74/67/1418017467.db2.gz FAHHCIPJMLQGQJ-AWEZNQCLSA-N 0 1 392.402 3.200 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000179585199 1429453075 /nfs/dbraw/zinc/45/30/75/1429453075.db2.gz CYOLKWNCQFEPPH-SQWLQELKSA-N 0 1 398.450 3.129 10 0 GGAEMN Cn1cc(CNCc2cc3c(cc2OC(F)F)OCO3)c(-c2ccncc2)n1 ZINC000152621776 1422171343 /nfs/dbraw/zinc/17/13/43/1422171343.db2.gz FWDITAJRVVPRHL-UHFFFAOYSA-N 0 1 388.374 3.102 10 0 GGAEMN COc1cc(OC)c(CN2CCC(C(=O)N3CCCCCC3)CC2)c(OC)c1 ZINC000179753570 1429539970 /nfs/dbraw/zinc/53/99/70/1429539970.db2.gz WPKUNGWTFJIBRE-UHFFFAOYSA-N 0 1 390.524 3.327 10 0 GGAEMN COc1ccccc1[C@H](CNC(=O)N[C@H](CCO)c1ccccc1)N1CCCC1 ZINC000152927511 1422298248 /nfs/dbraw/zinc/29/82/48/1422298248.db2.gz DZHAAVUGTMWOMP-RTWAWAEBSA-N 0 1 397.519 3.255 10 0 GGAEMN COc1cc(CN2CC[C@H](NCc3c(Cl)nc(Cl)n3C)C2)cc(OC)c1 ZINC000153362372 1422494465 /nfs/dbraw/zinc/49/44/65/1422494465.db2.gz GAIORYNSNNHUCK-ZDUSSCGKSA-N 0 1 399.322 3.108 10 0 GGAEMN COc1ccc2cccc(CC(=O)N3CCC(N4CCO[C@@H](C)C4)CC3)c2c1 ZINC000153735941 1422730159 /nfs/dbraw/zinc/73/01/59/1422730159.db2.gz LEJVRGASCRMNGV-KRWDZBQOSA-N 0 1 382.504 3.103 10 0 GGAEMN Cc1nn(C)c(N2CCOCC2)c1CN[C@@H](C)c1cccc(N2CCCC2)c1 ZINC000154142527 1422846254 /nfs/dbraw/zinc/84/62/54/1422846254.db2.gz BKPJEZAOWOCPGJ-KRWDZBQOSA-N 0 1 383.540 3.016 10 0 GGAEMN O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N1CC[C@@H](Oc2ccncc2)C1 ZINC000154277857 1422865865 /nfs/dbraw/zinc/86/58/65/1422865865.db2.gz DWXPNLJSFJLFIM-OAQYLSRUSA-N 0 1 398.482 3.048 10 0 GGAEMN COc1ccc(CN(C)C(=O)CN2CCC[C@H](Nc3ccccc3)C2)cc1OC ZINC000154930964 1423083505 /nfs/dbraw/zinc/08/35/05/1423083505.db2.gz GVWOVUYEDMUMIH-FQEVSTJZSA-N 0 1 397.519 3.239 10 0 GGAEMN C[C@@H]1CN(c2ccc(NS(=O)(=O)c3ccc(C#N)cc3F)cc2)C[C@@H](C)O1 ZINC000158105197 1424168132 /nfs/dbraw/zinc/16/81/32/1424168132.db2.gz FTAPQZSUZIMQSZ-ZIAGYGMSSA-N 0 1 389.452 3.112 10 0 GGAEMN O=C1[C@@H](NCc2ccc(F)c(Br)c2)CCCN1CC(F)(F)F ZINC000158315824 1424224728 /nfs/dbraw/zinc/22/47/28/1424224728.db2.gz BFYYELLVSCXTJQ-LBPRGKRZSA-N 0 1 383.183 3.231 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)N2CCN(C3CCCC3)CC2)C1 ZINC000160005867 1424561725 /nfs/dbraw/zinc/56/17/25/1424561725.db2.gz CUYLMUNNEGNZJO-DLBZAZTESA-N 0 1 379.545 3.157 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)N2CCN(C3CCCC3)CC2)C1 ZINC000160006129 1424561892 /nfs/dbraw/zinc/56/18/92/1424561892.db2.gz CUYLMUNNEGNZJO-IAGOWNOFSA-N 0 1 379.545 3.157 10 0 GGAEMN COc1ccc2c(c1)CCN2C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1 ZINC000161225103 1424667679 /nfs/dbraw/zinc/66/76/79/1424667679.db2.gz LEEWJNKJEXLIDC-INIZCTEOSA-N 0 1 380.492 3.388 10 0 GGAEMN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1cc(F)ccc1F ZINC000163490051 1425007348 /nfs/dbraw/zinc/00/73/48/1425007348.db2.gz FRUZDYRQCZBSPC-RYUDHWBXSA-N 0 1 382.432 3.046 10 0 GGAEMN O=C(c1cccc(CNCc2csc(Br)c2)c1)N1CCOCC1 ZINC000166270119 1425209337 /nfs/dbraw/zinc/20/93/37/1425209337.db2.gz GIHWPFJHPJYQKW-UHFFFAOYSA-N 0 1 395.322 3.273 10 0 GGAEMN O=C1[C@H]2CN(Cc3ccc(F)c(Cl)c3)C[C@H]2C(=O)N1CCc1ccccc1 ZINC000169756894 1425247413 /nfs/dbraw/zinc/24/74/13/1425247413.db2.gz ZFOOETRFVCTBFC-CALCHBBNSA-N 0 1 386.854 3.139 10 0 GGAEMN CCC(=O)N(C1CCOCC1)C1CCN(Cc2ccc(OC)c(OC)c2)CC1 ZINC000169760496 1425248389 /nfs/dbraw/zinc/24/83/89/1425248389.db2.gz SVPOEICAXXDYST-UHFFFAOYSA-N 0 1 390.524 3.086 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC[C@@H](Cc2noc(-c3cccnc3)n2)C1 ZINC000169771029 1425251412 /nfs/dbraw/zinc/25/14/12/1425251412.db2.gz LMBITMZGLJCZOZ-AWEZNQCLSA-N 0 1 388.431 3.103 10 0 GGAEMN COC[C@H]1CN(C(C)=O)CC12CCN(Cc1cccc(C(F)(F)F)c1)CC2 ZINC000169782740 1425256121 /nfs/dbraw/zinc/25/61/21/1425256121.db2.gz SMMUKGJQMNPOPU-GOSISDBHSA-N 0 1 384.442 3.412 10 0 GGAEMN C[C@@H](NC(=O)[C@@H](C)N1CCC(C2OCCO2)CC1)c1cccc2ccccc21 ZINC000171238293 1425560958 /nfs/dbraw/zinc/56/09/58/1425560958.db2.gz IBCLFQCOGZAMKO-IAGOWNOFSA-N 0 1 382.504 3.490 10 0 GGAEMN COc1ccc(C(=O)N(C)C)cc1NS(=O)(=O)c1cccc(C(C)C)c1 ZINC000172887609 1426239966 /nfs/dbraw/zinc/23/99/66/1426239966.db2.gz SQPONQLHCGKBAI-UHFFFAOYSA-N 0 1 376.478 3.321 10 0 GGAEMN COc1ccc(-c2cc(C(=O)N3CCO[C@H](c4n[nH]c(C)n4)C3)sc2C)cc1 ZINC000173087528 1426336756 /nfs/dbraw/zinc/33/67/56/1426336756.db2.gz NFFAZLFWFAEVIR-KRWDZBQOSA-N 0 1 398.488 3.372 10 0 GGAEMN CCOCCCn1c(NC(=O)CCSc2nnc(C)[nH]2)nc2ccccc21 ZINC000174573136 1427233262 /nfs/dbraw/zinc/23/32/62/1427233262.db2.gz APPCADUMWYWIKY-UHFFFAOYSA-N 0 1 388.497 3.010 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2cccnc2Oc2cccc(F)c2)[nH]1 ZINC000174637404 1427280187 /nfs/dbraw/zinc/28/01/87/1427280187.db2.gz AWZGTKJVYRRTTJ-UHFFFAOYSA-N 0 1 387.440 3.238 10 0 GGAEMN CC[C@@H](NCC(=O)Nc1ccnn1C1CCCC1)c1ccc2c(c1)OCCO2 ZINC000180644154 1429951752 /nfs/dbraw/zinc/95/17/52/1429951752.db2.gz DKPAWWPVNHRKLR-QGZVFWFLSA-N 0 1 384.480 3.449 10 0 GGAEMN CC[C@H](NCC(=O)Nc1ccnn1C1CCCC1)c1ccc2c(c1)OCCO2 ZINC000180644137 1429951799 /nfs/dbraw/zinc/95/17/99/1429951799.db2.gz DKPAWWPVNHRKLR-KRWDZBQOSA-N 0 1 384.480 3.449 10 0 GGAEMN C[C@H](NCc1cc(=O)n2cc(Cl)ccc2n1)c1ccc(-n2cccn2)cc1 ZINC000180822934 1430058300 /nfs/dbraw/zinc/05/83/00/1430058300.db2.gz HMAXJBPQNXCEAX-AWEZNQCLSA-N 0 1 379.851 3.384 10 0 GGAEMN COC(=O)c1ccc(C)c(NC(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000180849886 1430069049 /nfs/dbraw/zinc/06/90/49/1430069049.db2.gz HDISDFMWSCPWPN-MRXNPFEDSA-N 0 1 392.459 3.257 10 0 GGAEMN COC(=O)c1ccc(C)c(NC(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000180849866 1430069303 /nfs/dbraw/zinc/06/93/03/1430069303.db2.gz HDISDFMWSCPWPN-INIZCTEOSA-N 0 1 392.459 3.257 10 0 GGAEMN CCOc1ccc(C(=O)N2CCC[C@H](c3nnc(-c4ccccc4)[nH]3)C2)cn1 ZINC000181363046 1430282133 /nfs/dbraw/zinc/28/21/33/1430282133.db2.gz LCTOIMAQCMKNRU-KRWDZBQOSA-N 0 1 377.448 3.285 10 0 GGAEMN CCc1nc(NC(=O)CN[C@@H](C)c2cccc(N3CCCC3=O)c2)sc1C ZINC000181434352 1430298166 /nfs/dbraw/zinc/29/81/66/1430298166.db2.gz FCBAUDMNAXSEEJ-ZDUSSCGKSA-N 0 1 386.521 3.430 10 0 GGAEMN CCc1nc(NC(=O)CN[C@H](C)c2cccc(N3CCCC3=O)c2)sc1C ZINC000181434379 1430298181 /nfs/dbraw/zinc/29/81/81/1430298181.db2.gz FCBAUDMNAXSEEJ-CYBMUJFWSA-N 0 1 386.521 3.430 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccnn1C1CCCC1)c1cccc(N2CCCC2=O)c1 ZINC000181441627 1430300353 /nfs/dbraw/zinc/30/03/53/1430300353.db2.gz CFDANLIJZMSGNK-MRXNPFEDSA-N 0 1 395.507 3.414 10 0 GGAEMN CCOC(=O)c1cnc(=NNC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc32)[nH]c1C ZINC000182717543 1430525531 /nfs/dbraw/zinc/52/55/31/1430525531.db2.gz DUMFQURABXTVTQ-QZTJIDSGSA-N 0 1 390.443 3.362 10 0 GGAEMN CCOC(=O)c1cnc(=NNC(=O)[C@H]2C[C@@H]2c2cccc3ccccc32)[nH]c1C ZINC000182717566 1430525726 /nfs/dbraw/zinc/52/57/26/1430525726.db2.gz DUMFQURABXTVTQ-MSOLQXFVSA-N 0 1 390.443 3.362 10 0 GGAEMN C[C@@H](CCc1cccc(F)c1)N1CCN(CC(=O)N2C[C@H](C)C[C@H](C)C2)CC1 ZINC000182998848 1430588779 /nfs/dbraw/zinc/58/87/79/1430588779.db2.gz AFSBXCNDHVIQOY-ZCNNSNEGSA-N 0 1 389.559 3.269 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1 ZINC000184581124 1430909141 /nfs/dbraw/zinc/90/91/41/1430909141.db2.gz OUKCAIKVBQGICO-UHFFFAOYSA-N 0 1 393.369 3.470 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1 ZINC000184581124 1430909147 /nfs/dbraw/zinc/90/91/47/1430909147.db2.gz OUKCAIKVBQGICO-UHFFFAOYSA-N 0 1 393.369 3.470 10 0 GGAEMN Cn1cc(-c2cc(CN3CCC(n4ccc(C(F)(F)F)n4)CC3)on2)cn1 ZINC000185058542 1431051500 /nfs/dbraw/zinc/05/15/00/1431051500.db2.gz VZFHTCYOOJUBJP-UHFFFAOYSA-N 0 1 380.374 3.128 10 0 GGAEMN Fc1cc(CNCc2cnc(-c3ccccc3)s2)cnc1N1CCOCC1 ZINC000185079767 1431055697 /nfs/dbraw/zinc/05/56/97/1431055697.db2.gz LAQDRKIZCYGPHV-UHFFFAOYSA-N 0 1 384.480 3.471 10 0 GGAEMN Cn1c(CN2CCN(Cc3ccccc3)CC2)nnc1-c1ccc(Cl)cc1 ZINC000186268926 1431367151 /nfs/dbraw/zinc/36/71/51/1431367151.db2.gz DGIBHLOEHOGAQJ-UHFFFAOYSA-N 0 1 381.911 3.453 10 0 GGAEMN CCOC(=O)c1nn(C)cc1CNCCOc1ccccc1-c1ccccc1 ZINC000186327613 1431383969 /nfs/dbraw/zinc/38/39/69/1431383969.db2.gz BBXUVYDTUBWPBF-UHFFFAOYSA-N 0 1 379.460 3.432 10 0 GGAEMN O=C(NCCN1CCCOCC1)NCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000186850443 1431540208 /nfs/dbraw/zinc/54/02/08/1431540208.db2.gz GOWNGUOEYXHCSJ-UHFFFAOYSA-N 0 1 387.455 3.140 10 0 GGAEMN Cc1ccc(-c2cc(C(=O)NC3CCN(Cc4cccnc4)CC3)[nH]n2)c(C)c1 ZINC000188281754 1431869219 /nfs/dbraw/zinc/86/92/19/1431869219.db2.gz JECWJBDPLGTFSX-UHFFFAOYSA-N 0 1 389.503 3.483 10 0 GGAEMN Cc1cc(NC(=O)CN[C@@H]2CCO[C@H]2c2ccccc2)n(-c2ccccc2F)n1 ZINC000191935134 1432759667 /nfs/dbraw/zinc/75/96/67/1432759667.db2.gz DCNCJHFUFCNJOS-GCJKJVERSA-N 0 1 394.450 3.378 10 0 GGAEMN Cc1cc(NC(=O)CN[C@@H]2CCO[C@H]2c2ccccc2)n(-c2ccc(F)cc2)n1 ZINC000191954798 1432766187 /nfs/dbraw/zinc/76/61/87/1432766187.db2.gz FIUNAXJYNORSMY-KNQAVFIVSA-N 0 1 394.450 3.378 10 0 GGAEMN O=C(CN[C@@H]1CCCc2c(O)cccc21)Nc1ccc(N2CCCCC2)nc1 ZINC000192354459 1432835530 /nfs/dbraw/zinc/83/55/30/1432835530.db2.gz BKPDWYQPZVCLOI-LJQANCHMSA-N 0 1 380.492 3.383 10 0 GGAEMN CCCCNC(=O)C1CCN([C@H](C)C(=O)N2c3ccccc3CC[C@H]2C)CC1 ZINC000192869321 1432901202 /nfs/dbraw/zinc/90/12/02/1432901202.db2.gz CWGJAYSSEBIKIW-QZTJIDSGSA-N 0 1 385.552 3.371 10 0 GGAEMN CCCCNC(=O)C1CCN([C@@H](C)C(=O)N2c3ccccc3CC[C@H]2C)CC1 ZINC000192869306 1432901282 /nfs/dbraw/zinc/90/12/82/1432901282.db2.gz CWGJAYSSEBIKIW-MSOLQXFVSA-N 0 1 385.552 3.371 10 0 GGAEMN O=C(c1cc(-c2ccccc2O)[nH]n1)N1CCN(C/C=C\c2ccccc2)CC1 ZINC000229995762 1433372293 /nfs/dbraw/zinc/37/22/93/1433372293.db2.gz ARHDDKKAOMOQAR-TWGQIWQCSA-N 0 1 388.471 3.254 10 0 GGAEMN CC(C)(C)N1C[C@H](NCc2cc(Br)c3c(c2)OCCCO3)CC1=O ZINC000236649733 1433375190 /nfs/dbraw/zinc/37/51/90/1433375190.db2.gz AMFWGGYWDYTOBG-CYBMUJFWSA-N 0 1 397.313 3.099 10 0 GGAEMN CC(C)n1ncc2cc(CN[C@H](CN3CCCC3=O)c3ccccc3)cnc21 ZINC000236868897 1433381435 /nfs/dbraw/zinc/38/14/35/1433381435.db2.gz ABXQEMMXUGIABH-HXUWFJFHSA-N 0 1 377.492 3.466 10 0 GGAEMN CCOc1c(Br)cc(CNCc2ccc(C(N)=O)cc2)cc1OC ZINC000237029033 1433386321 /nfs/dbraw/zinc/38/63/21/1433386321.db2.gz FIPXGNOROJZRTB-UHFFFAOYSA-N 0 1 393.281 3.245 10 0 GGAEMN CCOc1c(Cl)cc(CNCc2cnc(N3CCOCC3)s2)cc1OC ZINC000237040008 1433386911 /nfs/dbraw/zinc/38/69/11/1433386911.db2.gz ATCJEKIYSBGJBV-UHFFFAOYSA-N 0 1 397.928 3.330 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2ccc(F)c(Br)c2)C1=O ZINC000237105052 1433389180 /nfs/dbraw/zinc/38/91/80/1433389180.db2.gz HSGOIWKSWQASJE-HNNXBMFYSA-N 0 1 393.256 3.492 10 0 GGAEMN COc1ccc(CNCc2cnc(N3CCOCC3)s2)cc1Br ZINC000237271989 1433395323 /nfs/dbraw/zinc/39/53/23/1433395323.db2.gz HFRNFYHGUMBAPX-UHFFFAOYSA-N 0 1 398.326 3.041 10 0 GGAEMN COc1cc(CNC(=O)[C@H]2Cc3ccccc3CN2)ccc1OCCC(C)C ZINC000237320855 1433397139 /nfs/dbraw/zinc/39/71/39/1433397139.db2.gz FSCUBUVAMOTCEN-HXUWFJFHSA-N 0 1 382.504 3.451 10 0 GGAEMN COc1ccc(Br)c(CNC[C@@H](O)COc2ccc(F)cc2)c1 ZINC000237326966 1433397441 /nfs/dbraw/zinc/39/74/41/1433397441.db2.gz HOKFGCQVAOEWKQ-CQSZACIVSA-N 0 1 384.245 3.126 10 0 GGAEMN Cc1nn(C)c(OCC(F)(F)F)c1CNCc1cccc(Cn2cccn2)c1 ZINC000237770195 1433422852 /nfs/dbraw/zinc/42/28/52/1433422852.db2.gz HKLJTXNHFSNFMV-UHFFFAOYSA-N 0 1 393.413 3.204 10 0 GGAEMN O=C(Nc1ccc(CNCc2cccc3c2OCCO3)cc1)c1ccncc1 ZINC000238107973 1433443187 /nfs/dbraw/zinc/44/31/87/1433443187.db2.gz GRLKZQOMVRSCEU-UHFFFAOYSA-N 0 1 375.428 3.395 10 0 GGAEMN COc1ccc(NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)cc1OC ZINC000242803099 1433447306 /nfs/dbraw/zinc/44/73/06/1433447306.db2.gz FFBWBOHINLSTBI-UHFFFAOYSA-N 0 1 386.521 3.265 10 0 GGAEMN CCOC(=O)c1ccc(NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000243341996 1433449298 /nfs/dbraw/zinc/44/92/98/1433449298.db2.gz LTKMFWHXDQTNSX-UHFFFAOYSA-N 0 1 398.532 3.424 10 0 GGAEMN COc1cc(C)c(C)cc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000244327669 1433452458 /nfs/dbraw/zinc/45/24/58/1433452458.db2.gz XMBXLYPFACYCSS-UHFFFAOYSA-N 0 1 388.533 3.255 10 0 GGAEMN COc1cc(C)c(C)cc1S(=O)(=O)Nc1cc(OC)c(OC)c(OC)c1 ZINC000244394303 1433452759 /nfs/dbraw/zinc/45/27/59/1433452759.db2.gz YGORZWCZQCBPIY-UHFFFAOYSA-N 0 1 381.450 3.139 10 0 GGAEMN COC(=O)c1ccc(NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000244391120 1433452781 /nfs/dbraw/zinc/45/27/81/1433452781.db2.gz YFPLWBFHFGWOAW-UHFFFAOYSA-N 0 1 384.505 3.034 10 0 GGAEMN C[C@H](CNC(=O)N[C@@H]1CCO[C@H]1c1ccccc1)N1CCc2ccccc2C1 ZINC000245413528 1433463130 /nfs/dbraw/zinc/46/31/30/1433463130.db2.gz BPDQBESIXYHQQQ-YHYVQYDKSA-N 0 1 379.504 3.263 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H](CC)c2ccc(F)cc2F)C1 ZINC000245835912 1433524367 /nfs/dbraw/zinc/52/43/67/1433524367.db2.gz BEEKTGKILLAGTJ-IYOUNJFTSA-N 0 1 382.451 3.196 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000245990100 1433554160 /nfs/dbraw/zinc/55/41/60/1433554160.db2.gz CYOLKWNCQFEPPH-IIAWOOMASA-N 0 1 398.450 3.129 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1 ZINC000249331099 1433841451 /nfs/dbraw/zinc/84/14/51/1433841451.db2.gz HOYKAFANLVXRFT-GBESFXJTSA-N 0 1 397.563 3.183 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000249331099 1433841452 /nfs/dbraw/zinc/84/14/52/1433841452.db2.gz HOYKAFANLVXRFT-GBESFXJTSA-N 0 1 397.563 3.183 10 0 GGAEMN C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000249680414 1433848767 /nfs/dbraw/zinc/84/87/67/1433848767.db2.gz AMTVNJPQVZSRSP-ZIAGYGMSSA-N 0 1 378.879 3.429 10 0 GGAEMN CC(=O)NC[C@@H]1CCCN([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000249810241 1433852499 /nfs/dbraw/zinc/85/24/99/1433852499.db2.gz HPIVIIBCNORQHC-LMMKCTJWSA-N 0 1 381.520 3.254 10 0 GGAEMN CCCNC(=O)[C@@H]1CCCN([C@H](C)C(=O)N[C@H](C)c2cc3ccccc3o2)C1 ZINC000250428734 1433856290 /nfs/dbraw/zinc/85/62/90/1433856290.db2.gz HBQDIQORCFQHBC-JFIYKMOQSA-N 0 1 385.508 3.237 10 0 GGAEMN COc1ccc(S(=O)(=O)N2CCC[C@H](n3c(C)cnc3C)C2)cc1Cl ZINC000257177307 1433893543 /nfs/dbraw/zinc/89/35/43/1433893543.db2.gz WKIMJRHLZAFHQE-AWEZNQCLSA-N 0 1 383.901 3.188 10 0 GGAEMN COCCN1CC2(CCN(C(=O)c3ccccc3C)CC2)[C@H]1c1ccncc1 ZINC000257178231 1433893656 /nfs/dbraw/zinc/89/36/56/1433893656.db2.gz ZMXBWLVKUIWONE-OAQYLSRUSA-N 0 1 379.504 3.316 10 0 GGAEMN O=C(c1ccn[nH]1)N1CCC(N2C(=O)C3(CCCC3)[C@@H]2c2ccccc2)CC1 ZINC000257180477 1433893831 /nfs/dbraw/zinc/89/38/31/1433893831.db2.gz DOTLLZQWDBOZIV-IBGZPJMESA-N 0 1 378.476 3.158 10 0 GGAEMN O=C(CC1CCCC1)N1CCC([N@H+]2C[C@@H](OCC3CC3)C23CCOCC3)CC1 ZINC000257185228 1433894218 /nfs/dbraw/zinc/89/42/18/1433894218.db2.gz WGUZPLNELZHSSZ-OAQYLSRUSA-N 0 1 390.568 3.218 10 0 GGAEMN O=C(CC1CCCC1)N1CCC(N2C[C@@H](OCC3CC3)C23CCOCC3)CC1 ZINC000257185228 1433894220 /nfs/dbraw/zinc/89/42/20/1433894220.db2.gz WGUZPLNELZHSSZ-OAQYLSRUSA-N 0 1 390.568 3.218 10 0 GGAEMN O=C1[C@@H](OCC2CC2)C2(CCCCC2)N1C1CCN(Cc2cccnc2)CC1 ZINC000257188075 1433894292 /nfs/dbraw/zinc/89/42/92/1433894292.db2.gz DIRBKWSETKZEIK-OAQYLSRUSA-N 0 1 383.536 3.386 10 0 GGAEMN Cc1ccc(NC(=O)N2CCC[C@@H]2c2nnc3n2CCN(C)CC3)c(Cl)c1 ZINC000257188055 1433894332 /nfs/dbraw/zinc/89/43/32/1433894332.db2.gz DFRSRTBUAWKNGY-MRXNPFEDSA-N 0 1 388.903 3.097 10 0 GGAEMN O=C(CCc1c[nH]c2ccccc12)N1CCC2(CC[C@H]2N2CCOCC2)CC1 ZINC000257189926 1433894469 /nfs/dbraw/zinc/89/44/69/1433894469.db2.gz OELADONOEJGJMB-OAQYLSRUSA-N 0 1 381.520 3.204 10 0 GGAEMN O=C(CCc1c[nH]c2ccccc12)N1CCC2(CC[C@@H]2N2CCOCC2)CC1 ZINC000257189925 1433894510 /nfs/dbraw/zinc/89/45/10/1433894510.db2.gz OELADONOEJGJMB-NRFANRHFSA-N 0 1 381.520 3.204 10 0 GGAEMN CC(=O)CCC(=O)N1CCC(CCn2c(C)cnc2C2CCOCC2)CC1 ZINC000257191141 1433894552 /nfs/dbraw/zinc/89/45/52/1433894552.db2.gz PJZHMGSCUJQQOC-UHFFFAOYSA-N 0 1 375.513 3.083 10 0 GGAEMN Cc1cc(C(=O)N2CCC(CCn3c(C)cnc3-c3cccnc3)CC2)n[nH]1 ZINC000257193080 1433894633 /nfs/dbraw/zinc/89/46/33/1433894633.db2.gz RHOBCJLVKCGUGJ-UHFFFAOYSA-N 0 1 378.480 3.228 10 0 GGAEMN CC(C)C(=O)N1CCCn2ccnc2[C@@H]1C1CCN(Cc2cccnc2)CC1 ZINC000257196728 1433894824 /nfs/dbraw/zinc/89/48/24/1433894824.db2.gz YTWCWJKBQLMELS-FQEVSTJZSA-N 0 1 381.524 3.120 10 0 GGAEMN CC(C)[C@@H](C)N1Cc2cccc(NC(=O)C(=O)N(C)C[C@H]3CCCCO3)c2C1 ZINC000263942459 1434051346 /nfs/dbraw/zinc/05/13/46/1434051346.db2.gz DHFDFVQUJKFMIS-SJLPKXTDSA-N 0 1 387.524 3.013 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](C(=O)Nc2ccccc2-c2nnc[nH]2)C1 ZINC000271487844 1434829098 /nfs/dbraw/zinc/82/90/98/1434829098.db2.gz FXRDTPYLGJRGRE-ZIAGYGMSSA-N 0 1 385.468 3.494 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@@H](C)N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000271654511 1434842063 /nfs/dbraw/zinc/84/20/63/1434842063.db2.gz FTHVAHYJLXBGSE-QWHCGFSZSA-N 0 1 391.418 3.325 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)N[C@@H](C)c2ccccc2OC(F)F)c1 ZINC000271654514 1434842102 /nfs/dbraw/zinc/84/21/02/1434842102.db2.gz FTHVAHYJLXBGSE-STQMWFEESA-N 0 1 391.418 3.325 10 0 GGAEMN CCN(CC)Cc1nc(C2(NC(=O)c3ccc(O)c(Cl)c3)CCCC2)no1 ZINC000272581029 1434910455 /nfs/dbraw/zinc/91/04/55/1434910455.db2.gz FWLNODBZFMTGHW-UHFFFAOYSA-N 0 1 392.887 3.470 10 0 GGAEMN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000272881149 1434938432 /nfs/dbraw/zinc/93/84/32/1434938432.db2.gz CLLLNZCSTLCMMH-LHGDWWLVSA-N 0 1 388.533 3.349 10 0 GGAEMN COc1ccc(COCc2cccc(NC(=O)[C@H](C)CN3CCOCC3)c2)cc1 ZINC000273007309 1434949446 /nfs/dbraw/zinc/94/94/46/1434949446.db2.gz AOXWSVUVABDCHL-GOSISDBHSA-N 0 1 398.503 3.319 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(CNC(=O)OC(C)(C)C)cc2)[nH]1 ZINC000275109553 1435116546 /nfs/dbraw/zinc/11/65/46/1435116546.db2.gz GXOICHKWIDXMDI-UHFFFAOYSA-N 0 1 391.497 3.259 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NC(=O)NCc2cnn(Cc3ccccc3)c2)n[nH]1 ZINC000277095862 1435261456 /nfs/dbraw/zinc/26/14/56/1435261456.db2.gz DRADIQNWYXAWGC-CABCVRRESA-N 0 1 381.484 3.123 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)NCc2cnn(Cc3ccccc3)c2)n[nH]1 ZINC000277095865 1435261515 /nfs/dbraw/zinc/26/15/15/1435261515.db2.gz DRADIQNWYXAWGC-GJZGRUSLSA-N 0 1 381.484 3.123 10 0 GGAEMN CC(C)c1nnc(C=CC(=O)N2CCC[C@@H](c3ncc(C(F)(F)F)[nH]3)C2)o1 ZINC000278541614 1435398579 /nfs/dbraw/zinc/39/85/79/1435398579.db2.gz AGHBVRULMRAKRY-MVIFTORASA-N 0 1 383.374 3.354 10 0 GGAEMN COc1cccc(-c2nc(CN[C@H]3CCC(=O)NC34CCC4)cs2)c1OC ZINC000282725259 1435857999 /nfs/dbraw/zinc/85/79/99/1435857999.db2.gz HYGBYZWAHJLHIC-INIZCTEOSA-N 0 1 387.505 3.118 10 0 GGAEMN Cc1cc([C@@H]2CCCN(C(=O)C=Cc3ccc(C(=O)NC4CC4)cc3)C2)n[nH]1 ZINC000283336962 1435884899 /nfs/dbraw/zinc/88/48/99/1435884899.db2.gz AOIVYVMUSLRXQM-PMQIGOLDSA-N 0 1 378.476 3.030 10 0 GGAEMN Cc1ccnc(Oc2cc(NC(=O)N3CCOC[C@H]3c3nnc[nH]3)ccc2C)c1 ZINC000284653048 1436037640 /nfs/dbraw/zinc/03/76/40/1436037640.db2.gz SVKABHYFSYXQAB-INIZCTEOSA-N 0 1 394.435 3.214 10 0 GGAEMN O=C([O-])[C@H](NC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1cccs1 ZINC000379638526 939131528 /nfs/dbraw/zinc/13/15/28/939131528.db2.gz ULEPIHMNWDRJAI-SJLPKXTDSA-N 0 1 387.505 3.228 10 0 GGAEMN C[C@]1(CNC(=O)N[C@H](C(=O)[O-])c2cccs2)CCC[N@H+]1Cc1ccccc1 ZINC000397908493 939138415 /nfs/dbraw/zinc/13/84/15/939138415.db2.gz XSASRCZFBKWJMG-FXAWDEMLSA-N 0 1 387.505 3.228 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)N[C@H](C(=O)[O-])c2ccccc2)[C@H]1c1cccs1 ZINC000780584840 939139633 /nfs/dbraw/zinc/13/96/33/939139633.db2.gz HMIVPYJRLMZZNH-SZMVWBNQSA-N 0 1 387.505 3.256 10 0 GGAEMN C[N@@H+](CCOc1ccccc1)Cc1ccc(NC(=O)[C@H](C(=O)[O-])C2CC2)cc1 ZINC000902730128 939287230 /nfs/dbraw/zinc/28/72/30/939287230.db2.gz PGGNIPNAELNRHE-HXUWFJFHSA-N 0 1 382.460 3.247 10 0 GGAEMN C[C@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+]1CCc2sccc2C1 ZINC000908851422 939336368 /nfs/dbraw/zinc/33/63/68/939336368.db2.gz LCISRXLVOZVNOI-VLIAUNLRSA-N 0 1 393.553 3.218 10 0 GGAEMN C[C@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2sccc2C1 ZINC000908851422 939336374 /nfs/dbraw/zinc/33/63/74/939336374.db2.gz LCISRXLVOZVNOI-VLIAUNLRSA-N 0 1 393.553 3.218 10 0 GGAEMN C[C@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2ccccc2C1 ZINC000908914668 939351311 /nfs/dbraw/zinc/35/13/11/939351311.db2.gz ZXUAZDWXXSSCNA-ZHRRBRCNSA-N 0 1 387.524 3.156 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC000908924874 939353914 /nfs/dbraw/zinc/35/39/14/939353914.db2.gz NCCSJKOPJANZPQ-ICSRJNTNSA-N 0 1 387.524 3.231 10 0 GGAEMN C[C@@]1(CNC(=O)N[C@@H](C(=O)[O-])C2CCCCC2)CCC[N@H+]1Cc1ccccc1 ZINC000908960358 939361937 /nfs/dbraw/zinc/36/19/37/939361937.db2.gz RKVIQQUGCKWTRH-KNQAVFIVSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+](C)Cc1ccccc1 ZINC000908988989 939367411 /nfs/dbraw/zinc/36/74/11/939367411.db2.gz MKFMQSKTAVEGHR-IIBYNOLFSA-N 0 1 375.513 3.230 10 0 GGAEMN CC1(C)CCC[C@](NC(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)(C(=O)[O-])C1 ZINC000908999054 939369247 /nfs/dbraw/zinc/36/92/47/939369247.db2.gz WPFJXVRBENQXQV-PGRDOPGGSA-N 0 1 387.524 3.374 10 0 GGAEMN O=C([O-])[C@H](NC(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1)C1CCCCCC1 ZINC000908998797 939369822 /nfs/dbraw/zinc/36/98/22/939369822.db2.gz UTONDPNOGUYMRU-WOJBJXKFSA-N 0 1 387.524 3.374 10 0 GGAEMN CC[C@@](NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)(C(=O)[O-])c1ccc(Cl)cc1 ZINC000909051735 939374374 /nfs/dbraw/zinc/37/43/74/939374374.db2.gz GHIRQFPRDOVCGY-KRXYWNSISA-N 0 1 393.915 3.344 10 0 GGAEMN Cc1[nH+]ccn1CCCCNC(=O)N[C@H](C(=O)[O-])c1ccc2ccccc2c1 ZINC000909053876 939374644 /nfs/dbraw/zinc/37/46/44/939374644.db2.gz BAHAUUXTLXLPRY-IBGZPJMESA-N 0 1 380.448 3.250 10 0 GGAEMN C[C@@H]1C[C@@H](NC(=O)N[C@@]2(C(=O)[O-])CCCC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000909094217 939380615 /nfs/dbraw/zinc/38/06/15/939380615.db2.gz HPYKRYRRWHQYFY-CDMIOBSGSA-N 0 1 387.524 3.372 10 0 GGAEMN COc1cccc([C@H](NC(=O)NCC[C@@H](C)[N@@H+](C)Cc2ccccc2)C(=O)[O-])c1 ZINC000909136310 939384418 /nfs/dbraw/zinc/38/44/18/939384418.db2.gz GLQCQYFADCELEO-UZLBHIALSA-N 0 1 399.491 3.031 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@@H](C(=O)[O-])c1ccc(OC)c(Cl)c1 ZINC000909795217 939733480 /nfs/dbraw/zinc/73/34/80/939733480.db2.gz JYFZCODOMYDJTA-APPDUMDISA-N 0 1 379.844 3.001 10 0 GGAEMN CC(C)CCSCC(=O)N[C@]1(C(=O)[O-])CCC[N@@H+](Cc2ccccc2)C1 ZINC001123268903 939817564 /nfs/dbraw/zinc/81/75/64/939817564.db2.gz VQXUEFCDIQXFOJ-HXUWFJFHSA-N 0 1 378.538 3.001 10 0 GGAEMN Cc1ccc(Cl)cc1C(=O)N[C@]1(C(=O)[O-])CCC[N@@H+](Cc2ccccc2)C1 ZINC001123270590 939818571 /nfs/dbraw/zinc/81/85/71/939818571.db2.gz JLOZWGJZFWURKO-OAQYLSRUSA-N 0 1 386.879 3.498 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)[C@H](C(=O)[O-])C2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000663108743 939855966 /nfs/dbraw/zinc/85/59/66/939855966.db2.gz VSKZZDOFTRWQAD-OIISXLGYSA-N 0 1 398.425 3.315 10 0 GGAEMN O[C@H]([C@H](Cc1ccccc1)NCc1cc(-c2cccnc2)n[nH]1)C(F)(F)F ZINC000675100098 1126105105 /nfs/dbraw/zinc/10/51/05/1126105105.db2.gz WBGDKODMJSQAKT-ZWKOTPCHSA-N 0 1 376.382 3.096 10 0 GGAEMN OCC1(NCc2cn(-c3ccc(Cl)c(Cl)c3)nn2)Cc2ccccc2C1 ZINC000679853712 1126105687 /nfs/dbraw/zinc/10/56/87/1126105687.db2.gz URSPZRGOCWSSSL-UHFFFAOYSA-N 0 1 389.286 3.194 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@@H](Cc3ccccc3)[C@H](O)C(F)(F)F)ccc21 ZINC000684379269 1126106358 /nfs/dbraw/zinc/10/63/58/1126106358.db2.gz XTIMUQBVSLYFFP-YOEHRIQHSA-N 0 1 396.434 3.224 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@@H](Cc3ccccc3)[C@@H](O)C(F)(F)F)ccc21 ZINC000684379268 1126106416 /nfs/dbraw/zinc/10/64/16/1126106416.db2.gz XTIMUQBVSLYFFP-WMLDXEAASA-N 0 1 396.434 3.224 10 0 GGAEMN Cc1ccc(C[C@@H](CO)NCc2cnc(NC(=O)OC(C)(C)C)cn2)cc1C ZINC000865599323 1126114538 /nfs/dbraw/zinc/11/45/38/1126114538.db2.gz XPOOXDSKQOUKBX-KRWDZBQOSA-N 0 1 386.496 3.134 10 0 GGAEMN Cn1ccc(-c2nc(CN[C@@](C)(CO)Cc3ccc(Cl)cc3)cs2)n1 ZINC000922318348 1126134631 /nfs/dbraw/zinc/13/46/31/1126134631.db2.gz QRMIBKIIOPHUQM-GOSISDBHSA-N 0 1 376.913 3.280 10 0 GGAEMN CCc1cc2c(C[NH2+][C@@](C)(CO)Cc3ccccc3F)cc(=O)oc2cc1[O-] ZINC001620624570 1126241888 /nfs/dbraw/zinc/24/18/88/1126241888.db2.gz ZYHLCPDPKUQOAA-JOCHJYFZSA-N 0 1 385.435 3.283 10 0 GGAEMN C[C@@](CO)(Cc1ccc(Br)cc1)NCc1noc2c1CCCC2 ZINC001620623964 1126241395 /nfs/dbraw/zinc/24/13/95/1126241395.db2.gz LIUCZYKHGMBUBS-SFHVURJKSA-N 0 1 379.298 3.399 10 0 GGAEMN C[C@](CO)(Cc1ccccc1F)NCc1csc(-c2ccc(C(N)=O)cc2)n1 ZINC001620624392 1126241652 /nfs/dbraw/zinc/24/16/52/1126241652.db2.gz WGRQQJIXRGJLGK-OAQYLSRUSA-N 0 1 399.491 3.131 10 0 GGAEMN C[C@@](CO)(Cc1ccccc1F)NCc1ccn(-c2ccc(F)cc2F)n1 ZINC001648467064 1126250692 /nfs/dbraw/zinc/25/06/92/1126250692.db2.gz VFKYGLHFYOZGRR-FQEVSTJZSA-N 0 1 375.394 3.373 10 0 GGAEMN COC(=O)c1ccc(-c2nc(CN[C@@](C)(CO)Cc3ccc(F)cc3)co2)cc1 ZINC001654940688 1126254970 /nfs/dbraw/zinc/25/49/70/1126254970.db2.gz OUNMFZDGFRVUIG-JOCHJYFZSA-N 0 1 398.434 3.351 10 0 GGAEMN CCc1cc2c(C[NH2+][C@@](C)(CO)Cc3ccc(F)cc3)cc(=O)oc2cc1[O-] ZINC001655735409 1126255917 /nfs/dbraw/zinc/25/59/17/1126255917.db2.gz DYECJKPJKUROIM-JOCHJYFZSA-N 0 1 385.435 3.283 10 0 GGAEMN CCOC(=O)C1(c2ccccc2)CCN(C[C@H](O)COc2ccccc2)CC1 ZINC000005650527 206292719 /nfs/dbraw/zinc/29/27/19/206292719.db2.gz ZDAXTCOLRCZCRR-FQEVSTJZSA-N 0 1 383.488 3.023 10 0 GGAEMN Cc1cc(OCCCC(=O)N2CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC2)ccc1Cl ZINC000186653406 206320427 /nfs/dbraw/zinc/32/04/27/206320427.db2.gz HGBJUZJQSUEVBZ-MRXNPFEDSA-N 0 1 396.915 3.205 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2ccc(COc3ccccc3)cc2)CC1 ZINC000186641829 206306294 /nfs/dbraw/zinc/30/62/94/206306294.db2.gz ACNIUBSPBDFEIG-UHFFFAOYSA-N 0 1 396.487 3.277 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2)n[nH]1)N1CCN(c2ccccc2F)CC1 ZINC000007733339 206721888 /nfs/dbraw/zinc/72/18/88/206721888.db2.gz RZLHCHUEYUIGCZ-UHFFFAOYSA-N 0 1 397.479 3.052 10 0 GGAEMN O=C(CN1CCC(C(=O)Nc2ccccc2O)CC1)N(C1=CCCCC1)C1CC1 ZINC000014199193 207015642 /nfs/dbraw/zinc/01/56/42/207015642.db2.gz SNBMQFSTRQXBAE-UHFFFAOYSA-N 0 1 397.519 3.492 10 0 GGAEMN CCN(CCCOc1ccc(OC)cc1)CC(=O)Nc1ccc(NC(C)=O)cc1 ZINC000014198372 207015661 /nfs/dbraw/zinc/01/56/61/207015661.db2.gz ZKPYIYMITNHDAY-UHFFFAOYSA-N 0 1 399.491 3.383 10 0 GGAEMN Cc1nc[nH]c1CN1CCC2(CC1)C(=O)N(CC(C)C)C(=O)N2CCC(C)C ZINC000014539899 207023401 /nfs/dbraw/zinc/02/34/01/207023401.db2.gz HZGQFBYMLJVVKE-UHFFFAOYSA-N 0 1 389.544 3.019 10 0 GGAEMN COc1ccc(CCn2nc(C(=O)N(C)C)c3c2CCN(C2CCCC2)C3)cc1 ZINC000014733665 207028125 /nfs/dbraw/zinc/02/81/25/207028125.db2.gz FOOGCIPUYNVRKX-UHFFFAOYSA-N 0 1 396.535 3.137 10 0 GGAEMN CSc1cccc(NC(=O)CCC2=Nc3ccccc3S(=O)(=O)N2)c1 ZINC000015726018 207056954 /nfs/dbraw/zinc/05/69/54/207056954.db2.gz FBTNOBHDWUAQOR-UHFFFAOYSA-N 0 1 375.475 3.149 10 0 GGAEMN CCCN1CCN(c2ncc3c(n2)CCN(Cc2ccccc2Cl)C3)CC1 ZINC000015779553 207060562 /nfs/dbraw/zinc/06/05/62/207060562.db2.gz MHVKQJYHKAWYES-UHFFFAOYSA-N 0 1 385.943 3.220 10 0 GGAEMN CCN1CCN(c2cc(C)c3cc(NC(=O)c4ccccn4)ccc3n2)CC1 ZINC000015825870 207062169 /nfs/dbraw/zinc/06/21/69/207062169.db2.gz FQGYAONMXPMKFV-UHFFFAOYSA-N 0 1 375.476 3.332 10 0 GGAEMN COc1cn(CC(=O)Nc2cccc(Cl)c2)c(CN2CCCCC2)cc1=O ZINC000016974418 207081653 /nfs/dbraw/zinc/08/16/53/207081653.db2.gz QFBXNEUEPZWQMG-UHFFFAOYSA-N 0 1 389.883 3.135 10 0 GGAEMN O=C(Nn1cnc2scc(-c3ccccc3)c2c1=O)c1[nH]nc2ccccc21 ZINC000017172389 207087111 /nfs/dbraw/zinc/08/71/11/207087111.db2.gz NKNLPEIZVKGKLX-UHFFFAOYSA-N 0 1 387.424 3.385 10 0 GGAEMN Cc1nnc(NC(=O)c2ccc([C@@H]3CCC[N@@H+]3Cc3cccc(O)c3)s2)[n-]1 ZINC000019839762 207166080 /nfs/dbraw/zinc/16/60/80/207166080.db2.gz VXIOCYVWWIYPCS-HNNXBMFYSA-N 0 1 383.477 3.470 10 0 GGAEMN Cc1nnc(NC(=O)c2ccc([C@@H]3CCC[N@H+]3Cc3cccc(O)c3)s2)[n-]1 ZINC000019839762 207166083 /nfs/dbraw/zinc/16/60/83/207166083.db2.gz VXIOCYVWWIYPCS-HNNXBMFYSA-N 0 1 383.477 3.470 10 0 GGAEMN O=C(CN1CCCCC1)Nc1ccc(N2CCn3c4ccccc4nc3C2)cc1 ZINC000019855255 207167074 /nfs/dbraw/zinc/16/70/74/207167074.db2.gz NFMXXCJHQZIVDG-UHFFFAOYSA-N 0 1 389.503 3.481 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)nc2ccc(NC(=S)N3CCCCC3)cc12 ZINC000020153773 207180648 /nfs/dbraw/zinc/18/06/48/207180648.db2.gz AIHIQFKQKQRNDO-UHFFFAOYSA-N 0 1 383.565 3.478 10 0 GGAEMN O=C(C[C@@H]1C(=O)NCCN1C1CCCC1)NCC1(c2ccccc2)CCCCC1 ZINC000020206248 207182396 /nfs/dbraw/zinc/18/23/96/207182396.db2.gz KJLLCWIZFBLNJD-OAQYLSRUSA-N 0 1 397.563 3.138 10 0 GGAEMN CCOC(=O)C1=C(CNCc2cccs2)NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000020213818 207183848 /nfs/dbraw/zinc/18/38/48/207183848.db2.gz ZWCYCCFRPJUECU-SFHVURJKSA-N 0 1 385.489 3.017 10 0 GGAEMN CCOC(=O)C1=C(CN(C)c2ccc(F)cc2)NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020214352 207184038 /nfs/dbraw/zinc/18/40/38/207184038.db2.gz AIONUTCNSBSJHU-HXUWFJFHSA-N 0 1 397.450 3.442 10 0 GGAEMN COc1ccccc1-c1cc(C(=O)N2CCN(Cc3ccccc3)CC2)n[nH]1 ZINC000020285763 207185594 /nfs/dbraw/zinc/18/55/94/207185594.db2.gz UOKSELZIZCJYJK-UHFFFAOYSA-N 0 1 376.460 3.043 10 0 GGAEMN Cc1ccc(-c2cc(C(=O)N3CCN(Cc4ccc(F)cc4)CC3)n[nH]2)cc1 ZINC000020285721 207186475 /nfs/dbraw/zinc/18/64/75/207186475.db2.gz LAAQSLBCGWYDIR-UHFFFAOYSA-N 0 1 378.451 3.482 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cncc(C(=O)N[C@@H]3CCCC[C@H]3C)c2)cc1 ZINC000020532764 207201784 /nfs/dbraw/zinc/20/17/84/207201784.db2.gz YIHNAUBYFRMWGS-DNVCBOLYSA-N 0 1 387.505 3.499 10 0 GGAEMN CCOC(=O)C1=C(CN2CCc3ccccc32)NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000020560210 207202624 /nfs/dbraw/zinc/20/26/24/207202624.db2.gz METKGMVNWKIDHS-NRFANRHFSA-N 0 1 391.471 3.229 10 0 GGAEMN CCOC(=O)C1C(CN2CCc3ccccc32)=NC(=O)N[C@H]1c1ccc(F)cc1 ZINC000020557843 207203781 /nfs/dbraw/zinc/20/37/81/207203781.db2.gz IDRLPOJQRTUBDK-FQEVSTJZSA-N 0 1 395.434 3.060 10 0 GGAEMN CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)Nc1ccc(OC)c(Cl)c1 ZINC000020574926 207204115 /nfs/dbraw/zinc/20/41/15/207204115.db2.gz MHQGSAPAGUHBMO-UHFFFAOYSA-N 0 1 386.857 3.271 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc3c(c2)C(=C(C)C)C(=O)N3)c(OC)c1 ZINC000020577673 207204652 /nfs/dbraw/zinc/20/46/52/207204652.db2.gz YVMQIMSXXXDQNP-UHFFFAOYSA-N 0 1 388.445 3.250 10 0 GGAEMN CC(C)(CC(=O)NCc1cccs1)CC1=Nc2ccccc2S(=O)(=O)N1 ZINC000020618537 207206958 /nfs/dbraw/zinc/20/69/58/207206958.db2.gz GSYHLBSVVHVQEE-UHFFFAOYSA-N 0 1 391.518 3.193 10 0 GGAEMN Cc1c(C(=O)N(C)c2ccccc2C)sc2ncnc(N3CCN(C)CC3)c12 ZINC000021636624 207232663 /nfs/dbraw/zinc/23/26/63/207232663.db2.gz KDYSZXQVYDWTCG-UHFFFAOYSA-N 0 1 395.532 3.337 10 0 GGAEMN Cc1c(C(=O)Nc2ccc(F)cc2)sc2ncnc(N3CCN(C)CC3)c12 ZINC000021636541 207232708 /nfs/dbraw/zinc/23/27/08/207232708.db2.gz FIUHRIUAPYLGQL-UHFFFAOYSA-N 0 1 385.468 3.143 10 0 GGAEMN O=C(NC1CCCC1)c1cncc(NS(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000021748462 207237071 /nfs/dbraw/zinc/23/70/71/207237071.db2.gz JFPFZJUPCHQMLW-UHFFFAOYSA-N 0 1 379.869 3.208 10 0 GGAEMN CCCN1CCN(c2nc3c(cnn3C)c(Nc3ccc(Cl)cc3)n2)CC1 ZINC000021928469 207242508 /nfs/dbraw/zinc/24/25/08/207242508.db2.gz YDEIFNWDKRTXFX-UHFFFAOYSA-N 0 1 385.903 3.292 10 0 GGAEMN C[C@@H](NCc1ccc(S(N)(=O)=O)cc1)c1ccc(Br)s1 ZINC000038001690 207248974 /nfs/dbraw/zinc/24/89/74/207248974.db2.gz DYNCOGSZNDZKFB-SECBINFHSA-N 0 1 375.313 3.009 10 0 GGAEMN C[NH+]1CCN([C@H](c2sc3nc(-c4ccco4)nn3c2[O-])c2ccccc2)CC1 ZINC000022577340 207256227 /nfs/dbraw/zinc/25/62/27/207256227.db2.gz DAOSXKJUJSVTQJ-INIZCTEOSA-N 0 1 395.488 3.093 10 0 GGAEMN CCN1CCN([C@H](c2ccc(Cl)cc2)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022697054 207259031 /nfs/dbraw/zinc/25/90/31/207259031.db2.gz QIHWZKKYKNGLEB-HXUWFJFHSA-N 0 1 389.927 3.263 10 0 GGAEMN CCc1ccc(NC(=O)Cn2cc(OC)c(=O)cc2CN2CCC(C)CC2)cc1 ZINC000022698462 207259560 /nfs/dbraw/zinc/25/95/60/207259560.db2.gz VWKJHJYALYMPIB-UHFFFAOYSA-N 0 1 397.519 3.290 10 0 GGAEMN CCN1CCN([C@H](c2ccccc2Cl)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022696969 207260232 /nfs/dbraw/zinc/26/02/32/207260232.db2.gz NTNCKMSHXMTSRH-HXUWFJFHSA-N 0 1 389.927 3.263 10 0 GGAEMN CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)NC[C@@H](c1ccsc1)N(C)C ZINC000023133357 207270059 /nfs/dbraw/zinc/27/00/59/207270059.db2.gz MYEOOYVRRJEWQP-ROUUACIJSA-N 0 1 379.570 3.188 10 0 GGAEMN Cc1ccccc1CN1CCN(Cn2nc(C(F)(F)F)n(C)c2=S)CC1 ZINC000023323155 207272860 /nfs/dbraw/zinc/27/28/60/207272860.db2.gz WKQRLADPYVRDMG-UHFFFAOYSA-N 0 1 385.459 3.054 10 0 GGAEMN COc1ccc(OCCN2CCN(Cc3ccc(-n4cccn4)cc3)CC2)cc1 ZINC000022946051 207266630 /nfs/dbraw/zinc/26/66/30/207266630.db2.gz WIPHRPFQMVGHLE-UHFFFAOYSA-N 0 1 392.503 3.078 10 0 GGAEMN O=c1cc(C2CC2)nc(-c2cccc(CN3CCN(c4cccnc4)CC3)c2)[nH]1 ZINC000023619996 207280530 /nfs/dbraw/zinc/28/05/30/207280530.db2.gz PWJYUPUEUGWUNB-UHFFFAOYSA-N 0 1 387.487 3.032 10 0 GGAEMN Fc1ccccc1N1CCN(Cn2nc(CN3CCCCC3)oc2=S)CC1 ZINC000024240426 207288557 /nfs/dbraw/zinc/28/85/57/207288557.db2.gz WOKGDNWOPWLULM-UHFFFAOYSA-N 0 1 391.516 3.110 10 0 GGAEMN CCOC(=O)c1ccc(OC[C@@H](O)CN2CCc3sccc3[C@@H]2C)cc1 ZINC000027473804 207325372 /nfs/dbraw/zinc/32/53/72/207325372.db2.gz BWAJFVFSQPXYEZ-HOCLYGCPSA-N 0 1 375.490 3.284 10 0 GGAEMN O=C(NC1CCCCCC1)[C@H]1CCCN(C(=O)c2cc(-c3ccncc3)[nH]n2)C1 ZINC000046017279 207667123 /nfs/dbraw/zinc/66/71/23/207667123.db2.gz HKIFZBXZKVPRIJ-KRWDZBQOSA-N 0 1 395.507 3.163 10 0 GGAEMN COc1ccc2cc(CN3CCN(C)C[C@H]3CO)c(-c3cccs3)nc2c1 ZINC000072407889 208016444 /nfs/dbraw/zinc/01/64/44/208016444.db2.gz JJGGLCXDYWIOSG-KRWDZBQOSA-N 0 1 383.517 3.080 10 0 GGAEMN Cc1cnn(-c2ccc(C(=O)NC[C@@H](c3cccnc3)N3CCCC3)cc2)c1 ZINC000089702524 208107161 /nfs/dbraw/zinc/10/71/61/208107161.db2.gz HBGKPTDHISIZGA-NRFANRHFSA-N 0 1 375.476 3.143 10 0 GGAEMN O=c1[nH]c2ccc([S@](=O)CCN3CCC(Cc4ccccc4)CC3)cc2o1 ZINC000090676933 208113522 /nfs/dbraw/zinc/11/35/22/208113522.db2.gz RXYVUTNKSXMMJS-MHZLTWQESA-N 0 1 384.501 3.183 10 0 GGAEMN CN1CCN([C@H]2CCCCN(C(=O)c3csc(-c4cccs4)n3)C2)CC1 ZINC000095402010 208178456 /nfs/dbraw/zinc/17/84/56/208178456.db2.gz JOPKHNAPIHEYED-HNNXBMFYSA-N 0 1 390.578 3.114 10 0 GGAEMN CN1CCN([C@@H]2CCCCN(C(=O)c3csc(-c4cccs4)n3)C2)CC1 ZINC000095402009 208179038 /nfs/dbraw/zinc/17/90/38/208179038.db2.gz JOPKHNAPIHEYED-OAHLLOKOSA-N 0 1 390.578 3.114 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCN1C[C@@H](C)O ZINC000095408118 208179902 /nfs/dbraw/zinc/17/99/02/208179902.db2.gz BZHPCWHKQXLQCJ-SJLPKXTDSA-N 0 1 384.480 3.183 10 0 GGAEMN Cc1nc(CNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccn12 ZINC000095436616 208180381 /nfs/dbraw/zinc/18/03/81/208180381.db2.gz RISRWGSZNZXECW-UHFFFAOYSA-N 0 1 386.496 3.296 10 0 GGAEMN COCCOc1cccc(C(=O)N2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)c1 ZINC000095441904 208181170 /nfs/dbraw/zinc/18/11/70/208181170.db2.gz YWMMATQSZJFMMG-IBGZPJMESA-N 0 1 392.459 3.474 10 0 GGAEMN COCCOc1cccc(C(=O)N2CCC[C@H]2c2nc(-c3ccccc3)n[nH]2)c1 ZINC000095441904 208181176 /nfs/dbraw/zinc/18/11/76/208181176.db2.gz YWMMATQSZJFMMG-IBGZPJMESA-N 0 1 392.459 3.474 10 0 GGAEMN O=C(NC[C@H]1C[C@@H](O)CN1Cc1ccccc1)C1(c2ccc(F)cc2)CCCC1 ZINC000095446275 208183341 /nfs/dbraw/zinc/18/33/41/208183341.db2.gz XHIDGBOSWSKYDQ-FGZHOGPDSA-N 0 1 396.506 3.389 10 0 GGAEMN C[C@@H](OC(=O)[C@@H]1CCCc2cn[nH]c21)C(=O)Nc1ccc(Br)cc1 ZINC000095443979 208183804 /nfs/dbraw/zinc/18/38/04/208183804.db2.gz NPHQPRADJSJNLX-QMTHXVAHSA-N 0 1 392.253 3.163 10 0 GGAEMN C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)o1 ZINC000095444989 208184986 /nfs/dbraw/zinc/18/49/86/208184986.db2.gz OOIAGFVFXYNQEW-SAJDGTNDSA-N 0 1 382.504 3.087 10 0 GGAEMN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)[C@@H]3C[C@H]3c3nc[nH]n3)CC2)cc1 ZINC000095465164 208187603 /nfs/dbraw/zinc/18/76/03/208187603.db2.gz IUXUZYFGODYFFA-RTBURBONSA-N 0 1 380.492 3.228 10 0 GGAEMN COc1ccc(OCc2nc(CNCCCn3ccccc3=O)cs2)cc1 ZINC000095959241 208243532 /nfs/dbraw/zinc/24/35/32/208243532.db2.gz COGNIKRHKXSONA-UHFFFAOYSA-N 0 1 385.489 3.072 10 0 GGAEMN CC[C@H](NC(=O)c1cc(-c2ccccc2)nc2c1cnn2CC)c1n[nH]c(C)n1 ZINC000095961570 208246274 /nfs/dbraw/zinc/24/62/74/208246274.db2.gz AHSOVGUQVQIURC-KRWDZBQOSA-N 0 1 389.463 3.426 10 0 GGAEMN C[C@@H](CS(=O)(=O)c1ccccc1)N[C@@H](Cc1nccn1C)c1ccccc1 ZINC000095986458 208248245 /nfs/dbraw/zinc/24/82/45/208248245.db2.gz SJRQXUMPXCMFDE-PXNSSMCTSA-N 0 1 383.517 3.156 10 0 GGAEMN CCO[C@H]1C[C@H](N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)C12CCC2 ZINC000096009198 208253392 /nfs/dbraw/zinc/25/33/92/208253392.db2.gz YMCHAQPYLNQVNX-OALUTQOASA-N 0 1 376.928 3.374 10 0 GGAEMN COCCN1C(=O)[C@H](c2ccccc2)CC12CCN(Cc1ccncc1)CC2 ZINC000096061360 208258708 /nfs/dbraw/zinc/25/87/08/208258708.db2.gz QEBOAUJJBIANQU-NRFANRHFSA-N 0 1 379.504 3.079 10 0 GGAEMN C[C@@H]1CN(C(C)(C)CNC(=O)/C=C\c2cccc(Br)c2)C[C@H](C)O1 ZINC000096129755 208266258 /nfs/dbraw/zinc/26/62/58/208266258.db2.gz JOOOJPWXZZWYQJ-VMZPBXKQSA-N 0 1 395.341 3.466 10 0 GGAEMN O=C(Nc1cccc(F)c1)[C@@H]1CCCN(C(=O)c2cc(-c3cccnc3)[nH]n2)C1 ZINC000096324740 208307715 /nfs/dbraw/zinc/30/77/15/208307715.db2.gz OOIVRBZRLQVOCN-OAHLLOKOSA-N 0 1 393.422 3.102 10 0 GGAEMN Cc1ccccc1NC(=O)C1CCN(C(=O)c2cc(-c3ccncc3)[nH]n2)CC1 ZINC000096324581 208308054 /nfs/dbraw/zinc/30/80/54/208308054.db2.gz KDWLANYQHSNUSS-UHFFFAOYSA-N 0 1 389.459 3.271 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2cc(-c3ccno3)sc2C)cc1 ZINC000096323622 208308672 /nfs/dbraw/zinc/30/86/72/208308672.db2.gz FSQKCUORVCKTPR-UHFFFAOYSA-N 0 1 378.431 3.299 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2ccc(OC)c(F)c2)n1 ZINC000096379815 208311810 /nfs/dbraw/zinc/31/18/10/208311810.db2.gz OAZWAHGDPVTNPR-UHFFFAOYSA-N 0 1 394.428 3.192 10 0 GGAEMN CCc1nnc(-c2[nH]c(C)c(S(=O)(=O)Nc3cc(F)cc(F)c3)c2C)o1 ZINC000096379448 208312041 /nfs/dbraw/zinc/31/20/41/208312041.db2.gz PXSXSYNFTOZIQO-UHFFFAOYSA-N 0 1 382.392 3.323 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2ccc(C)c(F)c2)n1 ZINC000096379799 208312320 /nfs/dbraw/zinc/31/23/20/208312320.db2.gz WTJBKEMSHGPTOF-UHFFFAOYSA-N 0 1 378.429 3.492 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2cccc(OC)c2)n1 ZINC000096379777 208312816 /nfs/dbraw/zinc/31/28/16/208312816.db2.gz ZNXLOZXNVYYAFP-UHFFFAOYSA-N 0 1 376.438 3.053 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2ccc(F)cc2C)n1 ZINC000096379803 208312882 /nfs/dbraw/zinc/31/28/82/208312882.db2.gz WCYBESBQLXYPBG-UHFFFAOYSA-N 0 1 378.429 3.492 10 0 GGAEMN COc1cccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nc(C3CC3)no2)c1 ZINC000096379830 208313015 /nfs/dbraw/zinc/31/30/15/208313015.db2.gz IFVDKXPHIWSSHT-UHFFFAOYSA-N 0 1 388.449 3.368 10 0 GGAEMN C[C@@H](Sc1nc(C=Cc2cccs2)n[nH]1)C(=O)NC(=O)NC(C)(C)C ZINC000096940186 208330923 /nfs/dbraw/zinc/33/09/23/208330923.db2.gz WDFHBCCBARDEFO-GQYWMQPJSA-N 0 1 379.511 3.142 10 0 GGAEMN COc1ccc(OC)c(NC(=O)CSc2nc(C=Cc3ccco3)n[nH]2)c1 ZINC000096941432 208331182 /nfs/dbraw/zinc/33/11/82/208331182.db2.gz MFMTXPBYZOTMCK-VURMDHGXSA-N 0 1 386.433 3.316 10 0 GGAEMN COc1cc(NC(=O)CSc2nc(C=Cc3ccco3)n[nH]2)cc(OC)c1 ZINC000096941442 208331679 /nfs/dbraw/zinc/33/16/79/208331679.db2.gz UINSPAJPCCYYCK-WAYWQWQTSA-N 0 1 386.433 3.316 10 0 GGAEMN COc1cccc([C@H](CNC(=O)/C=C\c2cnn(-c3ccccc3)c2)N(C)C)c1 ZINC000096943723 208332276 /nfs/dbraw/zinc/33/22/76/208332276.db2.gz QHHDYHAAYOFFCO-MLUDITRGSA-N 0 1 390.487 3.313 10 0 GGAEMN Cn1cnn(CN2CCN(Cc3ccc(-c4ccccc4)s3)CC2)c1=S ZINC000097029972 208333705 /nfs/dbraw/zinc/33/37/05/208333705.db2.gz SDEXZWSJIGCJOF-UHFFFAOYSA-N 0 1 385.562 3.455 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cccc(OCc2cccnc2)c1 ZINC000097143664 208340701 /nfs/dbraw/zinc/34/07/01/208340701.db2.gz WSRFAWDHKGXLBJ-UHFFFAOYSA-N 0 1 399.454 3.418 10 0 GGAEMN Cc1cccnc1NC(=O)C1CCN([C@@H](C(=O)NC2CC2)c2ccccc2)CC1 ZINC000096747840 208321975 /nfs/dbraw/zinc/32/19/75/208321975.db2.gz OPITZEZPKWWAKX-HXUWFJFHSA-N 0 1 392.503 3.060 10 0 GGAEMN O=C(C=C([O-])C(=O)Nc1ccc(Br)cn1)c1ccc(Cl)cc1 ZINC000100400362 208377455 /nfs/dbraw/zinc/37/74/55/208377455.db2.gz UXBUTXJDDZMMOZ-UHFFFAOYSA-N 0 1 381.613 3.278 10 0 GGAEMN O=C([N-]n1c(=O)c2ccccc2[n-]c1=S)c1cccnc1Oc1ccccc1 ZINC000100253519 208373739 /nfs/dbraw/zinc/37/37/39/208373739.db2.gz PPQKUDLPCBEUBI-UHFFFAOYSA-N 0 1 390.424 3.256 10 0 GGAEMN CCOc1ccccc1NS(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)[C@H]2C ZINC000101665211 208394702 /nfs/dbraw/zinc/39/47/02/208394702.db2.gz GWJAUFNOEHWIBB-ZDUSSCGKSA-N 0 1 386.473 3.282 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@H]1CCCN(C(=O)c2ccccc2Oc2ccccc2)CC1 ZINC000241644495 209019538 /nfs/dbraw/zinc/01/95/38/209019538.db2.gz PRGWPVHHLLTOEC-KRWDZBQOSA-N 0 1 382.460 3.490 10 0 GGAEMN CC(=O)Nc1cccc(NC(=O)Nc2cc(C)cc(N3CCN(C)CC3)c2)c1 ZINC000241653298 209020523 /nfs/dbraw/zinc/02/05/23/209020523.db2.gz PTYTUISQRFHIFK-UHFFFAOYSA-N 0 1 381.480 3.349 10 0 GGAEMN Cc1cc(C)n(-c2ccc(N3CCC[C@@H]3c3n[nH]c(-c4ccccc4)n3)nn2)n1 ZINC000252537527 209037242 /nfs/dbraw/zinc/03/72/42/209037242.db2.gz LNDDPKMNYRPXKK-QGZVFWFLSA-N 0 1 386.463 3.406 10 0 GGAEMN Cc1cc(C)n(-c2ccc(N3CCC[C@@H]3c3nc(-c4ccccc4)n[nH]3)nn2)n1 ZINC000252537527 209037245 /nfs/dbraw/zinc/03/72/45/209037245.db2.gz LNDDPKMNYRPXKK-QGZVFWFLSA-N 0 1 386.463 3.406 10 0 GGAEMN COc1ccc(NC(=O)c2cncc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1 ZINC000009151993 221071124 /nfs/dbraw/zinc/07/11/24/221071124.db2.gz ZSUSAGDFRLWTDM-UHFFFAOYSA-N 0 1 397.456 3.452 10 0 GGAEMN Cc1ccc(NC(=O)CN(C)C(=O)[C@H](C)N[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000012755375 221225295 /nfs/dbraw/zinc/22/52/95/221225295.db2.gz WPISHCYFKVOVJQ-CABCVRRESA-N 0 1 389.446 3.409 10 0 GGAEMN COc1cn(CC(=O)Nc2ccc(C)cc2)c(CN2CCC(C)CC2)cc1=O ZINC000017042277 221376318 /nfs/dbraw/zinc/37/63/18/221376318.db2.gz RWCPLTQBWYHSOV-UHFFFAOYSA-N 0 1 383.492 3.036 10 0 GGAEMN CN1CCN(c2ccc(C(F)(F)F)cc2NC(=O)NCc2ccoc2)CC1 ZINC000058379702 136155378 /nfs/dbraw/zinc/15/53/78/136155378.db2.gz ZTCKZEIMVURXOH-UHFFFAOYSA-N 0 1 382.386 3.372 10 0 GGAEMN O=C(C1=CCN(Cc2cccc(F)c2)CC1)N1CCN(c2ccccc2F)CC1 ZINC000064818082 136157924 /nfs/dbraw/zinc/15/79/24/136157924.db2.gz JMGLYKDHZZDOMX-UHFFFAOYSA-N 0 1 397.469 3.446 10 0 GGAEMN Clc1ccc2nc(Cn3c(CN4CCOCC4)nc4ccccc43)[nH]c2c1 ZINC000073636122 526964131 /nfs/dbraw/zinc/96/41/31/526964131.db2.gz LSRPEABSRDWLHC-UHFFFAOYSA-N 0 1 381.867 3.447 10 0 GGAEMN COc1ccccc1N1CCN([C@@H](C)c2cccc(OCC(=O)N(C)C)c2)CC1 ZINC000097165314 537069035 /nfs/dbraw/zinc/06/90/35/537069035.db2.gz XSEPCUVJKKUXAT-SFHVURJKSA-N 0 1 397.519 3.045 10 0 GGAEMN C[C@H](NCc1ccc(Br)s1)c1ccc(S(N)(=O)=O)cc1 ZINC000036954860 564419622 /nfs/dbraw/zinc/41/96/22/564419622.db2.gz GLZHGYSKZQHXSR-VIFPVBQESA-N 0 1 375.313 3.009 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Cl)cc(Br)c2)CCN1C[C@@H](C)O ZINC000124135931 564472098 /nfs/dbraw/zinc/47/20/98/564472098.db2.gz TZAWXJZXMANFRE-ABAIWWIYSA-N 0 1 389.721 3.020 10 0 GGAEMN C[C@H](NCCN1CCCC1=O)c1ccc(Br)cc1Br ZINC000405371456 565587161 /nfs/dbraw/zinc/58/71/61/565587161.db2.gz CJQYSYVDMSLIHN-JTQLQIEISA-N 0 1 390.119 3.485 10 0 GGAEMN CCOc1c(Br)cc(Br)cc1CNCc1c[nH]nn1 ZINC000398342891 565578183 /nfs/dbraw/zinc/57/81/83/565578183.db2.gz LHSUEDUPWKOGIO-UHFFFAOYSA-N 0 1 390.079 3.018 10 0 GGAEMN O=C([O-])[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2I)C1 ZINC000405270308 565585730 /nfs/dbraw/zinc/58/57/30/565585730.db2.gz UPKYWQYSABGBJS-VIFPVBQESA-N 0 1 379.625 3.241 10 0 GGAEMN O=C([O-])[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2I)C1 ZINC000405270308 565585733 /nfs/dbraw/zinc/58/57/33/565585733.db2.gz UPKYWQYSABGBJS-VIFPVBQESA-N 0 1 379.625 3.241 10 0 GGAEMN CCN1CCC[C@H](NC(=O)c2scc(Br)c2Br)C1 ZINC000528434798 567422721 /nfs/dbraw/zinc/42/27/21/567422721.db2.gz CCRUCAMAFFSNGZ-QMMMGPOBSA-N 0 1 396.148 3.487 10 0 GGAEMN O=C(Nc1ccn(-c2ccncc2)n1)c1n[nH]c2ccc(Br)cc21 ZINC000505814434 564191081 /nfs/dbraw/zinc/19/10/81/564191081.db2.gz XMIKCIMQGRHJMZ-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN CC(C)c1n[nH]c(C(=O)NCc2ccc(F)c(CN(C)C)c2)c1Br ZINC000115417039 564193542 /nfs/dbraw/zinc/19/35/42/564193542.db2.gz HPXFMORRFIIMDT-UHFFFAOYSA-N 0 1 397.292 3.426 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccc(Br)o1 ZINC000116246964 564206082 /nfs/dbraw/zinc/20/60/82/564206082.db2.gz XNWJQHPRVQUCQH-JSGCOSHPSA-N 0 1 378.270 3.078 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1cccc(Br)c1 ZINC000116249251 564206127 /nfs/dbraw/zinc/20/61/27/564206127.db2.gz QIDJAHGNKWXSIN-KDOFPFPSSA-N 0 1 388.309 3.485 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccccc1Br ZINC000116252920 564206615 /nfs/dbraw/zinc/20/66/15/564206615.db2.gz IHVIXMBSAQMEJX-KDOFPFPSSA-N 0 1 388.309 3.485 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1coc(Br)c1 ZINC000116246056 564206668 /nfs/dbraw/zinc/20/66/68/564206668.db2.gz SFYYDWJYGGISPQ-DOMZBBRYSA-N 0 1 378.270 3.078 10 0 GGAEMN Cn1cc([C@H]2CCN(Cc3nc(-c4cccc(Br)c4)no3)C2)cn1 ZINC000116319820 564207427 /nfs/dbraw/zinc/20/74/27/564207427.db2.gz AEDHAOXJBHDVHA-ZDUSSCGKSA-N 0 1 388.269 3.222 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2cc(Br)ccc2C)CCN1CCOC ZINC000117445352 564227333 /nfs/dbraw/zinc/22/73/33/564227333.db2.gz JXILCIHBJQBNDF-HNNXBMFYSA-N 0 1 384.318 3.332 10 0 GGAEMN CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)Nc1cccc(SC)c1 ZINC000006887608 564228822 /nfs/dbraw/zinc/22/88/22/564228822.db2.gz ABWJXRNUIQZNRY-UHFFFAOYSA-N 0 1 382.507 3.341 10 0 GGAEMN O=C(CSC1=Nc2ccccc2S(=O)(=O)N1)Nc1ccccc1Cl ZINC000006918676 564230308 /nfs/dbraw/zinc/23/03/08/564230308.db2.gz RZAJDUBCEMXREM-UHFFFAOYSA-N 0 1 381.866 3.182 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(Cl)cc2)c1C(=O)N1CCCC1 ZINC000006917037 564230317 /nfs/dbraw/zinc/23/03/17/564230317.db2.gz PSXLQOXYWNMTGM-UHFFFAOYSA-N 0 1 381.885 3.322 10 0 GGAEMN CCCc1nc(SCc2cc(=O)n3nc(C(CC)CC)sc3n2)n[nH]1 ZINC000007007174 564230853 /nfs/dbraw/zinc/23/08/53/564230853.db2.gz OKIIXXGYKCSMOM-UHFFFAOYSA-N 0 1 378.527 3.418 10 0 GGAEMN CCCc1n[nH]c(SCc2cc(=O)n3nc(C(CC)CC)sc3n2)n1 ZINC000007007174 564230857 /nfs/dbraw/zinc/23/08/57/564230857.db2.gz OKIIXXGYKCSMOM-UHFFFAOYSA-N 0 1 378.527 3.418 10 0 GGAEMN CCCCc1nn2c(nc(CSc3n[nH]c(CC(C)C)n3)cc2=O)s1 ZINC000007007169 564231276 /nfs/dbraw/zinc/23/12/76/564231276.db2.gz YURPOGTZHVOGKG-UHFFFAOYSA-N 0 1 378.527 3.103 10 0 GGAEMN CCCCc1nn2c(nc(CSc3nc(CC(C)C)n[nH]3)cc2=O)s1 ZINC000007007169 564231278 /nfs/dbraw/zinc/23/12/78/564231278.db2.gz YURPOGTZHVOGKG-UHFFFAOYSA-N 0 1 378.527 3.103 10 0 GGAEMN COC(=O)c1ccc(CN(C)C[C@@H](c2cccs2)N2CCOCC2)s1 ZINC000119002450 564250133 /nfs/dbraw/zinc/25/01/33/564250133.db2.gz ABGUSHGUSKJWAT-HNNXBMFYSA-N 0 1 380.535 3.102 10 0 GGAEMN CCc1cccc(NC(=O)CSC2=Nc3ccccc3S(=O)(=O)N2)c1 ZINC000009530199 564254188 /nfs/dbraw/zinc/25/41/88/564254188.db2.gz LZCOIIWSVLSXMZ-UHFFFAOYSA-N 0 1 375.475 3.091 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)C2(c3ccc(Br)cc3)CC2)[nH]n1 ZINC000119328700 564265947 /nfs/dbraw/zinc/26/59/47/564265947.db2.gz SGUOVGXOIJFCCN-UHFFFAOYSA-N 0 1 386.253 3.243 10 0 GGAEMN CCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1cc(Br)ccc1F ZINC000013123645 564274653 /nfs/dbraw/zinc/27/46/53/564274653.db2.gz KODBONYZOQBXOT-ZDUSSCGKSA-N 0 1 381.205 3.032 10 0 GGAEMN Cn1c(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)nc2ccccc21 ZINC000119736441 564286273 /nfs/dbraw/zinc/28/62/73/564286273.db2.gz BPDNJLZEYPDAMZ-UHFFFAOYSA-N 0 1 397.280 3.411 10 0 GGAEMN Cn1c(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)nc2ccccc21 ZINC000119736441 564286280 /nfs/dbraw/zinc/28/62/80/564286280.db2.gz BPDNJLZEYPDAMZ-UHFFFAOYSA-N 0 1 397.280 3.411 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)C(C)(C)c2cccc(Br)c2)[nH]n1 ZINC000119779572 564287858 /nfs/dbraw/zinc/28/78/58/564287858.db2.gz CPIKBFPQBMKROA-UHFFFAOYSA-N 0 1 388.269 3.489 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cc(Cl)ccc2Br)[nH]n1 ZINC000119823704 564290032 /nfs/dbraw/zinc/29/00/32/564290032.db2.gz MCKHLDDBBKKAEA-UHFFFAOYSA-N 0 1 380.633 3.478 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCCCc2cccc(Br)c2)n[nH]1 ZINC000119879650 564292488 /nfs/dbraw/zinc/29/24/88/564292488.db2.gz WOVKIZJHCCIGHI-GFCCVEGCSA-N 0 1 379.302 3.344 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cc3c(cccc3Br)[nH]2)[nH]n1 ZINC000119865389 564292515 /nfs/dbraw/zinc/29/25/15/564292515.db2.gz YGSPFNTUTWBMLP-UHFFFAOYSA-N 0 1 385.225 3.306 10 0 GGAEMN O=C(Nc1c[nH]cc(Br)c1=O)c1cn[nH]c1-c1ccccc1F ZINC000119950221 564296934 /nfs/dbraw/zinc/29/69/34/564296934.db2.gz HTDNHELATLYOTJ-UHFFFAOYSA-N 0 1 377.173 3.331 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Nc2cccnc2Br)c2ccccc2)n[nH]1 ZINC000119993443 564299029 /nfs/dbraw/zinc/29/90/29/564299029.db2.gz FOFYEWVCDLAENL-ZDUSSCGKSA-N 0 1 387.241 3.182 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCCCc2ccc(Br)cc2F)n[nH]1 ZINC000120286068 564313648 /nfs/dbraw/zinc/31/36/48/564313648.db2.gz HRGFFBXCXCMINQ-LLVKDONJSA-N 0 1 397.292 3.483 10 0 GGAEMN C[C@H]1CCCCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120516114 564323607 /nfs/dbraw/zinc/32/36/07/564323607.db2.gz IOQXWCBBMIJNSL-NSHDSACASA-N 0 1 378.274 3.318 10 0 GGAEMN C[C@H]1CCCCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120516114 564323610 /nfs/dbraw/zinc/32/36/10/564323610.db2.gz IOQXWCBBMIJNSL-NSHDSACASA-N 0 1 378.274 3.318 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H](C)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000023762099 564326492 /nfs/dbraw/zinc/32/64/92/564326492.db2.gz KNEJGHPVULRKOI-QMMMGPOBSA-N 0 1 381.458 3.262 10 0 GGAEMN CCCCN1C(=O)N=NC1S[C@H](C)C(=O)N1CCSc2ccccc21 ZINC000024302308 564329201 /nfs/dbraw/zinc/32/92/01/564329201.db2.gz ZKIGYMSPPSLRHA-GFCCVEGCSA-N 0 1 378.523 3.403 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCC2(c3ccccc3Br)CC2)n[nH]1 ZINC000120668051 564331599 /nfs/dbraw/zinc/33/15/99/564331599.db2.gz VKCHPEIPXDQTDI-GFCCVEGCSA-N 0 1 391.313 3.443 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(C(N)=O)c(Cl)c2)c(Cl)cc1F ZINC000120815356 564338757 /nfs/dbraw/zinc/33/87/57/564338757.db2.gz KTGWRQSWLLEWDN-UHFFFAOYSA-N 0 1 377.224 3.341 10 0 GGAEMN COc1cc(CNC(C)(C)C(=O)NCC(C)(C)C)cc(Br)c1O ZINC000121226650 564359933 /nfs/dbraw/zinc/35/99/33/564359933.db2.gz GSFACFJBERSVJZ-UHFFFAOYSA-N 0 1 387.318 3.194 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)CCCc3cc(Cl)sc3Cl)CCO2)n[nH]1 ZINC000121307404 564363951 /nfs/dbraw/zinc/36/39/51/564363951.db2.gz SRVYARRHMUECBW-LLVKDONJSA-N 0 1 389.308 3.404 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3cccc(Br)c3C)CCO2)n[nH]1 ZINC000121353900 564365915 /nfs/dbraw/zinc/36/59/15/564365915.db2.gz AHSQWPCEHYZGAD-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN C[C@H](NCc1cc(Br)ccc1F)c1ccc(S(N)(=O)=O)cc1 ZINC000121525730 564372883 /nfs/dbraw/zinc/37/28/83/564372883.db2.gz XJFBCVHFPREFFI-JTQLQIEISA-N 0 1 387.274 3.086 10 0 GGAEMN O[C@@H](CN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000121578617 564375611 /nfs/dbraw/zinc/37/56/11/564375611.db2.gz FHRZRRFTKTYTTE-AAEUAGOBSA-N 0 1 375.778 3.493 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(C[S@](C)=O)c2)c(Cl)cc1F ZINC000121601505 564376662 /nfs/dbraw/zinc/37/66/62/564376662.db2.gz YXZVFCLLSWBMPH-JOCHJYFZSA-N 0 1 375.874 3.467 10 0 GGAEMN COc1cc(Cl)c(CN2CCCN(Cc3cnn(C)c3)CC2)cc1Cl ZINC000121605330 564377825 /nfs/dbraw/zinc/37/78/25/564377825.db2.gz GQDMPHIKUDOOJP-UHFFFAOYSA-N 0 1 383.323 3.443 10 0 GGAEMN Brc1cccc(-c2noc(CN3CCCC[C@H]3c3nnc[nH]3)n2)c1 ZINC000121675074 564380404 /nfs/dbraw/zinc/38/04/04/564380404.db2.gz SLSLQNQDUITZNO-ZDUSSCGKSA-N 0 1 389.257 3.344 10 0 GGAEMN C[C@@]1(C(=O)Nc2ccc(F)c(NS(=O)(=O)c3cccs3)c2)CCCO1 ZINC000121718626 564383606 /nfs/dbraw/zinc/38/36/06/564383606.db2.gz VQYYVEMGYOCJRK-INIZCTEOSA-N 0 1 384.454 3.196 10 0 GGAEMN NC(=O)c1ccc(NS(=O)(=O)c2ccccc2Br)cc1Cl ZINC000031720973 564391621 /nfs/dbraw/zinc/39/16/21/564391621.db2.gz ZOFYNQCRHFIWGD-UHFFFAOYSA-N 0 1 389.658 3.002 10 0 GGAEMN CC(C)NC(=O)CSc1nc2c(sc(=S)n2-c2ccccc2)c(=O)[nH]1 ZINC000032948554 564408865 /nfs/dbraw/zinc/40/88/65/564408865.db2.gz UKKAURIWBHNGEF-UHFFFAOYSA-N 0 1 392.531 3.121 10 0 GGAEMN C[C@@H](NCc1ccc(Br)s1)c1ccc(S(N)(=O)=O)cc1 ZINC000036954861 564419330 /nfs/dbraw/zinc/41/93/30/564419330.db2.gz GLZHGYSKZQHXSR-SECBINFHSA-N 0 1 375.313 3.009 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CC3)c(Cl)cc1F ZINC000122781120 564427542 /nfs/dbraw/zinc/42/75/42/564427542.db2.gz SZJOGMLGDYCHJX-UHFFFAOYSA-N 0 1 382.844 3.216 10 0 GGAEMN C[C@@H](NCCC(=O)N(C)C)c1ccc(Br)cc1Br ZINC000041653410 564435847 /nfs/dbraw/zinc/43/58/47/564435847.db2.gz SHISTSDHPRFHSI-SECBINFHSA-N 0 1 378.108 3.341 10 0 GGAEMN C[C@H](NC[C@@H]1COCCO1)c1ccc(Br)cc1Br ZINC000041660410 564436065 /nfs/dbraw/zinc/43/60/65/564436065.db2.gz HQVINFRCYIEZJG-GXSJLCMTSA-N 0 1 379.092 3.278 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)CCN1C ZINC000123440736 564448755 /nfs/dbraw/zinc/44/87/55/564448755.db2.gz OPHMSWANQMJLNS-OCCSQVGLSA-N 0 1 379.353 3.182 10 0 GGAEMN CNC(=O)c1ccc(CN[C@H]2CCOc3ccc(Br)cc32)cc1 ZINC000123857883 564464262 /nfs/dbraw/zinc/46/42/62/564464262.db2.gz CBDNEETUNOOJNU-INIZCTEOSA-N 0 1 375.266 3.422 10 0 GGAEMN C[C@H](C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCOCC1 ZINC000123971892 564467383 /nfs/dbraw/zinc/46/73/83/564467383.db2.gz VWJWEAZNKMCMEI-JTQLQIEISA-N 0 1 379.258 3.235 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(Br)cc3)cc21 ZINC000123973683 564467387 /nfs/dbraw/zinc/46/73/87/564467387.db2.gz WFUNVDCHIIBBGZ-CHWSQXEVSA-N 0 1 399.248 3.167 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3cc(Br)ccc3Cl)cc21 ZINC000124033024 564469272 /nfs/dbraw/zinc/46/92/72/564469272.db2.gz BEZZPNYBMYJAEH-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@@H]3C[C@@H]3c3cccc(Br)c3)cc21 ZINC000124079080 564471518 /nfs/dbraw/zinc/47/15/18/564471518.db2.gz QFZIILLGNZYRCW-CHWSQXEVSA-N 0 1 399.248 3.167 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Cl)cc(Br)c2)CCN1C[C@@H](C)O ZINC000124135705 564472341 /nfs/dbraw/zinc/47/23/41/564472341.db2.gz TZAWXJZXMANFRE-IAQYHMDHSA-N 0 1 389.721 3.020 10 0 GGAEMN C[C@@H]1CN(C2CCN(C(=O)Nc3ccccc3Br)CC2)CCO1 ZINC000124183900 564473929 /nfs/dbraw/zinc/47/39/29/564473929.db2.gz FDVYECWFAJKIHG-CYBMUJFWSA-N 0 1 382.302 3.166 10 0 GGAEMN Cc1ccc(NC(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c(Br)c1 ZINC000124315393 564477539 /nfs/dbraw/zinc/47/75/39/564477539.db2.gz OAJVSDBKDKVRPK-CQSZACIVSA-N 0 1 396.329 3.475 10 0 GGAEMN Cc1ccc(NC(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c(Br)c1 ZINC000124315708 564477558 /nfs/dbraw/zinc/47/75/58/564477558.db2.gz OAJVSDBKDKVRPK-AWEZNQCLSA-N 0 1 396.329 3.475 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N(C)Cc2cc(Br)ccc2F)n[nH]1 ZINC000124566247 564485619 /nfs/dbraw/zinc/48/56/19/564485619.db2.gz UDSJMHINQGQSJK-SNVBAGLBSA-N 0 1 383.265 3.392 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000124569860 564486968 /nfs/dbraw/zinc/48/69/68/564486968.db2.gz GELKHIHCKZNXQZ-BMIGLBTASA-N 0 1 393.285 3.235 10 0 GGAEMN Cc1ccc(Br)cc1NC(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000124810437 564493199 /nfs/dbraw/zinc/49/31/99/564493199.db2.gz DRELVGXWCPJHBO-CQSZACIVSA-N 0 1 396.329 3.475 10 0 GGAEMN Cc1ccc(Br)cc1NC(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000124810642 564493468 /nfs/dbraw/zinc/49/34/68/564493468.db2.gz DRELVGXWCPJHBO-AWEZNQCLSA-N 0 1 396.329 3.475 10 0 GGAEMN O=c1[nH]c2ccc(NS(=O)(=O)c3ccccc3Br)cc2s1 ZINC000046017647 564493518 /nfs/dbraw/zinc/49/35/18/564493518.db2.gz KRFOGMGGZRQFLN-UHFFFAOYSA-N 0 1 385.264 3.153 10 0 GGAEMN CCOC(=O)C1CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000046345356 564501593 /nfs/dbraw/zinc/50/15/93/564501593.db2.gz UWDKUVPNKOOTDW-ZDUSSCGKSA-N 0 1 376.280 3.008 10 0 GGAEMN CN(C)[C@@H](CNC(=O)NCc1cn2cc(Cl)ccc2n1)c1cccs1 ZINC000047832282 564527007 /nfs/dbraw/zinc/52/70/07/564527007.db2.gz UCADGPAXKJFDBQ-AWEZNQCLSA-N 0 1 377.901 3.151 10 0 GGAEMN O=C(NCCCCN1CCOCC1)C1(c2ccc(Br)cc2)CCC1 ZINC000048286517 564535745 /nfs/dbraw/zinc/53/57/45/564535745.db2.gz UMRCREXOOOPWSX-UHFFFAOYSA-N 0 1 395.341 3.099 10 0 GGAEMN O=C(CCCOc1ccc(Cl)cc1Cl)NCCCCN1CCOCC1 ZINC000048284843 564535762 /nfs/dbraw/zinc/53/57/62/564535762.db2.gz YQZLSJODVKCRER-UHFFFAOYSA-N 0 1 389.323 3.381 10 0 GGAEMN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1S(C)(=O)=O)c1cccc(Cl)c1 ZINC000126214811 564540638 /nfs/dbraw/zinc/54/06/38/564540638.db2.gz YCGIMYRVGIUOJP-OLZOCXBDSA-N 0 1 380.897 3.421 10 0 GGAEMN O=c1c(Br)c[nH]cc1NS(=O)(=O)c1c(F)cccc1Cl ZINC000126370287 564546999 /nfs/dbraw/zinc/54/69/99/564546999.db2.gz YQEPPOZBASYOBY-UHFFFAOYSA-N 0 1 381.610 3.143 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc2cccc(Br)c2o1 ZINC000053450329 564588290 /nfs/dbraw/zinc/58/82/90/564588290.db2.gz QVOFAGMOBKAUPK-UHFFFAOYSA-N 0 1 381.270 3.038 10 0 GGAEMN COc1cc(Br)c(CN2CC[C@@H](c3cnn(C)c3)C2)c(OC)c1 ZINC000128397021 564617226 /nfs/dbraw/zinc/61/72/26/564617226.db2.gz HSDBCUOYPZFGPG-GFCCVEGCSA-N 0 1 380.286 3.189 10 0 GGAEMN COc1ccc(C(=O)N(C)C)cc1NS(=O)(=O)c1cccc(Cl)c1C ZINC000055665980 564628880 /nfs/dbraw/zinc/62/88/80/564628880.db2.gz UPQDIPTYSHAIQA-UHFFFAOYSA-N 0 1 382.869 3.160 10 0 GGAEMN COCc1ccc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)o1 ZINC000129240969 564642547 /nfs/dbraw/zinc/64/25/47/564642547.db2.gz VCHQJHYWLBZFAQ-UHFFFAOYSA-N 0 1 377.242 3.263 10 0 GGAEMN COCc1ccc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)o1 ZINC000129240969 564642549 /nfs/dbraw/zinc/64/25/49/564642549.db2.gz VCHQJHYWLBZFAQ-UHFFFAOYSA-N 0 1 377.242 3.263 10 0 GGAEMN COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCN(C2CCOCC2)CC1 ZINC000129411568 564648315 /nfs/dbraw/zinc/64/83/15/564648315.db2.gz DWOZWDKSACAYEC-KRWDZBQOSA-N 0 1 387.307 3.004 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCc3[nH]c4c(cccc4Br)c3C2)C1 ZINC000056752742 564652831 /nfs/dbraw/zinc/65/28/31/564652831.db2.gz NJOORRPSJSPQQS-LBPRGKRZSA-N 0 1 391.313 3.092 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3cccc(C)c3Br)[nH]c21 ZINC000129928666 564664843 /nfs/dbraw/zinc/66/48/43/564664843.db2.gz PQUJPNOHFUIEOG-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCc2nc3cccc(C)c3[nH]2)c(Br)c1 ZINC000129933206 564664953 /nfs/dbraw/zinc/66/49/53/564664953.db2.gz FBVCQWIVUSVWQZ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(Br)cc3)[nH]c21 ZINC000129990887 564666918 /nfs/dbraw/zinc/66/69/18/564666918.db2.gz FSSZQOOPBOIEEW-UHFFFAOYSA-N 0 1 380.267 3.112 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1csc(-c2ccc(Cl)s2)n1 ZINC000057432254 564668059 /nfs/dbraw/zinc/66/80/59/564668059.db2.gz DMZGDUWKIPHHBA-UHFFFAOYSA-N 0 1 385.942 3.367 10 0 GGAEMN COc1cc(Br)c(CNC[C@@H]2COc3ccccc3O2)cc1OC ZINC000057681581 564671441 /nfs/dbraw/zinc/67/14/41/564671441.db2.gz WSCVVUXKTOSBQR-CYBMUJFWSA-N 0 1 394.265 3.396 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)C3(c4cccc(Br)c4)CC3)cc21 ZINC000130357321 564677966 /nfs/dbraw/zinc/67/79/66/564677966.db2.gz BFKQMFQMCXDEKE-UHFFFAOYSA-N 0 1 399.248 3.095 10 0 GGAEMN C[C@@H](N[C@@H](C)c1cccc(Br)c1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000130923416 564696018 /nfs/dbraw/zinc/69/60/18/564696018.db2.gz ZYARFRGLULVFIW-NWDGAFQWSA-N 0 1 390.281 3.226 10 0 GGAEMN O=C(c1[nH]nc(-c2ccccc2)c1Br)N1CCCN(C2CC2)CC1 ZINC000061603925 564707353 /nfs/dbraw/zinc/70/73/53/564707353.db2.gz TZHYDOJHTDMCDP-UHFFFAOYSA-N 0 1 389.297 3.150 10 0 GGAEMN CN(C)c1ccc(Br)c(S(=O)(=O)Nc2cc(O)cc(F)c2)c1 ZINC000131384579 564710273 /nfs/dbraw/zinc/71/02/73/564710273.db2.gz QRMIAITVXJNJTC-UHFFFAOYSA-N 0 1 389.246 3.161 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)c2cc(F)c(Br)cc2Cl)n[nH]1 ZINC000526010880 564716083 /nfs/dbraw/zinc/71/60/83/564716083.db2.gz ZOWQMEGBOAWKHG-UHFFFAOYSA-N 0 1 390.596 3.394 10 0 GGAEMN COc1cc(CN[C@H]2CCN(C3CCCCC3)C2=O)cc(Br)c1O ZINC000131671955 564719404 /nfs/dbraw/zinc/71/94/04/564719404.db2.gz SAAYXCVWPMEIGC-HNNXBMFYSA-N 0 1 397.313 3.187 10 0 GGAEMN CC[C@@H]1CN(CCCOc2cccc(I)c2)CCO1 ZINC000064140650 564726640 /nfs/dbraw/zinc/72/66/40/564726640.db2.gz CKBHKFCPZUMKPU-CQSZACIVSA-N 0 1 375.250 3.171 10 0 GGAEMN Cc1cccc2nc(CNC(=O)N(C)Cc3cc(Br)cn3C)[nH]c21 ZINC000132006820 564731225 /nfs/dbraw/zinc/73/12/25/564731225.db2.gz JPMMJYKKPZFZPI-UHFFFAOYSA-N 0 1 390.285 3.314 10 0 GGAEMN Cc1noc([C@@H]2CCCN(C[C@@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000064638503 564733644 /nfs/dbraw/zinc/73/36/44/564733644.db2.gz LZACBSRJCGZLES-CHWSQXEVSA-N 0 1 386.279 3.304 10 0 GGAEMN CC(C)Cn1ccnc1NC(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000064658668 564733918 /nfs/dbraw/zinc/73/39/18/564733918.db2.gz YFQQUUXOHCCTNC-UHFFFAOYSA-N 0 1 388.269 3.366 10 0 GGAEMN CC(C)CN1CCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2C1=O ZINC000065254822 564741670 /nfs/dbraw/zinc/74/16/70/564741670.db2.gz UZTGLXWPGDKMTA-UHFFFAOYSA-N 0 1 381.885 3.054 10 0 GGAEMN CCc1ccc(S(=O)(=O)N(CCN(C)C)Cc2ccc(F)cc2F)s1 ZINC000065972559 564753673 /nfs/dbraw/zinc/75/36/73/564753673.db2.gz RRQOOHFLSPNOIC-UHFFFAOYSA-N 0 1 388.505 3.341 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)C(=O)NCCCCN1CCOCC1 ZINC000132928502 564758091 /nfs/dbraw/zinc/75/80/91/564758091.db2.gz ISNYLKQEVDUXIN-INIZCTEOSA-N 0 1 397.357 3.246 10 0 GGAEMN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000133053907 564761730 /nfs/dbraw/zinc/76/17/30/564761730.db2.gz GEMQYUNOLDGJHK-LLVKDONJSA-N 0 1 381.263 3.234 10 0 GGAEMN O=C(CCCOc1cccc(Cl)c1Cl)NCCCCN1CCOCC1 ZINC000066315898 564762642 /nfs/dbraw/zinc/76/26/42/564762642.db2.gz UICZRDWNMDBPSO-UHFFFAOYSA-N 0 1 389.323 3.381 10 0 GGAEMN CSc1cc(C(=O)N2CCO[C@H](c3n[nH]c(C)n3)C2)c(Cl)cc1Cl ZINC000133108693 564763079 /nfs/dbraw/zinc/76/30/79/564763079.db2.gz HZXROBNBUMICQM-LBPRGKRZSA-N 0 1 387.292 3.356 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1csc(-c2ccccc2Cl)n1 ZINC000066615521 564771210 /nfs/dbraw/zinc/77/12/10/564771210.db2.gz BVEZBIDIPGVZPX-UHFFFAOYSA-N 0 1 379.913 3.306 10 0 GGAEMN O=C(Cc1c[nH]c2cccc(Br)c12)N1CCN2CCCC[C@@H]2C1 ZINC000133438387 564774350 /nfs/dbraw/zinc/77/43/50/564774350.db2.gz UAQJBTLYCGYWRE-CQSZACIVSA-N 0 1 376.298 3.170 10 0 GGAEMN CS(=O)(=O)c1ccc(OCCSc2nc(-c3ccccc3)n[nH]2)cc1 ZINC000133667273 564782173 /nfs/dbraw/zinc/78/21/73/564782173.db2.gz GZMCRZIOZUHMFL-UHFFFAOYSA-N 0 1 375.475 3.046 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000067653517 564797039 /nfs/dbraw/zinc/79/70/39/564797039.db2.gz NEJVIMIBPZLYAU-BBRMVZONSA-N 0 1 389.323 3.066 10 0 GGAEMN Cc1cc(NC(=O)N[C@H](C)c2nnc[nH]2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000493985410 564814820 /nfs/dbraw/zinc/81/48/20/564814820.db2.gz YZGQNRFLQMAOFJ-SECBINFHSA-N 0 1 380.239 3.488 10 0 GGAEMN CCN(Cc1ccc(Cl)s1)C(=O)c1ccnc(N2CCN(C)CC2)c1 ZINC000068317387 564814918 /nfs/dbraw/zinc/81/49/18/564814918.db2.gz LMLRBOUQAGJDKB-UHFFFAOYSA-N 0 1 378.929 3.211 10 0 GGAEMN CCOc1cccc(CCN[C@@H](C(N)=O)c2ccc(Br)cc2)c1 ZINC000135134168 564823720 /nfs/dbraw/zinc/82/37/20/564823720.db2.gz IEMDPNGDRIOGFE-QGZVFWFLSA-N 0 1 377.282 3.207 10 0 GGAEMN O[C@@H]1CCCC[C@@H]1CNCc1ncc(Br)cc1Br ZINC000135304071 564828016 /nfs/dbraw/zinc/82/80/16/564828016.db2.gz FMJGZKYAZVBRPS-NOZJJQNGSA-N 0 1 378.108 3.247 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1cc2cc(Br)ccc2o1 ZINC000069505471 564840871 /nfs/dbraw/zinc/84/08/71/564840871.db2.gz HOUPMXQREMCDDZ-CQSZACIVSA-N 0 1 381.270 3.036 10 0 GGAEMN COc1cc(CN[C@]2(CO)CCc3ccccc32)cc(Br)c1O ZINC000135899165 564842052 /nfs/dbraw/zinc/84/20/52/564842052.db2.gz YGTWSLPGBYXCRO-SFHVURJKSA-N 0 1 378.266 3.087 10 0 GGAEMN C[C@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000084063647 564868642 /nfs/dbraw/zinc/86/86/42/564868642.db2.gz BQGABDJVAXDGMB-GXSJLCMTSA-N 0 1 390.119 3.483 10 0 GGAEMN COCCN1CCCN(C(=O)c2csc(-c3ccc(Cl)s3)n2)CC1 ZINC000140614899 564872160 /nfs/dbraw/zinc/87/21/60/564872160.db2.gz VTAHMXMJBOAUEC-UHFFFAOYSA-N 0 1 385.942 3.319 10 0 GGAEMN C[N@@H+](Cc1ccc(-n2cncn2)cc1)[C@H](CO)c1cccc(Br)c1 ZINC000093815632 564890499 /nfs/dbraw/zinc/89/04/99/564890499.db2.gz GFHATDWNJSFUPX-GOSISDBHSA-N 0 1 387.281 3.195 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(C)n[nH]c3c2)cc1Cl ZINC000093909135 564892807 /nfs/dbraw/zinc/89/28/07/564892807.db2.gz LJMLLVNAZZUMLX-UHFFFAOYSA-N 0 1 379.825 3.112 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(C)[nH]nc3c2)cc1Cl ZINC000093909135 564892813 /nfs/dbraw/zinc/89/28/13/564892813.db2.gz LJMLLVNAZZUMLX-UHFFFAOYSA-N 0 1 379.825 3.112 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCC2(CCC2)C1 ZINC000151053241 564903531 /nfs/dbraw/zinc/90/35/31/564903531.db2.gz OPCGSBUGKXPZKA-UHFFFAOYSA-N 0 1 390.285 3.320 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCC2(CCC2)C1 ZINC000151053241 564903536 /nfs/dbraw/zinc/90/35/36/564903536.db2.gz OPCGSBUGKXPZKA-UHFFFAOYSA-N 0 1 390.285 3.320 10 0 GGAEMN CC[C@@](O)(CNC(=O)[C@@H]1CCCc2[nH]ncc21)c1ccc(Br)cc1 ZINC000151161581 564908319 /nfs/dbraw/zinc/90/83/19/564908319.db2.gz CYDYGHFAGVXHTM-RDTXWAMCSA-N 0 1 392.297 3.006 10 0 GGAEMN C[C@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)cc1Br ZINC000097996896 564911105 /nfs/dbraw/zinc/91/11/05/564911105.db2.gz MCLNXQFCCWIQIU-JQWIXIFHSA-N 0 1 392.135 3.193 10 0 GGAEMN C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)NCCCCN1CCOCC1 ZINC000101789947 564921974 /nfs/dbraw/zinc/92/19/74/564921974.db2.gz FLWJUEYNNHOPCP-AWEZNQCLSA-N 0 1 388.339 3.336 10 0 GGAEMN C[C@@H](NC(=O)c1c[nH]c2ccc(I)cc2c1=O)C(C)(C)C ZINC000151698410 564933423 /nfs/dbraw/zinc/93/34/23/564933423.db2.gz HISQFIYVBNFXBA-SECBINFHSA-N 0 1 398.244 3.297 10 0 GGAEMN CCC(C)(CC)NC(=O)c1c[nH]c2ccc(I)cc2c1=O ZINC000151730235 564934282 /nfs/dbraw/zinc/93/42/82/564934282.db2.gz NWNLHYKPOYLOFO-UHFFFAOYSA-N 0 1 398.244 3.441 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CC1)Nc1ccc2c(c1)OCO2 ZINC000102924244 564939707 /nfs/dbraw/zinc/93/97/07/564939707.db2.gz FVDCXZBXHFNIAZ-UHFFFAOYSA-N 0 1 389.249 3.395 10 0 GGAEMN C[C@@H]1CC[C@@H](C)N1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000151929064 564940789 /nfs/dbraw/zinc/94/07/89/564940789.db2.gz RYZOCHDYZNQYRT-GHMZBOCLSA-N 0 1 378.274 3.317 10 0 GGAEMN C[C@@H]1CC[C@@H](C)N1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000151929064 564940792 /nfs/dbraw/zinc/94/07/92/564940792.db2.gz RYZOCHDYZNQYRT-GHMZBOCLSA-N 0 1 378.274 3.317 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3ccc(Br)c(C)c3)CCO2)n[nH]1 ZINC000151995699 564943483 /nfs/dbraw/zinc/94/34/83/564943483.db2.gz IWKIRQHWLHOTOJ-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000103286445 564945421 /nfs/dbraw/zinc/94/54/21/564945421.db2.gz TWOSBBIRZDDXBZ-HNNXBMFYSA-N 0 1 378.270 3.334 10 0 GGAEMN Cc1nc([C@H](NC(=O)c2sccc2Br)c2ccccc2)n[nH]1 ZINC000103280935 564945552 /nfs/dbraw/zinc/94/55/52/564945552.db2.gz BHDRWMCBBPEZPY-GFCCVEGCSA-N 0 1 377.267 3.457 10 0 GGAEMN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000103283413 564945645 /nfs/dbraw/zinc/94/56/45/564945645.db2.gz QXWVYWIDPQXQOP-WCQYABFASA-N 0 1 378.270 3.190 10 0 GGAEMN Cc1[nH]c2nc(S(=O)(=O)Cc3ccc(F)cc3)nc-2cc1Br ZINC000152059185 564945652 /nfs/dbraw/zinc/94/56/52/564945652.db2.gz XVIPDXXXOYSFLD-UHFFFAOYSA-N 0 1 384.230 3.142 10 0 GGAEMN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1cccs1 ZINC000152143417 564948273 /nfs/dbraw/zinc/94/82/73/564948273.db2.gz FOWYTCMSMUSUER-CQSZACIVSA-N 0 1 386.564 3.071 10 0 GGAEMN O[C@H](COc1cc(Cl)ccc1Cl)CN1CC[C@H](Oc2cccnc2)C1 ZINC000152220407 564951204 /nfs/dbraw/zinc/95/12/04/564951204.db2.gz NVJRGLSHVPSAPG-HOCLYGCPSA-N 0 1 383.275 3.281 10 0 GGAEMN C[C@H](C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1)c1ccc(Br)cc1 ZINC000152361258 564956315 /nfs/dbraw/zinc/95/63/15/564956315.db2.gz BWLZQXHVHTWWGG-VIFPVBQESA-N 0 1 387.237 3.167 10 0 GGAEMN COCc1c(Br)cccc1NC(=O)N1CCN2CCCC[C@@H]2C1 ZINC000105028541 564962582 /nfs/dbraw/zinc/96/25/82/564962582.db2.gz IVRJLADIBOYOIP-CYBMUJFWSA-N 0 1 382.302 3.298 10 0 GGAEMN C[C@H]1CCC[C@@H]1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000105570341 564968829 /nfs/dbraw/zinc/96/88/29/564968829.db2.gz CCBQTNMTGVJDSB-GWCFXTLKSA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@H]1CCC[C@@H]1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000105570341 564968832 /nfs/dbraw/zinc/96/88/32/564968832.db2.gz CCBQTNMTGVJDSB-GWCFXTLKSA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@@H]1CCC[C@H]1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000105570344 564968870 /nfs/dbraw/zinc/96/88/70/564968870.db2.gz CCBQTNMTGVJDSB-ZWNOBZJWSA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@@H]1CCC[C@H]1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000105570344 564968873 /nfs/dbraw/zinc/96/88/73/564968873.db2.gz CCBQTNMTGVJDSB-ZWNOBZJWSA-N 0 1 378.274 3.222 10 0 GGAEMN COC(=O)c1cccc(CS(=O)(=O)Nc2cc(Cl)c(Cl)cn2)c1 ZINC000152836832 564973680 /nfs/dbraw/zinc/97/36/80/564973680.db2.gz VBDCOJXXFMTGIE-UHFFFAOYSA-N 0 1 375.233 3.117 10 0 GGAEMN COc1ccsc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000106022701 564976355 /nfs/dbraw/zinc/97/63/55/564976355.db2.gz OEJSIDFXAQWSJB-UHFFFAOYSA-N 0 1 393.266 3.234 10 0 GGAEMN COc1ccsc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000106022701 564976358 /nfs/dbraw/zinc/97/63/58/564976358.db2.gz OEJSIDFXAQWSJB-UHFFFAOYSA-N 0 1 393.266 3.234 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2cccc(Cl)c2Cl)C[C@H]1CC ZINC000106119094 564977714 /nfs/dbraw/zinc/97/77/14/564977714.db2.gz NQGOLLZRMFOFTI-CQSZACIVSA-N 0 1 388.339 3.365 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1CC ZINC000106119128 564977772 /nfs/dbraw/zinc/97/77/72/564977772.db2.gz GUSBFKAYLFKABL-CQSZACIVSA-N 0 1 388.339 3.365 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)C[C@@H]1CC ZINC000106119427 564978502 /nfs/dbraw/zinc/97/85/02/564978502.db2.gz PMCQTPVEXDLIPG-HNNXBMFYSA-N 0 1 388.339 3.365 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3cc(F)ccc3Br)CC2)cn1 ZINC000106154494 564979335 /nfs/dbraw/zinc/97/93/35/564979335.db2.gz JATOUSJIPFOWAC-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN Cn1ccnc1CC1CCN(C[C@@H](O)c2cccc(Br)c2)CC1 ZINC000106165581 564979370 /nfs/dbraw/zinc/97/93/70/564979370.db2.gz PCBYLHQMZAJBNC-QGZVFWFLSA-N 0 1 378.314 3.171 10 0 GGAEMN Cn1ccnc1CC1CCN(C[C@H](O)c2cccc(Br)c2)CC1 ZINC000106165579 564979618 /nfs/dbraw/zinc/97/96/18/564979618.db2.gz PCBYLHQMZAJBNC-KRWDZBQOSA-N 0 1 378.314 3.171 10 0 GGAEMN Cn1cc(CN2CCCN(CCOc3cc(Cl)ccc3Cl)CC2)cn1 ZINC000106156510 564979655 /nfs/dbraw/zinc/97/96/55/564979655.db2.gz JZYOFVDBGREOLO-UHFFFAOYSA-N 0 1 383.323 3.314 10 0 GGAEMN CCN(CC(=O)N1CCC[C@@H]1c1ccc(I)cc1)C1CC1 ZINC000153165200 564986606 /nfs/dbraw/zinc/98/66/06/564986606.db2.gz MTTQBHZIBRLWFN-MRXNPFEDSA-N 0 1 398.288 3.439 10 0 GGAEMN Cc1ccc(Br)c(C(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c1 ZINC000153546004 564999651 /nfs/dbraw/zinc/99/96/51/564999651.db2.gz YQTPGDAQHKCELN-AWEZNQCLSA-N 0 1 381.314 3.083 10 0 GGAEMN Brc1ccc(-c2nc(CNc3ncnc4ccncc43)n[nH]2)cc1 ZINC000502746047 565004274 /nfs/dbraw/zinc/00/42/74/565004274.db2.gz BKLZPKKIPHCCQO-UHFFFAOYSA-N 0 1 382.225 3.185 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNc3ncnc4ccncc43)n2)cc1 ZINC000502746047 565004277 /nfs/dbraw/zinc/00/42/77/565004277.db2.gz BKLZPKKIPHCCQO-UHFFFAOYSA-N 0 1 382.225 3.185 10 0 GGAEMN Cc1cc(Br)cc2cc(C(=O)NCCCCN3CCOCC3)oc21 ZINC000153654343 565005016 /nfs/dbraw/zinc/00/50/16/565005016.db2.gz YPUPZJLQWMHQQY-UHFFFAOYSA-N 0 1 395.297 3.346 10 0 GGAEMN C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000153836743 565013479 /nfs/dbraw/zinc/01/34/79/565013479.db2.gz VNZIUCZQZKPEGN-ZYHUDNBSSA-N 0 1 382.835 3.216 10 0 GGAEMN O=C(Nc1nc(-c2ccsc2)ns1)c1ccc2c(=O)[nH]c(=S)[nH]c2c1 ZINC000109695408 565030019 /nfs/dbraw/zinc/03/00/19/565030019.db2.gz ATRMVRBFWGPFHR-UHFFFAOYSA-N 0 1 387.471 3.044 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2Br)n[nH]1)Nc1ccncc1 ZINC000154317026 565033294 /nfs/dbraw/zinc/03/32/94/565033294.db2.gz PDUJHCGUIXUXKA-UHFFFAOYSA-N 0 1 390.266 3.360 10 0 GGAEMN Cc1ncc(Cl)c(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)n1 ZINC000154644040 565047340 /nfs/dbraw/zinc/04/73/40/565047340.db2.gz GBSKDHCPHCXNRM-UHFFFAOYSA-N 0 1 379.291 3.486 10 0 GGAEMN COc1ccc2c(c1)[nH]nc2NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000505101258 565048719 /nfs/dbraw/zinc/04/87/19/565048719.db2.gz RNIQGGUCADXIKT-UHFFFAOYSA-N 0 1 386.209 3.463 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H](C(=O)OC)c1cccc(Br)c1 ZINC000154677791 565048946 /nfs/dbraw/zinc/04/89/46/565048946.db2.gz LPDQWTQQQPJSJW-NSHDSACASA-N 0 1 386.271 3.163 10 0 GGAEMN CCc1c(NC(=O)[C@H]2C[C@@H]2C(=O)OC)[nH]nc1-c1ccc(Br)cc1 ZINC000111148505 565051355 /nfs/dbraw/zinc/05/13/55/565051355.db2.gz SQCCFNYKGNECQB-STQMWFEESA-N 0 1 392.253 3.149 10 0 GGAEMN CC(=O)c1ccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1 ZINC000111596189 565055622 /nfs/dbraw/zinc/05/56/22/565055622.db2.gz FCDAJPROAKSSLA-UHFFFAOYSA-N 0 1 399.248 3.367 10 0 GGAEMN CC(=O)c1ccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1 ZINC000111596189 565055624 /nfs/dbraw/zinc/05/56/24/565055624.db2.gz FCDAJPROAKSSLA-UHFFFAOYSA-N 0 1 399.248 3.367 10 0 GGAEMN CCCN(C[C@H](O)CN1CCCC1=O)[C@@H](C)c1ccccc1Br ZINC000111684286 565057067 /nfs/dbraw/zinc/05/70/67/565057067.db2.gz DEQVANPCKBZXJA-GJZGRUSLSA-N 0 1 383.330 3.205 10 0 GGAEMN CCCc1cc(NC(=O)c2cc(=O)c3cc(Br)ccc3[nH]2)n[nH]1 ZINC000112638068 565065290 /nfs/dbraw/zinc/06/52/90/565065290.db2.gz PZSRIPPLRJWITL-UHFFFAOYSA-N 0 1 375.226 3.219 10 0 GGAEMN C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000113305425 565069364 /nfs/dbraw/zinc/06/93/64/565069364.db2.gz HBDLBULIPSKRTD-CMPLNLGQSA-N 0 1 382.835 3.216 10 0 GGAEMN O=C(CCCCc1ccc(Br)cc1)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000155582709 565069630 /nfs/dbraw/zinc/06/96/30/565069630.db2.gz HLMMPOYTXBQZRU-AWEZNQCLSA-N 0 1 392.301 3.081 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000113408084 565069899 /nfs/dbraw/zinc/06/98/99/565069899.db2.gz QCVJKJUBEFAPDW-MRXNPFEDSA-N 0 1 386.323 3.392 10 0 GGAEMN CCCc1cc(C(=O)N2CCN(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000155752371 565071296 /nfs/dbraw/zinc/07/12/96/565071296.db2.gz XYICLWFERHJFRV-UHFFFAOYSA-N 0 1 391.313 3.083 10 0 GGAEMN Cc1cc(NC(=O)[C@@H](C)N[C@H](CO)c2ccccc2)ccc1Br ZINC000183626269 565083592 /nfs/dbraw/zinc/08/35/92/565083592.db2.gz MKCQHRXJHUEUNF-CXAGYDPISA-N 0 1 377.282 3.408 10 0 GGAEMN Cc1cc(NC(=O)[C@@H](C)N[C@@H](CO)c2ccccc2)ccc1Br ZINC000183626231 565083852 /nfs/dbraw/zinc/08/38/52/565083852.db2.gz MKCQHRXJHUEUNF-DYVFJYSZSA-N 0 1 377.282 3.408 10 0 GGAEMN C[C@@H](CN[C@H](c1ccco1)c1ccc(Br)cc1)N1CCOCC1 ZINC000183692442 565088807 /nfs/dbraw/zinc/08/88/07/565088807.db2.gz UIIILEDAMJWQAZ-KSSFIOAISA-N 0 1 379.298 3.442 10 0 GGAEMN C[C@@H](Oc1ccccc1Br)C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000369408524 565091460 /nfs/dbraw/zinc/09/14/60/565091460.db2.gz POVKQJMTFLYTQY-GFCCVEGCSA-N 0 1 378.270 3.346 10 0 GGAEMN C[C@H]1C[C@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@@H+]1C ZINC000292013382 565092173 /nfs/dbraw/zinc/09/21/73/565092173.db2.gz UQYVPGGDVYDGDH-NWDGAFQWSA-N 0 1 392.297 3.258 10 0 GGAEMN C[C@H]1C[C@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@H+]1C ZINC000292013382 565092177 /nfs/dbraw/zinc/09/21/77/565092177.db2.gz UQYVPGGDVYDGDH-NWDGAFQWSA-N 0 1 392.297 3.258 10 0 GGAEMN C[C@H]1C[C@@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@@H+]1C ZINC000292013385 565092634 /nfs/dbraw/zinc/09/26/34/565092634.db2.gz UQYVPGGDVYDGDH-RYUDHWBXSA-N 0 1 392.297 3.258 10 0 GGAEMN C[C@H]1C[C@@H](N(C)C(=O)c2c([O-])cnc3c(Br)cccc32)CC[N@H+]1C ZINC000292013385 565092635 /nfs/dbraw/zinc/09/26/35/565092635.db2.gz UQYVPGGDVYDGDH-RYUDHWBXSA-N 0 1 392.297 3.258 10 0 GGAEMN O=C1O[C@H](CN[C@H](CO)c2cccc(Br)c2)CN1c1ccccc1 ZINC000183918549 565104355 /nfs/dbraw/zinc/10/43/55/565104355.db2.gz VWCQBPMXULXCPT-IAGOWNOFSA-N 0 1 391.265 3.098 10 0 GGAEMN O=C1O[C@@H](CN[C@H](CO)c2cccc(Br)c2)CN1c1ccccc1 ZINC000183918525 565104509 /nfs/dbraw/zinc/10/45/09/565104509.db2.gz VWCQBPMXULXCPT-DLBZAZTESA-N 0 1 391.265 3.098 10 0 GGAEMN Cc1ccnc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000184082016 565113294 /nfs/dbraw/zinc/11/32/94/565113294.db2.gz LQYGIUUAKCCQNA-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1ccnc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000184082016 565113299 /nfs/dbraw/zinc/11/32/99/565113299.db2.gz LQYGIUUAKCCQNA-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN COc1cccc2c1nc(NC(=O)c1ccc(Br)c(O)c1)n2C ZINC000184140861 565115854 /nfs/dbraw/zinc/11/58/54/565115854.db2.gz XPTPFHUVRUGVDI-UHFFFAOYSA-N 0 1 376.210 3.302 10 0 GGAEMN O=C(Nc1cccc(Cl)c1O)c1cc2c(cc1Br)NC(=O)CO2 ZINC000184137673 565116177 /nfs/dbraw/zinc/11/61/77/565116177.db2.gz WFDZINZHBIBAEW-UHFFFAOYSA-N 0 1 397.612 3.391 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCC[C@@H]2c2ccc(Br)cc2)[nH]1 ZINC000369951144 565119783 /nfs/dbraw/zinc/11/97/83/565119783.db2.gz LOBVODAYSSVHNO-CYBMUJFWSA-N 0 1 381.299 3.331 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CCC[C@@H]2c2ccc(Br)cc2)n1 ZINC000369951144 565119789 /nfs/dbraw/zinc/11/97/89/565119789.db2.gz LOBVODAYSSVHNO-CYBMUJFWSA-N 0 1 381.299 3.331 10 0 GGAEMN O=C(CN[C@@H](c1nnc[nH]1)c1ccccc1)Nc1cccc(Cl)c1Cl ZINC000370071531 565126678 /nfs/dbraw/zinc/12/66/78/565126678.db2.gz HLQKDLUDXFXTOT-MRXNPFEDSA-N 0 1 376.247 3.429 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)N[C@H](c1nccs1)C(F)(F)F ZINC000292744558 565132226 /nfs/dbraw/zinc/13/22/26/565132226.db2.gz HQIFXHWBKFRGHX-SNVBAGLBSA-N 0 1 386.804 3.387 10 0 GGAEMN CCOC(=O)C[C@H](NC(=O)CSc1n[nH]c(=S)s1)c1ccccc1C ZINC000267833135 565133001 /nfs/dbraw/zinc/13/30/01/565133001.db2.gz XINFAFGBTKFCAZ-LBPRGKRZSA-N 0 1 397.547 3.038 10 0 GGAEMN O=S1(=O)CCC(CN2CCC(c3cccc(Br)c3)CC2)CC1 ZINC000370213651 565133031 /nfs/dbraw/zinc/13/30/31/565133031.db2.gz WXKAXJVELHLZTM-UHFFFAOYSA-N 0 1 386.355 3.453 10 0 GGAEMN O=C(CSCC(=O)N1CCC(c2cnc[nH]2)CC1)c1ccc(Cl)cc1 ZINC000370245737 565134344 /nfs/dbraw/zinc/13/43/44/565134344.db2.gz YHRYXNOJAITSBQ-UHFFFAOYSA-N 0 1 377.897 3.385 10 0 GGAEMN O=C(CCOc1ccccc1Br)N1CCC(c2cnc[nH]2)CC1 ZINC000370244378 565135047 /nfs/dbraw/zinc/13/50/47/565135047.db2.gz RIRKNOQGEAQPOI-UHFFFAOYSA-N 0 1 378.270 3.347 10 0 GGAEMN Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000370415133 565142233 /nfs/dbraw/zinc/14/22/33/565142233.db2.gz MFLPPEUCLSHUTC-OAHLLOKOSA-N 0 1 388.269 3.345 10 0 GGAEMN COc1ccc(Br)cc1CN(C)C(=O)[C@H]1CCCc2[nH]ncc21 ZINC000268191633 565143306 /nfs/dbraw/zinc/14/33/06/565143306.db2.gz ZUXMKAQEHRQWBP-ZDUSSCGKSA-N 0 1 378.270 3.259 10 0 GGAEMN COc1cc(C)c(Br)cc1NC(=O)N1CCN2CCCC[C@@H]2C1 ZINC000184549560 565143772 /nfs/dbraw/zinc/14/37/72/565143772.db2.gz MVJRHXSJEOEPCA-CYBMUJFWSA-N 0 1 382.302 3.468 10 0 GGAEMN Cc1ccc(I)c(C(=O)Nc2nc(C3CCC3)n[nH]2)c1 ZINC000184563171 565144275 /nfs/dbraw/zinc/14/42/75/565144275.db2.gz LXVGYBHGCWDQHS-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN Cc1ccc(I)c(C(=O)Nc2n[nH]c(C3CCC3)n2)c1 ZINC000184563171 565144280 /nfs/dbraw/zinc/14/42/80/565144280.db2.gz LXVGYBHGCWDQHS-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN O=C(N[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCCc2[nH]ncc21 ZINC000268191649 565144768 /nfs/dbraw/zinc/14/47/68/565144768.db2.gz ZWDLOXNATRFHAP-RISCZKNCSA-N 0 1 376.254 3.232 10 0 GGAEMN COc1ccc(CCNCc2c(Br)cnn2C)c(Cl)c1OC ZINC000293010620 565145601 /nfs/dbraw/zinc/14/56/01/565145601.db2.gz PRAVOPXIKWBDDF-UHFFFAOYSA-N 0 1 388.693 3.186 10 0 GGAEMN CCOc1c(Br)cc(C(=O)Nc2nc(C3CCC3)n[nH]2)cc1OC ZINC000184583612 565146447 /nfs/dbraw/zinc/14/64/47/565146447.db2.gz KTHBOWZNGBLJOG-UHFFFAOYSA-N 0 1 395.257 3.494 10 0 GGAEMN CCOc1c(Br)cc(C(=O)Nc2n[nH]c(C3CCC3)n2)cc1OC ZINC000184583612 565146450 /nfs/dbraw/zinc/14/64/50/565146450.db2.gz KTHBOWZNGBLJOG-UHFFFAOYSA-N 0 1 395.257 3.494 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)NC(=O)CCSc1nnc(C)[nH]1 ZINC000268485142 565154323 /nfs/dbraw/zinc/15/43/23/565154323.db2.gz FOTXVVVPZMUODP-CYBMUJFWSA-N 0 1 397.342 3.495 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)N[C@H]2CCc3nc[nH]c3C2)cc1Br ZINC000370672131 565155693 /nfs/dbraw/zinc/15/56/93/565155693.db2.gz BOAHKJFUOOTNBT-PWSUYJOCSA-N 0 1 393.285 3.099 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Nc2ccc(I)cc2)n[nH]1 ZINC000158260854 565162415 /nfs/dbraw/zinc/16/24/15/565162415.db2.gz LDGKNAJHZARCEQ-VIFPVBQESA-N 0 1 384.221 3.075 10 0 GGAEMN COC1(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCCCC1 ZINC000184884141 565164057 /nfs/dbraw/zinc/16/40/57/565164057.db2.gz JKYCYJIBRPABLZ-UHFFFAOYSA-N 0 1 393.285 3.200 10 0 GGAEMN COC1(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCCCC1 ZINC000184884141 565164059 /nfs/dbraw/zinc/16/40/59/565164059.db2.gz JKYCYJIBRPABLZ-UHFFFAOYSA-N 0 1 393.285 3.200 10 0 GGAEMN CC(C)C(=O)NC[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000184962308 565167153 /nfs/dbraw/zinc/16/71/53/565167153.db2.gz YOUNNOKDBPPWAW-CYBMUJFWSA-N 0 1 393.329 3.310 10 0 GGAEMN O=C(NCC1CC1)[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000184948076 565167317 /nfs/dbraw/zinc/16/73/17/565167317.db2.gz CXENTSSZTDVLJP-CYBMUJFWSA-N 0 1 391.313 3.064 10 0 GGAEMN FC(F)(F)CN1CCCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000184945646 565167596 /nfs/dbraw/zinc/16/75/96/565167596.db2.gz IFMLSGKXPWRPTR-UHFFFAOYSA-N 0 1 391.235 3.395 10 0 GGAEMN CCO[C@H]1C[C@@H](O)C12CCN(Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000184974174 565168563 /nfs/dbraw/zinc/16/85/63/565168563.db2.gz VNTZVAFLDONMOC-CVEARBPZSA-N 0 1 394.313 3.077 10 0 GGAEMN Cc1nc(C[C@H]2CCCN(Cc3nc4ccc(Br)cc4[nH]3)C2)no1 ZINC000184964916 565168579 /nfs/dbraw/zinc/16/85/79/565168579.db2.gz VPAYIQCKLKEDMQ-GFCCVEGCSA-N 0 1 390.285 3.472 10 0 GGAEMN Brc1ccc2nc(CN3CCCC[C@H]3CN3CCOCC3)[nH]c2c1 ZINC000184976174 565169220 /nfs/dbraw/zinc/16/92/20/565169220.db2.gz RDSXGCJONIIYJJ-HNNXBMFYSA-N 0 1 393.329 3.012 10 0 GGAEMN CCn1cnnc1[C@@H]1CCCN(C[C@H](O)c2ccc(F)c(Br)c2)C1 ZINC000184993496 565170833 /nfs/dbraw/zinc/17/08/33/565170833.db2.gz GTCRAKPMIDTYOW-CJNGLKHVSA-N 0 1 397.292 3.113 10 0 GGAEMN CCn1cnnc1[C@H]1CCCN(C[C@H](O)c2ccc(F)c(Br)c2)C1 ZINC000184993512 565170878 /nfs/dbraw/zinc/17/08/78/565170878.db2.gz GTCRAKPMIDTYOW-BBRMVZONSA-N 0 1 397.292 3.113 10 0 GGAEMN Oc1ccccc1N1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000158637325 565176566 /nfs/dbraw/zinc/17/65/66/565176566.db2.gz AYCSLMDXUFNNTI-UHFFFAOYSA-N 0 1 387.281 3.353 10 0 GGAEMN Cc1ccc(CNCc2cnc(N3CCOCC3)c(F)c2)cc1Br ZINC000185078889 565176583 /nfs/dbraw/zinc/17/65/83/565176583.db2.gz AMVKQZITNVBLKR-UHFFFAOYSA-N 0 1 394.288 3.418 10 0 GGAEMN Cc1noc(C2CCN(C[C@@](C)(O)c3ccc(Br)cc3F)CC2)n1 ZINC000293617724 565177416 /nfs/dbraw/zinc/17/74/16/565177416.db2.gz VYKZJLTZPOPLLG-QGZVFWFLSA-N 0 1 398.276 3.367 10 0 GGAEMN CC(C)N(C)C(=O)C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000158693206 565178286 /nfs/dbraw/zinc/17/82/86/565178286.db2.gz QVGLMCGFMFMXAQ-UHFFFAOYSA-N 0 1 393.329 3.404 10 0 GGAEMN CCc1ncsc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000158701303 565178404 /nfs/dbraw/zinc/17/84/04/565178404.db2.gz FMQFFQZBBNHFSC-UHFFFAOYSA-N 0 1 392.282 3.183 10 0 GGAEMN CCc1ncsc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000158701303 565178411 /nfs/dbraw/zinc/17/84/11/565178411.db2.gz FMQFFQZBBNHFSC-UHFFFAOYSA-N 0 1 392.282 3.183 10 0 GGAEMN CCc1nc(CN2CCC[C@H]2c2ccc(I)cc2)n[nH]1 ZINC000158753102 565180091 /nfs/dbraw/zinc/18/00/91/565180091.db2.gz WKBVRZQVQBAUEW-ZDUSSCGKSA-N 0 1 382.249 3.309 10 0 GGAEMN O=C(Nc1ccc2[nH]nnc2c1)c1ncc(Br)cc1Br ZINC000185173051 565182865 /nfs/dbraw/zinc/18/28/65/565182865.db2.gz NTZZOSZKLOMAKT-UHFFFAOYSA-N 0 1 397.030 3.130 10 0 GGAEMN C[C@@](O)(CN1CCCN(CC(F)F)CC1)c1ccc(Br)cc1F ZINC000293778027 565184001 /nfs/dbraw/zinc/18/40/01/565184001.db2.gz LNNIIAVLXQYZLS-MRXNPFEDSA-N 0 1 395.263 3.069 10 0 GGAEMN Cc1cc(C)n2c(CN3CCC(n4cc(Br)cn4)CC3)cnc2n1 ZINC000371332618 565187142 /nfs/dbraw/zinc/18/71/42/565187142.db2.gz AGEYBCSJOFJRBD-UHFFFAOYSA-N 0 1 389.301 3.142 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371362442 565188891 /nfs/dbraw/zinc/18/88/91/565188891.db2.gz WDTDAFFWGGPQSQ-ZYHUDNBSSA-N 0 1 380.261 3.164 10 0 GGAEMN CCN1CC[C@H]2OCCN(C(=O)c3csc(-c4ccc(Cl)s4)n3)[C@H]2C1 ZINC000293940829 565191985 /nfs/dbraw/zinc/19/19/85/565191985.db2.gz QUQHDGWAHFFCLV-QWHCGFSZSA-N 0 1 397.953 3.460 10 0 GGAEMN O=C(CCNC(=O)[C@@H]1CCCc2[nH]ncc21)Nc1cc(Cl)cc(Cl)c1 ZINC000293963811 565192107 /nfs/dbraw/zinc/19/21/07/565192107.db2.gz FHBVGXDNXHZUPI-CYBMUJFWSA-N 0 1 381.263 3.281 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H]1CCOC2(CCSCC2)C1)c1ccsc1 ZINC000269555903 565194518 /nfs/dbraw/zinc/19/45/18/565194518.db2.gz ZEPWOGPJBHVFOM-JKSUJKDBSA-N 0 1 383.583 3.095 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159156032 565196648 /nfs/dbraw/zinc/19/66/48/565196648.db2.gz ACLSMGYRGPINKX-ZDUSSCGKSA-N 0 1 379.302 3.206 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(F)cc(Br)c1 ZINC000371554354 565200141 /nfs/dbraw/zinc/20/01/41/565200141.db2.gz RDIHPGMAIXFFJX-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C(=O)Nc3ccc(Cl)cc3Cl)[nH]c21 ZINC000159327328 565202141 /nfs/dbraw/zinc/20/21/41/565202141.db2.gz VAUVMKLVKXZCFQ-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C(=O)Nc3cccc(Cl)c3Cl)[nH]c21 ZINC000159327760 565202649 /nfs/dbraw/zinc/20/26/49/565202649.db2.gz USYSYKNKYRLBFZ-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1ccccc1I ZINC000371680148 565204681 /nfs/dbraw/zinc/20/46/81/565204681.db2.gz YCYUXMHARQNBOO-UHFFFAOYSA-N 0 1 390.184 3.329 10 0 GGAEMN O=c1oc(-c2ccc(F)cc2)nn1Cc1nc2ccc(Br)cc2[nH]1 ZINC000185499813 565205569 /nfs/dbraw/zinc/20/55/69/565205569.db2.gz RHQJYNPFEMRBKF-UHFFFAOYSA-N 0 1 389.184 3.330 10 0 GGAEMN O=C(Nc1cc(-c2ccc(Br)s2)[nH]n1)[C@H]1CCc2[nH]cnc2C1 ZINC000616798598 565209097 /nfs/dbraw/zinc/20/90/97/565209097.db2.gz FDBUMGCEXXGSRW-QMMMGPOBSA-N 0 1 392.282 3.367 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC(OCC2CC2)CC1 ZINC000371789986 565209124 /nfs/dbraw/zinc/20/91/24/565209124.db2.gz KEKGPRONQADEJN-UHFFFAOYSA-N 0 1 378.270 3.357 10 0 GGAEMN COc1cc(Br)cc(S(=O)(=O)Nc2ccc3c(C)[nH]nc3c2)c1 ZINC000185607392 565210615 /nfs/dbraw/zinc/21/06/15/565210615.db2.gz DFBFPXFQFOUVFN-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN O[C@@H](COC1CCOCC1)CN1CCC[C@H]1c1ccc(Br)cc1 ZINC000371896937 565213927 /nfs/dbraw/zinc/21/39/27/565213927.db2.gz DLOWSNSHVQZJBL-AEFFLSMTSA-N 0 1 384.314 3.143 10 0 GGAEMN CNC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2OC(F)F)cc1 ZINC000185661180 565214807 /nfs/dbraw/zinc/21/48/07/565214807.db2.gz STKSICQATBKVGA-UHFFFAOYSA-N 0 1 390.795 3.102 10 0 GGAEMN COc1ccc(OC[C@@H](O)CN2CCc3ccccc3C2)c(Br)c1 ZINC000185690804 565217265 /nfs/dbraw/zinc/21/72/65/565217265.db2.gz LKSUTTASMMHUML-INIZCTEOSA-N 0 1 392.293 3.256 10 0 GGAEMN O=C(c1ccc(-c2nnc[nH]2)cc1)N1CCc2cccc(Br)c2C1 ZINC000185776668 565221183 /nfs/dbraw/zinc/22/11/83/565221183.db2.gz XCKYXCCJQBMTAT-UHFFFAOYSA-N 0 1 383.249 3.433 10 0 GGAEMN O=C1COc2ccc(CN[C@@H]3CCOc4c(Br)cccc43)cc2N1 ZINC000294630396 565221145 /nfs/dbraw/zinc/22/11/45/565221145.db2.gz JPMPCOZWMYTSMB-CQSZACIVSA-N 0 1 389.249 3.393 10 0 GGAEMN O=C(Cc1cscc1Br)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000294651322 565221581 /nfs/dbraw/zinc/22/15/81/565221581.db2.gz SHKQZDWHRAIPJC-NSHDSACASA-N 0 1 395.326 3.455 10 0 GGAEMN COC(=O)c1c(C)oc(C)c1S(=O)(=O)N[C@@H](CC(C)(C)C)C(F)(F)F ZINC000185811957 565223033 /nfs/dbraw/zinc/22/30/33/565223033.db2.gz BEEYYLWYFPVQIX-JTQLQIEISA-N 0 1 385.404 3.328 10 0 GGAEMN C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)CSCc1cscn1 ZINC000372164276 565224914 /nfs/dbraw/zinc/22/49/14/565224914.db2.gz UIGNLCLKAUWZOO-MRXNPFEDSA-N 0 1 375.563 3.499 10 0 GGAEMN C[C@H]1CCN(Cc2ccccc2)CCN1C(=O)CSCc1cscn1 ZINC000372164274 565225022 /nfs/dbraw/zinc/22/50/22/565225022.db2.gz UIGNLCLKAUWZOO-INIZCTEOSA-N 0 1 375.563 3.499 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C[C@@H](C)O ZINC000185912080 565228322 /nfs/dbraw/zinc/22/83/22/565228322.db2.gz ZDZDKZRIQAATIF-YPMHNXCESA-N 0 1 378.822 3.276 10 0 GGAEMN COc1cc(Br)c(C(=O)Nc2nc(C3CCC3)n[nH]2)cc1OC ZINC000294996938 565238920 /nfs/dbraw/zinc/23/89/20/565238920.db2.gz RCEWDGAFFPROGE-UHFFFAOYSA-N 0 1 381.230 3.104 10 0 GGAEMN COc1cc(Br)c(C(=O)Nc2n[nH]c(C3CCC3)n2)cc1OC ZINC000294996938 565238924 /nfs/dbraw/zinc/23/89/24/565238924.db2.gz RCEWDGAFFPROGE-UHFFFAOYSA-N 0 1 381.230 3.104 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000372459561 565240628 /nfs/dbraw/zinc/24/06/28/565240628.db2.gz GEMVTINCIBXVRZ-OAHLLOKOSA-N 0 1 397.287 3.321 10 0 GGAEMN CSc1ccc(S(=O)(=O)N[C@H](c2nnc[nH]2)c2ccccc2)cc1Cl ZINC000372461123 565240645 /nfs/dbraw/zinc/24/06/45/565240645.db2.gz ZEBSAYFXVUMGQS-HNNXBMFYSA-N 0 1 394.909 3.248 10 0 GGAEMN C[C@H](CO)[C@H](C)NCc1coc(-c2ccc(I)cc2)n1 ZINC000295071401 565243161 /nfs/dbraw/zinc/24/31/61/565243161.db2.gz AHXXSEGIKLTKSS-MNOVXSKESA-N 0 1 386.233 3.053 10 0 GGAEMN O=S(=O)(N[C@@H](c1nnc[nH]1)c1ccccc1)c1c(Cl)cccc1Cl ZINC000372602216 565246591 /nfs/dbraw/zinc/24/65/91/565246591.db2.gz VXVXBAAXYNULFE-CYBMUJFWSA-N 0 1 383.260 3.179 10 0 GGAEMN CSC[C@H](CCO)N[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186209998 565247298 /nfs/dbraw/zinc/24/72/98/565247298.db2.gz XJYSDIWRUXZNLW-HOTGVXAUSA-N 0 1 382.327 3.032 10 0 GGAEMN CSC[C@@H](CCO)N[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186209979 565247523 /nfs/dbraw/zinc/24/75/23/565247523.db2.gz XJYSDIWRUXZNLW-CVEARBPZSA-N 0 1 382.327 3.032 10 0 GGAEMN COC1(CN[C@@H](c2ccc(Br)cc2)c2cncnc2)CCOCC1 ZINC000186293447 565253051 /nfs/dbraw/zinc/25/30/51/565253051.db2.gz TXESFDLCKGVNHK-KRWDZBQOSA-N 0 1 392.297 3.114 10 0 GGAEMN O=C1[C@H](N[C@@H]2CCOc3c(Br)cccc32)CCN1CC(F)(F)F ZINC000271435769 565253221 /nfs/dbraw/zinc/25/32/21/565253221.db2.gz FLBYEMYEECYRJR-VXGBXAGGSA-N 0 1 393.203 3.026 10 0 GGAEMN O=C1[C@H](N[C@H]2CCOc3c(Br)cccc32)CCN1CC(F)(F)F ZINC000271435762 565253332 /nfs/dbraw/zinc/25/33/32/565253332.db2.gz FLBYEMYEECYRJR-NWDGAFQWSA-N 0 1 393.203 3.026 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCn3c(cc4cc(Cl)ccc43)C2)[nH]1 ZINC000372864601 565257758 /nfs/dbraw/zinc/25/77/58/565257758.db2.gz ZMVYPCBLOXFZAM-UHFFFAOYSA-N 0 1 375.885 3.246 10 0 GGAEMN O=S(=O)(Cc1c(Cl)cccc1Cl)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000372878656 565259008 /nfs/dbraw/zinc/25/90/08/565259008.db2.gz PBLWRSXUAVPHSB-HNNXBMFYSA-N 0 1 397.287 3.321 10 0 GGAEMN O=S(=O)(N[C@H](c1nnc[nH]1)c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000372877861 565259260 /nfs/dbraw/zinc/25/92/60/565259260.db2.gz LVWSGXMIIKJWOO-AWEZNQCLSA-N 0 1 383.260 3.179 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)c2cnccc2N(C)C)cc1Br ZINC000186392841 565259948 /nfs/dbraw/zinc/25/99/48/565259948.db2.gz YEKUYVVQXPXHGW-LLVKDONJSA-N 0 1 378.270 3.410 10 0 GGAEMN Cc1nc(NC(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)ccc1Br ZINC000372904048 565260819 /nfs/dbraw/zinc/26/08/19/565260819.db2.gz JDAWRGGLJNPEBR-CQSZACIVSA-N 0 1 387.241 3.182 10 0 GGAEMN COc1ccc(Br)c(CN(C)C(=O)[C@H]2CCCc3[nH]ncc32)c1 ZINC000372939203 565261791 /nfs/dbraw/zinc/26/17/91/565261791.db2.gz DGFSSOYSSRRWKJ-ZDUSSCGKSA-N 0 1 378.270 3.259 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCc2c(F)ccc(Br)c2C1 ZINC000295409902 565265042 /nfs/dbraw/zinc/26/50/42/565265042.db2.gz BTUSJNUEPWZKHW-LLVKDONJSA-N 0 1 378.245 3.316 10 0 GGAEMN CO[C@H]1COCC[C@@H]1CC(=O)Nc1cc(Br)cc(Cl)c1O ZINC000295477180 565267974 /nfs/dbraw/zinc/26/79/74/565267974.db2.gz JANOVLVPTKMSJC-PELKAZGASA-N 0 1 378.650 3.188 10 0 GGAEMN O=C(CCCC(=O)c1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000373093561 565268938 /nfs/dbraw/zinc/26/89/38/565268938.db2.gz WUGDBBQGVWOANB-CQSZACIVSA-N 0 1 390.281 3.199 10 0 GGAEMN C[C@H]1CN(c2ccc(CNCc3cncc(Br)c3)cn2)C[C@H](C)O1 ZINC000186590410 565271315 /nfs/dbraw/zinc/27/13/15/565271315.db2.gz GRHSRFQIPIGOBX-KBPBESRZSA-N 0 1 391.313 3.143 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)CC1 ZINC000186626881 565273112 /nfs/dbraw/zinc/27/31/12/565273112.db2.gz AYZIEBYOBKQMKC-HZPDHXFCSA-N 0 1 385.291 3.104 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)CCCSc2ccc(Cl)cc2)CC1 ZINC000186625271 565273187 /nfs/dbraw/zinc/27/31/87/565273187.db2.gz YNDDBHKKNWMNJS-UHFFFAOYSA-N 0 1 384.929 3.220 10 0 GGAEMN COC[C@H](C)OC[C@H](O)CN1CCC[C@@H]1c1ccc(Br)s1 ZINC000373181505 565273911 /nfs/dbraw/zinc/27/39/11/565273911.db2.gz UFXLQBXWZNRRBD-YNEHKIRRSA-N 0 1 378.332 3.060 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)Nc2ccc(C(F)(F)F)cc2Br)n1 ZINC000272482930 565288523 /nfs/dbraw/zinc/28/85/23/565288523.db2.gz SXNJEQBZTQRGCI-UHFFFAOYSA-N 0 1 392.179 3.259 10 0 GGAEMN Cc1c(Br)c2ccccc2n1CC(=O)NCc1n[nH]c(C(C)C)n1 ZINC000295836463 565289597 /nfs/dbraw/zinc/28/95/97/565289597.db2.gz VHIIVIAQUKRFDN-UHFFFAOYSA-N 0 1 390.285 3.270 10 0 GGAEMN Cc1cc(Br)c(S(=O)(=O)Nc2cnoc2)cc1Br ZINC000161672463 565290405 /nfs/dbraw/zinc/29/04/05/565290405.db2.gz ZTLHXQBDXALECW-UHFFFAOYSA-N 0 1 396.060 3.309 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2c[nH]c3cccc(Br)c23)[nH]n1 ZINC000161695398 565291385 /nfs/dbraw/zinc/29/13/85/565291385.db2.gz CGFJKJRRNMOUCA-UHFFFAOYSA-N 0 1 385.225 3.306 10 0 GGAEMN COc1ccc(CCC(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1Br ZINC000161765117 565292574 /nfs/dbraw/zinc/29/25/74/565292574.db2.gz QHTDUJMQVNZPQP-LLVKDONJSA-N 0 1 380.286 3.169 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Cn2c(C)c(Br)c3ccccc32)n[nH]1 ZINC000161855382 565294941 /nfs/dbraw/zinc/29/49/41/565294941.db2.gz FIIHGQWAPCEHEI-NSHDSACASA-N 0 1 389.297 3.491 10 0 GGAEMN COc1cc(C)c(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)cc1OC ZINC000272734069 565295953 /nfs/dbraw/zinc/29/59/53/565295953.db2.gz DKJMYHCYTSHLSM-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)CSc2ncnc3sc(C)c(C)c32)n[nH]1 ZINC000161869952 565296365 /nfs/dbraw/zinc/29/63/65/565296365.db2.gz QMXDPTGIPVBCAO-VIFPVBQESA-N 0 1 375.523 3.179 10 0 GGAEMN Cn1cc(-c2cc(F)ccc2NC(=O)CSc2n[nH]c(=S)s2)cn1 ZINC000373657354 565297548 /nfs/dbraw/zinc/29/75/48/565297548.db2.gz PVBQAQADCGWFLD-UHFFFAOYSA-N 0 1 381.483 3.097 10 0 GGAEMN CC[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@]2(CCOC2)O1 ZINC000373802990 565304614 /nfs/dbraw/zinc/30/46/14/565304614.db2.gz BYGGAEMWVCIAOZ-SUMWQHHRSA-N 0 1 380.286 3.095 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C ZINC000187177258 565314616 /nfs/dbraw/zinc/31/46/16/565314616.db2.gz ISHQLGLNAUAUGL-GWCFXTLKSA-N 0 1 384.851 3.462 10 0 GGAEMN O=C(N[C@H]1CCOc2ccc(Br)cc21)c1cccc(-c2nnc[nH]2)c1 ZINC000162361779 565315158 /nfs/dbraw/zinc/31/51/58/565315158.db2.gz GAQQFJCGMJNNEX-HNNXBMFYSA-N 0 1 399.248 3.488 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C ZINC000187177242 565315122 /nfs/dbraw/zinc/31/51/22/565315122.db2.gz ISHQLGLNAUAUGL-MFKMUULPSA-N 0 1 384.851 3.462 10 0 GGAEMN COc1c(Br)cccc1CN[C@@H](Cc1ccccc1)C(=O)N(C)C ZINC000187227418 565316885 /nfs/dbraw/zinc/31/68/85/565316885.db2.gz LDHOZRJBQKNQDQ-KRWDZBQOSA-N 0 1 391.309 3.247 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)CCOc2ccc(C)cc2Br)n[nH]1 ZINC000162456462 565317051 /nfs/dbraw/zinc/31/70/51/565317051.db2.gz WDKLYTOYHLHKKU-GFCCVEGCSA-N 0 1 380.286 3.305 10 0 GGAEMN O=S(=O)(NCCN[C@H]1CCCOc2ccc(Cl)cc21)c1ccccc1 ZINC000162456346 565317831 /nfs/dbraw/zinc/31/78/31/565317831.db2.gz LUKFESGDIHCAAA-KRWDZBQOSA-N 0 1 380.897 3.122 10 0 GGAEMN Brc1cc2cccnc2c(CN2CCCN(c3cccnn3)CC2)c1 ZINC000162536776 565320022 /nfs/dbraw/zinc/32/00/22/565320022.db2.gz QLWHETCQUSYFCX-UHFFFAOYSA-N 0 1 398.308 3.500 10 0 GGAEMN O=C(Nc1cc(Cl)c(Cl)cc1F)C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000374182180 565324306 /nfs/dbraw/zinc/32/43/06/565324306.db2.gz GTADDMFQOILYLN-UHFFFAOYSA-N 0 1 385.226 3.200 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1sccc1Br ZINC000162835302 565329036 /nfs/dbraw/zinc/32/90/36/565329036.db2.gz YXDMXYJCIGEGGM-UHFFFAOYSA-N 0 1 377.267 3.268 10 0 GGAEMN O=C(Cc1ccc(Br)cc1)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000162876105 565330583 /nfs/dbraw/zinc/33/05/83/565330583.db2.gz YIHNYPRCEJRZCC-UHFFFAOYSA-N 0 1 385.265 3.136 10 0 GGAEMN O=C(NCC[C@@H]1C(=O)Nc2ccccc21)c1cc(Br)cc2nc[nH]c21 ZINC000374302292 565331690 /nfs/dbraw/zinc/33/16/90/565331690.db2.gz MQVHVHOGLNPEKK-LBPRGKRZSA-N 0 1 399.248 3.181 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)N[C@H](c2nccs2)C(F)(F)F)n[nH]1 ZINC000296721058 565332326 /nfs/dbraw/zinc/33/23/26/565332326.db2.gz BPIOPIMLCTUOQA-XHNCKOQMSA-N 0 1 376.408 3.439 10 0 GGAEMN O=C(Cc1ccccc1Br)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000162955238 565332571 /nfs/dbraw/zinc/33/25/71/565332571.db2.gz HPMBMITVMGZHJS-UHFFFAOYSA-N 0 1 385.265 3.136 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3cc(Br)ccc3C)CCO2)n[nH]1 ZINC000162966207 565332629 /nfs/dbraw/zinc/33/26/29/565332629.db2.gz WNZYVHYVDDIWTL-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)N[C@@H](c2nccs2)C(F)(F)F)n[nH]1 ZINC000296721063 565332708 /nfs/dbraw/zinc/33/27/08/565332708.db2.gz BPIOPIMLCTUOQA-YIZRAAEISA-N 0 1 376.408 3.439 10 0 GGAEMN CC(=O)N1Cc2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc2C1 ZINC000374344767 565332990 /nfs/dbraw/zinc/33/29/90/565332990.db2.gz IJRNBOMADXRPOH-UHFFFAOYSA-N 0 1 399.248 3.440 10 0 GGAEMN Cc1ccc(NC(=O)CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1Cl ZINC000163069156 565336154 /nfs/dbraw/zinc/33/61/54/565336154.db2.gz CJULDACDWDXPKZ-ZDUSSCGKSA-N 0 1 380.897 3.341 10 0 GGAEMN C[C@@H](N[C@@H](C)C(=O)Nc1cccc(Cl)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000163141903 565337441 /nfs/dbraw/zinc/33/74/41/565337441.db2.gz KEYVTGOFYQBUGH-OLZOCXBDSA-N 0 1 380.897 3.421 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3cc(C)cc(Br)c3)CCO2)n[nH]1 ZINC000187517501 565338352 /nfs/dbraw/zinc/33/83/52/565338352.db2.gz JSRBGNRYOBZJDU-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccc(Cl)cc1 ZINC000163248780 565341375 /nfs/dbraw/zinc/34/13/75/565341375.db2.gz FIFCUKVJNKGVOS-QWHCGFSZSA-N 0 1 380.897 3.421 10 0 GGAEMN CCC1(CC)CN(Cc2nc3ccc(Br)cc3[nH]2)CC[S@@]1=O ZINC000187561987 565341519 /nfs/dbraw/zinc/34/15/19/565341519.db2.gz WKTBAOYPOFWJSY-QFIPXVFZSA-N 0 1 384.343 3.449 10 0 GGAEMN Brc1ccc2nc(CN3CCSC4(CCOCC4)C3)[nH]c2c1 ZINC000187566038 565341885 /nfs/dbraw/zinc/34/18/85/565341885.db2.gz OVVKZZZLAHRNQY-UHFFFAOYSA-N 0 1 382.327 3.423 10 0 GGAEMN COc1cc(Br)ccc1CN[C@@H](C)c1ccc(-n2cnnn2)cc1 ZINC000187574159 565342800 /nfs/dbraw/zinc/34/28/00/565342800.db2.gz WZHNSEXINYOTJM-LBPRGKRZSA-N 0 1 388.269 3.284 10 0 GGAEMN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccccc1Cl ZINC000163470721 565345928 /nfs/dbraw/zinc/34/59/28/565345928.db2.gz DWVGHZGCYILNNE-QWHCGFSZSA-N 0 1 380.897 3.421 10 0 GGAEMN Cc1cn2c(n1)CN(C(=O)c1cc(-c3ccc(Br)cc3)[nH]n1)CC2 ZINC000374663933 565349739 /nfs/dbraw/zinc/34/97/39/565349739.db2.gz ONGZLBNRMQROKQ-UHFFFAOYSA-N 0 1 386.253 3.000 10 0 GGAEMN COC(=O)c1cc(NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)ccc1Br ZINC000187711299 565350297 /nfs/dbraw/zinc/35/02/97/565350297.db2.gz IEPJMIUZAOZPJA-VIFPVBQESA-N 0 1 395.257 3.020 10 0 GGAEMN O=C(COc1cc(Cl)cc(Cl)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000374843045 565356844 /nfs/dbraw/zinc/35/68/44/565356844.db2.gz UPEJTGVATQLCOW-MRXNPFEDSA-N 0 1 377.231 3.396 10 0 GGAEMN Fc1cc(CNCc2csc(Br)c2)cnc1N1CCOCC1 ZINC000274105794 565357651 /nfs/dbraw/zinc/35/76/51/565357651.db2.gz UVAABPQPJISWCB-UHFFFAOYSA-N 0 1 386.290 3.171 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC(N3CCO[C@H](C)C3)CC2)cc1Br ZINC000187830737 565358020 /nfs/dbraw/zinc/35/80/20/565358020.db2.gz ZZLDGAVYJXRJAH-OAHLLOKOSA-N 0 1 395.341 3.012 10 0 GGAEMN C[C@@H]1CC[C@@](CO)(N(C)Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000187938334 565364676 /nfs/dbraw/zinc/36/46/76/565364676.db2.gz KUUJYQHROCLIHL-SJKOYZFVSA-N 0 1 380.286 3.482 10 0 GGAEMN C[C@H]1CC[C@@](CO)(N(C)Cc2nc(-c3cccc(Br)c3)no2)C1 ZINC000187973164 565367354 /nfs/dbraw/zinc/36/73/54/565367354.db2.gz BWPWPDXACBTXAE-YVEFUNNKSA-N 0 1 380.286 3.482 10 0 GGAEMN CC(C)c1nc(CNC(=O)N[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000297481438 565374364 /nfs/dbraw/zinc/37/43/64/565374364.db2.gz VLOYUYIDBSXLEI-GFCCVEGCSA-N 0 1 394.273 3.014 10 0 GGAEMN CC(C)c1nc(CNC(=O)N[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000297481439 565374939 /nfs/dbraw/zinc/37/49/39/565374939.db2.gz VLOYUYIDBSXLEI-LBPRGKRZSA-N 0 1 394.273 3.014 10 0 GGAEMN Cc1cc(C2CCN(C(=O)c3cc(Br)c(F)cc3[O-])CC2)n[nH]1 ZINC000297529762 565375275 /nfs/dbraw/zinc/37/52/75/565375275.db2.gz PCSSBSJZDDAHIL-UHFFFAOYSA-N 0 1 382.233 3.345 10 0 GGAEMN C[C@@H]1N(Cc2nnc(-c3ccc(Br)o3)o2)CCC12CCOCC2 ZINC000375237801 565377218 /nfs/dbraw/zinc/37/72/18/565377218.db2.gz PIFBPNDGONGVGV-NSHDSACASA-N 0 1 382.258 3.483 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@H](C)NCc2ccc(F)cc2CSC)c1 ZINC000167120472 565377430 /nfs/dbraw/zinc/37/74/30/565377430.db2.gz OJTGQHVYURFRCL-ZDUSSCGKSA-N 0 1 382.526 3.448 10 0 GGAEMN O=C(Cc1ccc(F)cc1Br)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000375333842 565382190 /nfs/dbraw/zinc/38/21/90/565382190.db2.gz QZYPMVKGKNMTKQ-MRXNPFEDSA-N 0 1 389.228 3.155 10 0 GGAEMN CCOc1cc(CN2CC[C@H](COCCOC)C2)cc(Br)c1O ZINC000297874085 565390099 /nfs/dbraw/zinc/39/00/99/565390099.db2.gz PYINOIZUYUUORH-ZDUSSCGKSA-N 0 1 388.302 3.038 10 0 GGAEMN O=C(CN[C@H](c1nnc[nH]1)c1ccccc1)Nc1cc(Cl)ccc1Cl ZINC000375553515 565394298 /nfs/dbraw/zinc/39/42/98/565394298.db2.gz VNQOUKYXMPRVEW-INIZCTEOSA-N 0 1 376.247 3.429 10 0 GGAEMN CCOc1cc(CN[C@@H]2CCCc3nn(C)cc32)cc(Br)c1O ZINC000298134245 565400778 /nfs/dbraw/zinc/40/07/78/565400778.db2.gz QGVFMEZVXODRDM-CQSZACIVSA-N 0 1 380.286 3.454 10 0 GGAEMN CN(CC(=O)N1CCc2sccc2[C@H]1c1cccs1)[C@@H]1CCC[C@H]1O ZINC000375750349 565403651 /nfs/dbraw/zinc/40/36/51/565403651.db2.gz LEQMUIRVRMKQPQ-CLCXKQKWSA-N 0 1 376.547 3.129 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Nc2cccc(Br)n2)c2ccccc2)n[nH]1 ZINC000188505644 565405678 /nfs/dbraw/zinc/40/56/78/565405678.db2.gz HYJWHPFIRPFPNR-AWEZNQCLSA-N 0 1 387.241 3.182 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1cc(F)cc2nc[nH]c21 ZINC000188530765 565406795 /nfs/dbraw/zinc/40/67/95/565406795.db2.gz KCHWYMIEMHHDQZ-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)NCCCc1cn[nH]c1C ZINC000188563434 565408903 /nfs/dbraw/zinc/40/89/03/565408903.db2.gz OATBMUZNGRUMBV-GFCCVEGCSA-N 0 1 395.301 3.482 10 0 GGAEMN CC(F)(F)c1cccc(NS(=O)(=O)c2ccc(S(C)(=O)=O)c(F)c2)c1 ZINC000188563307 565409307 /nfs/dbraw/zinc/40/93/07/565409307.db2.gz CHQBKCVSOIEWFS-UHFFFAOYSA-N 0 1 393.408 3.142 10 0 GGAEMN CCOc1cc(CNCc2ccc(N(C)C)nc2)cc(Br)c1O ZINC000298417085 565413027 /nfs/dbraw/zinc/41/30/27/565413027.db2.gz PGZGTMGSLKCPQO-UHFFFAOYSA-N 0 1 380.286 3.304 10 0 GGAEMN Cc1nc2ccc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)cc2o1 ZINC000171180032 565415808 /nfs/dbraw/zinc/41/58/08/565415808.db2.gz MJIHQJAKLCHAAI-UHFFFAOYSA-N 0 1 380.809 3.362 10 0 GGAEMN Cc1nc2cc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)ccc2o1 ZINC000171179971 565415880 /nfs/dbraw/zinc/41/58/80/565415880.db2.gz FRUZWFZAKXPYMU-UHFFFAOYSA-N 0 1 380.809 3.362 10 0 GGAEMN CC(C)c1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)[nH]n1 ZINC000171222552 565418929 /nfs/dbraw/zinc/41/89/29/565418929.db2.gz WCCFQWQSHRTGOD-UHFFFAOYSA-N 0 1 389.257 3.011 10 0 GGAEMN CC(C)c1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)[nH]n1 ZINC000171222552 565418938 /nfs/dbraw/zinc/41/89/38/565418938.db2.gz WCCFQWQSHRTGOD-UHFFFAOYSA-N 0 1 389.257 3.011 10 0 GGAEMN Cn1cc(Cl)cc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223067 565418969 /nfs/dbraw/zinc/41/89/69/565418969.db2.gz OHXHKSRPWXZXAY-UHFFFAOYSA-N 0 1 394.660 3.156 10 0 GGAEMN Cn1cc(Cl)cc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223067 565418977 /nfs/dbraw/zinc/41/89/77/565418977.db2.gz OHXHKSRPWXZXAY-UHFFFAOYSA-N 0 1 394.660 3.156 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc(Cl)c[nH]1 ZINC000171223152 565419036 /nfs/dbraw/zinc/41/90/36/565419036.db2.gz ROXXEKZYRHIIKN-UHFFFAOYSA-N 0 1 380.633 3.146 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc(Cl)c[nH]1 ZINC000171223152 565419042 /nfs/dbraw/zinc/41/90/42/565419042.db2.gz ROXXEKZYRHIIKN-UHFFFAOYSA-N 0 1 380.633 3.146 10 0 GGAEMN CCCCO[C@@H](C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171222136 565419316 /nfs/dbraw/zinc/41/93/16/565419316.db2.gz XEIJSSVXMQWSLV-NSHDSACASA-N 0 1 381.274 3.056 10 0 GGAEMN CCCCO[C@@H](C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171222136 565419321 /nfs/dbraw/zinc/41/93/21/565419321.db2.gz XEIJSSVXMQWSLV-NSHDSACASA-N 0 1 381.274 3.056 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc(C2CC2)on1 ZINC000171222867 565419787 /nfs/dbraw/zinc/41/97/87/565419787.db2.gz HJFXMEJDIDPYFQ-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc(C2CC2)on1 ZINC000171222867 565419789 /nfs/dbraw/zinc/41/97/89/565419789.db2.gz HJFXMEJDIDPYFQ-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN Cc1cnc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)s1 ZINC000171247265 565421302 /nfs/dbraw/zinc/42/13/02/565421302.db2.gz GCWXKULZZWIHBW-UHFFFAOYSA-N 0 1 393.270 3.321 10 0 GGAEMN Cc1cnc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)s1 ZINC000171247265 565421305 /nfs/dbraw/zinc/42/13/05/565421305.db2.gz GCWXKULZZWIHBW-UHFFFAOYSA-N 0 1 393.270 3.321 10 0 GGAEMN Cc1cccnc1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171247282 565421361 /nfs/dbraw/zinc/42/13/61/565421361.db2.gz KXUJUKYFMVUXBU-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1cccnc1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171247282 565421367 /nfs/dbraw/zinc/42/13/67/565421367.db2.gz KXUJUKYFMVUXBU-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1csc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)n1 ZINC000171247301 565421681 /nfs/dbraw/zinc/42/16/81/565421681.db2.gz VHUMJUNTOPCWTQ-UHFFFAOYSA-N 0 1 393.270 3.321 10 0 GGAEMN Cc1csc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000171247301 565421684 /nfs/dbraw/zinc/42/16/84/565421684.db2.gz VHUMJUNTOPCWTQ-UHFFFAOYSA-N 0 1 393.270 3.321 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000188883348 565429739 /nfs/dbraw/zinc/42/97/39/565429739.db2.gz PDXTWBBVEQAPSC-GXFFZTMASA-N 0 1 378.270 3.478 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000188883386 565430263 /nfs/dbraw/zinc/43/02/63/565430263.db2.gz PDXTWBBVEQAPSC-GWCFXTLKSA-N 0 1 378.270 3.478 10 0 GGAEMN CC(C)[C@@H](C(=O)Nc1cc([O-])c(Br)cc1Br)[NH+](C)C ZINC000298825857 565431304 /nfs/dbraw/zinc/43/13/04/565431304.db2.gz BQHBRRSFRGQDBU-LBPRGKRZSA-N 0 1 394.107 3.442 10 0 GGAEMN Cc1noc(C2CCC(NS(=O)(=O)c3c(Cl)ccc(F)c3F)CC2)n1 ZINC000376350991 565432114 /nfs/dbraw/zinc/43/21/14/565432114.db2.gz RYGCTJRJIPBSCK-UHFFFAOYSA-N 0 1 391.827 3.314 10 0 GGAEMN COc1c(Br)cc(Br)cc1CN(C)CC1(CO)CC1 ZINC000188953967 565435273 /nfs/dbraw/zinc/43/52/73/565435273.db2.gz UAXPITDBTNYCPC-UHFFFAOYSA-N 0 1 393.119 3.425 10 0 GGAEMN Fc1cc(Br)cc(OCCN2CCC(Nc3cccnn3)CC2)c1 ZINC000188954147 565435324 /nfs/dbraw/zinc/43/53/24/565435324.db2.gz QWUBQOQUJQGVKJ-UHFFFAOYSA-N 0 1 395.276 3.334 10 0 GGAEMN O=C(NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1ccc(O)c(Cl)c1 ZINC000376424849 565435588 /nfs/dbraw/zinc/43/55/88/565435588.db2.gz GFARQJKMTJVBDI-UHFFFAOYSA-N 0 1 382.247 3.062 10 0 GGAEMN O=C1[C@@H](NCc2cc(Br)c(Cl)s2)CCN1C1CCOCC1 ZINC000376455313 565437119 /nfs/dbraw/zinc/43/71/19/565437119.db2.gz PXJGMDJSUJGSSW-LBPRGKRZSA-N 0 1 393.734 3.034 10 0 GGAEMN CCOC(=O)c1csc(CCNCc2c(Cl)n(C)nc2C(F)(F)F)n1 ZINC000276164314 565439118 /nfs/dbraw/zinc/43/91/18/565439118.db2.gz IEMXPVZXOCLSKO-UHFFFAOYSA-N 0 1 396.822 3.058 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)N2CCN3CCCC[C@@H]3C2)cc1Br ZINC000171597640 565439210 /nfs/dbraw/zinc/43/92/10/565439210.db2.gz KLTXYHGGSAANST-DZGCQCFKSA-N 0 1 396.329 3.398 10 0 GGAEMN CN(C)[C@H](Cc1ccccc1)C(=O)NCc1ccc(F)cc1Br ZINC000171612628 565439318 /nfs/dbraw/zinc/43/93/18/565439318.db2.gz QUILYQBXAUEXTR-QGZVFWFLSA-N 0 1 379.273 3.377 10 0 GGAEMN COC(=O)COc1ccc([C@@H](C)NCc2ccc(Br)cn2)cc1 ZINC000299224273 565443904 /nfs/dbraw/zinc/44/39/04/565443904.db2.gz IDLLVOROGOXOGS-GFCCVEGCSA-N 0 1 379.254 3.247 10 0 GGAEMN C[C@](O)(CN1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1)C(F)(F)F ZINC000376625915 565445475 /nfs/dbraw/zinc/44/54/75/565445475.db2.gz IEUGTKQHASUTPZ-ZBFHGGJFSA-N 0 1 376.806 3.401 10 0 GGAEMN C[C@@](O)(CN1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1)C(F)(F)F ZINC000376625911 565445783 /nfs/dbraw/zinc/44/57/83/565445783.db2.gz IEUGTKQHASUTPZ-GDBMZVCRSA-N 0 1 376.806 3.401 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)CCCCc1cn[nH]n1 ZINC000189138731 565446000 /nfs/dbraw/zinc/44/60/00/565446000.db2.gz DKYQNHQHQNPREU-NSHDSACASA-N 0 1 381.274 3.166 10 0 GGAEMN COCCc1ccccc1NS(=O)(=O)c1cc2c(cc1Cl)OCCO2 ZINC000276383776 565447552 /nfs/dbraw/zinc/44/75/52/565447552.db2.gz ZIYKLZFOAJMYQG-UHFFFAOYSA-N 0 1 383.853 3.101 10 0 GGAEMN CN(C)[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1cccs1 ZINC000171771097 565449669 /nfs/dbraw/zinc/44/96/69/565449669.db2.gz BXLGRTYCCXHCBG-ZDUSSCGKSA-N 0 1 393.310 3.420 10 0 GGAEMN COc1cc(CNCc2cnn3ccccc23)cc(Br)c1OC ZINC000171767854 565449682 /nfs/dbraw/zinc/44/96/82/565449682.db2.gz UKYWGFBYANJWHH-UHFFFAOYSA-N 0 1 376.254 3.404 10 0 GGAEMN O=C(CSC(=S)N1CCCC1)Nc1cccc(CN2CCSCC2)c1 ZINC000299474753 565451914 /nfs/dbraw/zinc/45/19/14/565451914.db2.gz FCKKSYUIJDXECY-UHFFFAOYSA-N 0 1 395.619 3.288 10 0 GGAEMN O=C(NCCCCNc1ccccn1)c1n[nH]c2ccc(Br)cc21 ZINC000171807492 565452194 /nfs/dbraw/zinc/45/21/94/565452194.db2.gz STGZOCAEVOCVDW-UHFFFAOYSA-N 0 1 388.269 3.343 10 0 GGAEMN O=C(NCC[C@@H]1C(=O)Nc2ccccc21)c1n[nH]c2ccc(Br)cc21 ZINC000171948534 565459227 /nfs/dbraw/zinc/45/92/27/565459227.db2.gz GKZRLHOXZFQPDF-LBPRGKRZSA-N 0 1 399.248 3.181 10 0 GGAEMN CN(Cc1ccc(Br)cn1)C[C@@H](c1cccs1)N1CCOCC1 ZINC000171960707 565460536 /nfs/dbraw/zinc/46/05/36/565460536.db2.gz HEOCSPHEVUGELX-INIZCTEOSA-N 0 1 396.354 3.411 10 0 GGAEMN [O-]c1c(Br)cc(CN2CC[N@H+]3CCC[C@H]3C2)cc1Br ZINC000300438632 565461644 /nfs/dbraw/zinc/46/16/44/565461644.db2.gz FGMFPDNXMJSSTO-NSHDSACASA-N 0 1 390.119 3.197 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(Br)c(F)cc1F ZINC000376984162 565462051 /nfs/dbraw/zinc/46/20/51/565462051.db2.gz ZXMWUBSVKDTLOZ-AWEZNQCLSA-N 0 1 393.191 3.365 10 0 GGAEMN O=C(CCNC(=O)c1n[nH]c2ccc(Br)cc21)Nc1ccccc1 ZINC000172046516 565463412 /nfs/dbraw/zinc/46/34/12/565463412.db2.gz LCQSHFVSWRZHHP-UHFFFAOYSA-N 0 1 387.237 3.084 10 0 GGAEMN CCc1c(NS(=O)(=O)c2ccnn2CC)cnn1-c1cccc(Cl)c1 ZINC000277009555 565471620 /nfs/dbraw/zinc/47/16/20/565471620.db2.gz ZNLTXJPCYJVCBJ-UHFFFAOYSA-N 0 1 379.873 3.105 10 0 GGAEMN CCN1CCC[C@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000172290925 565476265 /nfs/dbraw/zinc/47/62/65/565476265.db2.gz FBQASNULNFTNMC-QMMMGPOBSA-N 0 1 396.148 3.487 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3cc(Br)ccc3C2)n[nH]1 ZINC000189612043 565477650 /nfs/dbraw/zinc/47/76/50/565477650.db2.gz UASHMOPKEORGQH-NSHDSACASA-N 0 1 377.286 3.180 10 0 GGAEMN COc1cnccc1[C@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000189630900 565478701 /nfs/dbraw/zinc/47/87/01/565478701.db2.gz REGGPGWNVSLQEU-VIFPVBQESA-N 0 1 375.226 3.220 10 0 GGAEMN Cc1cc(C[C@H](C)N2C(=O)[C@H](c3cccc(Br)c3)N(C)C2=O)n[nH]1 ZINC000277258927 565486023 /nfs/dbraw/zinc/48/60/23/565486023.db2.gz IOHTYYUUPJNXNG-NHYWBVRUSA-N 0 1 391.269 3.047 10 0 GGAEMN Cc1cc(C[C@H](C)N2C(=O)[C@@H](c3cccc(Br)c3)N(C)C2=O)n[nH]1 ZINC000277258929 565486044 /nfs/dbraw/zinc/48/60/44/565486044.db2.gz IOHTYYUUPJNXNG-XHDPSFHLSA-N 0 1 391.269 3.047 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@H]1CC=CCC1 ZINC000172485447 565488059 /nfs/dbraw/zinc/48/80/59/565488059.db2.gz ZERNRPDYQRSMMC-ZDUSSCGKSA-N 0 1 376.258 3.142 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@H]1CC=CCC1 ZINC000172485447 565488061 /nfs/dbraw/zinc/48/80/61/565488061.db2.gz ZERNRPDYQRSMMC-ZDUSSCGKSA-N 0 1 376.258 3.142 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(F)c(Br)c1 ZINC000189779782 565488257 /nfs/dbraw/zinc/48/82/57/565488257.db2.gz ZXFXMJNRFLIUFU-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN O[C@@H](COC[C@@H]1CCCO1)CN1CCC(c2ccccc2Br)CC1 ZINC000189807312 565489690 /nfs/dbraw/zinc/48/96/90/565489690.db2.gz NLKJVWQSFZYTEO-SJORKVTESA-N 0 1 398.341 3.185 10 0 GGAEMN CCc1cc(=O)n2nc(NC[C@@H](c3ccc(Cl)cc3)N(C)C)sc2n1 ZINC000301486790 565490192 /nfs/dbraw/zinc/49/01/92/565490192.db2.gz XZMXPFYNNDFJHR-AWEZNQCLSA-N 0 1 377.901 3.082 10 0 GGAEMN COc1ccc(CN(C)C2CCN(c3cnccn3)CC2)c(Br)c1 ZINC000377626671 565490329 /nfs/dbraw/zinc/49/03/29/565490329.db2.gz NPPIGHCCWZZZPD-UHFFFAOYSA-N 0 1 391.313 3.349 10 0 GGAEMN C[C@H](NC[C@@H](O)CC(F)(F)F)c1cc2c(cc1Br)OCCO2 ZINC000189833714 565491106 /nfs/dbraw/zinc/49/11/06/565491106.db2.gz KCLPKZBIJFBLNL-IUCAKERBSA-N 0 1 384.192 3.184 10 0 GGAEMN C[C@H]1CN(CCCNC(=O)C2(c3ccccc3Br)CC2)C[C@H](C)O1 ZINC000189847785 565491994 /nfs/dbraw/zinc/49/19/94/565491994.db2.gz AFCYOXKJGVYIRC-GJZGRUSLSA-N 0 1 395.341 3.096 10 0 GGAEMN O=C(Nc1nncs1)C1CCN(Cc2cnc(-c3ccco3)s2)CC1 ZINC000377696605 565493268 /nfs/dbraw/zinc/49/32/68/565493268.db2.gz KVTJFSXJCFRERK-UHFFFAOYSA-N 0 1 375.479 3.105 10 0 GGAEMN CN1CC[C@H](N[C@H](C(N)=O)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000377730293 565495710 /nfs/dbraw/zinc/49/57/10/565495710.db2.gz XUNCVBUGRDDVCA-BZSNNMDCSA-N 0 1 388.309 3.011 10 0 GGAEMN CC1(C)CCCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000172660300 565497760 /nfs/dbraw/zinc/49/77/60/565497760.db2.gz SSVPRYCAGZHTSL-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN CC1(C)CCCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000172660300 565497762 /nfs/dbraw/zinc/49/77/62/565497762.db2.gz SSVPRYCAGZHTSL-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN CCOCCCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(Br)cc1OC ZINC000189976043 565499598 /nfs/dbraw/zinc/49/95/98/565499598.db2.gz ORNAINJSWRFEBP-QWHCGFSZSA-N 0 1 387.318 3.040 10 0 GGAEMN CCOc1cc(Br)ccc1NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000377810791 565500004 /nfs/dbraw/zinc/50/00/04/565500004.db2.gz FGEYKQHBWVNURK-LLVKDONJSA-N 0 1 379.258 3.250 10 0 GGAEMN Cc1cc(C[C@@H](C)N2C(=O)N[C@@H](Cc3cc(Cl)cc(Cl)c3)C2=O)n[nH]1 ZINC000277563340 565506633 /nfs/dbraw/zinc/50/66/33/565506633.db2.gz ZXYILDRSQKXAOT-BMIGLBTASA-N 0 1 381.263 3.119 10 0 GGAEMN Ic1ccc([C@H]2CCCN2c2ncnc3[nH]cnc32)cc1 ZINC000301812556 565510334 /nfs/dbraw/zinc/51/03/34/565510334.db2.gz FIMAOFHCVXKUGK-GFCCVEGCSA-N 0 1 391.216 3.299 10 0 GGAEMN CC(C)c1cccc(S(=O)(=O)Nc2cc(F)c(S(C)(=O)=O)c(F)c2)c1 ZINC000172891832 565511162 /nfs/dbraw/zinc/51/11/62/565511162.db2.gz VZPQSJIADYPRMO-UHFFFAOYSA-N 0 1 389.445 3.293 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378101982 565513286 /nfs/dbraw/zinc/51/32/86/565513286.db2.gz RHAJYUYIMZLBGM-JRPNMDOOSA-N 0 1 393.260 3.024 10 0 GGAEMN CCCc1cc(C(=O)N(CCOC)Cc2sccc2Br)n[nH]1 ZINC000190170936 565513925 /nfs/dbraw/zinc/51/39/25/565513925.db2.gz UYTAROYYKQVRQC-UHFFFAOYSA-N 0 1 386.315 3.475 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)c1cc(C2CC2)[nH]n1 ZINC000190179864 565514169 /nfs/dbraw/zinc/51/41/69/565514169.db2.gz ICCOUUPHXLQSER-UHFFFAOYSA-N 0 1 384.299 3.400 10 0 GGAEMN CCc1nc2n(n1)CCC[C@H]2NC(=O)c1cn[nH]c1-c1ccc(Cl)s1 ZINC000190269513 565519592 /nfs/dbraw/zinc/51/95/92/565519592.db2.gz NPZZANISEBXGDW-SNVBAGLBSA-N 0 1 376.873 3.210 10 0 GGAEMN Cc1cc(C(=O)N[C@@H]2CCc3nc[nH]c3C2)c2ccc(Br)cc2n1 ZINC000378304090 565520510 /nfs/dbraw/zinc/52/05/10/565520510.db2.gz GNEBUHCTJFKPOE-GFCCVEGCSA-N 0 1 385.265 3.316 10 0 GGAEMN CC(C)Cn1ccnc1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000173031288 565521214 /nfs/dbraw/zinc/52/12/14/565521214.db2.gz HARZRQRAOKXUMD-UHFFFAOYSA-N 0 1 376.258 3.108 10 0 GGAEMN CCOC(=O)c1csc(CCNCc2cc(O)ccc2Br)n1 ZINC000190337855 565523203 /nfs/dbraw/zinc/52/32/03/565523203.db2.gz PUBKQRJPYIZEAY-UHFFFAOYSA-N 0 1 385.283 3.120 10 0 GGAEMN C[C@@H](CO)N1CCN(c2ccc3cc(Br)cc(Cl)c3n2)CC1 ZINC000301998794 565524393 /nfs/dbraw/zinc/52/43/93/565524393.db2.gz IIBRCRSWSHINKM-NSHDSACASA-N 0 1 384.705 3.154 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)CCCc3ccc(Cl)c(Cl)c3)CCO2)n[nH]1 ZINC000173087731 565525959 /nfs/dbraw/zinc/52/59/59/565525959.db2.gz NTPFJFFFRHTLGT-HNNXBMFYSA-N 0 1 383.279 3.343 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)[C@@H](C)Sc3ccccc3Cl)CCO2)n[nH]1 ZINC000173096090 565527290 /nfs/dbraw/zinc/52/72/90/565527290.db2.gz OTLKEICTYFVVMP-DGCLKSJQSA-N 0 1 380.901 3.101 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1C(F)(F)F ZINC000378456205 565528986 /nfs/dbraw/zinc/52/89/86/565528986.db2.gz CELDIZWOKIIRBD-VIFPVBQESA-N 0 1 388.187 3.478 10 0 GGAEMN CCN1CCN(c2ccc(CNc3ccc(Br)c(C)n3)cn2)CC1 ZINC000302096130 565530578 /nfs/dbraw/zinc/53/05/78/565530578.db2.gz SESITTGWDBCDCJ-UHFFFAOYSA-N 0 1 390.329 3.302 10 0 GGAEMN COc1cc(Br)ccc1CN1CCC[C@H]1C[C@@H](O)c1cnn(C)c1 ZINC000378611328 565536226 /nfs/dbraw/zinc/53/62/26/565536226.db2.gz OYZQJJOZSCBXNM-DLBZAZTESA-N 0 1 394.313 3.279 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)CCN1C ZINC000173273603 565543005 /nfs/dbraw/zinc/54/30/05/565543005.db2.gz PSFAQNGMALQESI-GHMZBOCLSA-N 0 1 382.860 3.045 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CCN1C ZINC000173272734 565543579 /nfs/dbraw/zinc/54/35/79/565543579.db2.gz HYBJPSIASSRXPA-PWSUYJOCSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CCN1C ZINC000173272752 565543633 /nfs/dbraw/zinc/54/36/33/565543633.db2.gz HYBJPSIASSRXPA-JQWIXIFHSA-N 0 1 384.851 3.462 10 0 GGAEMN CC[C@@H]1CN(C)CCCN1S(=O)(=O)c1c(Cl)cccc1Br ZINC000386147378 565546951 /nfs/dbraw/zinc/54/69/51/565546951.db2.gz ZFMGCVGAOGRGAN-LLVKDONJSA-N 0 1 395.750 3.207 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2ccccc2F)[C@@H]1c1cccs1 ZINC000173323309 565547686 /nfs/dbraw/zinc/54/76/86/565547686.db2.gz NUZYQAJNQJEFER-KBXCAEBGSA-N 0 1 382.526 3.390 10 0 GGAEMN C[N@H+]1CCC[C@H](C[N-]S(=O)(=O)c2c(F)cccc2F)[C@@H]1c1cccs1 ZINC000173324064 565547794 /nfs/dbraw/zinc/54/77/94/565547794.db2.gz HGEYYVPZRDKFAH-MLGOLLRUSA-N 0 1 386.489 3.388 10 0 GGAEMN C[N@H+]1CCC[C@@H](C[N-]S(=O)(=O)c2c(F)cccc2F)[C@@H]1c1cccs1 ZINC000173324081 565548312 /nfs/dbraw/zinc/54/83/12/565548312.db2.gz HGEYYVPZRDKFAH-BLLLJJGKSA-N 0 1 386.489 3.388 10 0 GGAEMN OCCCN1CCN(c2ccnc3c(Cl)cc(Br)cc23)CC1 ZINC000302704523 565551161 /nfs/dbraw/zinc/55/11/61/565551161.db2.gz CBJOXSDIUSXUED-UHFFFAOYSA-N 0 1 384.705 3.155 10 0 GGAEMN Fc1ccc(Br)cc1-c1nnc(N2CCN3CCC2CC3)s1 ZINC000302789498 565556546 /nfs/dbraw/zinc/55/65/46/565556546.db2.gz XVSRAWODCAWPLE-UHFFFAOYSA-N 0 1 383.290 3.391 10 0 GGAEMN C[C@H]1CN(c2ccnc3c(Cl)cc(Br)cc23)CCN1CCO ZINC000302798412 565557527 /nfs/dbraw/zinc/55/75/27/565557527.db2.gz RKBWDWSTMYUOFE-NSHDSACASA-N 0 1 384.705 3.154 10 0 GGAEMN CCNC(=O)CCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1 ZINC000190784401 565558359 /nfs/dbraw/zinc/55/83/59/565558359.db2.gz FNUDAUIYFYPGKI-CQSZACIVSA-N 0 1 393.285 3.162 10 0 GGAEMN COc1cc(Br)c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(=O)[O-])cc1OC ZINC000390991821 565560567 /nfs/dbraw/zinc/56/05/67/565560567.db2.gz GZTZLEZVKKBPCY-KANYHAFZSA-N 0 1 384.270 3.151 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cc(C)cc(Br)c2O)ccc1F ZINC000190818386 565560838 /nfs/dbraw/zinc/56/08/38/565560838.db2.gz NNFPXRKVFTYRER-UHFFFAOYSA-N 0 1 390.230 3.412 10 0 GGAEMN CC[C@H](NC(=O)CCSc1nnc(C)[nH]1)c1nc(C(F)(F)F)cs1 ZINC000173497069 565562452 /nfs/dbraw/zinc/56/24/52/565562452.db2.gz GHVQHCSRTONGMO-QMMMGPOBSA-N 0 1 379.433 3.338 10 0 GGAEMN CC1(CNCc2cc(Br)cc(Br)c2N)OCCCO1 ZINC000190839543 565562878 /nfs/dbraw/zinc/56/28/78/565562878.db2.gz BETOVHGPMMAJBZ-UHFFFAOYSA-N 0 1 394.107 3.037 10 0 GGAEMN Cn1ncc(Br)c1CNCCc1nc(-c2ccccn2)cs1 ZINC000278534481 565564895 /nfs/dbraw/zinc/56/48/95/565564895.db2.gz SFVMDYPURDUUKB-UHFFFAOYSA-N 0 1 378.299 3.033 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)c3sc4ccccc4c3Cl)CCO2)n[nH]1 ZINC000173559329 565566955 /nfs/dbraw/zinc/56/69/55/565566955.db2.gz SBOJQMZFLAENDU-LLVKDONJSA-N 0 1 376.869 3.449 10 0 GGAEMN OC[C@@H]1CCC[C@H](NCc2c(Br)cncc2Br)C1 ZINC000394532223 565570933 /nfs/dbraw/zinc/57/09/33/565570933.db2.gz PGYONUIERAFDAS-ZJUUUORDSA-N 0 1 378.108 3.247 10 0 GGAEMN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000173660427 565574729 /nfs/dbraw/zinc/57/47/29/565574729.db2.gz JPAUVNKFKXMLGQ-YPMHNXCESA-N 0 1 378.270 3.190 10 0 GGAEMN COCC[C@H](CO)N[C@H](C)c1ccc(Br)cc1Br ZINC000305946050 565576563 /nfs/dbraw/zinc/57/65/63/565576563.db2.gz SPOUWJIWTMOLQA-MWLCHTKSSA-N 0 1 381.108 3.260 10 0 GGAEMN OC[C@@H]1CCC[C@@H](NCc2ncc(Br)cc2Br)C1 ZINC000310710416 565579839 /nfs/dbraw/zinc/57/98/39/565579839.db2.gz CBSKYMXGNFCZPA-MWLCHTKSSA-N 0 1 378.108 3.247 10 0 GGAEMN OC[C@@H]1CCC[C@H](NCc2ncc(Br)cc2Br)C1 ZINC000310710415 565579954 /nfs/dbraw/zinc/57/99/54/565579954.db2.gz CBSKYMXGNFCZPA-KOLCDFICSA-N 0 1 378.108 3.247 10 0 GGAEMN COCCN(Cc1cccnc1)C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000191107118 565583045 /nfs/dbraw/zinc/58/30/45/565583045.db2.gz VNPSCTJNXGLTQU-OAHLLOKOSA-N 0 1 385.291 3.277 10 0 GGAEMN C[C@@H]1[C@H](NC(=O)c2nscc2Br)CCN1Cc1ccccc1 ZINC000404939376 565583722 /nfs/dbraw/zinc/58/37/22/565583722.db2.gz LKIIDWPMOUFQJR-BXUZGUMPSA-N 0 1 380.311 3.298 10 0 GGAEMN O=C(c1nscc1Br)N1CCCN(Cc2ccccc2)CC1 ZINC000404712371 565583788 /nfs/dbraw/zinc/58/37/88/565583788.db2.gz NRRXODMGFAJCKX-UHFFFAOYSA-N 0 1 380.311 3.254 10 0 GGAEMN C[C@@H]1C[C@@H](NC(=O)c2nscc2Br)CN1Cc1ccccc1 ZINC000404817782 565583873 /nfs/dbraw/zinc/58/38/73/565583873.db2.gz QSQGLRDVJSCFBY-DGCLKSJQSA-N 0 1 380.311 3.298 10 0 GGAEMN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)c1nscc1Br ZINC000404970634 565585303 /nfs/dbraw/zinc/58/53/03/565585303.db2.gz ZMVJYIQEDURIEJ-ZDUSSCGKSA-N 0 1 380.311 3.300 10 0 GGAEMN Cc1cnn(CCNCc2cc(Cl)ccc2I)c1 ZINC000405214388 565585507 /nfs/dbraw/zinc/58/55/07/565585507.db2.gz MSVJMFALMGICJR-UHFFFAOYSA-N 0 1 375.641 3.239 10 0 GGAEMN C[C@H](CN1CCCCC1)NS(=O)(=O)c1c(Cl)cccc1Br ZINC000314242189 565586288 /nfs/dbraw/zinc/58/62/88/565586288.db2.gz RNSUHKVBCVFUKS-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN O=C1C[C@]2(CCN(Cc3csc(-c4cccc(Br)c4)n3)C2)CN1 ZINC000278973140 565587653 /nfs/dbraw/zinc/58/76/53/565587653.db2.gz YCELZQROBLGTPW-QGZVFWFLSA-N 0 1 392.322 3.285 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3ccc(C)cc3Br)C2)n[nH]1 ZINC000407976145 565588104 /nfs/dbraw/zinc/58/81/04/565588104.db2.gz JOFASOBFGHKFCK-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2cc(C)cc(Br)c2)n[nH]1 ZINC000407975444 565588347 /nfs/dbraw/zinc/58/83/47/565588347.db2.gz HFWBKTTXXRWBMO-CQSZACIVSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2ccc(Br)c(C)c2)n[nH]1 ZINC000407971564 565588360 /nfs/dbraw/zinc/58/83/60/565588360.db2.gz BVRQOODGURUUEV-AWEZNQCLSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2cccc(Cl)c2Cl)n[nH]1 ZINC000407975032 565588486 /nfs/dbraw/zinc/58/84/86/565588486.db2.gz FOCZTRFNDIVVCU-LLVKDONJSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2cc(Br)ccc2C)n[nH]1 ZINC000407976919 565588497 /nfs/dbraw/zinc/58/84/97/565588497.db2.gz OBDZBHYMYCOCNF-ZDUSSCGKSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3cc(C)cc(Br)c3)C2)n[nH]1 ZINC000407974984 565588517 /nfs/dbraw/zinc/58/85/17/565588517.db2.gz DWRZZCMSIOWEGM-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3)C2)n[nH]1 ZINC000407974399 565588529 /nfs/dbraw/zinc/58/85/29/565588529.db2.gz AJKWBWVUDIHVQB-LBPRGKRZSA-N 0 1 384.299 3.049 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2cc(C)cc(Br)c2)n[nH]1 ZINC000407975436 565588645 /nfs/dbraw/zinc/58/86/45/565588645.db2.gz HFWBKTTXXRWBMO-AWEZNQCLSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3C)C2)n[nH]1 ZINC000407978110 565589158 /nfs/dbraw/zinc/58/91/58/565589158.db2.gz VZYBRXRIUQWJNJ-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2cccc(Br)c2C)n[nH]1 ZINC000407977391 565589199 /nfs/dbraw/zinc/58/91/99/565589199.db2.gz RIPDVHJSHBLEQG-CYBMUJFWSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3cc(Br)ccc3C)C2)n[nH]1 ZINC000407977814 565589345 /nfs/dbraw/zinc/58/93/45/565589345.db2.gz UJWONHCKIVBBMP-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1cc([C@H]2CCCN(C(=O)[C@H]3COc4ccc(Br)cc43)C2)n[nH]1 ZINC000407981341 565589483 /nfs/dbraw/zinc/58/94/83/565589483.db2.gz SFJZPQZORPYEIJ-WFASDCNBSA-N 0 1 390.281 3.363 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000407977953 565589763 /nfs/dbraw/zinc/58/97/63/565589763.db2.gz ZUXWXRZIKIYHOQ-CYBMUJFWSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1cc([C@H]2CCCN(C(=O)[C@@H]3COc4ccc(Br)cc43)C2)n[nH]1 ZINC000407981339 565589919 /nfs/dbraw/zinc/58/99/19/565589919.db2.gz SFJZPQZORPYEIJ-SWLSCSKDSA-N 0 1 390.281 3.363 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@@H]2CCC[C@H]21 ZINC000408098455 565594145 /nfs/dbraw/zinc/59/41/45/565594145.db2.gz VAXNZYJQLWOLHZ-CHWSQXEVSA-N 0 1 376.254 3.233 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCC[C@H]1[C@@H]1CCCO1 ZINC000408091795 565594559 /nfs/dbraw/zinc/59/45/59/565594559.db2.gz XLTXUFRGNBXATC-HOTGVXAUSA-N 0 1 391.265 3.074 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@H]2C)cc1Cl ZINC000173885119 565596963 /nfs/dbraw/zinc/59/69/63/565596963.db2.gz WYYCTQNKOPAEAC-MFKMUULPSA-N 0 1 381.325 3.009 10 0 GGAEMN Cc1cc(N2CCC(N(C)S(C)(=O)=O)CC2)c2cc(Cl)cc(C)c2n1 ZINC000408175693 565598189 /nfs/dbraw/zinc/59/81/89/565598189.db2.gz XLRMMMVOELFFHM-UHFFFAOYSA-N 0 1 381.929 3.365 10 0 GGAEMN O=S(=O)(N[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Br)o1 ZINC000408216059 565598919 /nfs/dbraw/zinc/59/89/19/565598919.db2.gz SSORVSRBCOVDGG-HTQZYQBOSA-N 0 1 376.194 3.442 10 0 GGAEMN CC(C)(C)[C@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@H]1O ZINC000408211916 565599801 /nfs/dbraw/zinc/59/98/01/565599801.db2.gz SAMPNHMTUJLFIZ-GXTWGEPZSA-N 0 1 380.286 3.195 10 0 GGAEMN COc1ccc(-c2n[nH]c(SC[C@H](O)C(F)(F)F)n2)cc1Br ZINC000191390924 565600363 /nfs/dbraw/zinc/60/03/63/565600363.db2.gz KPOMZQLBQPNARG-VIFPVBQESA-N 0 1 398.204 3.258 10 0 GGAEMN CO[C@]1(C)CCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000408325255 565604423 /nfs/dbraw/zinc/60/44/23/565604423.db2.gz YIDANZASLQDRSF-GOSISDBHSA-N 0 1 393.281 3.322 10 0 GGAEMN C[C@H]1CCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CCS1 ZINC000408440512 565609671 /nfs/dbraw/zinc/60/96/71/565609671.db2.gz CPISLUGITJAEJE-JTQLQIEISA-N 0 1 381.295 3.258 10 0 GGAEMN NC(=O)c1coc(CN[C@@H](c2cccc(Br)c2)C2CCOCC2)c1 ZINC000191549843 565612900 /nfs/dbraw/zinc/61/29/00/565612900.db2.gz UNPKBHBUOBFLGT-QGZVFWFLSA-N 0 1 393.281 3.399 10 0 GGAEMN CC[C@@H](CO)N1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)CC1 ZINC000174133174 565615403 /nfs/dbraw/zinc/61/54/03/565615403.db2.gz KJEADKHAMVRRHG-SFHVURJKSA-N 0 1 379.957 3.276 10 0 GGAEMN CC[C@H](CO)N1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)CC1 ZINC000174133187 565615546 /nfs/dbraw/zinc/61/55/46/565615546.db2.gz KJEADKHAMVRRHG-GOSISDBHSA-N 0 1 379.957 3.276 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2nnc(-c3ccccc3Cl)s2)[nH]1 ZINC000174235335 565622262 /nfs/dbraw/zinc/62/22/62/565622262.db2.gz ASJWABZZAUIMNM-UHFFFAOYSA-N 0 1 380.886 3.406 10 0 GGAEMN O=C([O-])[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1Cc1nc(-c2cccc(Br)c2)no1 ZINC000326494313 565624916 /nfs/dbraw/zinc/62/49/16/565624916.db2.gz YNDJNICNXHHEDO-LNSITVRQSA-N 0 1 392.253 3.184 10 0 GGAEMN O=C([O-])[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1Cc1nc(-c2cccc(Br)c2)no1 ZINC000326494315 565625057 /nfs/dbraw/zinc/62/50/57/565625057.db2.gz YNDJNICNXHHEDO-ZLDLUXBVSA-N 0 1 392.253 3.184 10 0 GGAEMN O=C1[C@@H](NCc2cccc(Br)c2)CCN1Cc1ccc(F)cc1 ZINC000191760721 565628736 /nfs/dbraw/zinc/62/87/36/565628736.db2.gz GOAPMZIYHYKCCQ-KRWDZBQOSA-N 0 1 377.257 3.479 10 0 GGAEMN O=C1[C@H](NCc2ccc(Br)cc2)CCN1Cc1ccc(F)cc1 ZINC000191767153 565630296 /nfs/dbraw/zinc/63/02/96/565630296.db2.gz OXEUUEIGJQNSDG-QGZVFWFLSA-N 0 1 377.257 3.479 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@@H]2CCOc3c(Br)cccc32)C[C@@H]1C ZINC000409703984 565634806 /nfs/dbraw/zinc/63/48/06/565634806.db2.gz CJWCTSJJAGOBHT-HEHGZKQESA-N 0 1 396.329 3.397 10 0 GGAEMN C[C@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cccnc1 ZINC000174506009 565640884 /nfs/dbraw/zinc/64/08/84/565640884.db2.gz KSYHAUFLSZGRQF-NSHDSACASA-N 0 1 386.253 3.049 10 0 GGAEMN C[C@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccnc1 ZINC000174506009 565640887 /nfs/dbraw/zinc/64/08/87/565640887.db2.gz KSYHAUFLSZGRQF-NSHDSACASA-N 0 1 386.253 3.049 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H]2CCc3c2cccc3Br)[nH]1 ZINC000174562383 565643303 /nfs/dbraw/zinc/64/33/03/565643303.db2.gz HDKMBZCGGZDASW-CYBMUJFWSA-N 0 1 381.299 3.162 10 0 GGAEMN O=C(Nc1nc2c(s1)COCC2)c1ccc(CN2CCSCC2)cc1 ZINC000328820368 565643411 /nfs/dbraw/zinc/64/34/11/565643411.db2.gz FGYGJDARNIGPLA-UHFFFAOYSA-N 0 1 375.519 3.017 10 0 GGAEMN C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000329299963 565661919 /nfs/dbraw/zinc/66/19/19/565661919.db2.gz VHWFPNVSFPFBDZ-WFASDCNBSA-N 0 1 397.953 3.321 10 0 GGAEMN CCC(=O)N1CSC[C@H]1C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000174915289 565665645 /nfs/dbraw/zinc/66/56/45/565665645.db2.gz NPOMPSKHRWWULW-JTQLQIEISA-N 0 1 393.690 3.058 10 0 GGAEMN C[C@@H]1[C@@H](C)CCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000174922255 565667716 /nfs/dbraw/zinc/66/77/16/565667716.db2.gz XETPODSNAKRDTG-WDEREUQCSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1[C@@H](C)CCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000174922255 565667718 /nfs/dbraw/zinc/66/77/18/565667718.db2.gz XETPODSNAKRDTG-WDEREUQCSA-N 0 1 378.274 3.174 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)[C@H]2CCO[C@@H](C)C2)c2cccs2)CC1 ZINC000329629231 565674261 /nfs/dbraw/zinc/67/42/61/565674261.db2.gz VYRFOPGEJZATDB-YESZJQIVSA-N 0 1 386.583 3.008 10 0 GGAEMN O=C(CSc1n[n-]c(=S)s1)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000175071622 565677264 /nfs/dbraw/zinc/67/72/64/565677264.db2.gz KOVPLLVMAJMGAI-AWEZNQCLSA-N 0 1 394.591 3.464 10 0 GGAEMN C[C@@H]1C[N@H+](C2CCN(C(=O)Nc3cc(Cl)c(N)c(Cl)c3)CC2)CCO1 ZINC000192295331 565677371 /nfs/dbraw/zinc/67/73/71/565677371.db2.gz FZAZPEUPORAGFP-LLVKDONJSA-N 0 1 387.311 3.293 10 0 GGAEMN C[C@@H]1CN(C2CCN(C(=O)Nc3cc(Cl)c(N)c(Cl)c3)CC2)CCO1 ZINC000192295331 565677376 /nfs/dbraw/zinc/67/73/76/565677376.db2.gz FZAZPEUPORAGFP-LLVKDONJSA-N 0 1 387.311 3.293 10 0 GGAEMN Cc1ccc(CN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)cc1 ZINC000280556805 565680256 /nfs/dbraw/zinc/68/02/56/565680256.db2.gz JGJFIKWOLPSKSR-GFCCVEGCSA-N 0 1 383.311 3.256 10 0 GGAEMN COC(=O)CC[N@@H+](CCc1ccccn1)Cc1cccc(Br)c1 ZINC000192328100 565680866 /nfs/dbraw/zinc/68/08/66/565680866.db2.gz PHLLQIDCXINBGN-UHFFFAOYSA-N 0 1 377.282 3.452 10 0 GGAEMN CS(=O)(=O)Cc1cccc(CNC(=O)c2c(O)cc(Cl)cc2Cl)c1 ZINC000175212230 565684913 /nfs/dbraw/zinc/68/49/13/565684913.db2.gz DYCSNYWOEPKSSR-UHFFFAOYSA-N 0 1 388.272 3.174 10 0 GGAEMN CN(c1cccnn1)C1CCN(C(=O)c2c(O)cc(Cl)cc2Cl)CC1 ZINC000175222558 565686380 /nfs/dbraw/zinc/68/63/80/565686380.db2.gz LCFHRWKPUPCTKP-UHFFFAOYSA-N 0 1 381.263 3.230 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3cc(Cl)c(F)c(Cl)c3)CCO2)n[nH]1 ZINC000192422256 565688664 /nfs/dbraw/zinc/68/86/64/565688664.db2.gz DUVPFWJUGKIJAB-LLVKDONJSA-N 0 1 388.230 3.418 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Cl)C[C@]2(CCCOC2)O1 ZINC000330100335 565692359 /nfs/dbraw/zinc/69/23/59/565692359.db2.gz DVDQAUWWXZQLNK-XUWXXGDYSA-N 0 1 390.307 3.003 10 0 GGAEMN C[C@@H](N[C@H]1CCCc2occc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280777999 565694481 /nfs/dbraw/zinc/69/44/81/565694481.db2.gz SBZZHZOJRHOUNJ-YGRLFVJLSA-N 0 1 399.310 3.418 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2cc(Cl)ccc2Cl)C[C@]2(CCCOC2)O1 ZINC000330139527 565694631 /nfs/dbraw/zinc/69/46/31/565694631.db2.gz WIPNMBSZGOYPDB-XUWXXGDYSA-N 0 1 390.307 3.003 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2cc(Cl)ccc2Cl)C[C@@]2(CCCOC2)O1 ZINC000330139524 565695100 /nfs/dbraw/zinc/69/51/00/565695100.db2.gz WIPNMBSZGOYPDB-QIIPPGSGSA-N 0 1 390.307 3.003 10 0 GGAEMN CN1CC[C@@H]2OCCN(C(=O)c3cc(Cl)c4cc(Cl)ccc4n3)[C@H]2C1 ZINC000410844753 565698436 /nfs/dbraw/zinc/69/84/36/565698436.db2.gz CONCCVDXLSYKOW-IRXDYDNUSA-N 0 1 380.275 3.087 10 0 GGAEMN Cc1ccsc1CN[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280825282 565698762 /nfs/dbraw/zinc/69/87/62/565698762.db2.gz XDLYUYLBWFGBFB-SNVBAGLBSA-N 0 1 389.340 3.317 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NC1CCN(Cc2cccnc2)CC1 ZINC000192575782 565700733 /nfs/dbraw/zinc/70/07/33/565700733.db2.gz HKDGYHNTVRQKGX-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN C[C@H](NCc1ccc(Br)cc1F)c1ccc(S(N)(=O)=O)cc1 ZINC000192728604 565707803 /nfs/dbraw/zinc/70/78/03/565707803.db2.gz BUTQAJOXVNZJSQ-JTQLQIEISA-N 0 1 387.274 3.086 10 0 GGAEMN CN(Cc1cc(Br)cs1)C(=O)CN1CCCC[C@@H]1CC(N)=O ZINC000330454697 565707798 /nfs/dbraw/zinc/70/77/98/565707798.db2.gz MLTLGTRWCSFDIG-GFCCVEGCSA-N 0 1 388.331 3.249 10 0 GGAEMN C[C@@H](NCc1ccc(Br)cc1F)c1ccc(S(N)(=O)=O)cc1 ZINC000192728612 565708080 /nfs/dbraw/zinc/70/80/80/565708080.db2.gz BUTQAJOXVNZJSQ-SNVBAGLBSA-N 0 1 387.274 3.086 10 0 GGAEMN CN(Cc1cc(Br)cs1)C(=O)CN1CCCC[C@H]1CC(N)=O ZINC000330454698 565708123 /nfs/dbraw/zinc/70/81/23/565708123.db2.gz MLTLGTRWCSFDIG-LBPRGKRZSA-N 0 1 388.331 3.249 10 0 GGAEMN CO[C@H](C)c1nc(C)c(C(=O)NCC2(N3CCSCC3)CCCC2)s1 ZINC000175563505 565709514 /nfs/dbraw/zinc/70/95/14/565709514.db2.gz MNIRFUQSMIIHBZ-CQSZACIVSA-N 0 1 383.583 3.250 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2ccc(Cl)c(F)c2)[C@@H]1c1ccccc1 ZINC000192817930 565712505 /nfs/dbraw/zinc/71/25/05/565712505.db2.gz XJSQZEDWIKEDPF-ROUUACIJSA-N 0 1 382.888 3.344 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CC[N@H+]1C ZINC000281181737 565716618 /nfs/dbraw/zinc/71/66/18/565716618.db2.gz FFHQSJJEFWANSG-ISWURRPUSA-N 0 1 380.330 3.429 10 0 GGAEMN C[C@@H](NS(=O)(=O)c1c(F)c(F)cc(F)c1F)c1ccc2c(c1)OCO2 ZINC000192902119 565718611 /nfs/dbraw/zinc/71/86/11/565718611.db2.gz AYHBQUYRFZDIKV-SSDOTTSWSA-N 0 1 377.315 3.011 10 0 GGAEMN C[C@H](NS(=O)(=O)c1c(F)c(F)cc(F)c1F)c1ccc2c(c1)OCO2 ZINC000192902105 565718685 /nfs/dbraw/zinc/71/86/85/565718685.db2.gz AYHBQUYRFZDIKV-ZETCQYMHSA-N 0 1 377.315 3.011 10 0 GGAEMN Cc1nn(C)c(C)c1[C@@H](NS(=O)(=O)c1cc(C)ccc1F)C(F)(F)F ZINC000330693650 565719321 /nfs/dbraw/zinc/71/93/21/565719321.db2.gz CGSOZADOCTWIMY-CQSZACIVSA-N 0 1 379.379 3.066 10 0 GGAEMN Cc1nn(C)c(C)c1[C@H](NS(=O)(=O)c1ccc(C)cc1F)C(F)(F)F ZINC000330702505 565719429 /nfs/dbraw/zinc/71/94/29/565719429.db2.gz IJSSVLBNYIEALO-AWEZNQCLSA-N 0 1 379.379 3.066 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)CN1CCC[C@H](C(F)(F)F)C1 ZINC000192924644 565719558 /nfs/dbraw/zinc/71/95/58/565719558.db2.gz CKHSMYFKNWSPAA-AAEUAGOBSA-N 0 1 382.220 3.463 10 0 GGAEMN Cc1nc([C@H](C)N[C@H](C)c2nc(-c3ccc(Br)cc3)no2)n[nH]1 ZINC000411525309 565734186 /nfs/dbraw/zinc/73/41/86/565734186.db2.gz ASFBQVVVWJNURW-DTWKUNHWSA-N 0 1 377.246 3.337 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCC(=O)Nc1ccccc1Br ZINC000411612784 565740163 /nfs/dbraw/zinc/74/01/63/565740163.db2.gz FAUOYHCXYDKTHV-AHIWAGSCSA-N 0 1 395.297 3.051 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCc2[nH]c3ccc(F)cc3c2C1 ZINC000175995293 565740141 /nfs/dbraw/zinc/74/01/41/565740141.db2.gz SYZCAESOSKFOSK-UHFFFAOYSA-N 0 1 380.495 3.124 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3ccnn3C)C2=O)ccc1Br ZINC000193293207 565743368 /nfs/dbraw/zinc/74/33/68/565743368.db2.gz PTEGWACMXXLTRD-XJKSGUPXSA-N 0 1 391.313 3.337 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@@H](C)c3ccnn3C)C2=O)ccc1Br ZINC000193293193 565743746 /nfs/dbraw/zinc/74/37/46/565743746.db2.gz PTEGWACMXXLTRD-BBRMVZONSA-N 0 1 391.313 3.337 10 0 GGAEMN Cc1ccc(CN(CCO)CCC(=O)Nc2ccccc2Br)o1 ZINC000411658300 565743904 /nfs/dbraw/zinc/74/39/04/565743904.db2.gz BRBQILSQLWIGOA-UHFFFAOYSA-N 0 1 381.270 3.174 10 0 GGAEMN CN1CC[C@@H](NCc2ccc(S(C)(=O)=O)o2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000411747580 565749054 /nfs/dbraw/zinc/74/90/54/565749054.db2.gz LGLGREWARWBRII-WBVHZDCISA-N 0 1 386.876 3.011 10 0 GGAEMN Cc1nnc([C@H](C)N2CC[C@H](Cc3cccc(I)c3)C2)[nH]1 ZINC000411776821 565751322 /nfs/dbraw/zinc/75/13/22/565751322.db2.gz XYZXHZJYVLVXSY-SMDDNHRTSA-N 0 1 396.276 3.343 10 0 GGAEMN O=S(=O)(NCCC[C@H]1CCCC[C@H]1O)c1cc(C(F)(F)F)ccc1O ZINC000331352281 565756536 /nfs/dbraw/zinc/75/65/36/565756536.db2.gz ZHBKMTWUHFDOEI-DGCLKSJQSA-N 0 1 381.416 3.021 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)cc2Br)CCN1C ZINC000281939789 565756618 /nfs/dbraw/zinc/75/66/18/565756618.db2.gz QOCDFIZDTFYZKI-JQWIXIFHSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccoc1Br ZINC000193592265 565764175 /nfs/dbraw/zinc/76/41/75/565764175.db2.gz SVJJTROOGNRVKB-DOMZBBRYSA-N 0 1 378.270 3.078 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000282129528 565766204 /nfs/dbraw/zinc/76/62/04/565766204.db2.gz FICZJLWSWWGLDL-JOYOIKCWSA-N 0 1 394.273 3.014 10 0 GGAEMN CC(C)N(CC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1)C[C@H]1CCC(=O)N1 ZINC000412064412 565767836 /nfs/dbraw/zinc/76/78/36/565767836.db2.gz JXNPTWQPEPXIPI-TZMCWYRMSA-N 0 1 386.323 3.160 10 0 GGAEMN CC(C)N(CC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1)C[C@@H]1CCC(=O)N1 ZINC000412064408 565768608 /nfs/dbraw/zinc/76/86/08/565768608.db2.gz JXNPTWQPEPXIPI-OCCSQVGLSA-N 0 1 386.323 3.160 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(Cc2ccc(Br)c3cccnc23)C1 ZINC000412084422 565769434 /nfs/dbraw/zinc/76/94/34/565769434.db2.gz STHCTQIQBHXSSY-ZDUSSCGKSA-N 0 1 395.322 3.335 10 0 GGAEMN CC(C)N(CC[S@](=O)c1cc(Cl)ccc1Cl)C[C@@H]1CCC(=O)N1 ZINC000412092258 565771174 /nfs/dbraw/zinc/77/11/74/565771174.db2.gz VSIPVSGEYWTHHW-NPMABZOXSA-N 0 1 377.337 3.090 10 0 GGAEMN C[C@H]1CN(C(=O)CSc2n[nH]c(=S)s2)C[C@@H](c2ccc(F)cc2)O1 ZINC000176441741 565772995 /nfs/dbraw/zinc/77/29/95/565772995.db2.gz QYWGVDWBCGSJTJ-CABZTGNLSA-N 0 1 385.511 3.420 10 0 GGAEMN Cc1nn(C)c(NS(=O)(=O)c2c(Cl)cccc2Br)c1C ZINC000282326859 565774650 /nfs/dbraw/zinc/77/46/50/565774650.db2.gz PGOYPDBPZMMMMG-UHFFFAOYSA-N 0 1 378.679 3.254 10 0 GGAEMN C[C@@H](NCC(=O)N(C)Cc1ccc(Cl)s1)c1ccc2c(c1)OCCO2 ZINC000176486620 565776564 /nfs/dbraw/zinc/77/65/64/565776564.db2.gz HZVKBYCMPYJPLG-GFCCVEGCSA-N 0 1 380.897 3.482 10 0 GGAEMN Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000282382005 565777135 /nfs/dbraw/zinc/77/71/35/565777135.db2.gz YTHRSTPGVXMYSB-ZDUSSCGKSA-N 0 1 390.241 3.163 10 0 GGAEMN Cc1ccc([C@H](CNC(=O)c2ccc(O)c(Cl)c2)N2CCOCC2)s1 ZINC000176557016 565783608 /nfs/dbraw/zinc/78/36/08/565783608.db2.gz QDWZMUZVRUXJHO-HNNXBMFYSA-N 0 1 380.897 3.219 10 0 GGAEMN CCc1noc(CC)c1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000176557210 565784293 /nfs/dbraw/zinc/78/42/93/565784293.db2.gz KPQQWPOHVWMVCD-UHFFFAOYSA-N 0 1 377.242 3.368 10 0 GGAEMN COc1cc(Cl)c(Cl)cc1C(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000176567415 565784864 /nfs/dbraw/zinc/78/48/64/565784864.db2.gz YFCCPPYHDCTOEK-LBPRGKRZSA-N 0 1 387.307 3.327 10 0 GGAEMN CO[C@@H](C)c1nc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cs1 ZINC000282559830 565785691 /nfs/dbraw/zinc/78/56/91/565785691.db2.gz SOOFHZPEKQEEAX-QMMMGPOBSA-N 0 1 395.282 3.419 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)c2cc(Br)cc3[nH]cnc32)n[nH]1 ZINC000282585046 565787626 /nfs/dbraw/zinc/78/76/26/565787626.db2.gz VEVQVGUCQABZBJ-QMMMGPOBSA-N 0 1 377.246 3.058 10 0 GGAEMN CS(=O)(=O)N1CCC[C@H](CN2CCc3sccc3[C@@H]2c2cccs2)C1 ZINC000176625599 565789512 /nfs/dbraw/zinc/78/95/12/565789512.db2.gz ZYVOSVSCMGSBOX-RDTXWAMCSA-N 0 1 396.603 3.429 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)[C@H]1CCCc2[nH]ncc21 ZINC000282719360 565793464 /nfs/dbraw/zinc/79/34/64/565793464.db2.gz HDUUFISUNNLTGQ-IINYFYTJSA-N 0 1 376.254 3.232 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@H](C)c3cc(Br)cs3)C2=O)n(C)n1 ZINC000194148576 565796892 /nfs/dbraw/zinc/79/68/92/565796892.db2.gz HODQZUHCIQSTIG-YPMHNXCESA-N 0 1 397.342 3.399 10 0 GGAEMN O[C@H]1[C@@H](CNCc2c(F)ccc(Br)c2F)CCC12CCOCC2 ZINC000282841803 565799261 /nfs/dbraw/zinc/79/92/61/565799261.db2.gz OVRIDBNWWHGLDO-BZNIZROVSA-N 0 1 390.268 3.385 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCO[C@H](c2ccco2)C1 ZINC000176775982 565802078 /nfs/dbraw/zinc/80/20/78/565802078.db2.gz DOGLFBPNXRTYTI-AWEZNQCLSA-N 0 1 376.210 3.132 10 0 GGAEMN CSc1cc(C(=O)N2CCC[C@H](c3nc(=O)[nH][nH]3)C2)c(Cl)cc1Cl ZINC000282896116 565802068 /nfs/dbraw/zinc/80/20/68/565802068.db2.gz LEPQBEGIYYLUJP-QMMMGPOBSA-N 0 1 387.292 3.147 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)N[C@H]1CCOc2c(Br)cccc21 ZINC000282905752 565803446 /nfs/dbraw/zinc/80/34/46/565803446.db2.gz RPAUBOQJNNOYQL-UONOGXRCSA-N 0 1 391.269 3.373 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2Br)CCN1C ZINC000282964005 565804665 /nfs/dbraw/zinc/80/46/65/565804665.db2.gz KSBOMDGOCRZBKC-QWRGUYRKSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H](NC[C@@H]1CCC2(CCOCC2)[C@@H]1O)c1ncc(Br)cc1F ZINC000283367246 565817125 /nfs/dbraw/zinc/81/71/25/565817125.db2.gz NSXJXZBUPWGRBW-MQIPJXDCSA-N 0 1 387.293 3.202 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCOc3ccc(Br)cc3C2)n[nH]1 ZINC000283692650 565826207 /nfs/dbraw/zinc/82/62/07/565826207.db2.gz VXRBWOCYZPOZAQ-NSHDSACASA-N 0 1 393.285 3.016 10 0 GGAEMN O=S(=O)(Cc1ccc(Br)cc1)Nc1cc(-c2ccncc2)[nH]n1 ZINC000194619182 565826452 /nfs/dbraw/zinc/82/64/52/565826452.db2.gz IRDCBYLSTYGODC-UHFFFAOYSA-N 0 1 393.266 3.176 10 0 GGAEMN CCSc1ccc(Cl)cc1NC(=O)N1CCO[C@H](c2n[nH]c(C)n2)C1 ZINC000177085178 565827544 /nfs/dbraw/zinc/82/75/44/565827544.db2.gz DVHOFCCRUPRMMH-ZDUSSCGKSA-N 0 1 381.889 3.484 10 0 GGAEMN COC(=O)C1(CSc2nc(-c3ccc(OC)c(Br)c3)n[nH]2)CC1 ZINC000413006326 565829244 /nfs/dbraw/zinc/82/92/44/565829244.db2.gz OTFWVKWAXNAQCG-UHFFFAOYSA-N 0 1 398.282 3.288 10 0 GGAEMN CN(CCC(=O)OC(C)(C)C)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000177145498 565831665 /nfs/dbraw/zinc/83/16/65/565831665.db2.gz XAWTWGXKWCALPI-UHFFFAOYSA-N 0 1 382.258 3.129 10 0 GGAEMN NC(=O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 ZINC000177170091 565833209 /nfs/dbraw/zinc/83/32/09/565833209.db2.gz POPJEAIYXXRUQB-UHFFFAOYSA-N 0 1 378.759 3.259 10 0 GGAEMN CN1CC[C@H](N[C@@H](C(N)=O)c2cccc(Br)c2)[C@H]1c1ccccc1 ZINC000283885843 565833885 /nfs/dbraw/zinc/83/38/85/565833885.db2.gz DZQGPVYAYCWMPI-RCCFBDPRSA-N 0 1 388.309 3.011 10 0 GGAEMN CN1CC[C@H](N[C@H](C(N)=O)c2cccc(Br)c2)[C@@H]1c1ccccc1 ZINC000283885833 565833942 /nfs/dbraw/zinc/83/39/42/565833942.db2.gz DZQGPVYAYCWMPI-BZSNNMDCSA-N 0 1 388.309 3.011 10 0 GGAEMN Brc1ccc2c(ccnc2N2CC[C@@H](CN3CCOCC3)C2)c1 ZINC000413176352 565838676 /nfs/dbraw/zinc/83/86/76/565838676.db2.gz RSHSWVGESCSLBG-AWEZNQCLSA-N 0 1 376.298 3.156 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)[C@H]2CCCc3[nH]ncc32)cc1Br ZINC000177280404 565840354 /nfs/dbraw/zinc/84/03/54/565840354.db2.gz NDVGXUFTDAKEOJ-JQWIXIFHSA-N 0 1 378.270 3.478 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(Cl)cc(F)c1Br ZINC000284084906 565841301 /nfs/dbraw/zinc/84/13/01/565841301.db2.gz RJTDZLNZNJSVJY-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000284127756 565843311 /nfs/dbraw/zinc/84/33/11/565843311.db2.gz UHRCVENFOFEYRE-HOCLYGCPSA-N 0 1 396.329 3.087 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000284160903 565844408 /nfs/dbraw/zinc/84/44/08/565844408.db2.gz WHXVKAPUIGBKEN-HOCLYGCPSA-N 0 1 396.329 3.087 10 0 GGAEMN COc1cc(CNCc2ccnc(OC(F)F)c2)cc(Br)c1O ZINC000284182835 565845572 /nfs/dbraw/zinc/84/55/72/565845572.db2.gz XSYXTBHBGGCCRY-UHFFFAOYSA-N 0 1 389.196 3.450 10 0 GGAEMN CC(C)Oc1ccc(NS(=O)(=O)Cc2ccccc2C(F)(F)F)nn1 ZINC000194984727 565851990 /nfs/dbraw/zinc/85/19/90/565851990.db2.gz GZAZELMGNHAFLD-UHFFFAOYSA-N 0 1 375.372 3.225 10 0 GGAEMN CCSc1ccc(Cl)cc1C(=O)N1CCO[C@H](c2n[nH]c(CC)n2)C1 ZINC000177502768 565856520 /nfs/dbraw/zinc/85/65/20/565856520.db2.gz HAJZGMPCLLKUTA-ZDUSSCGKSA-N 0 1 380.901 3.346 10 0 GGAEMN O=C(N[C@@H](c1cncc(Br)c1)C1CC1)[C@H]1CCCc2[nH]ncc21 ZINC000284522500 565857788 /nfs/dbraw/zinc/85/77/88/565857788.db2.gz BYNIRFDQBGSWEB-XJKSGUPXSA-N 0 1 375.270 3.255 10 0 GGAEMN CCCCOC[C@H](O)CN[C@H](C)c1cc2c(cc1Br)OCCO2 ZINC000195212559 565866229 /nfs/dbraw/zinc/86/62/29/565866229.db2.gz WVJQAFSYJSFRGV-CHWSQXEVSA-N 0 1 388.302 3.049 10 0 GGAEMN CCCCOC[C@H](O)CN[C@@H](C)c1cc2c(cc1Br)OCCO2 ZINC000195212536 565866414 /nfs/dbraw/zinc/86/64/14/565866414.db2.gz WVJQAFSYJSFRGV-QWHCGFSZSA-N 0 1 388.302 3.049 10 0 GGAEMN O=S(=O)([C@@H]1C[C@@H]2CC[C@H]1C2)N1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000333181212 565870080 /nfs/dbraw/zinc/87/00/80/565870080.db2.gz PVZDVGMOSJXXIU-YVECIDJPSA-N 0 1 377.432 3.126 10 0 GGAEMN O=C(CN1CCN2CCCC[C@@H]2C1)Nc1c(Cl)cccc1C(F)(F)F ZINC000177758936 565871759 /nfs/dbraw/zinc/87/17/59/565871759.db2.gz ZVVXOIUKKUQITB-GFCCVEGCSA-N 0 1 375.822 3.467 10 0 GGAEMN CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cccc(-c3ncon3)c2)c1 ZINC000177825486 565875091 /nfs/dbraw/zinc/87/50/91/565875091.db2.gz YPIRIFHTYNEWIW-UHFFFAOYSA-N 0 1 377.809 3.393 10 0 GGAEMN O=C(N[C@H](CO)CN1CCCCC1)c1sc2ccccc2c1Br ZINC000413799587 565875642 /nfs/dbraw/zinc/87/56/42/565875642.db2.gz OMZKDFQCKNKFAC-LBPRGKRZSA-N 0 1 397.338 3.240 10 0 GGAEMN Cc1csc([C@H]2CCCN(CC(=O)N3CCC[C@H](C(F)(F)F)C3)C2)n1 ZINC000195337744 565877225 /nfs/dbraw/zinc/87/72/25/565877225.db2.gz OIHAZIKBYVFLMN-KBPBESRZSA-N 0 1 375.460 3.432 10 0 GGAEMN O=S(=O)(Nc1cccc(-c2ncon2)c1)c1ccccc1Br ZINC000195450234 565884304 /nfs/dbraw/zinc/88/43/04/565884304.db2.gz GDJHETDYTOKCKB-UHFFFAOYSA-N 0 1 380.223 3.300 10 0 GGAEMN O=C([C@@H]1CCc2[nH]nnc2C1)N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000285052992 565885579 /nfs/dbraw/zinc/88/55/79/565885579.db2.gz JNDJWPPOOFJZNT-BDJLRTHQSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@@H]1CCc2nn[nH]c2C1)N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000285052992 565885583 /nfs/dbraw/zinc/88/55/83/565885583.db2.gz JNDJWPPOOFJZNT-BDJLRTHQSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@@H]1CCc2[nH]nnc2C1)N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000285052999 565886058 /nfs/dbraw/zinc/88/60/58/565886058.db2.gz JNDJWPPOOFJZNT-BZNIZROVSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@@H]1CCc2nn[nH]c2C1)N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000285052999 565886062 /nfs/dbraw/zinc/88/60/62/565886062.db2.gz JNDJWPPOOFJZNT-BZNIZROVSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1c(F)cc(F)cc1Br ZINC000195505372 565889385 /nfs/dbraw/zinc/88/93/85/565889385.db2.gz QBPSQWBPBSWYBA-UHFFFAOYSA-N 0 1 399.239 3.269 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cn2cc(Cl)ccc2n1 ZINC000414073523 565892393 /nfs/dbraw/zinc/89/23/93/565892393.db2.gz VXWGKIYWTORTDB-NSHDSACASA-N 0 1 395.688 3.090 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)NCc1cccc(C(F)(F)F)n1 ZINC000414154483 565899590 /nfs/dbraw/zinc/89/95/90/565899590.db2.gz ZHBBGYJYEMUDMZ-SNVBAGLBSA-N 0 1 390.203 3.203 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000218767738 565900916 /nfs/dbraw/zinc/90/09/16/565900916.db2.gz UQGUXGPVYJUDNW-JTQLQIEISA-N 0 1 376.092 3.036 10 0 GGAEMN CC[N@H+]1CCC[C@@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000219671284 565902572 /nfs/dbraw/zinc/90/25/72/565902572.db2.gz FFOZQUZLAJTORN-CYBMUJFWSA-N 0 1 390.119 3.426 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 ZINC000220550347 565903531 /nfs/dbraw/zinc/90/35/31/565903531.db2.gz QTPXCUFKXAWHHX-GFCCVEGCSA-N 0 1 379.291 3.170 10 0 GGAEMN C[C@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccs1 ZINC000178173996 565904302 /nfs/dbraw/zinc/90/43/02/565904302.db2.gz NDEQQIFEUSLADM-GJZGRUSLSA-N 0 1 380.535 3.181 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H](c2cncc(Br)c2)C2CC2)n[nH]1 ZINC000285438721 565906700 /nfs/dbraw/zinc/90/67/00/565906700.db2.gz OGNWCXLLFOORIB-QLJPJBMISA-N 0 1 392.301 3.257 10 0 GGAEMN COC(C)(C)CS(=O)(=O)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1 ZINC000414367669 565915674 /nfs/dbraw/zinc/91/56/74/565915674.db2.gz AZQZAZMDPMFJRS-UHFFFAOYSA-N 0 1 388.917 3.133 10 0 GGAEMN COc1cc(S(=O)(=O)[N-]c2ccc(OCC[NH+](C)C)cc2)ccc1Cl ZINC000414378236 565917860 /nfs/dbraw/zinc/91/78/60/565917860.db2.gz CSBXIBSLNVQBPU-UHFFFAOYSA-N 0 1 384.885 3.090 10 0 GGAEMN C[C@H](CC(=O)c1ccco1)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000178448681 565919692 /nfs/dbraw/zinc/91/96/92/565919692.db2.gz LTPNDHNWASROMK-SECBINFHSA-N 0 1 376.210 3.310 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000227275778 565922014 /nfs/dbraw/zinc/92/20/14/565922014.db2.gz MIJJNURNKDIZNQ-ZETCQYMHSA-N 0 1 382.121 3.097 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000227275770 565922107 /nfs/dbraw/zinc/92/21/07/565922107.db2.gz MIJJNURNKDIZNQ-SSDOTTSWSA-N 0 1 382.121 3.097 10 0 GGAEMN CSc1ccccc1S(=O)(=O)Nc1ccc(F)cc1N1CCOCC1 ZINC000414390571 565922503 /nfs/dbraw/zinc/92/25/03/565922503.db2.gz ABIVGXRBSRPPEX-UHFFFAOYSA-N 0 1 382.482 3.185 10 0 GGAEMN C[C@H](CC(=O)N1CCN(C[C@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000178601808 565927983 /nfs/dbraw/zinc/92/79/83/565927983.db2.gz NFUICMGSJXVXSP-HZPDHXFCSA-N 0 1 395.341 3.123 10 0 GGAEMN C[C@@H](CC(=O)N1CCN(C[C@@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000178601771 565928037 /nfs/dbraw/zinc/92/80/37/565928037.db2.gz NFUICMGSJXVXSP-HOTGVXAUSA-N 0 1 395.341 3.123 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000178688770 565934184 /nfs/dbraw/zinc/93/41/84/565934184.db2.gz VMQOLTYELVGVOV-NEPJUHHUSA-N 0 1 379.302 3.342 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2cc(Br)c(C)cc2Cl)c1 ZINC000414459417 565937728 /nfs/dbraw/zinc/93/77/28/565937728.db2.gz BGTIRUNIZXCCCJ-UHFFFAOYSA-N 0 1 378.679 3.428 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1Br ZINC000414473088 565940361 /nfs/dbraw/zinc/94/03/61/565940361.db2.gz UNUOGNZTVQJCSI-UHFFFAOYSA-N 0 1 398.204 3.386 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)c2ccc(C(=O)C(C)C)cc2)c1Br ZINC000414471672 565940448 /nfs/dbraw/zinc/94/04/48/565940448.db2.gz QDCBVFABTPAJNY-UHFFFAOYSA-N 0 1 386.271 3.120 10 0 GGAEMN O=C(NCCCc1nc[nH]n1)Nc1ccc(C(F)(F)F)cc1Br ZINC000286150146 565944802 /nfs/dbraw/zinc/94/48/02/565944802.db2.gz YAOVOGGYWGNDCC-UHFFFAOYSA-N 0 1 392.179 3.340 10 0 GGAEMN C[C@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccc(=O)[nH]n1 ZINC000286165909 565945942 /nfs/dbraw/zinc/94/59/42/565945942.db2.gz PNDQSODYVGJWOU-QMMMGPOBSA-N 0 1 376.176 3.402 10 0 GGAEMN COc1cc(-c2noc([C@H]3CC[N@H+](C)[C@@H](C)C3)n2)cc(Br)c1[O-] ZINC000351235811 565947505 /nfs/dbraw/zinc/94/75/05/565947505.db2.gz YTUYBVBOSZAQOU-UWVGGRQHSA-N 0 1 382.258 3.411 10 0 GGAEMN COc1cc(-c2noc([C@H]3CC[N@@H+](C)[C@@H](C)C3)n2)cc(Br)c1[O-] ZINC000351235811 565947508 /nfs/dbraw/zinc/94/75/08/565947508.db2.gz YTUYBVBOSZAQOU-UWVGGRQHSA-N 0 1 382.258 3.411 10 0 GGAEMN C[C@H](N[C@H](CO)c1cccc(Br)c1)c1ccc2c(c1)OCC(=O)N2 ZINC000286215837 565948249 /nfs/dbraw/zinc/94/82/49/565948249.db2.gz SAXWUMHTNRPKQL-MEDUHNTESA-N 0 1 391.265 3.164 10 0 GGAEMN CC(C)N(Cc1cnn(-c2ccc(Br)cc2)c1)C[C@H]1CCC(=O)N1 ZINC000414556623 565948764 /nfs/dbraw/zinc/94/87/64/565948764.db2.gz KJKAFDIFMZJRIO-MRXNPFEDSA-N 0 1 391.313 3.124 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000414570499 565949249 /nfs/dbraw/zinc/94/92/49/565949249.db2.gz ROSXNEAMIJDFEP-AWEZNQCLSA-N 0 1 398.322 3.063 10 0 GGAEMN COC(=O)[C@H]1CSCCN(Cc2cnc(-c3c(F)cccc3F)s2)C1 ZINC000414578022 565949796 /nfs/dbraw/zinc/94/97/96/565949796.db2.gz HYKUUSMZLFLEEC-LLVKDONJSA-N 0 1 384.473 3.426 10 0 GGAEMN COC(=O)c1ccc(CNCc2cc3c(c(Br)c2)OCO3)cc1 ZINC000237103135 565950484 /nfs/dbraw/zinc/95/04/84/565950484.db2.gz JOZCAVXDMVTAIQ-UHFFFAOYSA-N 0 1 378.222 3.254 10 0 GGAEMN COC(=O)c1cncc(NS(=O)(=O)c2cc(C)c(Br)cc2C)c1 ZINC000179008152 565952245 /nfs/dbraw/zinc/95/22/45/565952245.db2.gz XWAGLDMULJKVDJ-UHFFFAOYSA-N 0 1 399.266 3.048 10 0 GGAEMN COCCc1noc(CN2CCC[C@H]2Cc2ccc(Br)cc2)n1 ZINC000361585074 565971340 /nfs/dbraw/zinc/97/13/40/565971340.db2.gz ZWGRDGFDCFDWKP-HNNXBMFYSA-N 0 1 380.286 3.228 10 0 GGAEMN COCCc1noc(CN2CCC[C@@H]2Cc2ccc(Br)cc2)n1 ZINC000361585075 565971684 /nfs/dbraw/zinc/97/16/84/565971684.db2.gz ZWGRDGFDCFDWKP-OAHLLOKOSA-N 0 1 380.286 3.228 10 0 GGAEMN O=C([C@H]1COc2ccc(Br)cc21)N1CCC(c2cnc[nH]2)CC1 ZINC000361790911 565972740 /nfs/dbraw/zinc/97/27/40/565972740.db2.gz WKWGDGMOLJIFJJ-AWEZNQCLSA-N 0 1 376.254 3.054 10 0 GGAEMN CCc1cc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)no1 ZINC000606957909 565973909 /nfs/dbraw/zinc/97/39/09/565973909.db2.gz JHKKYLHLWJKNDG-UHFFFAOYSA-N 0 1 391.229 3.106 10 0 GGAEMN CCc1cc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)no1 ZINC000606957909 565973912 /nfs/dbraw/zinc/97/39/12/565973912.db2.gz JHKKYLHLWJKNDG-UHFFFAOYSA-N 0 1 391.229 3.106 10 0 GGAEMN CC(=O)Nc1cccc(CN[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000286696184 565975090 /nfs/dbraw/zinc/97/50/90/565975090.db2.gz WETBFCPRWRSQGC-SFHVURJKSA-N 0 1 377.282 3.405 10 0 GGAEMN O=C(CCOc1cccc(Br)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000179355055 565975476 /nfs/dbraw/zinc/97/54/76/565975476.db2.gz JDZJBFCMHLIGTA-AWEZNQCLSA-N 0 1 379.258 3.090 10 0 GGAEMN CC(=O)c1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)nc1C ZINC000179363830 565976540 /nfs/dbraw/zinc/97/65/40/565976540.db2.gz WIYZYYJVEPHUEV-UHFFFAOYSA-N 0 1 387.237 3.161 10 0 GGAEMN Cc1c(I)cccc1C(=O)N1CCCC[C@H]1c1nnc[nH]1 ZINC000179359755 565976720 /nfs/dbraw/zinc/97/67/20/565976720.db2.gz UMRGVBKQYYGKAI-ZDUSSCGKSA-N 0 1 396.232 3.085 10 0 GGAEMN COc1ccc(-c2nc3c(s2)[C@@H](N[C@H](C)CS(C)(=O)=O)CCC3)cc1 ZINC000362295347 565977984 /nfs/dbraw/zinc/97/79/84/565977984.db2.gz YNGSMPHMMATOHB-DOMZBBRYSA-N 0 1 380.535 3.219 10 0 GGAEMN COc1ccc(-c2nc3c(s2)[C@H](N[C@@H](C)CS(C)(=O)=O)CCC3)cc1 ZINC000362295351 565978311 /nfs/dbraw/zinc/97/83/11/565978311.db2.gz YNGSMPHMMATOHB-SWLSCSKDSA-N 0 1 380.535 3.219 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NCCC(=O)Nc1ccc(Br)cc1 ZINC000179574910 565989629 /nfs/dbraw/zinc/98/96/29/565989629.db2.gz YBPWSXWPWHEROV-UHFFFAOYSA-N 0 1 393.285 3.363 10 0 GGAEMN CCc1nc([C@@H]2CN(C[C@H](C)c3cccc(Br)c3)CCO2)n[nH]1 ZINC000245502940 565993358 /nfs/dbraw/zinc/99/33/58/565993358.db2.gz HFQPATXGOPCGCA-WFASDCNBSA-N 0 1 379.302 3.307 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000245578182 565996907 /nfs/dbraw/zinc/99/69/07/565996907.db2.gz AESLJFKFOBUIDT-ZNMIVQPWSA-N 0 1 375.270 3.425 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCCOCc2ccc(Cl)cc2Cl)n[nH]1 ZINC000179665194 565997986 /nfs/dbraw/zinc/99/79/86/565997986.db2.gz SBQMNKWTAREJTH-NSHDSACASA-N 0 1 385.295 3.472 10 0 GGAEMN Cc1nnc(NC(=O)NC[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)s1 ZINC000245654209 566000178 /nfs/dbraw/zinc/00/01/78/566000178.db2.gz DCOKDLDYLREPNU-RISCZKNCSA-N 0 1 383.880 3.454 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000179682743 566000246 /nfs/dbraw/zinc/00/02/46/566000246.db2.gz GTSASNRJCBXDHV-CYBMUJFWSA-N 0 1 375.281 3.169 10 0 GGAEMN CN1CC[C@H](CNC(=O)NCc2cscn2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245667297 566000437 /nfs/dbraw/zinc/00/04/37/566000437.db2.gz HGTOPAAJZIARNK-MLGOLLRUSA-N 0 1 382.892 3.428 10 0 GGAEMN C[C@H]1CC[C@H](C(N)=O)CN1Cc1ccc(OC(F)F)c(Br)c1 ZINC000179720010 566002709 /nfs/dbraw/zinc/00/27/09/566002709.db2.gz RFLXHKOCEMXALA-ONGXEEELSA-N 0 1 377.229 3.136 10 0 GGAEMN CCOCCN1CCN(CC2=Cc3cc(Br)ccc3OC2)C[C@H]1C ZINC000245757999 566006183 /nfs/dbraw/zinc/00/61/83/566006183.db2.gz PDALFMIGKKXKQM-OAHLLOKOSA-N 0 1 395.341 3.268 10 0 GGAEMN CN1CC[C@H](CNC(=O)[C@H]2CSCCS2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000245755556 566006564 /nfs/dbraw/zinc/00/65/64/566006564.db2.gz YHURWUIYUBXBLC-WQVCFCJDSA-N 0 1 388.961 3.437 10 0 GGAEMN Cc1nc(C[C@@H]2CCCN(C[C@@H](O)c3cccc(Br)c3)C2)no1 ZINC000245835320 566007395 /nfs/dbraw/zinc/00/73/95/566007395.db2.gz CPSGIXYQQLFILT-XJKSGUPXSA-N 0 1 380.286 3.129 10 0 GGAEMN O=C(CC[N@H+]1CCC[C@@H](c2ccncn2)C1)Nc1cccc(Br)c1 ZINC000363550280 566009716 /nfs/dbraw/zinc/00/97/16/566009716.db2.gz ZKYYIGHCNSWODK-CQSZACIVSA-N 0 1 389.297 3.447 10 0 GGAEMN COc1ccsc1S(=O)(=O)NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000245969696 566012727 /nfs/dbraw/zinc/01/27/27/566012727.db2.gz AAOUQLAZRFHZTF-DOMZBBRYSA-N 0 1 386.564 3.180 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2cccc(F)c2F)[C@H]1c1cccs1 ZINC000246051098 566014270 /nfs/dbraw/zinc/01/42/70/566014270.db2.gz CGLGDUZXMGOFNH-PXAZEXFGSA-N 0 1 386.489 3.388 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)CCc2ccccc2)[C@H]1c1cccs1 ZINC000246099055 566015746 /nfs/dbraw/zinc/01/57/46/566015746.db2.gz HIBNARLHJKKSKD-MJGOQNOKSA-N 0 1 378.563 3.293 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Cl)cc(Br)c2)CCN1C[C@H](C)O ZINC000246143829 566019102 /nfs/dbraw/zinc/01/91/02/566019102.db2.gz TZAWXJZXMANFRE-NHYWBVRUSA-N 0 1 389.721 3.020 10 0 GGAEMN CO[C@H](C)c1nc(CN2CC[C@H](C)[C@H](NC(=O)C(F)(F)F)[C@@H]2C)cs1 ZINC000287446020 566019142 /nfs/dbraw/zinc/01/91/42/566019142.db2.gz QKAVRWPYVPRTPG-KQXIARHKSA-N 0 1 379.448 3.128 10 0 GGAEMN Brc1ccc(CN2CCC[C@@H]2CN2CCOCC2)c2ncccc12 ZINC000179950645 566020258 /nfs/dbraw/zinc/02/02/58/566020258.db2.gz GLVXGVQPEPCPDF-MRXNPFEDSA-N 0 1 390.325 3.294 10 0 GGAEMN COc1ccccc1S(=O)(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000246195285 566021698 /nfs/dbraw/zinc/02/16/98/566021698.db2.gz OIKCNPWSRBVSBK-KSSFIOAISA-N 0 1 380.535 3.118 10 0 GGAEMN O=C(Cc1ccc(Br)s1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000363864115 566024880 /nfs/dbraw/zinc/02/48/80/566024880.db2.gz CHDUNCANLMGYHA-CQSZACIVSA-N 0 1 377.267 3.077 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)cc1Cl ZINC000246483465 566030919 /nfs/dbraw/zinc/03/09/19/566030919.db2.gz WYYCTQNKOPAEAC-ZWNOBZJWSA-N 0 1 381.325 3.009 10 0 GGAEMN CC(C)(C)c1nc2ccc(S(=O)(=O)N3CCN4CCC[C@H]4C3)cc2s1 ZINC000246479359 566031494 /nfs/dbraw/zinc/03/14/94/566031494.db2.gz WRLHTBFLNOJYED-ZDUSSCGKSA-N 0 1 379.551 3.063 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1occc1Br ZINC000246540829 566032382 /nfs/dbraw/zinc/03/23/82/566032382.db2.gz STJIKUMIIUFKJT-SWLSCSKDSA-N 0 1 378.270 3.078 10 0 GGAEMN Cc1nc([C@H]2CN(CC3=Cc4cc(Cl)cc(Cl)c4OC3)CCO2)n[nH]1 ZINC000180107013 566032856 /nfs/dbraw/zinc/03/28/56/566032856.db2.gz PJJCKPKOUHMPPV-OAHLLOKOSA-N 0 1 381.263 3.269 10 0 GGAEMN C[C@H](NC(=O)Nc1cc(Br)ccc1Br)c1nnc[nH]1 ZINC000180130638 566035605 /nfs/dbraw/zinc/03/56/05/566035605.db2.gz BLKMLRRJFXZWKF-LURJTMIESA-N 0 1 389.051 3.212 10 0 GGAEMN Cc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(S(C)(=O)=O)c(F)c1 ZINC000180146389 566037943 /nfs/dbraw/zinc/03/79/43/566037943.db2.gz FBCJPQJWFVWFGH-UHFFFAOYSA-N 0 1 385.482 3.462 10 0 GGAEMN COc1cc(CN2CCC(C(=O)Nc3nncs3)CC2)ccc1SC ZINC000364191623 566038190 /nfs/dbraw/zinc/03/81/90/566038190.db2.gz QASSUCHYJQBXRH-UHFFFAOYSA-N 0 1 378.523 3.119 10 0 GGAEMN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CC[C@@H](Oc2cccnc2)C1 ZINC000246712986 566038286 /nfs/dbraw/zinc/03/82/86/566038286.db2.gz NVJRGLSHVPSAPG-GDBMZVCRSA-N 0 1 383.275 3.281 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Br)cc1)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000246817635 566042352 /nfs/dbraw/zinc/04/23/52/566042352.db2.gz JRJAOBQKJAFUMI-QWQRMKEZSA-N 0 1 381.314 3.403 10 0 GGAEMN CO[C@@H]1CC[C@H]2OCCN(CCC(=O)Nc3ccc(Br)cc3)[C@H]2C1 ZINC000246807974 566042778 /nfs/dbraw/zinc/04/27/78/566042778.db2.gz PUIQHKHDDUOGET-IXDOHACOSA-N 0 1 397.313 3.046 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc(Br)ccc1Br ZINC000364368556 566048266 /nfs/dbraw/zinc/04/82/66/566048266.db2.gz IIXQCLPSSWZMHG-VIFPVBQESA-N 0 1 399.086 3.222 10 0 GGAEMN C[C@@H]1C[N@H+]2CCC[C@H]2CN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000246982409 566048289 /nfs/dbraw/zinc/04/82/89/566048289.db2.gz DYHFLPLHINMCNH-PWSUYJOCSA-N 0 1 383.315 3.229 10 0 GGAEMN COC(=O)c1cc(Br)cc(NC(=O)[C@H]2CCCc3[nH]ncc32)c1C ZINC000416280739 566050619 /nfs/dbraw/zinc/05/06/19/566050619.db2.gz ZHHIZPLTPYAILO-NSHDSACASA-N 0 1 392.253 3.326 10 0 GGAEMN C[C@@H]1CN(C(=O)CCCCc2ccc(Br)cc2)[C@@H](C)CN1CCO ZINC000416294318 566052769 /nfs/dbraw/zinc/05/27/69/566052769.db2.gz KUOPJJHOAUDHJF-CVEARBPZSA-N 0 1 397.357 3.075 10 0 GGAEMN CS(=O)(=O)N1CCC[C@H](CN2CCC[C@H]2c2nc3ccccc3s2)C1 ZINC000247107369 566053038 /nfs/dbraw/zinc/05/30/38/566053038.db2.gz DRRRQPXORHBYNR-ZBFHGGJFSA-N 0 1 379.551 3.105 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)CCN1CCOC ZINC000247163522 566054752 /nfs/dbraw/zinc/05/47/52/566054752.db2.gz QRQFXXQBTADGGS-SQNIBIBYSA-N 0 1 395.341 3.122 10 0 GGAEMN CCCN(C[C@@H](O)CN1CCCC1=O)[C@H](C)c1ccccc1Br ZINC000247234816 566055880 /nfs/dbraw/zinc/05/58/80/566055880.db2.gz DEQVANPCKBZXJA-HUUCEWRRSA-N 0 1 383.330 3.205 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccc(Br)cc1 ZINC000247228317 566055928 /nfs/dbraw/zinc/05/59/28/566055928.db2.gz NRHDLDSVOUUIAY-KBXCAEBGSA-N 0 1 388.309 3.485 10 0 GGAEMN Cc1n[nH]c2cc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)ccc12 ZINC000180356020 566057370 /nfs/dbraw/zinc/05/73/70/566057370.db2.gz VEIYGOVLKBFPFU-UHFFFAOYSA-N 0 1 379.825 3.097 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccc(Br)o1 ZINC000247323607 566058023 /nfs/dbraw/zinc/05/80/23/566058023.db2.gz XNWJQHPRVQUCQH-GXTWGEPZSA-N 0 1 378.270 3.078 10 0 GGAEMN COc1cc(S(=O)(=O)N(CCN(C)C)Cc2cccs2)ccc1Cl ZINC000416415304 566064698 /nfs/dbraw/zinc/06/46/98/566064698.db2.gz HWEGOFSWCZJTNT-UHFFFAOYSA-N 0 1 388.942 3.163 10 0 GGAEMN C[C@@H]1C[NH+](C[C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@@H](C)O1 ZINC000247813137 566066822 /nfs/dbraw/zinc/06/68/22/566066822.db2.gz VLTAWFTUTFLLOA-JHJVBQTASA-N 0 1 387.307 3.413 10 0 GGAEMN C[C@H](O)CN1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)C[C@@H]1C ZINC000247808873 566066865 /nfs/dbraw/zinc/06/68/65/566066865.db2.gz UEAXFVJBBWLNKU-GJZGRUSLSA-N 0 1 379.957 3.274 10 0 GGAEMN CC[C@H]1CN([C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)CCN1CCOC ZINC000247808896 566067026 /nfs/dbraw/zinc/06/70/26/566067026.db2.gz UETBPNDQZBJCSU-HIFRSBDPSA-N 0 1 388.339 3.363 10 0 GGAEMN CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2ncc(Br)s2)ncn1 ZINC000180573601 566073914 /nfs/dbraw/zinc/07/39/14/566073914.db2.gz CIXJEMWBFYPHMG-GHMZBOCLSA-N 0 1 397.346 3.057 10 0 GGAEMN O=C1[C@@H](N=c2ccc3ccc(Cl)c(Cl)c3[nH]2)CCN1C1CCOCC1 ZINC000364903334 566074076 /nfs/dbraw/zinc/07/40/76/566074076.db2.gz FJGCDGXROOSCMD-AWEZNQCLSA-N 0 1 380.275 3.155 10 0 GGAEMN COc1cc(S(=O)(=O)N(C)CCCN(C)Cc2ccco2)ccc1Cl ZINC000416488764 566074941 /nfs/dbraw/zinc/07/49/41/566074941.db2.gz PKLDLDCZRPFSBU-UHFFFAOYSA-N 0 1 386.901 3.084 10 0 GGAEMN CCn1cnnc1[C@@H]1CCCN(C[C@@H](O)c2ccc(F)c(Br)c2)C1 ZINC000248423725 566077212 /nfs/dbraw/zinc/07/72/12/566077212.db2.gz GTCRAKPMIDTYOW-CZUORRHYSA-N 0 1 397.292 3.113 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(Cc3nc4ccc(Br)cc4[nH]3)[C@H]2C1 ZINC000248394478 566077286 /nfs/dbraw/zinc/07/72/86/566077286.db2.gz IAIAHNYOKZJVHG-KCXAZCMYSA-N 0 1 380.286 3.094 10 0 GGAEMN CCc1nc2n(n1)C[C@H](N[C@H]1CCc3c1c(Br)ccc3F)CC2 ZINC000180621841 566078083 /nfs/dbraw/zinc/07/80/83/566078083.db2.gz QKUNKMDRXDNEOB-YGRLFVJLSA-N 0 1 379.277 3.334 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000248494796 566079654 /nfs/dbraw/zinc/07/96/54/566079654.db2.gz CKHSMYFKNWSPAA-YPMHNXCESA-N 0 1 382.220 3.463 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)CN1CCC[C@@H](C(F)(F)F)C1 ZINC000248494796 566079657 /nfs/dbraw/zinc/07/96/57/566079657.db2.gz CKHSMYFKNWSPAA-YPMHNXCESA-N 0 1 382.220 3.463 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000248498559 566079712 /nfs/dbraw/zinc/07/97/12/566079712.db2.gz OKAREKGZLZOYPS-DGCLKSJQSA-N 0 1 382.220 3.463 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)CN1CCC[C@@H](C(F)(F)F)C1 ZINC000248498559 566079714 /nfs/dbraw/zinc/07/97/14/566079714.db2.gz OKAREKGZLZOYPS-DGCLKSJQSA-N 0 1 382.220 3.463 10 0 GGAEMN O=C(c1ncsc1Br)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000288601886 566081302 /nfs/dbraw/zinc/08/13/02/566081302.db2.gz JJQLUKFEIJQBKM-UHFFFAOYSA-N 0 1 380.311 3.254 10 0 GGAEMN O=C(c1ncsc1Br)N1CCCN(Cc2ccccc2)CC1 ZINC000288601886 566081307 /nfs/dbraw/zinc/08/13/07/566081307.db2.gz JJQLUKFEIJQBKM-UHFFFAOYSA-N 0 1 380.311 3.254 10 0 GGAEMN COCCCCS(=O)(=O)N1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000416528816 566081337 /nfs/dbraw/zinc/08/13/37/566081337.db2.gz DLEOCDSDQRYJLS-MRXNPFEDSA-N 0 1 385.917 3.500 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C[C@H](C)O ZINC000248592048 566082639 /nfs/dbraw/zinc/08/26/39/566082639.db2.gz ZDZDKZRIQAATIF-AAEUAGOBSA-N 0 1 378.822 3.276 10 0 GGAEMN CN(C(=O)c1ncsc1Br)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000288636481 566083617 /nfs/dbraw/zinc/08/36/17/566083617.db2.gz SJUPPARUIMGFLO-ZDUSSCGKSA-N 0 1 380.311 3.252 10 0 GGAEMN CN(C(=O)c1ncsc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000288636481 566083623 /nfs/dbraw/zinc/08/36/23/566083623.db2.gz SJUPPARUIMGFLO-ZDUSSCGKSA-N 0 1 380.311 3.252 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)CN(Cc1cccnc1)C1CC1 ZINC000180727973 566084732 /nfs/dbraw/zinc/08/47/32/566084732.db2.gz YGOSMHRWWSZRTE-KRWDZBQOSA-N 0 1 377.282 3.248 10 0 GGAEMN CCS(=O)(=O)C[C@H](C)N[C@H]1CCCOc2ccc(Br)cc21 ZINC000180821697 566091384 /nfs/dbraw/zinc/09/13/84/566091384.db2.gz VMJABMSBSTWEDD-FZMZJTMJSA-N 0 1 376.316 3.076 10 0 GGAEMN O[C@@H](CN1CCC[C@H](c2nncn2C2CC2)C1)c1cccc(Br)c1 ZINC000180864125 566093627 /nfs/dbraw/zinc/09/36/27/566093627.db2.gz CZXMIFPLOZTULT-YOEHRIQHSA-N 0 1 391.313 3.289 10 0 GGAEMN O[C@H](CN1CCC[C@H](c2nncn2C2CC2)C1)c1cccc(Br)c1 ZINC000180864112 566094335 /nfs/dbraw/zinc/09/43/35/566094335.db2.gz CZXMIFPLOZTULT-WMLDXEAASA-N 0 1 391.313 3.289 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)CC1 ZINC000249074793 566095331 /nfs/dbraw/zinc/09/53/31/566095331.db2.gz AYZIEBYOBKQMKC-JKSUJKDBSA-N 0 1 385.291 3.104 10 0 GGAEMN Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)N(C)c1c(Cl)cccc1Cl ZINC000180903722 566097796 /nfs/dbraw/zinc/09/77/96/566097796.db2.gz FDZSRHWUNWUIFA-UHFFFAOYSA-N 0 1 379.247 3.152 10 0 GGAEMN Cc1c(Cl)cc(S(=O)(=O)N2CCCC[C@@H]2c2nnc[nH]2)cc1Cl ZINC000180930611 566099976 /nfs/dbraw/zinc/09/99/76/566099976.db2.gz HDRCJXPFHHBEKK-CYBMUJFWSA-N 0 1 375.281 3.336 10 0 GGAEMN O=C1[C@H](N2CC[C@@]3(O)CCCC[C@@H]3C2)CCN1c1cccc(Br)c1 ZINC000249317328 566100616 /nfs/dbraw/zinc/10/06/16/566100616.db2.gz PSBOXSRWWJMZMH-BJZITVGISA-N 0 1 393.325 3.181 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N2CCCC[C@H]2c2nnc[nH]2)cc1Cl ZINC000180939411 566101553 /nfs/dbraw/zinc/10/15/53/566101553.db2.gz POFCKXJXNQRQNX-NSHDSACASA-N 0 1 391.280 3.036 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000289028675 566101937 /nfs/dbraw/zinc/10/19/37/566101937.db2.gz ASTKWLLJTDTCAC-HWPZZCPQSA-N 0 1 385.295 3.379 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000289028690 566102068 /nfs/dbraw/zinc/10/20/68/566102068.db2.gz ASTKWLLJTDTCAC-QLJPJBMISA-N 0 1 385.295 3.379 10 0 GGAEMN Cc1ccc(CN(CCO)C(=O)c2[nH]nc3ccc(Br)cc32)cc1 ZINC000180959983 566102818 /nfs/dbraw/zinc/10/28/18/566102818.db2.gz IEVVQZBHVWGCHO-UHFFFAOYSA-N 0 1 388.265 3.269 10 0 GGAEMN C[C@H](C(=O)NCc1ccc(Cl)cc1)N1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000249553050 566103763 /nfs/dbraw/zinc/10/37/63/566103763.db2.gz ISOJMQMFZZPESA-SKDZVZGDSA-N 0 1 378.925 3.114 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000250154578 566109512 /nfs/dbraw/zinc/10/95/12/566109512.db2.gz NEJVIMIBPZLYAU-CZUORRHYSA-N 0 1 389.323 3.066 10 0 GGAEMN CC(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2cn3c(n2)CCC[C@H]3C)c1 ZINC000416938627 566113358 /nfs/dbraw/zinc/11/33/58/566113358.db2.gz LIBDKWLQLKJJRN-SNVBAGLBSA-N 0 1 382.873 3.193 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)Nc3ccc(OC(F)F)cc3F)cn21 ZINC000416949649 566115021 /nfs/dbraw/zinc/11/50/21/566115021.db2.gz DHEJWTCWHRGIST-VIFPVBQESA-N 0 1 375.372 3.322 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1ccc(Br)cc1 ZINC000181106496 566116004 /nfs/dbraw/zinc/11/60/04/566116004.db2.gz MNOSYDKOSNNVPQ-JQFCIGGWSA-N 0 1 381.314 3.270 10 0 GGAEMN CC(C)c1cc(Br)ccc1NC(=O)N1C[C@H](C)N(CCO)C[C@@H]1C ZINC000416969013 566116726 /nfs/dbraw/zinc/11/67/26/566116726.db2.gz ZRXOXGYIBPUSSI-KBPBESRZSA-N 0 1 398.345 3.491 10 0 GGAEMN COc1ccc(C(=O)CSc2nnc(C(F)(F)F)s2)c2c1C(=O)CO2 ZINC000289328533 566117213 /nfs/dbraw/zinc/11/72/13/566117213.db2.gz HHNQBQODZLSYPG-UHFFFAOYSA-N 0 1 390.364 3.116 10 0 GGAEMN CC[N@H+]1CCC[C@H](NC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)C1 ZINC000253358395 566117985 /nfs/dbraw/zinc/11/79/85/566117985.db2.gz ORCSKBHTXUBZPH-DLBZAZTESA-N 0 1 396.329 3.016 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000253359154 566118343 /nfs/dbraw/zinc/11/83/43/566118343.db2.gz GHUHREAHBONCCM-GDBMZVCRSA-N 0 1 389.323 3.066 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000253359154 566118347 /nfs/dbraw/zinc/11/83/47/566118347.db2.gz GHUHREAHBONCCM-GDBMZVCRSA-N 0 1 389.323 3.066 10 0 GGAEMN CNC(=O)[C@@H](NCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)C(C)C ZINC000365849228 566122915 /nfs/dbraw/zinc/12/29/15/566122915.db2.gz PJTBADWNEZUBDY-WBVHZDCISA-N 0 1 386.323 3.017 10 0 GGAEMN Cc1cc(NC(=O)C[N@@H+]2[C@@H]3CCCC[C@@H]3C[C@H]2C(=O)[O-])ccc1Br ZINC000261597169 566125458 /nfs/dbraw/zinc/12/54/58/566125458.db2.gz ACRSYPPBFINJDM-WQVCFCJDSA-N 0 1 395.297 3.414 10 0 GGAEMN C[C@H](NC(=O)[C@@](C)(N)c1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000261629462 566126223 /nfs/dbraw/zinc/12/62/23/566126223.db2.gz BRBQAILQOMYQFP-VOJFVSQTSA-N 0 1 391.265 3.229 10 0 GGAEMN C[C@H](NC(=O)[C@](C)(N)c1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000261629460 566126332 /nfs/dbraw/zinc/12/63/32/566126332.db2.gz BRBQAILQOMYQFP-BBATYDOGSA-N 0 1 391.265 3.229 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CC(=O)Nc1ccc(Br)cc1F ZINC000261748410 566131865 /nfs/dbraw/zinc/13/18/65/566131865.db2.gz UMWUKWFGKBUMJR-ONERCXAPSA-N 0 1 399.260 3.244 10 0 GGAEMN CS(=O)(=O)NCC1CCN(Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000289623725 566132649 /nfs/dbraw/zinc/13/26/49/566132649.db2.gz WLPKHSPVFMLLLF-UHFFFAOYSA-N 0 1 399.969 3.225 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)N(Cc1csc(Br)c1)C1CC1 ZINC000366081171 566134244 /nfs/dbraw/zinc/13/42/44/566134244.db2.gz ASGCNJROUXAGSG-NSHDSACASA-N 0 1 395.326 3.465 10 0 GGAEMN CC(C)(NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccccc1Br ZINC000366089463 566135687 /nfs/dbraw/zinc/13/56/87/566135687.db2.gz IPRNCNBIZLNHLD-LLVKDONJSA-N 0 1 377.286 3.264 10 0 GGAEMN O=C(CCCOc1ccccc1Br)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181364161 566135811 /nfs/dbraw/zinc/13/58/11/566135811.db2.gz XLNPXZKTIVCRLK-CQSZACIVSA-N 0 1 393.285 3.480 10 0 GGAEMN O=C(COc1ccc(Br)cc1Cl)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181365979 566135844 /nfs/dbraw/zinc/13/58/44/566135844.db2.gz VEZXHTRPGBIZHG-GFCCVEGCSA-N 0 1 399.676 3.353 10 0 GGAEMN C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417212850 566136221 /nfs/dbraw/zinc/13/62/21/566136221.db2.gz BPAAJTCRSYODLH-RRQGHBQHSA-N 0 1 380.330 3.306 10 0 GGAEMN C[C@@](N)(C(=O)N1CCC[C@@]2(CCCOC2)C1)c1ccc(Br)cc1 ZINC000261823914 566136446 /nfs/dbraw/zinc/13/64/46/566136446.db2.gz SWYNYPHQOSQXLO-ZWKOTPCHSA-N 0 1 381.314 3.042 10 0 GGAEMN C[C@H](N[C@H](CO)c1cccc(Br)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000181395121 566138241 /nfs/dbraw/zinc/13/82/41/566138241.db2.gz FABNXGLBRWBCKW-YVEFUNNKSA-N 0 1 398.322 3.237 10 0 GGAEMN C[C@H](N[C@H](CO)c1cccc(Br)c1)c1ccc(-n2cncn2)cc1 ZINC000181394077 566138342 /nfs/dbraw/zinc/13/83/42/566138342.db2.gz GPSZLEXPPVCATL-SCLBCKFNSA-N 0 1 387.281 3.414 10 0 GGAEMN Cc1cc2ncc([C@@H](C)N[C@H](CO)c3cccc(Br)c3)c(C)n2n1 ZINC000181400678 566138587 /nfs/dbraw/zinc/13/85/87/566138587.db2.gz WABFKKASJFCRCW-SJKOYZFVSA-N 0 1 389.297 3.493 10 0 GGAEMN C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc(-n2cncn2)cc1 ZINC000181394039 566138679 /nfs/dbraw/zinc/13/86/79/566138679.db2.gz GPSZLEXPPVCATL-UGSOOPFHSA-N 0 1 387.281 3.414 10 0 GGAEMN COc1ccccc1CCN(C)C(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000261883677 566139317 /nfs/dbraw/zinc/13/93/17/566139317.db2.gz ZKJXBGKNNZBHBU-LJQANCHMSA-N 0 1 391.309 3.333 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)Nc1ncc(-c2cncc(F)c2)cn1 ZINC000366213583 566141952 /nfs/dbraw/zinc/14/19/52/566141952.db2.gz ZDIIOBZJRNHBDP-UHFFFAOYSA-N 0 1 378.816 3.440 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C[C@@H](C)O ZINC000181470105 566143041 /nfs/dbraw/zinc/14/30/41/566143041.db2.gz BTJQZWQUZIWYEN-YPMHNXCESA-N 0 1 378.822 3.276 10 0 GGAEMN Cc1nnc(CNC(C)(C)COc2ncccc2Br)n1C1CC1 ZINC000181514810 566146743 /nfs/dbraw/zinc/14/67/43/566146743.db2.gz VZXDYYVRADLDFN-UHFFFAOYSA-N 0 1 380.290 3.026 10 0 GGAEMN CC(C)c1nnc(CNC(C)(C)COc2ncccc2Br)n1C ZINC000181514835 566147161 /nfs/dbraw/zinc/14/71/61/566147161.db2.gz XGLUQERCTSCSKN-UHFFFAOYSA-N 0 1 382.306 3.043 10 0 GGAEMN CSc1ccccc1NC(=O)CCN1CCCC[C@@H]1CCS(C)(=O)=O ZINC000366437097 566151293 /nfs/dbraw/zinc/15/12/93/566151293.db2.gz LXOHDULNRKMTSV-OAHLLOKOSA-N 0 1 384.567 3.026 10 0 GGAEMN CS(=O)(=O)CC[C@H]1CCCCN1CCC(=O)Nc1ccc(Cl)cc1F ZINC000366445128 566152794 /nfs/dbraw/zinc/15/27/94/566152794.db2.gz VTYOYMFJQWKYBS-CQSZACIVSA-N 0 1 390.908 3.097 10 0 GGAEMN Cc1nc2c(s1)[C@H](N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)CCC2 ZINC000366477815 566154129 /nfs/dbraw/zinc/15/41/29/566154129.db2.gz OEUQBSSOSQTWCS-SWLSCSKDSA-N 0 1 379.551 3.444 10 0 GGAEMN Cc1nc(SC(F)F)sc1CC(=O)Nc1nc(-c2ccncc2)n[nH]1 ZINC000366595438 566159663 /nfs/dbraw/zinc/15/96/63/566159663.db2.gz GPIZQKMFWOXNIO-UHFFFAOYSA-N 0 1 382.421 3.128 10 0 GGAEMN C[C@H](CN1CCN(C)CC1)NC(=O)c1sc2ccccc2c1Br ZINC000290143811 566159893 /nfs/dbraw/zinc/15/98/93/566159893.db2.gz BWQJRUNAPKZSLA-GFCCVEGCSA-N 0 1 396.354 3.030 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CCC(=O)Nc1ccccc1Br ZINC000263038410 566170978 /nfs/dbraw/zinc/17/09/78/566170978.db2.gz CAACWKFHAWRTPR-MAZHCROVSA-N 0 1 395.297 3.495 10 0 GGAEMN COc1cc(Br)ccc1CN(CCC(N)=O)Cc1ccccc1 ZINC000182067155 566180343 /nfs/dbraw/zinc/18/03/43/566180343.db2.gz OAKJCFAUMAPSGP-UHFFFAOYSA-N 0 1 377.282 3.335 10 0 GGAEMN C[C@@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(Br)nc1 ZINC000290592384 566180461 /nfs/dbraw/zinc/18/04/61/566180461.db2.gz GOLQGDORTOMLKU-MLGOLLRUSA-N 0 1 392.272 3.435 10 0 GGAEMN Cn1nccc1[C@@H]1CCCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000366997076 566181105 /nfs/dbraw/zinc/18/11/05/566181105.db2.gz QGIYADBXADDWGV-LLVKDONJSA-N 0 1 388.269 3.079 10 0 GGAEMN Cn1nccc1[C@H]1CCCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000366997077 566181239 /nfs/dbraw/zinc/18/12/39/566181239.db2.gz QGIYADBXADDWGV-NSHDSACASA-N 0 1 388.269 3.079 10 0 GGAEMN O=C(CCc1cc(Cl)ccc1Br)N[C@@H]1CCc2nc[nH]c2C1 ZINC000367043593 566182057 /nfs/dbraw/zinc/18/20/57/566182057.db2.gz AOTLDJMXQXMKAG-GFCCVEGCSA-N 0 1 382.689 3.432 10 0 GGAEMN O=C(CCSc1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000367046203 566182387 /nfs/dbraw/zinc/18/23/87/566182387.db2.gz UJFHJMACLMFFMJ-LBPRGKRZSA-N 0 1 380.311 3.328 10 0 GGAEMN O=C(CSCC(=O)N1CCCC[C@H]1c1nnc[nH]1)c1ccc(Cl)cc1 ZINC000182101860 566183004 /nfs/dbraw/zinc/18/30/04/566183004.db2.gz VPPOUHKAGFLRIE-AWEZNQCLSA-N 0 1 378.885 3.128 10 0 GGAEMN C[C@H](Cc1cc(Br)ccc1F)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417950816 566183667 /nfs/dbraw/zinc/18/36/67/566183667.db2.gz XTPLSZKUEOYJDK-DFBGVHRSSA-N 0 1 384.293 3.055 10 0 GGAEMN CCn1nncc1CNCCOc1ccc(Br)cc1C(F)(F)F ZINC000417957463 566184843 /nfs/dbraw/zinc/18/48/43/566184843.db2.gz FMQJQJAPLQJPKE-UHFFFAOYSA-N 0 1 393.207 3.248 10 0 GGAEMN COc1cc(Br)ccc1CN1CCC[C@@H](CN2CCOCC2)C1 ZINC000182155543 566185577 /nfs/dbraw/zinc/18/55/77/566185577.db2.gz NFYCNCBFYCYPOC-HNNXBMFYSA-N 0 1 383.330 3.002 10 0 GGAEMN COc1cc(Br)ccc1CNCc1ccccc1C(=O)N(C)C ZINC000417990727 566185885 /nfs/dbraw/zinc/18/58/85/566185885.db2.gz KNKYSUJFXQECDS-UHFFFAOYSA-N 0 1 377.282 3.449 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](CCOc2cccc(Br)c2)C[C@H]1C(F)(F)F ZINC000263576589 566191351 /nfs/dbraw/zinc/19/13/51/566191351.db2.gz QQCAPTGPTZCELB-VXGBXAGGSA-N 0 1 382.176 3.023 10 0 GGAEMN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(F)cc2I)C1 ZINC000418042339 566192160 /nfs/dbraw/zinc/19/21/60/566192160.db2.gz KTUGYZRQNONHRF-MFKMUULPSA-N 0 1 391.224 3.252 10 0 GGAEMN C[C@H](NC1(c2cccc(Br)c2)CC1)c1ccc(S(N)(=O)=O)cc1 ZINC000182271158 566193788 /nfs/dbraw/zinc/19/37/88/566193788.db2.gz BTJMIVMNVNMWTM-LBPRGKRZSA-N 0 1 395.322 3.436 10 0 GGAEMN OCCN(Cc1ccc(F)cc1I)C1CCSCC1 ZINC000418108165 566197971 /nfs/dbraw/zinc/19/79/71/566197971.db2.gz AMTBEOMZVXPHSO-UHFFFAOYSA-N 0 1 395.281 3.120 10 0 GGAEMN CCC[C@@H]1CNCCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000418152113 566201272 /nfs/dbraw/zinc/20/12/72/566201272.db2.gz HHVPRSOJUIFZNA-DOMZBBRYSA-N 0 1 382.302 3.056 10 0 GGAEMN CCC[C@@H]1CNCCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000418152115 566201372 /nfs/dbraw/zinc/20/13/72/566201372.db2.gz HHVPRSOJUIFZNA-IUODEOHRSA-N 0 1 382.302 3.056 10 0 GGAEMN Clc1ccc(-n2cc(CN3CCCC[C@@H]3c3nnc[nH]3)nn2)cc1Cl ZINC000182395791 566202462 /nfs/dbraw/zinc/20/24/62/566202462.db2.gz SCDGVVRMEBDAHE-OAHLLOKOSA-N 0 1 378.267 3.419 10 0 GGAEMN O=C(N[C@H]1CCc2c1ccc(F)c2Br)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000418257020 566207866 /nfs/dbraw/zinc/20/78/66/566207866.db2.gz UGWVMVUXVDAUJV-RWSFTLGLSA-N 0 1 382.277 3.111 10 0 GGAEMN O=C(CCc1cc(F)ccc1Br)N1CCCC[C@H]1c1nnc[nH]1 ZINC000182584430 566214077 /nfs/dbraw/zinc/21/40/77/566214077.db2.gz FRDCZHYYXANLKM-AWEZNQCLSA-N 0 1 381.249 3.393 10 0 GGAEMN C[C@H](NCC(=O)NC(=O)Nc1ccccc1)c1cccc(Br)c1 ZINC000182580934 566214182 /nfs/dbraw/zinc/21/41/82/566214182.db2.gz SRNKJOWDXRJEKZ-LBPRGKRZSA-N 0 1 376.254 3.448 10 0 GGAEMN O=C(Cc1cccs1)N1CCC[C@@H]1C(=O)Nc1cc(Cl)c(O)cc1F ZINC000367789453 566216519 /nfs/dbraw/zinc/21/65/19/566216519.db2.gz ZBXPHDCQEZQFFY-CQSZACIVSA-N 0 1 382.844 3.418 10 0 GGAEMN C[C@@H](C[N@H+](C)Cc1ccccc1)NC(=O)c1ccc(Br)c([O-])c1 ZINC000182641787 566217627 /nfs/dbraw/zinc/21/76/27/566217627.db2.gz SSJJOGGBOAXYAX-ZDUSSCGKSA-N 0 1 377.282 3.405 10 0 GGAEMN C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1ccc(Br)c([O-])c1 ZINC000182641787 566217631 /nfs/dbraw/zinc/21/76/31/566217631.db2.gz SSJJOGGBOAXYAX-ZDUSSCGKSA-N 0 1 377.282 3.405 10 0 GGAEMN CCOC(=O)Cc1csc(NC(=O)CN[C@H](C)c2cccc(Cl)c2)n1 ZINC000182674794 566219224 /nfs/dbraw/zinc/21/92/24/566219224.db2.gz XIFDPUAHMYICNO-LLVKDONJSA-N 0 1 381.885 3.191 10 0 GGAEMN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCCC[C@H]1c1nnc[nH]1 ZINC000182733688 566221435 /nfs/dbraw/zinc/22/14/35/566221435.db2.gz KIDDIWUIXXQQEX-HNNXBMFYSA-N 0 1 382.295 3.297 10 0 GGAEMN O=C(NCC1(c2ccccc2Br)CC1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000367907539 566221890 /nfs/dbraw/zinc/22/18/90/566221890.db2.gz RWDKKHFVKVHPQJ-GFCCVEGCSA-N 0 1 389.297 3.061 10 0 GGAEMN O=C(NC[C@@H]1CCCN(Cc2ncc(C(F)(F)F)s2)C1)C(F)(F)F ZINC000291509024 566223195 /nfs/dbraw/zinc/22/31/95/566223195.db2.gz IEKHNGHDFKVRDT-QMMMGPOBSA-N 0 1 375.338 3.052 10 0 GGAEMN CCOc1ccc(Br)cc1NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000367975428 566225908 /nfs/dbraw/zinc/22/59/08/566225908.db2.gz YHDCNIGHCMAFAM-NSHDSACASA-N 0 1 379.258 3.250 10 0 GGAEMN COC(=O)c1cc(NS(=O)(=O)c2cc(C)oc2C)ccc1Br ZINC000182830914 566226307 /nfs/dbraw/zinc/22/63/07/566226307.db2.gz BOEMAKRGNUWLEI-UHFFFAOYSA-N 0 1 388.239 3.246 10 0 GGAEMN CN1CC[C@H](NCc2ncc(C3OCCO3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000368028738 566227599 /nfs/dbraw/zinc/22/75/99/566227599.db2.gz FXFGRBMOOSFMLY-WMLDXEAASA-N 0 1 379.913 3.377 10 0 GGAEMN CC(C)[C@@H]1C[C@@H](CN[C@@H](C(N)=O)c2ccc(Br)cc2F)CCO1 ZINC000419256932 566231992 /nfs/dbraw/zinc/23/19/92/566231992.db2.gz YALXBBZDXYTFDA-KNXALSJPSA-N 0 1 387.293 3.155 10 0 GGAEMN C[C@@H]1CN(Cc2csc(Cc3ccc(Cl)cc3)n2)[C@H](C)CN1CCO ZINC000419324662 566232671 /nfs/dbraw/zinc/23/26/71/566232671.db2.gz KEHNXUQLYFXQOA-HUUCEWRRSA-N 0 1 379.957 3.274 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000182962285 566232821 /nfs/dbraw/zinc/23/28/21/566232821.db2.gz YQOYRVQWXLDOLZ-AWEZNQCLSA-N 0 1 392.297 3.350 10 0 GGAEMN NC(=O)NC(=O)CN[C@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000182975862 566232880 /nfs/dbraw/zinc/23/28/80/566232880.db2.gz MAKXFTGXXBWTKE-OAHLLOKOSA-N 0 1 384.238 3.201 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000368193051 566233103 /nfs/dbraw/zinc/23/31/03/566233103.db2.gz BBCQCYVXMKAIBP-JQWIXIFHSA-N 0 1 395.276 3.099 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000368193053 566233315 /nfs/dbraw/zinc/23/33/15/566233315.db2.gz BBCQCYVXMKAIBP-ZYHUDNBSSA-N 0 1 395.276 3.099 10 0 GGAEMN C[C@@H](NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1F ZINC000368188803 566233342 /nfs/dbraw/zinc/23/33/42/566233342.db2.gz FARUXVDCBNBBEN-KOLCDFICSA-N 0 1 381.249 3.229 10 0 GGAEMN O=C(CCc1cc(Br)cs1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000368223229 566234352 /nfs/dbraw/zinc/23/43/52/566234352.db2.gz SYSQVEYJAPKLHE-OAHLLOKOSA-N 0 1 391.294 3.467 10 0 GGAEMN COCc1c(Br)cccc1NC(=O)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000183078246 566237312 /nfs/dbraw/zinc/23/73/12/566237312.db2.gz DUNGPGWEVPKWMU-CQSZACIVSA-N 0 1 394.273 3.473 10 0 GGAEMN O=S(=O)(Nc1cccc2c1OCC[C@@H]2O)c1cccc(Br)c1 ZINC000368527436 566240951 /nfs/dbraw/zinc/24/09/51/566240951.db2.gz SQXAAKDZSUDXAI-AWEZNQCLSA-N 0 1 384.251 3.066 10 0 GGAEMN O=S(=O)(Nc1cccc2c1OCC[C@H]2O)c1cccc(Br)c1 ZINC000368527437 566241123 /nfs/dbraw/zinc/24/11/23/566241123.db2.gz SQXAAKDZSUDXAI-CQSZACIVSA-N 0 1 384.251 3.066 10 0 GGAEMN Cc1nc2cc(NCc3c(Br)cnn3C)ccc2n1[C@@H](C)CO ZINC000419771603 566244096 /nfs/dbraw/zinc/24/40/96/566244096.db2.gz YAMXAOUXTZPWKK-JTQLQIEISA-N 0 1 378.274 3.006 10 0 GGAEMN Cn1ccnc1[C@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000183339230 566244665 /nfs/dbraw/zinc/24/46/65/566244665.db2.gz UWTPNGMGTXDBAI-OAHLLOKOSA-N 0 1 387.285 3.209 10 0 GGAEMN Cn1ccnc1[C@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000183339230 566244668 /nfs/dbraw/zinc/24/46/68/566244668.db2.gz UWTPNGMGTXDBAI-OAHLLOKOSA-N 0 1 387.285 3.209 10 0 GGAEMN CCc1nc([C@@H]2CN(Cc3ccc(Cl)c(Br)c3)CCO2)n[nH]1 ZINC000183416107 566246710 /nfs/dbraw/zinc/24/67/10/566246710.db2.gz GTQQMQWIOJOBDW-ZDUSSCGKSA-N 0 1 385.693 3.357 10 0 GGAEMN Brc1ccc2ncc(CN[C@H](c3nnc[nH]3)c3ccccc3)n2c1 ZINC000369020007 566249000 /nfs/dbraw/zinc/24/90/00/566249000.db2.gz TVKRBEMPPDLVQA-INIZCTEOSA-N 0 1 383.253 3.094 10 0 GGAEMN O=C(N[C@H](c1nn[nH]n1)c1ccc(Cl)c(F)c1)c1cc2[nH]ccc2s1 ZINC000369090630 566249755 /nfs/dbraw/zinc/24/97/55/566249755.db2.gz FVGOFALODGDAAB-ZDUSSCGKSA-N 0 1 376.804 3.054 10 0 GGAEMN C[C@H](NCC(=O)Nc1ccc2c(c1)OCO2)c1ccc(Br)cc1 ZINC000444740605 566250452 /nfs/dbraw/zinc/25/04/52/566250452.db2.gz XRTFTRTUFXILRL-NSHDSACASA-N 0 1 377.238 3.467 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000575114329 566251776 /nfs/dbraw/zinc/25/17/76/566251776.db2.gz FZZOLMWQYXGNKA-XQQFMLRXSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CC[C@H]2C[C@H]2C1 ZINC000575114329 566251777 /nfs/dbraw/zinc/25/17/77/566251777.db2.gz FZZOLMWQYXGNKA-XQQFMLRXSA-N 0 1 375.270 3.287 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Cl)cc(F)c2Br)CC1 ZINC000555790476 566251950 /nfs/dbraw/zinc/25/19/50/566251950.db2.gz YLJBQQBUDTXPBH-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN CN(C)[C@H](CNC(=O)[C@H]1CCCN1CC(F)(F)F)c1ccc(Cl)cc1 ZINC000575104105 566252247 /nfs/dbraw/zinc/25/22/47/566252247.db2.gz GYPQVSKJRSYNBJ-HUUCEWRRSA-N 0 1 377.838 3.086 10 0 GGAEMN CN(C)[C@H](CNC(=O)[C@@H]1CCCN1CC(F)(F)F)c1ccc(Cl)cc1 ZINC000575104106 566252429 /nfs/dbraw/zinc/25/24/29/566252429.db2.gz GYPQVSKJRSYNBJ-LSDHHAIUSA-N 0 1 377.838 3.086 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)c2cc(Cl)cc(Br)c2F)[nH][nH]1 ZINC000444811291 566252893 /nfs/dbraw/zinc/25/28/93/566252893.db2.gz IOUGNBNQXUURIE-UHFFFAOYSA-N 0 1 398.623 3.039 10 0 GGAEMN CCOC(=O)c1n[nH]c(C2CCN(Cc3cccc(Br)c3)CC2)n1 ZINC000444797911 566253194 /nfs/dbraw/zinc/25/31/94/566253194.db2.gz DXEDIQVDBGYHMY-UHFFFAOYSA-N 0 1 393.285 3.124 10 0 GGAEMN CNC(=O)C[C@@H](NCc1cc2c(c(Br)c1)OCO2)c1ccccc1 ZINC000481815601 566253645 /nfs/dbraw/zinc/25/36/45/566253645.db2.gz OWENMEJLVLOITK-OAHLLOKOSA-N 0 1 391.265 3.145 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)c2ccc(Br)c(Cl)c2F)[nH][nH]1 ZINC000444816375 566253657 /nfs/dbraw/zinc/25/36/57/566253657.db2.gz XOYRKNWSOYECHS-UHFFFAOYSA-N 0 1 398.623 3.039 10 0 GGAEMN COc1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)c(OC)c1 ZINC000599351828 566254480 /nfs/dbraw/zinc/25/44/80/566254480.db2.gz WXTSZQMPXJQZOZ-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN CC(C)Oc1ncccc1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000599351996 566255107 /nfs/dbraw/zinc/25/51/07/566255107.db2.gz HFJLPECOSSJNHV-UHFFFAOYSA-N 0 1 389.253 3.438 10 0 GGAEMN O=C(NCCOc1ccc(F)cc1)c1n[nH]c2ccc(Br)cc21 ZINC000599351797 566255292 /nfs/dbraw/zinc/25/52/92/566255292.db2.gz PZACXIHUUZKWCK-UHFFFAOYSA-N 0 1 378.201 3.273 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@H]2CC(=O)N(c3ccccc3Br)C2)n1 ZINC000575180060 566257667 /nfs/dbraw/zinc/25/76/67/566257667.db2.gz APBZZCMMWAFQSA-WCQYABFASA-N 0 1 393.285 3.399 10 0 GGAEMN COCC(C)(C)N1CCN(C(=O)NCc2csc(C(F)(F)F)c2)CC1 ZINC000624926820 566258643 /nfs/dbraw/zinc/25/86/43/566258643.db2.gz NMISOBBTANRCKI-UHFFFAOYSA-N 0 1 379.448 3.019 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)[C@H]1CCCN1CC(F)(F)F ZINC000462183241 566260504 /nfs/dbraw/zinc/26/05/04/566260504.db2.gz BOZNJHRIUYHCNR-LLVKDONJSA-N 0 1 391.191 3.291 10 0 GGAEMN COc1c(C)cc(C)cc1S(=O)(=O)Nc1cccc(C[S@@](C)=O)c1C ZINC000509090304 566261651 /nfs/dbraw/zinc/26/16/51/566261651.db2.gz POOVGGRTRKKHBR-XMMPIXPASA-N 0 1 381.519 3.300 10 0 GGAEMN COC(=O)c1cnc(CN2CC[C@H](Cc3ccc(Br)cc3)C2)cn1 ZINC000599427201 566263970 /nfs/dbraw/zinc/26/39/70/566263970.db2.gz HIDLWMUALXIZFQ-CQSZACIVSA-N 0 1 390.281 3.090 10 0 GGAEMN O=c1cc(CN2CC[C@@H](CC(F)(F)F)C2)nc2ccc(Br)cn12 ZINC000555975960 566265321 /nfs/dbraw/zinc/26/53/21/566265321.db2.gz HYHNPTSXEZDPKV-JTQLQIEISA-N 0 1 390.203 3.231 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](N2C[C@@H](O)C3(CC3)C2)C1=O ZINC000509142113 566266323 /nfs/dbraw/zinc/26/63/23/566266323.db2.gz UXFQFKZODIXORR-JKSUJKDBSA-N 0 1 393.325 3.018 10 0 GGAEMN Brc1ccc(-c2ncc(CN3CCc4n[nH]nc4C3)s2)cc1 ZINC000668790546 566266748 /nfs/dbraw/zinc/26/67/48/566266748.db2.gz AXSXGQWYLJYBOE-UHFFFAOYSA-N 0 1 376.283 3.249 10 0 GGAEMN CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C[C@H](O)CC1(O)CCC1 ZINC000625071504 566272005 /nfs/dbraw/zinc/27/20/05/566272005.db2.gz ZOAQTBJGMVDULM-CQSZACIVSA-N 0 1 389.323 3.310 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Nc2cc(I)ccc2C)n[nH]1 ZINC000481981049 566272064 /nfs/dbraw/zinc/27/20/64/566272064.db2.gz NJRLZMNRNONZFZ-SNVBAGLBSA-N 0 1 398.248 3.384 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(Br)c(F)c1 ZINC000462280058 566274031 /nfs/dbraw/zinc/27/40/31/566274031.db2.gz MHIWLCSFOWAQCD-RYUDHWBXSA-N 0 1 393.322 3.129 10 0 GGAEMN COc1c(Br)cccc1CN1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000482000405 566275927 /nfs/dbraw/zinc/27/59/27/566275927.db2.gz OVNWMIFEZJUTEC-HNNXBMFYSA-N 0 1 381.314 3.292 10 0 GGAEMN COc1cc([C@@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)ccn1 ZINC000556265118 566280289 /nfs/dbraw/zinc/28/02/89/566280289.db2.gz ZUHKARPYUTUCQW-LLVKDONJSA-N 0 1 388.269 3.489 10 0 GGAEMN COc1cc([C@@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)ccn1 ZINC000556265118 566280295 /nfs/dbraw/zinc/28/02/95/566280295.db2.gz ZUHKARPYUTUCQW-LLVKDONJSA-N 0 1 388.269 3.489 10 0 GGAEMN CCOc1ccc(Br)cc1CN(CCc1cn(C)nn1)C1CC1 ZINC000625137750 566282062 /nfs/dbraw/zinc/28/20/62/566282062.db2.gz SWTYOPIKGBPLBJ-UHFFFAOYSA-N 0 1 379.302 3.183 10 0 GGAEMN COC(=O)[C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)[C@H]2CCC[C@H]21 ZINC000599654105 566284082 /nfs/dbraw/zinc/28/40/82/566284082.db2.gz LOJPKTSZPKYQBJ-ZENOOKHLSA-N 0 1 392.297 3.489 10 0 GGAEMN CN(C)c1ccncc1C(=O)NCCC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000575776187 566285134 /nfs/dbraw/zinc/28/51/34/566285134.db2.gz BYQFURSQZODZDV-UHFFFAOYSA-N 0 1 381.263 3.213 10 0 GGAEMN CN(CCN1CCN(c2ccccc2)CC1)Cc1ccncc1Br ZINC000625178259 566286837 /nfs/dbraw/zinc/28/68/37/566286837.db2.gz FPPRWJYANURCKE-UHFFFAOYSA-N 0 1 389.341 3.098 10 0 GGAEMN CN(C(=O)c1c(F)c(F)c(Br)c(F)c1F)[C@@H]1CCCN(C)C1 ZINC000669177765 566288178 /nfs/dbraw/zinc/28/81/78/566288178.db2.gz NTFXNWNTYBJUTP-SSDOTTSWSA-N 0 1 383.183 3.172 10 0 GGAEMN CCN(CCOc1ccc(Br)cc1)C(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000669217515 566289775 /nfs/dbraw/zinc/28/97/75/566289775.db2.gz BWFHZCNVRMSLFP-CYBMUJFWSA-N 0 1 392.297 3.205 10 0 GGAEMN CO[C@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccccc2Br)n[nH]1 ZINC000648517807 566291702 /nfs/dbraw/zinc/29/17/02/566291702.db2.gz ZINFRZQEECUNFF-YPMHNXCESA-N 0 1 379.258 3.378 10 0 GGAEMN O=C(N[C@@H](CCO)C1CCCCC1)c1n[nH]c2ccc(Br)cc21 ZINC000535281800 566291864 /nfs/dbraw/zinc/29/18/64/566291864.db2.gz ZURYTKVNGVVZHH-AWEZNQCLSA-N 0 1 380.286 3.387 10 0 GGAEMN CCN([C@H]1CCN([C@H](C)c2ccccc2)C1)S(=O)(=O)CCC(F)(F)F ZINC000556378246 566294622 /nfs/dbraw/zinc/29/46/22/566294622.db2.gz KVCNGULTNOWLKL-ZBFHGGJFSA-N 0 1 378.460 3.426 10 0 GGAEMN CO[C@H](CC(C)C)CS(=O)(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000420674933 566296482 /nfs/dbraw/zinc/29/64/82/566296482.db2.gz NTQHRPKCMJEGQN-JZXOWHBKSA-N 0 1 388.599 3.112 10 0 GGAEMN COCC[N@H+]1CCC[C@@H]1CN[C@H](C)c1ccccc1I ZINC000482241776 566296994 /nfs/dbraw/zinc/29/69/94/566296994.db2.gz JFVGFAURTGPOAA-ZIAGYGMSSA-N 0 1 388.293 3.053 10 0 GGAEMN CC(=O)c1ccc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cc1C ZINC000535347345 566297490 /nfs/dbraw/zinc/29/74/90/566297490.db2.gz YDCLFMJPIKXPMS-UHFFFAOYSA-N 0 1 381.837 3.423 10 0 GGAEMN Clc1ccc(CCN2CCN(CCOC3CCOCC3)CC2)cc1Cl ZINC000625278168 566302263 /nfs/dbraw/zinc/30/22/63/566302263.db2.gz LTYHGSQYKJDMHW-UHFFFAOYSA-N 0 1 387.351 3.349 10 0 GGAEMN C[C@H](NCCOC1CCOCC1)c1cc2c(cc1Br)OCCO2 ZINC000625289391 566303426 /nfs/dbraw/zinc/30/34/26/566303426.db2.gz REYVDABBKJMXHX-LBPRGKRZSA-N 0 1 386.286 3.067 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@H]2CCCc3[nH]ncc32)c(C)cc1Br ZINC000599938471 566304205 /nfs/dbraw/zinc/30/42/05/566304205.db2.gz BIMGLNBNGKTWEG-JTQLQIEISA-N 0 1 392.253 3.326 10 0 GGAEMN COC(=O)c1cc(NC(=O)C(C)(C)c2cnc[nH]2)c(C)cc1Br ZINC000599938709 566304590 /nfs/dbraw/zinc/30/45/90/566304590.db2.gz FGMPAENWBXECPX-UHFFFAOYSA-N 0 1 380.242 3.184 10 0 GGAEMN COc1ccc(S(=O)(=O)NCCN2CCCC[C@H]2C)c(Cl)c1Cl ZINC000462443235 566304666 /nfs/dbraw/zinc/30/46/66/566304666.db2.gz WUINEDPDZCWCGF-LLVKDONJSA-N 0 1 381.325 3.155 10 0 GGAEMN C[C@@H]1C[C@H](CN(C)Cc2cn(-c3cccc(Br)c3)nn2)CCO1 ZINC000482435354 566306744 /nfs/dbraw/zinc/30/67/44/566306744.db2.gz HPWBWJBINJLMRV-ZIAGYGMSSA-N 0 1 379.302 3.277 10 0 GGAEMN O=C1Nc2ccc(Br)cc2CC[C@H]1N[C@H](CO)c1ccsc1 ZINC000625328365 566307572 /nfs/dbraw/zinc/30/75/72/566307572.db2.gz NIOSUCONYNSJPK-HUUCEWRRSA-N 0 1 381.295 3.087 10 0 GGAEMN O=C1Nc2ccc(Br)cc2CC[C@H]1N[C@@H](CO)c1ccsc1 ZINC000625328360 566307714 /nfs/dbraw/zinc/30/77/14/566307714.db2.gz NIOSUCONYNSJPK-CABCVRRESA-N 0 1 381.295 3.087 10 0 GGAEMN O=S(=O)(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(Cl)sc1Cl ZINC000445739425 566308582 /nfs/dbraw/zinc/30/85/82/566308582.db2.gz FRLLMLGLBUJOOI-LLVKDONJSA-N 0 1 389.289 3.241 10 0 GGAEMN O=C(NCCN1Cc2ccccc2C1)c1n[nH]c2ccc(Br)cc21 ZINC000600053452 566311872 /nfs/dbraw/zinc/31/18/72/566311872.db2.gz XRNMGLQCKNRKKA-UHFFFAOYSA-N 0 1 385.265 3.071 10 0 GGAEMN O=C(NCc1ccc(Br)cc1Cl)N[C@@H]1CCc2nc[nH]c2C1 ZINC000576081531 566312920 /nfs/dbraw/zinc/31/29/20/566312920.db2.gz RDMGKAIAYPHMTJ-LLVKDONJSA-N 0 1 383.677 3.182 10 0 GGAEMN C[C@@H](CC(=O)NCc1ccc(F)c(CN(C)C)c1)n1cc(Br)cn1 ZINC000648785794 566313714 /nfs/dbraw/zinc/31/37/14/566313714.db2.gz BDPYHNGJECFZQU-LBPRGKRZSA-N 0 1 397.292 3.114 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2Cl)cc1F ZINC000509559400 566316320 /nfs/dbraw/zinc/31/63/20/566316320.db2.gz UUALIKAOPSXUGG-UHFFFAOYSA-N 0 1 387.816 3.465 10 0 GGAEMN Cn1nc2cc(Br)ccc2c1C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000648815163 566316961 /nfs/dbraw/zinc/31/69/61/566316961.db2.gz IKPRRKJOEOKFBE-UHFFFAOYSA-N 0 1 388.269 3.079 10 0 GGAEMN COc1c(Br)ccc(F)c1C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000648815533 566317219 /nfs/dbraw/zinc/31/72/19/566317219.db2.gz UVQDKYZSNVWZLX-UHFFFAOYSA-N 0 1 382.233 3.340 10 0 GGAEMN Cc1cc(Br)c(O)c(NC(=O)C(=O)c2cnn(C(C)(C)C)c2)c1 ZINC000482563042 566318297 /nfs/dbraw/zinc/31/82/97/566318297.db2.gz ZKFXIFXNYQCOIV-UHFFFAOYSA-N 0 1 380.242 3.236 10 0 GGAEMN C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc2c(cncc2Br)s1 ZINC000648822076 566319195 /nfs/dbraw/zinc/31/91/95/566319195.db2.gz KERWTSHPTDVVBG-NOZJJQNGSA-N 0 1 380.311 3.271 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2cc3c(cncc3Br)s2)n[nH]1 ZINC000648832385 566320008 /nfs/dbraw/zinc/32/00/08/566320008.db2.gz MTVCZZGUKQRBQC-QMMMGPOBSA-N 0 1 379.283 3.451 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)NC3(c4nnc[nH]4)CCC3)coc21 ZINC000576168376 566321777 /nfs/dbraw/zinc/32/17/77/566321777.db2.gz BSEXHMOJOUDWMQ-UHFFFAOYSA-N 0 1 375.226 3.431 10 0 GGAEMN COC(=O)Cc1ccc(CNCc2cccc(Br)c2OC)cc1 ZINC000600184646 566321807 /nfs/dbraw/zinc/32/18/07/566321807.db2.gz HFZAHQOTLSSNEQ-UHFFFAOYSA-N 0 1 378.266 3.463 10 0 GGAEMN Cc1sc(C(N)=O)cc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000669710165 566321932 /nfs/dbraw/zinc/32/19/32/566321932.db2.gz JEOPKIYFNWRRFF-UHFFFAOYSA-N 0 1 379.239 3.047 10 0 GGAEMN O=C(NCCN1Cc2ccccc2C1)c1cc(Br)cc2nc[nH]c21 ZINC000669696910 566321963 /nfs/dbraw/zinc/32/19/63/566321963.db2.gz INOLNECJLPAFQN-UHFFFAOYSA-N 0 1 385.265 3.071 10 0 GGAEMN O=C(N[C@H]1COc2cc(F)cc(F)c21)c1cc(Br)cc2nc[nH]c21 ZINC000669717286 566324249 /nfs/dbraw/zinc/32/42/49/566324249.db2.gz HKBFARZVNJNWEI-LBPRGKRZSA-N 0 1 394.175 3.467 10 0 GGAEMN O=C(N[C@H]1CCc2cc(O)ccc2C1)c1cc(Br)cc2nc[nH]c21 ZINC000669722252 566324355 /nfs/dbraw/zinc/32/43/55/566324355.db2.gz LHVQRIQLNYAMSR-ZDUSSCGKSA-N 0 1 386.249 3.318 10 0 GGAEMN Brc1ccc(CN2CC(C3CCOCC3)C2)c(N2CCOCC2)c1 ZINC000669715367 566324711 /nfs/dbraw/zinc/32/47/11/566324711.db2.gz HWCLJLPDJTYNRP-UHFFFAOYSA-N 0 1 395.341 3.144 10 0 GGAEMN CN(C(=O)CCCC(=O)c1ccc(Br)cc1)[C@H]1CN2CCC1CC2 ZINC000446041353 566325981 /nfs/dbraw/zinc/32/59/81/566325981.db2.gz IIMYSBQPHVUUCL-KRWDZBQOSA-N 0 1 393.325 3.355 10 0 GGAEMN CS[C@H]1CN(C(=O)c2sc(C(F)(F)F)nc2C)C[C@@H]1N1CCCC1 ZINC000462586787 566329052 /nfs/dbraw/zinc/32/90/52/566329052.db2.gz AYDKQUCCNSHTTQ-QWRGUYRKSA-N 0 1 379.473 3.122 10 0 GGAEMN Fc1c(Br)ccc(CN2CCC(N3CCOCC3)CC2)c1F ZINC000625543990 566333652 /nfs/dbraw/zinc/33/36/52/566333652.db2.gz DAQFFMHQCMYRBU-UHFFFAOYSA-N 0 1 375.257 3.024 10 0 GGAEMN O=S1(=O)CCCN1C1CCN(Cc2ccc(Cl)c3ccccc23)CC1 ZINC000420979193 566334281 /nfs/dbraw/zinc/33/42/81/566334281.db2.gz VGYOMCYRKNUMTP-UHFFFAOYSA-N 0 1 378.925 3.493 10 0 GGAEMN OCC[C@@H]1CCCN(Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000421033645 566335533 /nfs/dbraw/zinc/33/55/33/566335533.db2.gz GGIZEAYIKPPNGG-CYBMUJFWSA-N 0 1 380.286 3.484 10 0 GGAEMN C/C=C/CNS(=O)(=O)c1scc(Br)c1Br ZINC000625557003 566335666 /nfs/dbraw/zinc/33/56/66/566335666.db2.gz DZTWAMKJRPLFIV-NSCUHMNNSA-N 0 1 375.107 3.128 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1cccc(I)c1 ZINC000509773571 566336061 /nfs/dbraw/zinc/33/60/61/566336061.db2.gz IVSJMFJABVWJJY-UHFFFAOYSA-N 0 1 390.184 3.329 10 0 GGAEMN COC(=O)CSCCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600469559 566340754 /nfs/dbraw/zinc/34/07/54/566340754.db2.gz BZXZWNWMBYAYDR-AWEZNQCLSA-N 0 1 393.336 3.009 10 0 GGAEMN O=C(N[C@@H]1CCO[C@@H](c2cccnc2)C1)c1cccc(Br)c1O ZINC000649065580 566341341 /nfs/dbraw/zinc/34/13/41/566341341.db2.gz IQTOOLFVYOKDBF-IUODEOHRSA-N 0 1 377.238 3.200 10 0 GGAEMN CN(C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)[C@@H]1CN2CCC1CC2 ZINC000600516802 566342686 /nfs/dbraw/zinc/34/26/86/566342686.db2.gz ONBYGVJJKTVQPU-QGZVFWFLSA-N 0 1 379.291 3.345 10 0 GGAEMN CN(C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)[C@H]1CN2CCC1CC2 ZINC000600516775 566343113 /nfs/dbraw/zinc/34/31/13/566343113.db2.gz NRWSQWOUIGSAAT-KRWDZBQOSA-N 0 1 379.291 3.345 10 0 GGAEMN O=S(=O)(NCC1(C(F)(F)F)CCCC1)c1ncccc1Br ZINC000625622982 566344220 /nfs/dbraw/zinc/34/42/20/566344220.db2.gz VIQMRAZOKLNXJE-UHFFFAOYSA-N 0 1 387.221 3.245 10 0 GGAEMN C[C@]1(CNC(=O)c2cc(Br)cc3nc[nH]c32)CCO[C@@H]1C1CC1 ZINC000556918781 566345149 /nfs/dbraw/zinc/34/51/49/566345149.db2.gz LJDGTYOLBJIBIH-NVXWUHKLSA-N 0 1 378.270 3.260 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000576434731 566345452 /nfs/dbraw/zinc/34/54/52/566345452.db2.gz LIUWQMLULBOONL-LBPRGKRZSA-N 0 1 399.504 3.013 10 0 GGAEMN C[C@@H]1CC2(CN1C(=O)c1[nH]nc3ccc(Br)cc31)CCOCC2 ZINC000649126695 566345598 /nfs/dbraw/zinc/34/55/98/566345598.db2.gz LAHHRQCXPIPYPT-LLVKDONJSA-N 0 1 378.270 3.357 10 0 GGAEMN Cc1cc(C2(NS(=O)(=O)c3c(Cl)cccc3Cl)CCOCC2)on1 ZINC000625654636 566346990 /nfs/dbraw/zinc/34/69/90/566346990.db2.gz XLRRONQJYYNPDZ-UHFFFAOYSA-N 0 1 391.276 3.274 10 0 GGAEMN CN(C)[C@@H](CNC(=O)NC[C@@H]1CSc2ccccc2O1)c1cccs1 ZINC000576460801 566348736 /nfs/dbraw/zinc/34/87/36/566348736.db2.gz FBOZMFLDWFPMNC-KGLIPLIRSA-N 0 1 377.535 3.203 10 0 GGAEMN CCCOc1ccc(Br)cc1CN[C@@H]1CC(=O)N([C@H]2C[C@H]2C)C1 ZINC000462743978 566349191 /nfs/dbraw/zinc/34/91/91/566349191.db2.gz FQAOWVBKPIGNIH-WQVCFCJDSA-N 0 1 381.314 3.337 10 0 GGAEMN C[C@H](CN1CC[C@H](Sc2ccc(Br)cc2)C1)CS(C)(=O)=O ZINC000625703370 566351555 /nfs/dbraw/zinc/35/15/55/566351555.db2.gz FXGOKCMRRSMNLX-DOMZBBRYSA-N 0 1 392.384 3.296 10 0 GGAEMN COc1cc(CNC(=O)c2c(C)n[nH]c2C(C)C)c(Br)cc1O ZINC000649195369 566352042 /nfs/dbraw/zinc/35/20/42/566352042.db2.gz HCGWXEBYBQRRLY-UHFFFAOYSA-N 0 1 382.258 3.248 10 0 GGAEMN O=C(c1csc(=NC2CC2)[nH]1)N1CCO[C@H](c2c(F)cccc2Cl)C1 ZINC000649204320 566353330 /nfs/dbraw/zinc/35/33/30/566353330.db2.gz BTFSJWOYCRKRSB-AWEZNQCLSA-N 0 1 381.860 3.146 10 0 GGAEMN CCn1c(CNC(=O)[C@H]2CCCCN2CC)nc2cc(Br)ccc21 ZINC000483053013 566355059 /nfs/dbraw/zinc/35/50/59/566355059.db2.gz VEFHDTVKQWRNAG-MRXNPFEDSA-N 0 1 393.329 3.309 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)CCc2cccc(Cl)c2)[C@H]1c1ccccc1 ZINC000510021037 566356648 /nfs/dbraw/zinc/35/66/48/566356648.db2.gz PRJCGARHEDZFJC-RBUKOAKNSA-N 0 1 378.925 3.247 10 0 GGAEMN COCc1ccc(S(=O)(=O)Nc2ccc(OC)nc2C(F)(F)F)cc1 ZINC000670329361 566356783 /nfs/dbraw/zinc/35/67/83/566356783.db2.gz CNYYLTGAIBAWSP-UHFFFAOYSA-N 0 1 376.356 3.056 10 0 GGAEMN CN(Cc1cc(Br)cs1)C(=O)CN1CC[C@H]2CC[C@@H](C1)S2 ZINC000625773733 566357401 /nfs/dbraw/zinc/35/74/01/566357401.db2.gz MLCCTROKFWDNPZ-OLZOCXBDSA-N 0 1 389.384 3.439 10 0 GGAEMN CN(Cc1nc2ccc(Br)cc2[nH]1)[C@H](CC(N)=O)c1ccccc1 ZINC000483112398 566358243 /nfs/dbraw/zinc/35/82/43/566358243.db2.gz SDDYNHSOJPHHTB-MRXNPFEDSA-N 0 1 387.281 3.374 10 0 GGAEMN Cn1nc2c(c1CNCc1cc3c(c(Br)c1)OCO3)CCCC2 ZINC000462854782 566360040 /nfs/dbraw/zinc/36/00/40/566360040.db2.gz BHHPIXNNRPLONI-UHFFFAOYSA-N 0 1 378.270 3.080 10 0 GGAEMN COC[C@@](C)(NS(=O)(=O)c1cc(Cl)ccc1OC(F)F)C(F)(F)F ZINC000421251840 566360735 /nfs/dbraw/zinc/36/07/35/566360735.db2.gz RCDRKNIIMSPVFF-LLVKDONJSA-N 0 1 397.749 3.187 10 0 GGAEMN Cc1ccc(CN(CCO)CCC(=O)Nc2cccc(Br)c2)o1 ZINC000483225297 566366125 /nfs/dbraw/zinc/36/61/25/566366125.db2.gz GNWVKGGUIWHODN-UHFFFAOYSA-N 0 1 381.270 3.174 10 0 GGAEMN O=S(=O)(Cc1ccc(Br)cc1)Nc1cc(C(F)(F)F)[nH]n1 ZINC000446788954 566366593 /nfs/dbraw/zinc/36/65/93/566366593.db2.gz ZTGIGPUFWBOSAL-UHFFFAOYSA-N 0 1 384.177 3.133 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1cccs1 ZINC000649493351 566369980 /nfs/dbraw/zinc/36/99/80/566369980.db2.gz JFHTWBHEJNSSPV-NSHDSACASA-N 0 1 379.423 3.427 10 0 GGAEMN C[C@@H](NC(=O)c1c(F)ccc(C(F)(F)F)c1Br)c1nnc[nH]1 ZINC000625938259 566370508 /nfs/dbraw/zinc/37/05/08/566370508.db2.gz ANTOPQBIPAMVLT-RXMQYKEDSA-N 0 1 381.127 3.216 10 0 GGAEMN C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281407 566370848 /nfs/dbraw/zinc/37/08/48/566370848.db2.gz MUQRXHCUAPQFRH-ZWNOBZJWSA-N 0 1 380.229 3.022 10 0 GGAEMN C[C@H]1OCC[C@H]1N(CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281407 566370857 /nfs/dbraw/zinc/37/08/57/566370857.db2.gz MUQRXHCUAPQFRH-ZWNOBZJWSA-N 0 1 380.229 3.022 10 0 GGAEMN CCCOc1c(Br)cc(CN2CC[C@@H](C(=O)NC)C2)cc1OCC ZINC000421386951 566371052 /nfs/dbraw/zinc/37/10/52/566371052.db2.gz OLGWTMUXTKDVCI-CQSZACIVSA-N 0 1 399.329 3.205 10 0 GGAEMN Cc1[nH]ncc1C1CCN(C(=O)c2c[nH]c3ncc(Br)cc23)CC1 ZINC000557174196 566371099 /nfs/dbraw/zinc/37/10/99/566371099.db2.gz HTAUGZLXYFBUJT-UHFFFAOYSA-N 0 1 388.269 3.377 10 0 GGAEMN C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281406 566371303 /nfs/dbraw/zinc/37/13/03/566371303.db2.gz MUQRXHCUAPQFRH-MFKMUULPSA-N 0 1 380.229 3.022 10 0 GGAEMN C[C@H]1OCC[C@@H]1N(CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281406 566371309 /nfs/dbraw/zinc/37/13/09/566371309.db2.gz MUQRXHCUAPQFRH-MFKMUULPSA-N 0 1 380.229 3.022 10 0 GGAEMN CN(C)C[C@@H](NCC(=O)NC(C1CC1)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000625983705 566372123 /nfs/dbraw/zinc/37/21/23/566372123.db2.gz YGUAKGSLAWYPCP-QGZVFWFLSA-N 0 1 384.351 3.491 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)c1 ZINC000625992922 566372378 /nfs/dbraw/zinc/37/23/78/566372378.db2.gz YPXNJQMFVLGWGQ-BMGDILEWSA-N 0 1 386.293 3.430 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2nscc2Br)CC1 ZINC000649536288 566372785 /nfs/dbraw/zinc/37/27/85/566372785.db2.gz QWAKFRDYXUHQNK-UHFFFAOYSA-N 0 1 395.326 3.300 10 0 GGAEMN Cc1cc(Br)ccc1[C@H]1CCCN1C[C@@H](O)COC1CCOCC1 ZINC000626009253 566374736 /nfs/dbraw/zinc/37/47/36/566374736.db2.gz CBSFCJVVQXSOFZ-VQIMIIECSA-N 0 1 398.341 3.451 10 0 GGAEMN C[C@@H](CNC(=O)c1nscc1Br)N1CCc2ccccc2C1 ZINC000649598742 566376994 /nfs/dbraw/zinc/37/69/94/566376994.db2.gz VKPRKECDMJWODM-NSHDSACASA-N 0 1 380.311 3.082 10 0 GGAEMN COC[C@H](C)OC[C@H](O)CN1CCC[C@@H]1c1ccc(Br)cc1C ZINC000626010040 566377150 /nfs/dbraw/zinc/37/71/50/566377150.db2.gz CLNQOVOETNTDED-YXJHDRRASA-N 0 1 386.330 3.307 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1cccs1)c1ccc(OC)cc1 ZINC000576791784 566377481 /nfs/dbraw/zinc/37/74/81/566377481.db2.gz DSSQNXIFCDXDAF-UHFFFAOYSA-N 0 1 382.551 3.435 10 0 GGAEMN COCCc1noc(CN2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)n1 ZINC000626040938 566378282 /nfs/dbraw/zinc/37/82/82/566378282.db2.gz OHSFXMKTXXXSGM-GXTWGEPZSA-N 0 1 380.286 3.399 10 0 GGAEMN C[C@H]1C[C@@H](c2ccc(Br)cc2)CN1Cc1coc(S(N)(=O)=O)c1 ZINC000626040725 566378728 /nfs/dbraw/zinc/37/87/28/566378728.db2.gz KVBIABPSQQTYGG-SMDDNHRTSA-N 0 1 399.310 3.068 10 0 GGAEMN C[C@H]1C[C@H](c2ccc(Br)cc2)CN1Cc1coc(S(N)(=O)=O)c1 ZINC000626040723 566378796 /nfs/dbraw/zinc/37/87/96/566378796.db2.gz KVBIABPSQQTYGG-FZMZJTMJSA-N 0 1 399.310 3.068 10 0 GGAEMN COCCc1noc(CN2C[C@H](c3ccc(Br)cc3)C[C@H]2C)n1 ZINC000626040941 566378936 /nfs/dbraw/zinc/37/89/36/566378936.db2.gz OHSFXMKTXXXSGM-TZMCWYRMSA-N 0 1 380.286 3.399 10 0 GGAEMN CN(Cc1cc(C(C)(C)C)[nH]n1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000447070507 566382209 /nfs/dbraw/zinc/38/22/09/566382209.db2.gz SKWVPTCYFVCSMO-UHFFFAOYSA-N 0 1 378.270 3.311 10 0 GGAEMN CNC(=O)C[C@H](NCc1nc2ccc(Br)cc2[nH]1)c1ccccc1 ZINC000483416263 566382549 /nfs/dbraw/zinc/38/25/49/566382549.db2.gz XGIYUQCBZGVERC-HNNXBMFYSA-N 0 1 387.281 3.292 10 0 GGAEMN CC(C)n1ncc2c1C[C@@H](NC(=O)c1cccc(Br)c1O)CC2 ZINC000557395930 566382780 /nfs/dbraw/zinc/38/27/80/566382780.db2.gz RPJNDHRMHBPJMD-LBPRGKRZSA-N 0 1 378.270 3.219 10 0 GGAEMN O=C1[C@@H](NCc2ccc3c[nH]nc3c2)CCN1c1cccc(Br)c1 ZINC000447071749 566382965 /nfs/dbraw/zinc/38/29/65/566382965.db2.gz BYFAYDOVMICECH-INIZCTEOSA-N 0 1 385.265 3.221 10 0 GGAEMN CC[C@@H]1CCCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000463113587 566384562 /nfs/dbraw/zinc/38/45/62/566384562.db2.gz ZGRVLBVHSXIYAP-SNVBAGLBSA-N 0 1 383.233 3.430 10 0 GGAEMN CCNC(=O)c1ccc(=N[C@H](CCOC)c2ccc(Cl)c(Cl)c2)[nH]n1 ZINC000557426147 566386271 /nfs/dbraw/zinc/38/62/71/566386271.db2.gz SUTCCDZNTAJCFB-CQSZACIVSA-N 0 1 383.279 3.145 10 0 GGAEMN CNS(=O)(=O)CCCN(Cc1cccs1)Cc1ccc2[nH]ccc2c1 ZINC000626112616 566386750 /nfs/dbraw/zinc/38/67/50/566386750.db2.gz HWKFRQQXBSUJCU-UHFFFAOYSA-N 0 1 377.535 3.171 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1C[C@@H](c2ccccc2)[C@](F)(CO)C1 ZINC000576938868 566390918 /nfs/dbraw/zinc/39/09/18/566390918.db2.gz JRBCJZOXIAARKO-KBXCAEBGSA-N 0 1 394.240 3.095 10 0 GGAEMN O=C(CCN1CCN(Cc2ccc(Br)cc2)CC1)NC1CCCC1 ZINC000483592186 566392250 /nfs/dbraw/zinc/39/22/50/566392250.db2.gz LNYQNWXNZXVASB-UHFFFAOYSA-N 0 1 394.357 3.016 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@H](CO)NCc1cc(Br)ccc1OC(F)F ZINC000576997929 566397013 /nfs/dbraw/zinc/39/70/13/566397013.db2.gz AHNZSKDPLVIWMR-TZMCWYRMSA-N 0 1 396.272 3.298 10 0 GGAEMN COc1cc(C)cc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)c1C ZINC000447263497 566398637 /nfs/dbraw/zinc/39/86/37/566398637.db2.gz JJKMHKZFEZUUDZ-UHFFFAOYSA-N 0 1 382.825 3.201 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)n[nH]1 ZINC000626303720 566399255 /nfs/dbraw/zinc/39/92/55/566399255.db2.gz NTBYUUIOHYRPCC-JQWOWJDXSA-N 0 1 389.297 3.454 10 0 GGAEMN COCCN1CCN(Cc2nc3ccc(Br)cc3o2)C(C)(C)C1 ZINC000649850902 566400066 /nfs/dbraw/zinc/40/00/66/566400066.db2.gz FFQVYNAXWGDOEM-UHFFFAOYSA-N 0 1 382.302 3.133 10 0 GGAEMN COc1cc(C)cc(NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)c1C ZINC000447266851 566400068 /nfs/dbraw/zinc/40/00/68/566400068.db2.gz YENVQTOLHIENTA-UHFFFAOYSA-N 0 1 380.853 3.261 10 0 GGAEMN COc1cc(Br)ccc1CCCN1CCO[C@@]2(CCCOC2)C1 ZINC000510641323 566400555 /nfs/dbraw/zinc/40/05/55/566400555.db2.gz PXTWRLBTSZVWMB-SFHVURJKSA-N 0 1 384.314 3.272 10 0 GGAEMN Cc1cc(C[C@H](C)Nc2ncnc(CC(C)C)c2I)[nH]n1 ZINC000557627708 566403222 /nfs/dbraw/zinc/40/32/22/566403222.db2.gz ZNNXQSBYOKSUTL-JTQLQIEISA-N 0 1 399.280 3.354 10 0 GGAEMN CC[C@H](CN1CCCC1)NS(=O)(=O)c1cccc(Br)c1Cl ZINC000671176112 566404090 /nfs/dbraw/zinc/40/40/90/566404090.db2.gz CVKRGXVAPYVHAT-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN Cc1ccc(I)c(C(=O)N2CCN(C3CCCC3)CC2)c1 ZINC000510685867 566404202 /nfs/dbraw/zinc/40/42/02/566404202.db2.gz LRXCQABUICHOMI-UHFFFAOYSA-N 0 1 398.288 3.300 10 0 GGAEMN Cc1cc2ncc([C@H](C)N[C@@H](CO)c3ccc(Br)cc3)c(C)n2n1 ZINC000536834842 566404994 /nfs/dbraw/zinc/40/49/94/566404994.db2.gz UPJUKXWPRODEQR-SJCJKPOMSA-N 0 1 389.297 3.493 10 0 GGAEMN COc1c(Br)c(C)sc1C(=O)NCCN1CCCC[C@@H]1C ZINC000463384943 566405564 /nfs/dbraw/zinc/40/55/64/566405564.db2.gz OTINXFFRUKUJBQ-JTQLQIEISA-N 0 1 375.332 3.432 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2I)o1 ZINC000536903454 566410837 /nfs/dbraw/zinc/41/08/37/566410837.db2.gz DAVCDHYJTVSJEB-UHFFFAOYSA-N 0 1 381.166 3.133 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](N[C@H]2CCCOc3cc(Br)ccc32)CC1=O ZINC000536868688 566407346 /nfs/dbraw/zinc/40/73/46/566407346.db2.gz HIEOMCFBDCNCOY-XTBFLFJDSA-N 0 1 379.298 3.262 10 0 GGAEMN O=C(NCc1ccsc1)c1n[nH]c2ccc(I)cc21 ZINC000463394179 566407565 /nfs/dbraw/zinc/40/75/65/566407565.db2.gz PKKBZJXFWDGUTH-UHFFFAOYSA-N 0 1 383.214 3.159 10 0 GGAEMN CN(CCc1cccc(Br)c1)CC(=O)N1CCO[C@H]2CCCC[C@H]21 ZINC000463413088 566409216 /nfs/dbraw/zinc/40/92/16/566409216.db2.gz JPDIPYIPINSUPA-MSOLQXFVSA-N 0 1 395.341 3.093 10 0 GGAEMN O=C(NCCc1cccs1)c1n[nH]c2ccc(I)cc21 ZINC000463474637 566411958 /nfs/dbraw/zinc/41/19/58/566411958.db2.gz RWVBIXXTJZRAFH-UHFFFAOYSA-N 0 1 397.241 3.202 10 0 GGAEMN O=C(NCc1ccccc1F)c1n[nH]c2ccc(I)cc21 ZINC000463456518 566412654 /nfs/dbraw/zinc/41/26/54/566412654.db2.gz OXVSUCLHJPLQGP-UHFFFAOYSA-N 0 1 395.175 3.237 10 0 GGAEMN O=C(Nc1ccc(OCCCO)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000557740980 566414328 /nfs/dbraw/zinc/41/43/28/566414328.db2.gz GUMNULXLGUNYPS-UHFFFAOYSA-N 0 1 390.237 3.339 10 0 GGAEMN C[C@@H]1CN(C)C[C@H](C)N1C(=O)c1cc(Br)cc(Br)c1 ZINC000536973001 566415245 /nfs/dbraw/zinc/41/52/45/566415245.db2.gz DSRDMUQRXSBHPZ-AOOOYVTPSA-N 0 1 390.119 3.376 10 0 GGAEMN COC1(c2ccccc2)CN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000557778405 566417726 /nfs/dbraw/zinc/41/77/26/566417726.db2.gz QAOZTBKCJHFMIT-UHFFFAOYSA-N 0 1 386.249 3.323 10 0 GGAEMN CC(C)Oc1cc(NC(=O)c2ccc(Br)cc2O)ccc1C(N)=O ZINC000447667234 566421679 /nfs/dbraw/zinc/42/16/79/566421679.db2.gz DFIHMQXRTOAUEO-UHFFFAOYSA-N 0 1 393.237 3.293 10 0 GGAEMN C[C@H](N[C@@H](CO)CC1CCCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000510994923 566426612 /nfs/dbraw/zinc/42/66/12/566426612.db2.gz CBBTZBJPEULNGY-CMPLNLGQSA-N 0 1 395.352 3.233 10 0 GGAEMN C[C@@H]1[C@@H](C)N(C(=O)Cc2noc3ccc(Br)cc32)[C@@H](C)CN1C ZINC000650155724 566429102 /nfs/dbraw/zinc/42/91/02/566429102.db2.gz FSOVVZWTKCYMTA-QJPTWQEYSA-N 0 1 380.286 3.072 10 0 GGAEMN CC(C)CN(C(=O)C(=O)c1ccc(Br)cc1)C1CCN(C)CC1 ZINC000511027656 566429284 /nfs/dbraw/zinc/42/92/84/566429284.db2.gz IVEFBQIXAWXCAY-UHFFFAOYSA-N 0 1 381.314 3.211 10 0 GGAEMN CCSc1ccc(CC(=O)NC2(c3nnc[nH]3)CCC2)c(Br)c1 ZINC000626620581 566429790 /nfs/dbraw/zinc/42/97/90/566429790.db2.gz IBFZJPSCKUHUSY-UHFFFAOYSA-N 0 1 395.326 3.417 10 0 GGAEMN CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)NCCN1CC[C@@H](O)C1 ZINC000626612637 566429928 /nfs/dbraw/zinc/42/99/28/566429928.db2.gz KMYJTLYACCALSR-SECBINFHSA-N 0 1 397.850 3.269 10 0 GGAEMN CC(C)n1cc(C(C)(C)NC(=O)c2n[nH]c3ccc(Br)cc32)nn1 ZINC000422072953 566431312 /nfs/dbraw/zinc/43/13/12/566431312.db2.gz SGBOTMWFHMRUOF-UHFFFAOYSA-N 0 1 391.273 3.163 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)N=c1cc(-c2ccc(C)o2)[nH][nH]1 ZINC000447799677 566432075 /nfs/dbraw/zinc/43/20/75/566432075.db2.gz KZILPISMYHTKME-UHFFFAOYSA-N 0 1 390.237 3.352 10 0 GGAEMN Cn1nccc1C1=CCN(CCOc2cc(F)cc(Br)c2)CC1 ZINC000511073732 566434168 /nfs/dbraw/zinc/43/41/68/566434168.db2.gz QYNPAUVSNNNCKD-UHFFFAOYSA-N 0 1 380.261 3.490 10 0 GGAEMN C[C@H]1CN(CCCNC(=O)N2CCc3c2cccc3Br)C[C@H](C)O1 ZINC000422137773 566434867 /nfs/dbraw/zinc/43/48/67/566434867.db2.gz AKMITRBDGWPNSW-KBPBESRZSA-N 0 1 396.329 3.021 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1Cc2ccccc2C1 ZINC000463801039 566434934 /nfs/dbraw/zinc/43/49/34/566434934.db2.gz DAYFIRBNLULNOD-UHFFFAOYSA-N 0 1 389.196 3.324 10 0 GGAEMN CCSc1ccc(CC(=O)N2CCC3(CN(C)C3)C2)c(Br)c1 ZINC000626670280 566441177 /nfs/dbraw/zinc/44/11/77/566441177.db2.gz ILWGIBAGBIWYBZ-UHFFFAOYSA-N 0 1 383.355 3.268 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000577520672 566441860 /nfs/dbraw/zinc/44/18/60/566441860.db2.gz KVESQFDTLYCCAE-AWEZNQCLSA-N 0 1 382.291 3.256 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1 ZINC000671699845 566442976 /nfs/dbraw/zinc/44/29/76/566442976.db2.gz QRFKGBSHXPOCSK-CQSZACIVSA-N 0 1 382.291 3.256 10 0 GGAEMN C[C@H]1CO[C@@H](C(F)(F)F)CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000671714486 566444848 /nfs/dbraw/zinc/44/48/48/566444848.db2.gz WSEKPBWHHGIFOT-QPUJVOFHSA-N 0 1 378.192 3.477 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 ZINC000577563463 566445667 /nfs/dbraw/zinc/44/56/67/566445667.db2.gz RNGDYWOLUSNKBZ-SFHVURJKSA-N 0 1 381.929 3.086 10 0 GGAEMN Cc1cc(C(=O)N=c2ncn(C(C)C)[nH]2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000650284503 566445992 /nfs/dbraw/zinc/44/59/92/566445992.db2.gz NHQZOINWCWQHFW-UHFFFAOYSA-N 0 1 379.251 3.334 10 0 GGAEMN Cc1cc(N2CCC[C@@H](NCc3cnc(C)nc3)C2=O)ccc1Br ZINC000464089098 566446068 /nfs/dbraw/zinc/44/60/68/566446068.db2.gz VVGBFVVVLYPQPY-QGZVFWFLSA-N 0 1 389.297 3.141 10 0 GGAEMN O=S(=O)(NC1CCC(OC(F)F)CC1)c1cc(C(F)(F)F)ccc1O ZINC000650294218 566446041 /nfs/dbraw/zinc/44/60/41/566446041.db2.gz YTTKEVVWLCRPFN-UHFFFAOYSA-N 0 1 389.342 3.240 10 0 GGAEMN C[C@@H]1[C@@H](C)CCCN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000464074499 566446097 /nfs/dbraw/zinc/44/60/97/566446097.db2.gz VCIKICWIRRBRQB-VHSXEESVSA-N 0 1 383.233 3.428 10 0 GGAEMN O=c1[nH]nc2n1CCN(Cc1ccc(-c3cccc(Br)c3)s1)C2 ZINC000484732491 566450250 /nfs/dbraw/zinc/45/02/50/566450250.db2.gz YDPSSSRUDVCEFR-UHFFFAOYSA-N 0 1 391.294 3.491 10 0 GGAEMN CC(C)Sc1cc(Br)ccc1CN1CCn2c(=O)[nH]nc2C1 ZINC000484748405 566451149 /nfs/dbraw/zinc/45/11/49/566451149.db2.gz AICQSTFRTNQFCQ-UHFFFAOYSA-N 0 1 383.315 3.263 10 0 GGAEMN O=C(Nc1cc(Cl)c(Cl)c(Cl)c1)N1CCN(Cc2nnc[nH]2)CC1 ZINC000650396326 566451520 /nfs/dbraw/zinc/45/15/20/566451520.db2.gz LVFNOWMKWKADFY-UHFFFAOYSA-N 0 1 389.674 3.115 10 0 GGAEMN COC(=O)[C@@H](c1cccc(Cl)c1Cl)N(C)C(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000602190882 566453075 /nfs/dbraw/zinc/45/30/75/566453075.db2.gz YUCQVJYMVAEIDG-UEKVPHQBSA-N 0 1 382.247 3.193 10 0 GGAEMN C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N=c2nc(-c3ccsc3)[n-]s2)C1 ZINC000448000781 566453603 /nfs/dbraw/zinc/45/36/03/566453603.db2.gz OQBKZGYEVHHLDD-LBPRGKRZSA-N 0 1 379.555 3.321 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC[C@H](c3n[nH]c(=O)o3)C2)c1 ZINC000626846229 566453750 /nfs/dbraw/zinc/45/37/50/566453750.db2.gz KAJPTZBDCDOJFH-VIFPVBQESA-N 0 1 384.205 3.005 10 0 GGAEMN O=S(=O)(CCNCc1cc(F)cc(Br)c1)c1ccc(F)cc1 ZINC000448110774 566458684 /nfs/dbraw/zinc/45/86/84/566458684.db2.gz UICJLWDDFWFXTD-UHFFFAOYSA-N 0 1 390.249 3.291 10 0 GGAEMN CCC1(C)CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000464245746 566458954 /nfs/dbraw/zinc/45/89/54/566458954.db2.gz OUMNNDADBJSSEG-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CCC1(C)CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000464245746 566458958 /nfs/dbraw/zinc/45/89/58/566458958.db2.gz OUMNNDADBJSSEG-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CCn1c(CNC(=O)[C@@H](C)Cc2cnc[nH]2)nc2cc(Br)ccc21 ZINC000577767229 566462801 /nfs/dbraw/zinc/46/28/01/566462801.db2.gz WAPDQYZFEZJTJZ-NSHDSACASA-N 0 1 390.285 3.037 10 0 GGAEMN O=C(NCC/C=C\c1ccc(Br)cc1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000627122434 566467984 /nfs/dbraw/zinc/46/79/84/566467984.db2.gz GIEBUGGHZWWJBE-JNPKQNEQSA-N 0 1 378.314 3.388 10 0 GGAEMN Cc1ccc([C@@H](CNC(=O)C(=O)c2ccc(Br)cc2)N(C)C)cc1 ZINC000511538096 566470070 /nfs/dbraw/zinc/47/00/70/566470070.db2.gz YKQVSBBAIJQULI-QGZVFWFLSA-N 0 1 389.293 3.359 10 0 GGAEMN C[C@@H]1CN(C(=O)N[C@H]2CCCSc3ccc(Br)cc32)CCN1 ZINC000627179829 566470574 /nfs/dbraw/zinc/47/05/74/566470574.db2.gz NKDFJPMVGPDFED-RISCZKNCSA-N 0 1 384.343 3.379 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)s[n-]1 ZINC000558414582 566470682 /nfs/dbraw/zinc/47/06/82/566470682.db2.gz PXJLINZOGBYRQA-FUNVUKJBSA-N 0 1 377.539 3.086 10 0 GGAEMN CCN(C(=O)CN[C@](C)(CO)c1ccc(Br)cc1)c1ccccc1 ZINC000511558990 566471452 /nfs/dbraw/zinc/47/14/52/566471452.db2.gz ANXCBRDPZIACFH-LJQANCHMSA-N 0 1 391.309 3.299 10 0 GGAEMN Cc1cccc(NC(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511561105 566471499 /nfs/dbraw/zinc/47/14/99/566471499.db2.gz HWMGMCDMIQMIOD-SFHVURJKSA-N 0 1 377.282 3.193 10 0 GGAEMN C[C@@H]1CN(C(=O)N[C@@H]2CCCSc3ccc(Br)cc32)CCN1 ZINC000627179827 566471582 /nfs/dbraw/zinc/47/15/82/566471582.db2.gz NKDFJPMVGPDFED-BXUZGUMPSA-N 0 1 384.343 3.379 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NC(=O)c2ccc(F)c(CSC)c2)c1 ZINC000537794841 566472392 /nfs/dbraw/zinc/47/23/92/566472392.db2.gz ANYUHJQPHFNBAY-UHFFFAOYSA-N 0 1 383.466 3.440 10 0 GGAEMN CN(CC1CCCCC1)C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511584813 566473723 /nfs/dbraw/zinc/47/37/23/566473723.db2.gz JSSHDHLHXBRZPG-IBGZPJMESA-N 0 1 397.357 3.285 10 0 GGAEMN C[C@@H]1CCCC[C@H]1N(C)C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511585649 566473986 /nfs/dbraw/zinc/47/39/86/566473986.db2.gz NVOQXMYDMMKPEU-LSBZLQRGSA-N 0 1 397.357 3.283 10 0 GGAEMN CCN1CCN(CC(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)CC1 ZINC000448452182 566474678 /nfs/dbraw/zinc/47/46/78/566474678.db2.gz KRIRWXXCDRHNOW-UHFFFAOYSA-N 0 1 381.973 3.061 10 0 GGAEMN COC(=O)c1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511605655 566475051 /nfs/dbraw/zinc/47/50/51/566475051.db2.gz RFCMPUOWCICRJG-GOSISDBHSA-N 0 1 378.266 3.233 10 0 GGAEMN C[C@@H]1CCC[C@H](NC(=O)CN[C@](C)(CO)c2ccc(Br)cc2)[C@H]1C ZINC000511609611 566476599 /nfs/dbraw/zinc/47/65/99/566476599.db2.gz IQTQYQMZAHKWRZ-MCPREKNCSA-N 0 1 397.357 3.187 10 0 GGAEMN COC(=O)c1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cc1F ZINC000511621480 566476683 /nfs/dbraw/zinc/47/66/83/566476683.db2.gz DVWUSOIUQCHCCK-GOSISDBHSA-N 0 1 396.256 3.372 10 0 GGAEMN COCCN1CCN(C(=O)[C@H](C)c2ccc(Br)s2)C(C)(C)C1 ZINC000650830534 566480846 /nfs/dbraw/zinc/48/08/46/566480846.db2.gz ASEPVNPIRJNLTB-GFCCVEGCSA-N 0 1 389.359 3.183 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000558498729 566481997 /nfs/dbraw/zinc/48/19/97/566481997.db2.gz HNQYUFYMZBKDTL-NSHDSACASA-N 0 1 396.232 3.002 10 0 GGAEMN CN1C[C@@H]2CCN(C(=O)c3scc(Br)c3Br)[C@@H]2C1 ZINC000627487632 566483212 /nfs/dbraw/zinc/48/32/12/566483212.db2.gz HYHATZGDFUYZGC-IONNQARKSA-N 0 1 394.132 3.049 10 0 GGAEMN C[C@@H](NC(=O)c1ccccc1)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000464548419 566483748 /nfs/dbraw/zinc/48/37/48/566483748.db2.gz AULCKIOGBLLISO-SNVBAGLBSA-N 0 1 387.237 3.082 10 0 GGAEMN CC(C)(C)n1cc(C(=O)C(=O)Nc2nc3ccc(Br)cc3[nH]2)cn1 ZINC000464553516 566483912 /nfs/dbraw/zinc/48/39/12/566483912.db2.gz JCYJYLSOLSNFSQ-UHFFFAOYSA-N 0 1 390.241 3.098 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@H]2CCCOc3ccc(Br)cc32)CC1=O ZINC000537988433 566484347 /nfs/dbraw/zinc/48/43/47/566484347.db2.gz XBIVJEOSNUBJBN-OYNZBZHQSA-N 0 1 379.298 3.262 10 0 GGAEMN COc1ccc(I)c(NS(=O)(=O)c2ccc(C)o2)c1 ZINC000538010769 566485438 /nfs/dbraw/zinc/48/54/38/566485438.db2.gz SUKJPGQMSVAUEV-UHFFFAOYSA-N 0 1 393.202 3.002 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1cccc(-n2cncn2)c1 ZINC000464567950 566485579 /nfs/dbraw/zinc/48/55/79/566485579.db2.gz GWMWTBDASCISJJ-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1ccc(-n2cncn2)cc1 ZINC000464556985 566485914 /nfs/dbraw/zinc/48/59/14/566485914.db2.gz UMJPVLRVYXCTGV-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN CCSc1ccc(CC(=O)NCc2n[nH]c(CC)n2)c(Br)c1 ZINC000627559046 566488529 /nfs/dbraw/zinc/48/85/29/566488529.db2.gz UKHXCZSMYIVBGN-UHFFFAOYSA-N 0 1 383.315 3.101 10 0 GGAEMN O=C1C[C@H](c2cccc(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)CN1 ZINC000485390444 566494065 /nfs/dbraw/zinc/49/40/65/566494065.db2.gz MMYODJNUZRGELH-NSHDSACASA-N 0 1 385.272 3.398 10 0 GGAEMN C[C@](N)(C(=O)NCCC[C@H]1CCCC[C@H]1O)c1ccc(Br)cc1 ZINC000578130642 566495411 /nfs/dbraw/zinc/49/54/11/566495411.db2.gz VEDICSSZHSRDHW-MZMPZRCHSA-N 0 1 383.330 3.071 10 0 GGAEMN CC[C@@H]1CN(CC)CCN1C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000627658475 566495928 /nfs/dbraw/zinc/49/59/28/566495928.db2.gz CPAYGEAOQFRRDB-UOAMXJAYSA-N 0 1 377.326 3.278 10 0 GGAEMN O=C(NCCCOCC(F)(F)F)c1cc(Br)cc2nc[nH]c21 ZINC000558634236 566495992 /nfs/dbraw/zinc/49/59/92/566495992.db2.gz ATSIKHBAWSLROE-UHFFFAOYSA-N 0 1 380.164 3.024 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cnc(-c2cccc(Cl)c2)s1 ZINC000651113191 566496286 /nfs/dbraw/zinc/49/62/86/566496286.db2.gz FYLAPVHXGIKJFD-UHFFFAOYSA-N 0 1 379.913 3.306 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)NC1(c2ccccc2Br)CCC1 ZINC000651107737 566496368 /nfs/dbraw/zinc/49/63/68/566496368.db2.gz PJWCTKDCCBJIKA-LBPRGKRZSA-N 0 1 389.297 3.408 10 0 GGAEMN Fc1ccccc1NCCCNCc1ncc(I)s1 ZINC000511913162 566497634 /nfs/dbraw/zinc/49/76/34/566497634.db2.gz VWCLYNNUEYAQKD-UHFFFAOYSA-N 0 1 391.253 3.479 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc3scc(Br)c3c2)CC1 ZINC000448799056 566498077 /nfs/dbraw/zinc/49/80/77/566498077.db2.gz WPAWGYWZMJBTBH-UHFFFAOYSA-N 0 1 397.338 3.458 10 0 GGAEMN CSc1ccccc1CSCC(=O)NC[C@H]1CN(CC(C)C)CCO1 ZINC000511932431 566499167 /nfs/dbraw/zinc/49/91/67/566499167.db2.gz AIFOVDLJURXVFF-KRWDZBQOSA-N 0 1 382.595 3.115 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)n[nH]1 ZINC000627716178 566501487 /nfs/dbraw/zinc/50/14/87/566501487.db2.gz NODMLUGJPLWSTP-BYCMXARLSA-N 0 1 389.297 3.067 10 0 GGAEMN CC[C@@H](CSC)NC(=O)c1n[nH]c2ccc(I)cc21 ZINC000538263539 566501619 /nfs/dbraw/zinc/50/16/19/566501619.db2.gz WLPDHOIULHSEII-VIFPVBQESA-N 0 1 389.262 3.039 10 0 GGAEMN C[C@H](CCO)C1(CNC(=O)c2n[nH]c3ccc(Br)cc32)CCC1 ZINC000538310288 566506841 /nfs/dbraw/zinc/50/68/41/566506841.db2.gz LVENFSZGYDDTDT-LLVKDONJSA-N 0 1 380.286 3.244 10 0 GGAEMN C[C@H]1CC(C)(C)C[C@](CO)(NCc2ncc(I)s2)C1 ZINC000512052964 566508986 /nfs/dbraw/zinc/50/89/86/566508986.db2.gz NZEWENKLRAIBBM-IINYFYTJSA-N 0 1 394.322 3.415 10 0 GGAEMN COc1ccc(I)c(NC(=O)[C@H]2CCCc3[nH]ncc32)c1 ZINC000578292425 566509949 /nfs/dbraw/zinc/50/99/49/566509949.db2.gz SNJANCRXOIGJEF-JTQLQIEISA-N 0 1 397.216 3.082 10 0 GGAEMN O[C@@H]1CCCC[C@@H]1CCCNCc1ncc(I)s1 ZINC000512067509 566510010 /nfs/dbraw/zinc/51/00/10/566510010.db2.gz LQSNHJOFKSUGKJ-GHMZBOCLSA-N 0 1 380.295 3.169 10 0 GGAEMN Cc1cc([C@@H](C)N[C@H]2CCN(C3CCOCC3)C2=O)sc1Br ZINC000512059614 566510217 /nfs/dbraw/zinc/51/02/17/566510217.db2.gz SIRQPEWOQQVUEE-YPMHNXCESA-N 0 1 387.343 3.250 10 0 GGAEMN CN(c1nnc([C@@H]2CCCS2)n1C)C1CCN(CCC(F)(F)F)CC1 ZINC000424097824 566510626 /nfs/dbraw/zinc/51/06/26/566510626.db2.gz KCZPNIMOYCHBOY-ZDUSSCGKSA-N 0 1 377.480 3.236 10 0 GGAEMN CN1CCN(C)[C@H](CNc2cc3nccc(Cl)c3cc2Br)C1 ZINC000651312604 566510732 /nfs/dbraw/zinc/51/07/32/566510732.db2.gz KZWVZPVDDKCHIB-LLVKDONJSA-N 0 1 383.721 3.308 10 0 GGAEMN O=S(=O)(CCNCc1cnc(-c2ccccn2)s1)c1ccc(Cl)cc1 ZINC000538403198 566511682 /nfs/dbraw/zinc/51/16/82/566511682.db2.gz NDRLMVZVGHNIPR-UHFFFAOYSA-N 0 1 393.921 3.422 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)Nc2ccnc(C)c2Br)n[nH]1 ZINC000558955662 566516692 /nfs/dbraw/zinc/51/66/92/566516692.db2.gz BCZWALSFPCVWRS-WCBMZHEXSA-N 0 1 381.278 3.089 10 0 GGAEMN CN1CCC[C@H]1C(=O)NCCOc1c(Cl)cc(Br)cc1Cl ZINC000538499654 566517613 /nfs/dbraw/zinc/51/76/13/566517613.db2.gz DPBINBQKFWJJHL-LBPRGKRZSA-N 0 1 396.112 3.345 10 0 GGAEMN O=C(NC[C@H]1OCCc2ccccc21)c1n[nH]c2ccc(Br)cc21 ZINC000603339524 566520065 /nfs/dbraw/zinc/52/00/65/566520065.db2.gz FHDFKKJKGSNTGO-MRXNPFEDSA-N 0 1 386.249 3.369 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)CCc2ccc(Cl)cc2)c1Br ZINC000424217391 566522263 /nfs/dbraw/zinc/52/22/63/566522263.db2.gz ZSUNQIMLBPFPEU-UHFFFAOYSA-N 0 1 378.679 3.118 10 0 GGAEMN C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@@H]1C(=O)[O-] ZINC000424268524 566524563 /nfs/dbraw/zinc/52/45/63/566524563.db2.gz NLVPASQCEFNAGX-BONVTDFDSA-N 0 1 387.249 3.102 10 0 GGAEMN C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@H]1C(=O)[O-] ZINC000424268525 566524641 /nfs/dbraw/zinc/52/46/41/566524641.db2.gz NLVPASQCEFNAGX-MEBBXXQBSA-N 0 1 387.249 3.102 10 0 GGAEMN CCN(C(=O)c1scc(Br)c1Br)[C@@H]1CCN(C)C1 ZINC000628053662 566527720 /nfs/dbraw/zinc/52/77/20/566527720.db2.gz FEKSWFOFOKZJJB-MRVPVSSYSA-N 0 1 396.148 3.439 10 0 GGAEMN CC(C)Cn1ccnc1NCc1cn(-c2ccccc2Br)nn1 ZINC000578514537 566529965 /nfs/dbraw/zinc/52/99/65/566529965.db2.gz LZAZBCHWBAXPSS-UHFFFAOYSA-N 0 1 375.274 3.494 10 0 GGAEMN CN(C)C(=O)[C@@H](Cc1ccccc1)NCc1cccc(Br)c1F ZINC000449122032 566530913 /nfs/dbraw/zinc/53/09/13/566530913.db2.gz KDRHOLSUTRJPSK-MRXNPFEDSA-N 0 1 379.273 3.377 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@H]1CCCOC1 ZINC000449123487 566531002 /nfs/dbraw/zinc/53/10/02/566531002.db2.gz NDQNBZQQGGJSBO-LBPRGKRZSA-N 0 1 384.263 3.234 10 0 GGAEMN COc1ccc(CN2CCC[C@@H](C(=O)N3CCCC3)C2)cc1Br ZINC000538729001 566531208 /nfs/dbraw/zinc/53/12/08/566531208.db2.gz KKEGXSVZNWOGOR-OAHLLOKOSA-N 0 1 381.314 3.292 10 0 GGAEMN O=C1[C@H](N[C@H]2CCc3c2ccc(F)c3Br)CCN1CC(F)(F)F ZINC000449147301 566531395 /nfs/dbraw/zinc/53/13/95/566531395.db2.gz QEEILGQWUNJIHR-NWDGAFQWSA-N 0 1 395.194 3.328 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@@H](NCc2cscc2Br)C1 ZINC000512389648 566531351 /nfs/dbraw/zinc/53/13/51/566531351.db2.gz PKPYFRONSVWJPS-CQSZACIVSA-N 0 1 395.322 3.280 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)cc3)c[nH]2)C[C@H]1C(=O)[O-] ZINC000578532615 566531562 /nfs/dbraw/zinc/53/15/62/566531562.db2.gz WBEGGBKWWLLIQX-SMDDNHRTSA-N 0 1 378.270 3.382 10 0 GGAEMN CN(C)C(=O)[C@@H](Cc1ccccc1)NCc1cc(F)cc(Br)c1 ZINC000449123965 566532165 /nfs/dbraw/zinc/53/21/65/566532165.db2.gz OSRWEICWWTWAQJ-QGZVFWFLSA-N 0 1 379.273 3.377 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)N1CC[C@@H](N2CCCCC2)C1 ZINC000651553768 566533914 /nfs/dbraw/zinc/53/39/14/566533914.db2.gz DHENINUPWZOHMM-GFCCVEGCSA-N 0 1 383.366 3.445 10 0 GGAEMN C[C@@H]1CCC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)[C@H]1C(=O)[O-] ZINC000424424751 566534297 /nfs/dbraw/zinc/53/42/97/566534297.db2.gz XBHLUXZKKQOSOW-MLGOLLRUSA-N 0 1 378.270 3.320 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1sc2ccccc2c1Br ZINC000578579133 566535442 /nfs/dbraw/zinc/53/54/42/566535442.db2.gz RQWOFMOHMYFDLX-UHFFFAOYSA-N 0 1 392.282 3.376 10 0 GGAEMN C[C@]1(CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCCS1 ZINC000628158249 566535560 /nfs/dbraw/zinc/53/55/60/566535560.db2.gz IWQJGHYRIGSBJA-QGZVFWFLSA-N 0 1 383.355 3.493 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CNC(C)(C)[C@@H](C)O ZINC000449200659 566537910 /nfs/dbraw/zinc/53/79/10/566537910.db2.gz DZMDJDKALKCWRB-SNVBAGLBSA-N 0 1 386.279 3.215 10 0 GGAEMN COc1nccnc1CNCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000449212401 566538015 /nfs/dbraw/zinc/53/80/15/566538015.db2.gz UYAXQIOFCFBKCX-UHFFFAOYSA-N 0 1 376.766 3.111 10 0 GGAEMN COc1ncc(C(=O)NC[C@@H](c2cccc(F)c2)N(C)C)cc1Br ZINC000424574418 566542263 /nfs/dbraw/zinc/54/22/63/566542263.db2.gz YTZOXGAOMBYZRS-HNNXBMFYSA-N 0 1 396.260 3.025 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651609888 566542487 /nfs/dbraw/zinc/54/24/87/566542487.db2.gz OVLIABQZFPNAJN-ZYHUDNBSSA-N 0 1 393.285 3.434 10 0 GGAEMN O=C(Nc1cnc2c(Br)cccn12)c1ccc(-c2nnc[nH]2)cc1 ZINC000578699179 566545173 /nfs/dbraw/zinc/54/51/73/566545173.db2.gz ZSYMUPCDWMCCBT-UHFFFAOYSA-N 0 1 383.209 3.134 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)NCc1nc(C(F)(F)F)no1 ZINC000651636654 566545746 /nfs/dbraw/zinc/54/57/46/566545746.db2.gz OLSSSUUIHRJXLD-UHFFFAOYSA-N 0 1 396.199 3.076 10 0 GGAEMN Cc1nc([C@@](C)(NS(=O)(=O)c2c(Cl)cc(F)cc2Cl)C2CC2)no1 ZINC000578708681 566547034 /nfs/dbraw/zinc/54/70/34/566547034.db2.gz PCMWANMRLBREOQ-AWEZNQCLSA-N 0 1 394.255 3.428 10 0 GGAEMN Cc1nnc(SCC(=O)NCC/C=C\c2ccc(Br)cc2)[nH]1 ZINC000628335062 566547513 /nfs/dbraw/zinc/54/75/13/566547513.db2.gz DUDMHOPRHWIKHJ-RQOWECAXSA-N 0 1 381.299 3.187 10 0 GGAEMN Cc1n[nH]c(SCC(=O)NCC/C=C\c2ccc(Br)cc2)n1 ZINC000628335062 566547520 /nfs/dbraw/zinc/54/75/20/566547520.db2.gz DUDMHOPRHWIKHJ-RQOWECAXSA-N 0 1 381.299 3.187 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)NCC/C=C/c1ccc(Br)cc1 ZINC000628335849 566547679 /nfs/dbraw/zinc/54/76/79/566547679.db2.gz VAGVOROWEJHFKE-HWKANZROSA-N 0 1 377.286 3.500 10 0 GGAEMN O=C(NCC/C=C\c1ccc(Br)cc1)[C@H]1CCCc2n[nH]nc21 ZINC000628336828 566548647 /nfs/dbraw/zinc/54/86/47/566548647.db2.gz PZYIMYDUGUFKHD-QLTUCANCSA-N 0 1 375.270 3.207 10 0 GGAEMN C[C@@H](N[C@H]1CCc2c1ccc(F)c2Br)C1(S(C)(=O)=O)CC1 ZINC000449322027 566548873 /nfs/dbraw/zinc/54/88/73/566548873.db2.gz NXGZVMZRFAKUNX-RNCFNFMXSA-N 0 1 376.291 3.131 10 0 GGAEMN COC(=O)CCOc1ccc(S(=O)(=O)Nc2nc(C(C)C)cs2)cc1 ZINC000604023097 566550021 /nfs/dbraw/zinc/55/00/21/566550021.db2.gz GVQZPTQZFBDKSG-UHFFFAOYSA-N 0 1 384.479 3.009 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@H](c2cccnc2)C2CC2)sc1Br ZINC000538941612 566550087 /nfs/dbraw/zinc/55/00/87/566550087.db2.gz DZICPGARSXMAOF-NSHDSACASA-N 0 1 388.312 3.039 10 0 GGAEMN O=C(N[C@H](c1cccc(F)c1)c1cccc(Br)c1)c1ncn[nH]1 ZINC000512683973 566550682 /nfs/dbraw/zinc/55/06/82/566550682.db2.gz AMRLGBGOGAPASK-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN O=C(N[C@H](c1cccc(F)c1)c1cccc(Br)c1)c1nc[nH]n1 ZINC000512683973 566550688 /nfs/dbraw/zinc/55/06/88/566550688.db2.gz AMRLGBGOGAPASK-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@H](C)[C@@H](C)OC ZINC000449333878 566550861 /nfs/dbraw/zinc/55/08/61/566550861.db2.gz HZEQYLNGFCQVFJ-GHMZBOCLSA-N 0 1 386.279 3.479 10 0 GGAEMN CSCC[C@H](NCc1cnc(-c2c(F)cccc2F)s1)C(=O)N(C)C ZINC000449331222 566550915 /nfs/dbraw/zinc/55/09/15/566550915.db2.gz XNOYJAGENRVASJ-AWEZNQCLSA-N 0 1 385.505 3.388 10 0 GGAEMN Cc1ccnc([C@H]2CC[N@@H+](Cc3cc(=O)n4cc(Br)ccc4n3)C2)c1 ZINC000578761281 566551650 /nfs/dbraw/zinc/55/16/50/566551650.db2.gz AMOKAFWFIMWOMM-AWEZNQCLSA-N 0 1 399.292 3.150 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2cccc(F)c2Br)c2ccccc21 ZINC000449359402 566552762 /nfs/dbraw/zinc/55/27/62/566552762.db2.gz QAOBJQJYSKISSJ-LBPRGKRZSA-N 0 1 384.270 3.249 10 0 GGAEMN CN(Cc1cnc(-c2ccc(Br)cc2)s1)[C@]1(CO)CCOC1 ZINC000628367274 566552962 /nfs/dbraw/zinc/55/29/62/566552962.db2.gz RVALCVJOFGUBFB-INIZCTEOSA-N 0 1 383.311 3.156 10 0 GGAEMN CC(C)(C)C[C@@H](O)CC(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000486063750 566553554 /nfs/dbraw/zinc/55/35/54/566553554.db2.gz PFJRHWWLSWNKLF-LBPRGKRZSA-N 0 1 381.274 3.360 10 0 GGAEMN CC(C)(C)C[C@H](O)CC(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000486063749 566553580 /nfs/dbraw/zinc/55/35/80/566553580.db2.gz PFJRHWWLSWNKLF-GFCCVEGCSA-N 0 1 381.274 3.360 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)s1 ZINC000466072834 566556883 /nfs/dbraw/zinc/55/68/83/566556883.db2.gz DLSUIDNEPWADBI-SWLSCSKDSA-N 0 1 379.555 3.179 10 0 GGAEMN OC[C@]12CCC[C@H]1CN(Cc1nc(-c3ccc(Br)cc3)c[nH]1)C2 ZINC000628460953 566557038 /nfs/dbraw/zinc/55/70/38/566557038.db2.gz BZXFCYXRRAGYMD-KBXCAEBGSA-N 0 1 376.298 3.434 10 0 GGAEMN OC[C@]12CCC[C@H]1CN(Cc1nc(-c3cccc(Br)c3)c[nH]1)C2 ZINC000628461071 566557403 /nfs/dbraw/zinc/55/74/03/566557403.db2.gz HSHYNKKWUJGQAZ-KBXCAEBGSA-N 0 1 376.298 3.434 10 0 GGAEMN CC1=CCN(CCNC(=O)[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651736025 566557679 /nfs/dbraw/zinc/55/76/79/566557679.db2.gz LBWYBTGGHHFSCC-HNNXBMFYSA-N 0 1 379.298 3.083 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N3CCC([C@@H](C)O)CC3)C2=O)ccc1Br ZINC000466198330 566558366 /nfs/dbraw/zinc/55/83/66/566558366.db2.gz BKTVCJKHWBEZBY-RDTXWAMCSA-N 0 1 395.341 3.346 10 0 GGAEMN O=S(=O)(CCNCC1(C(F)(F)F)CC1)c1cccc(Br)c1 ZINC000578860757 566560989 /nfs/dbraw/zinc/56/09/89/566560989.db2.gz IZUABCKDVWCSOH-UHFFFAOYSA-N 0 1 386.233 3.155 10 0 GGAEMN CS[C@@H](C)CCC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000539118911 566561701 /nfs/dbraw/zinc/56/17/01/566561701.db2.gz JYLOUBKSZKVYTP-JTQLQIEISA-N 0 1 383.315 3.382 10 0 GGAEMN CS[C@@H](C)CCC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000539118911 566561704 /nfs/dbraw/zinc/56/17/04/566561704.db2.gz JYLOUBKSZKVYTP-JTQLQIEISA-N 0 1 383.315 3.382 10 0 GGAEMN O=C(NCc1csc(Br)c1)Nc1cnn(-c2ccncc2)c1 ZINC000673863032 566562181 /nfs/dbraw/zinc/56/21/81/566562181.db2.gz KZLZLFSMVGNDSU-UHFFFAOYSA-N 0 1 378.255 3.413 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000628495766 566562446 /nfs/dbraw/zinc/56/24/46/566562446.db2.gz ZYQJBPCVIMDQMI-CQSZACIVSA-N 0 1 382.913 3.361 10 0 GGAEMN COc1c(Br)ccc(C)c1C(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1 ZINC000424738810 566564891 /nfs/dbraw/zinc/56/48/91/566564891.db2.gz BAMPPPFIAYKCMH-JTQLQIEISA-N 0 1 381.274 3.499 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(C)[C@@H](C)c1ccccc1Br ZINC000578922130 566565583 /nfs/dbraw/zinc/56/55/83/566565583.db2.gz OLFXWKSICWHFSN-ZDUSSCGKSA-N 0 1 377.348 3.114 10 0 GGAEMN COc1cc(CN[C@](C)(CO)c2ccc(Br)cc2)cc(OC)c1 ZINC000512885245 566566177 /nfs/dbraw/zinc/56/61/77/566566177.db2.gz MWHKHGOOVMHUSS-GOSISDBHSA-N 0 1 380.282 3.464 10 0 GGAEMN COc1ncc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cc1Br ZINC000424747414 566566772 /nfs/dbraw/zinc/56/67/72/566566772.db2.gz GDIVJOZRFMYUJX-HOTGVXAUSA-N 0 1 390.281 3.028 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1ccc(COc2ccccc2Br)cc1 ZINC000673946981 566567734 /nfs/dbraw/zinc/56/77/34/566567734.db2.gz BHYAEQPIPACXMH-UHFFFAOYSA-N 0 1 387.237 3.076 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 ZINC000673951725 566568601 /nfs/dbraw/zinc/56/86/01/566568601.db2.gz UNUXRYWQLGHTHR-UHFFFAOYSA-N 0 1 375.215 3.273 10 0 GGAEMN FCC1(CNCc2c(Br)cncc2Br)CCOCC1 ZINC000449488034 566568965 /nfs/dbraw/zinc/56/89/65/566568965.db2.gz BVPAALCUCYPVSA-UHFFFAOYSA-N 0 1 396.098 3.463 10 0 GGAEMN Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)NCc1c[nH]nn1 ZINC000673951492 566569088 /nfs/dbraw/zinc/56/90/88/566569088.db2.gz NYURKAPIBCZADX-UHFFFAOYSA-N 0 1 375.841 3.010 10 0 GGAEMN C[S@@](=O)c1ccc(CNCc2cc(Cl)ccc2N2CCOCC2)cc1 ZINC000466362659 566569572 /nfs/dbraw/zinc/56/95/72/566569572.db2.gz PIIWGODROYSSCJ-RUZDIDTESA-N 0 1 378.925 3.204 10 0 GGAEMN FCC1(CNCc2ncc(Br)cc2Br)CCOCC1 ZINC000449488131 566570070 /nfs/dbraw/zinc/57/00/70/566570070.db2.gz CUSYYAGWASGIBU-UHFFFAOYSA-N 0 1 396.098 3.463 10 0 GGAEMN COc1ccc([C@@H](C)[C@@H](C)NCc2nn(C)cc2Br)cc1OC ZINC000449484757 566570160 /nfs/dbraw/zinc/57/01/60/566570160.db2.gz NMMSIOMIHVUYPS-NWDGAFQWSA-N 0 1 382.302 3.482 10 0 GGAEMN CCS(=O)(=O)C[C@@H](C)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000539306642 566572074 /nfs/dbraw/zinc/57/20/74/566572074.db2.gz AOJCQHRVXROMRW-CJNGLKHVSA-N 0 1 376.925 3.029 10 0 GGAEMN CCC[C@H](C)[C@H](CO)NCc1ncc(Br)cc1Br ZINC000651893942 566572906 /nfs/dbraw/zinc/57/29/06/566572906.db2.gz LUMSEASQTGWXCA-ZANVPECISA-N 0 1 380.124 3.493 10 0 GGAEMN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)CCc1cnc[nH]1 ZINC000628675319 566573826 /nfs/dbraw/zinc/57/38/26/566573826.db2.gz BJIRZQYCWZUYSM-OAHLLOKOSA-N 0 1 378.270 3.477 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CNCc1cc(Cl)ccc1OCC1CC1 ZINC000513026757 566574061 /nfs/dbraw/zinc/57/40/61/566574061.db2.gz FPTVSENFMFSSAW-KRWDZBQOSA-N 0 1 386.945 3.033 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1COc2ccc(Cl)cc21 ZINC000559920647 566576915 /nfs/dbraw/zinc/57/69/15/566576915.db2.gz DOFCEBGQFZFGNV-YGRLFVJLSA-N 0 1 383.673 3.376 10 0 GGAEMN COc1ncc(C(=O)N(C)CCCN(C)Cc2ccco2)cc1Br ZINC000424852554 566579490 /nfs/dbraw/zinc/57/94/90/566579490.db2.gz PMXNZSGMFQINRF-UHFFFAOYSA-N 0 1 396.285 3.040 10 0 GGAEMN CC1(C)CC(=O)CCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000628689868 566579647 /nfs/dbraw/zinc/57/96/47/566579647.db2.gz FHILBUQKGQCFRP-UHFFFAOYSA-N 0 1 391.265 3.122 10 0 GGAEMN C[C@@H]1Cc2cc(S(=O)(=O)Nc3cnc(CC4CC4)nc3)cc(Cl)c2O1 ZINC000559971823 566579634 /nfs/dbraw/zinc/57/96/34/566579634.db2.gz AGBWACFWSFXQOO-SNVBAGLBSA-N 0 1 379.869 3.207 10 0 GGAEMN O=C(NCc1c[nH]nn1)Nc1ncc(Cc2cccc(Cl)c2Cl)s1 ZINC000674241843 566581382 /nfs/dbraw/zinc/58/13/82/566581382.db2.gz NCXKMONNCHWRPR-UHFFFAOYSA-N 0 1 383.264 3.481 10 0 GGAEMN Cn1cc(I)c(CN[C@H]2CC[C@H](c3ccccc3)C2)n1 ZINC000449604875 566582972 /nfs/dbraw/zinc/58/29/72/566582972.db2.gz LTDCFDQHUOXTHW-KBPBESRZSA-N 0 1 381.261 3.451 10 0 GGAEMN O=S(=O)(Nc1cnc(CC2CC2)nc1)c1cccc(Br)c1F ZINC000560013346 566585342 /nfs/dbraw/zinc/58/53/42/566585342.db2.gz WUJHPDIUBOFBJD-UHFFFAOYSA-N 0 1 386.246 3.132 10 0 GGAEMN CCN(C)[C@@H](C(=O)NCc1cc(Br)cnc1OC)c1ccccc1 ZINC000628794546 566586843 /nfs/dbraw/zinc/58/68/43/566586843.db2.gz LWGAPMSNIDNMAU-MRXNPFEDSA-N 0 1 392.297 3.162 10 0 GGAEMN O[C@H]([C@H]1CCN(CC2=Cc3cc(Br)ccc3OC2)C1)C(F)(F)F ZINC000449669328 566587942 /nfs/dbraw/zinc/58/79/42/566587942.db2.gz HRTPGEFLDDGTEC-XHDPSFHLSA-N 0 1 392.215 3.470 10 0 GGAEMN CN1CCN(c2ccc(Br)cc2NC(=O)[C@H]2CCC(C)(C)O2)CC1 ZINC000486435953 566588549 /nfs/dbraw/zinc/58/85/49/566588549.db2.gz RNYLJYOWSCEBOQ-MRXNPFEDSA-N 0 1 396.329 3.097 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1c(Cl)cc(F)cc1Br ZINC000449676314 566589532 /nfs/dbraw/zinc/58/95/32/566589532.db2.gz GIEPBCJLOFPFEY-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN Cc1noc(CN2CCN(CC/C=C/c3ccc(Br)cc3)CC2)n1 ZINC000604997363 566589772 /nfs/dbraw/zinc/58/97/72/566589772.db2.gz OUKQOXDNMMCEGK-DUXPYHPUSA-N 0 1 391.313 3.362 10 0 GGAEMN CC[C@@H]1CN(C(=O)NCCc2cccc(Cl)c2Cl)CCN1CCOC ZINC000605050585 566594012 /nfs/dbraw/zinc/59/40/12/566594012.db2.gz XTFSIKWQUPJUHA-OAHLLOKOSA-N 0 1 388.339 3.288 10 0 GGAEMN Cn1cc(Br)c(C(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)n1 ZINC000425043318 566600083 /nfs/dbraw/zinc/60/00/83/566600083.db2.gz QOMGAVUUORFFEB-UHFFFAOYSA-N 0 1 398.330 3.048 10 0 GGAEMN CC(C)(C)N1CCc2nc(NC(=O)c3ccc(S(C)(=O)=O)s3)sc2C1 ZINC000425033404 566600169 /nfs/dbraw/zinc/60/01/69/566600169.db2.gz DSJXPYGIRPGNDB-UHFFFAOYSA-N 0 1 399.563 3.017 10 0 GGAEMN COc1cccnc1CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628969380 566600270 /nfs/dbraw/zinc/60/02/70/566600270.db2.gz SYAOZOBTIGQJIC-INIZCTEOSA-N 0 1 382.291 3.359 10 0 GGAEMN CN(C)C[C@H](NC(=O)CCc1ccc(=O)[nH]c1)c1ccc(Cl)c(Cl)c1 ZINC000628969127 566600304 /nfs/dbraw/zinc/60/03/04/566600304.db2.gz OAFFTFOZHJEFOU-INIZCTEOSA-N 0 1 382.291 3.446 10 0 GGAEMN Cc1nn(C)c(C)c1CC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968854 566600468 /nfs/dbraw/zinc/60/04/68/566600468.db2.gz SUPCISXMDBZBKU-QGZVFWFLSA-N 0 1 383.323 3.305 10 0 GGAEMN CN(C)C[C@H](NC(=O)COc1ccc(O)cc1)c1ccc(Cl)c(Cl)c1 ZINC000628968988 566600510 /nfs/dbraw/zinc/60/05/10/566600510.db2.gz ZQEUZMYKLDCQHG-KRWDZBQOSA-N 0 1 383.275 3.497 10 0 GGAEMN CC(C)CC(=O)NCCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968495 566601225 /nfs/dbraw/zinc/60/12/25/566601225.db2.gz GSNSCLZVKQDCKN-MRXNPFEDSA-N 0 1 388.339 3.265 10 0 GGAEMN COCc1nc(C)c(C(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)s1 ZINC000425076477 566601326 /nfs/dbraw/zinc/60/13/26/566601326.db2.gz GAPMJTMYIXNVEB-UHFFFAOYSA-N 0 1 380.539 3.463 10 0 GGAEMN COC[C@@H]1CCCN(Cc2cn(-c3ccccc3Br)nn2)CC1 ZINC000449773608 566601407 /nfs/dbraw/zinc/60/14/07/566601407.db2.gz IUMCZVUOEXIBHC-CQSZACIVSA-N 0 1 379.302 3.278 10 0 GGAEMN CCN(CC)C(=O)CCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628969739 566602000 /nfs/dbraw/zinc/60/20/00/566602000.db2.gz XUGQDIGVUZLZGK-MRXNPFEDSA-N 0 1 388.339 3.361 10 0 GGAEMN CCN(CC)C(=O)CCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628969738 566602020 /nfs/dbraw/zinc/60/20/20/566602020.db2.gz XUGQDIGVUZLZGK-INIZCTEOSA-N 0 1 388.339 3.361 10 0 GGAEMN O=C(c1ccsc1Br)N1CCC(CCN2CCOCC2)CC1 ZINC000449818362 566606421 /nfs/dbraw/zinc/60/64/21/566606421.db2.gz DTYPYOGVJZURPK-UHFFFAOYSA-N 0 1 387.343 3.085 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1cc(OC)c(OC)cc1Br ZINC000560185327 566606406 /nfs/dbraw/zinc/60/64/06/566606406.db2.gz XBXASWNZCKBSFQ-AWEZNQCLSA-N 0 1 399.329 3.347 10 0 GGAEMN Cc1cnn(CCN(C)Cc2cccc(Br)c2OCC(C)(C)O)c1 ZINC000560194328 566607039 /nfs/dbraw/zinc/60/70/39/566607039.db2.gz CKNYJNZPNXOLHQ-UHFFFAOYSA-N 0 1 396.329 3.236 10 0 GGAEMN O=C(NCc1c[nH]nn1)Nc1ccnc(Oc2ccccc2Br)c1 ZINC000674757799 566607197 /nfs/dbraw/zinc/60/71/97/566607197.db2.gz DPFCCHBTSWDMTG-UHFFFAOYSA-N 0 1 389.213 3.076 10 0 GGAEMN O=C(N[C@@H]1CSc2ccc(Br)cc21)N[C@@H]1CCc2nc[nH]c2C1 ZINC000579419095 566607509 /nfs/dbraw/zinc/60/75/09/566607509.db2.gz CBFHUPUICSIOMK-QMTHXVAHSA-N 0 1 393.310 3.176 10 0 GGAEMN O=C(N[C@H]1CSc2ccc(Br)cc21)N[C@@H]1CCc2nc[nH]c2C1 ZINC000579419096 566607860 /nfs/dbraw/zinc/60/78/60/566607860.db2.gz CBFHUPUICSIOMK-YGRLFVJLSA-N 0 1 393.310 3.176 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(Br)c(F)c3)[nH]c2c1 ZINC000466927792 566608509 /nfs/dbraw/zinc/60/85/09/566608509.db2.gz VPBUVZBIFRTZEM-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cc(Br)ccc3C)[nH]c2c1 ZINC000466928121 566608528 /nfs/dbraw/zinc/60/85/28/566608528.db2.gz ZDBCJFJQTGSHNE-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(Br)s3)[nH]c2c1 ZINC000466935168 566609902 /nfs/dbraw/zinc/60/99/02/566609902.db2.gz IBRAIGMDWUJYSO-UHFFFAOYSA-N 0 1 386.296 3.174 10 0 GGAEMN C[NH+](C)Cc1ccc([N-]S(=O)(=O)c2ccccc2F)cc1Br ZINC000466962038 566610164 /nfs/dbraw/zinc/61/01/64/566610164.db2.gz ANENQFZODDHKJF-UHFFFAOYSA-N 0 1 387.274 3.451 10 0 GGAEMN O=C(c1cccc(Br)c1O)N(C[C@H]1CCCO1)[C@H]1CCSC1 ZINC000539889255 566611504 /nfs/dbraw/zinc/61/15/04/566611504.db2.gz DJQGKHLKHBHCMI-NWDGAFQWSA-N 0 1 386.311 3.281 10 0 GGAEMN O=C(CCCOc1ccc(Cl)cc1Cl)NC1(c2nn[nH]n2)CCCC1 ZINC000605532589 566612040 /nfs/dbraw/zinc/61/20/40/566612040.db2.gz YHZISLJNLMVXHW-UHFFFAOYSA-N 0 1 384.267 3.251 10 0 GGAEMN O=C([O-])C[N@@H+](Cc1ccccc1)C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000652456042 566612802 /nfs/dbraw/zinc/61/28/02/566612802.db2.gz YAJBYBKNSZHFDC-CQSZACIVSA-N 0 1 384.259 3.320 10 0 GGAEMN COc1cc(F)cc(CNC(=O)c2n[nH]c3ccc(Br)cc32)c1 ZINC000539916919 566613974 /nfs/dbraw/zinc/61/39/74/566613974.db2.gz HDPXVWYVVZXDCQ-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN O=C([O-])C[N@@H+](CCS(=O)(=O)c1cc(Cl)ccc1Cl)C1CCCCC1 ZINC000652482852 566614290 /nfs/dbraw/zinc/61/42/90/566614290.db2.gz XYBZQKLMBHCYKH-UHFFFAOYSA-N 0 1 394.320 3.486 10 0 GGAEMN O=C([O-])C[N@H+](C[C@@H](O)COc1c(Cl)cccc1Cl)C1CCCCC1 ZINC000652482798 566614713 /nfs/dbraw/zinc/61/47/13/566614713.db2.gz VRAHHKFGBSFOCD-CYBMUJFWSA-N 0 1 376.280 3.452 10 0 GGAEMN O=C([O-])C[N@H+](C[C@@H](O)COc1cc(Cl)ccc1Cl)C1CCCCC1 ZINC000652482502 566614738 /nfs/dbraw/zinc/61/47/38/566614738.db2.gz FAMRNYSPEVVCKM-CQSZACIVSA-N 0 1 376.280 3.452 10 0 GGAEMN O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000579541290 566617024 /nfs/dbraw/zinc/61/70/24/566617024.db2.gz PZBSKQBHWNSSIF-BPLDGKMQSA-N 0 1 389.297 3.275 10 0 GGAEMN COc1cc2nccc(N3C[C@H](C(N)=O)CC[C@H]3C)c2cc1Br ZINC000425211505 566617221 /nfs/dbraw/zinc/61/72/21/566617221.db2.gz XDUVGYLXXHISAV-GHMZBOCLSA-N 0 1 378.270 3.096 10 0 GGAEMN CC[C@H]1CN(CCCOc2cccc(I)c2)CCO1 ZINC000513682911 566617658 /nfs/dbraw/zinc/61/76/58/566617658.db2.gz CKBHKFCPZUMKPU-AWEZNQCLSA-N 0 1 375.250 3.171 10 0 GGAEMN COc1cc2nccc(N3C[C@@H](C(N)=O)CC[C@H]3C)c2cc1Br ZINC000425211506 566617617 /nfs/dbraw/zinc/61/76/17/566617617.db2.gz XDUVGYLXXHISAV-MNOVXSKESA-N 0 1 378.270 3.096 10 0 GGAEMN CCCN(CC(F)(F)F)C(=O)CSc1nc(C(F)(F)F)cc(=O)[nH]1 ZINC000629154292 566620981 /nfs/dbraw/zinc/62/09/81/566620981.db2.gz FHUOEVHVNCGMSI-UHFFFAOYSA-N 0 1 377.310 3.094 10 0 GGAEMN CNC(=O)C1CCC(Nc2ccnc3cc(OC)c(Br)cc32)CC1 ZINC000425242058 566621801 /nfs/dbraw/zinc/62/18/01/566621801.db2.gz BSKGPFCNFKBWDB-UHFFFAOYSA-N 0 1 392.297 3.145 10 0 GGAEMN CO[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CC[C@@H]1C ZINC000467078382 566624373 /nfs/dbraw/zinc/62/43/73/566624373.db2.gz HACLZOJRXCFLAG-MEDUHNTESA-N 0 1 378.270 3.336 10 0 GGAEMN Cc1nc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c(Br)s1 ZINC000579603390 566624385 /nfs/dbraw/zinc/62/43/85/566624385.db2.gz TWVHDHLJLADBNI-OCCSQVGLSA-N 0 1 380.311 3.389 10 0 GGAEMN COC(=O)c1cnc([C@@H](C)N=c2[nH]n3cc(C4CCCC4)nc3s2)s1 ZINC000425272456 566625690 /nfs/dbraw/zinc/62/56/90/566625690.db2.gz KTHQVZUQPHIOOO-SECBINFHSA-N 0 1 377.495 3.287 10 0 GGAEMN COCc1cnc(CN[C@@H]2CCN(c3ccccc3Br)C2)s1 ZINC000540067969 566626482 /nfs/dbraw/zinc/62/64/82/566626482.db2.gz ICTBQKWDRDOQKU-GFCCVEGCSA-N 0 1 382.327 3.421 10 0 GGAEMN O=C(N[C@H](C1CC1)C1CCOCC1)c1cc(Br)cc2nc[nH]c21 ZINC000652768402 566627361 /nfs/dbraw/zinc/62/73/61/566627361.db2.gz HPZNTZYVXAMVSI-OAHLLOKOSA-N 0 1 378.270 3.260 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCN(c2cc(Cl)ccc2Cl)CC1 ZINC000652747068 566627907 /nfs/dbraw/zinc/62/79/07/566627907.db2.gz LGQZABWRLYCJNY-CYBMUJFWSA-N 0 1 379.291 3.485 10 0 GGAEMN CC(C)O[C@H]1CCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000652748265 566628002 /nfs/dbraw/zinc/62/80/02/566628002.db2.gz PWEBOKOIDSGRQO-ZDUSSCGKSA-N 0 1 393.281 3.320 10 0 GGAEMN Cc1nnc(SCC(=O)N2C[C@H](c3ccc(Br)cc3)C[C@H]2C)[nH]1 ZINC000629247259 566628348 /nfs/dbraw/zinc/62/83/48/566628348.db2.gz OYHGJPWCPAQFQL-ZWNOBZJWSA-N 0 1 395.326 3.372 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2C[C@H](c3ccc(Br)cc3)C[C@H]2C)n1 ZINC000629247259 566628349 /nfs/dbraw/zinc/62/83/49/566628349.db2.gz OYHGJPWCPAQFQL-ZWNOBZJWSA-N 0 1 395.326 3.372 10 0 GGAEMN O=C(Nc1ccn(-c2ccc(Cl)cc2Cl)n1)[C@H]1CCCc2[nH]ncc21 ZINC000540118237 566629531 /nfs/dbraw/zinc/62/95/31/566629531.db2.gz ROIFBVUXSVXZDI-NSHDSACASA-N 0 1 376.247 3.383 10 0 GGAEMN O=S(=O)(NCCOCc1ccc(Cl)cc1)c1c(F)cc(F)cc1F ZINC000513850201 566630278 /nfs/dbraw/zinc/63/02/78/566630278.db2.gz OYTALRNPDPPLSS-UHFFFAOYSA-N 0 1 379.787 3.252 10 0 GGAEMN CO[C@H](C)CN(CC(=O)Nc1c(F)cc(F)cc1Br)C(C)C ZINC000467154765 566630377 /nfs/dbraw/zinc/63/03/77/566630377.db2.gz HISLMFTZYPUQAC-SNVBAGLBSA-N 0 1 379.245 3.411 10 0 GGAEMN CN(C)C[C@@H](N[C@H](Cc1ccccc1)C(N)=O)c1ccc(Cl)c(Cl)c1 ZINC000629264476 566630554 /nfs/dbraw/zinc/63/05/54/566630554.db2.gz PCMLSZNNOWFQBJ-QZTJIDSGSA-N 0 1 380.319 3.282 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCC[C@H]1c1ccc(Br)cn1 ZINC000560481932 566630504 /nfs/dbraw/zinc/63/05/04/566630504.db2.gz YCYXQHIROBSLND-LRDDRELGSA-N 0 1 375.270 3.351 10 0 GGAEMN CCN(C(=O)c1n[nH]c(-c2ccccc2)c1Br)[C@H]1CCCOC1 ZINC000652816496 566631237 /nfs/dbraw/zinc/63/12/37/566631237.db2.gz DFLMIFWHFAWJFQ-ZDUSSCGKSA-N 0 1 378.270 3.480 10 0 GGAEMN C[C@H](CNC(=O)[C@@H]1CCCc2[nH]ncc21)Oc1ccc(Br)cc1 ZINC000467202956 566633162 /nfs/dbraw/zinc/63/31/62/566633162.db2.gz UCSYFXXBUNADNL-BXUZGUMPSA-N 0 1 378.270 3.176 10 0 GGAEMN C[C@@H](CNC(=O)[C@@H]1CCCc2[nH]ncc21)Oc1ccc(Br)cc1 ZINC000467202959 566633481 /nfs/dbraw/zinc/63/34/81/566633481.db2.gz UCSYFXXBUNADNL-SMDDNHRTSA-N 0 1 378.270 3.176 10 0 GGAEMN C[C@H](CNC(=O)[C@H]1CCCc2[nH]ncc21)Oc1cccc(Br)c1 ZINC000467205091 566633744 /nfs/dbraw/zinc/63/37/44/566633744.db2.gz FCEBFYUMAWWMIW-RISCZKNCSA-N 0 1 378.270 3.176 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1ccc(C)cc1OCC(F)(F)F)C1CC1 ZINC000629286973 566634859 /nfs/dbraw/zinc/63/48/59/566634859.db2.gz DZBICHHCJDJFBZ-HNNXBMFYSA-N 0 1 381.416 3.493 10 0 GGAEMN COc1cnc(NS(=O)(=O)c2c(F)cccc2Cl)c(Br)c1 ZINC000675299607 566635506 /nfs/dbraw/zinc/63/55/06/566635506.db2.gz MHQRICYRTWRMFE-UHFFFAOYSA-N 0 1 395.637 3.446 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCC(=O)Nc1ccc(Br)cc1 ZINC000467296867 566637860 /nfs/dbraw/zinc/63/78/60/566637860.db2.gz BGJAKFDDTOYOBO-VMGRFDJRSA-N 0 1 395.297 3.051 10 0 GGAEMN CC(C)[C@H]1CN(C)CCN1C(=O)N[C@H](C)Cc1ccc(Br)cc1 ZINC000606645188 566638021 /nfs/dbraw/zinc/63/80/21/566638021.db2.gz XORADGBFYLTKCV-RHSMWYFYSA-N 0 1 382.346 3.362 10 0 GGAEMN CC(C)[C@@H]1CN(C)CCN1C(=O)N[C@@H](C)Cc1ccc(Br)cc1 ZINC000606645190 566638167 /nfs/dbraw/zinc/63/81/67/566638167.db2.gz XORADGBFYLTKCV-YOEHRIQHSA-N 0 1 382.346 3.362 10 0 GGAEMN CO[C@@H](Cc1ccc(F)cc1)CS(=O)(=O)Nc1cc(F)cc(F)c1F ZINC000629303292 566638694 /nfs/dbraw/zinc/63/86/94/566638694.db2.gz HRBJPWWDFAIVFL-ZDUSSCGKSA-N 0 1 377.359 3.242 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1c(O)ccc(Br)c1C)C1CC1 ZINC000629302319 566639303 /nfs/dbraw/zinc/63/93/03/566639303.db2.gz BYGQZBJZAFOGGN-ZDUSSCGKSA-N 0 1 378.288 3.020 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cc(Br)sc2C)cnc1OC ZINC000629315365 566640297 /nfs/dbraw/zinc/64/02/97/566640297.db2.gz TZDAPKSPKUGVEA-UHFFFAOYSA-N 0 1 393.284 3.032 10 0 GGAEMN Cc1c([C@@H](C)N[C@@H](C)C2(S(C)(=O)=O)CC2)cnn1-c1cccc(Cl)c1 ZINC000560582199 566640504 /nfs/dbraw/zinc/64/05/04/566640504.db2.gz YGLIQONBXYQRRZ-OCCSQVGLSA-N 0 1 381.929 3.450 10 0 GGAEMN CN(CC1CC1)C(=O)CN(Cc1cccc(Br)c1)C1CCOCC1 ZINC000467298541 566640614 /nfs/dbraw/zinc/64/06/14/566640614.db2.gz DSFNBIFFLMWYKI-UHFFFAOYSA-N 0 1 395.341 3.299 10 0 GGAEMN COc1ccc(CNC2(c3ccc(Br)cc3)CCOCC2)nn1 ZINC000514076015 566641180 /nfs/dbraw/zinc/64/11/80/566641180.db2.gz PWGDCLXVKYBUAA-UHFFFAOYSA-N 0 1 378.270 3.043 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)Nc1cnn(CCF)c1 ZINC000629321557 566642494 /nfs/dbraw/zinc/64/24/94/566642494.db2.gz UUFXATPCZMQROY-UHFFFAOYSA-N 0 1 376.251 3.033 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CC[C@@H](C2CCOCC2)C1 ZINC000514101493 566642637 /nfs/dbraw/zinc/64/26/37/566642637.db2.gz FFQQDWIBWLSROM-CQSZACIVSA-N 0 1 382.298 3.484 10 0 GGAEMN O=C(c1cc(Br)c(F)cc1[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000450190681 566643005 /nfs/dbraw/zinc/64/30/05/566643005.db2.gz VLCPGYKKZRKVSN-BDJLRTHQSA-N 0 1 397.288 3.383 10 0 GGAEMN CC(=O)N[C@@H](Cc1nc([C@H](N)CC(C)C)no1)c1ccc(Br)cc1 ZINC000579831821 566643181 /nfs/dbraw/zinc/64/31/81/566643181.db2.gz PCXXAKOGCXEMFN-CABCVRRESA-N 0 1 395.301 3.298 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3cc(Br)cc(C)c3C2)n[nH]1 ZINC000540326160 566645585 /nfs/dbraw/zinc/64/55/85/566645585.db2.gz YHDJTCXSRBBOPN-GFCCVEGCSA-N 0 1 391.313 3.488 10 0 GGAEMN O=C(NCC[C@H]1COc2ccccc2O1)c1cccc(Br)c1O ZINC000560637100 566646335 /nfs/dbraw/zinc/64/63/35/566646335.db2.gz UIDAXJKPILUXHS-NSHDSACASA-N 0 1 378.222 3.115 10 0 GGAEMN COC(=O)c1cnc([C@@H](C)NCc2nc3ccc(Br)cc3[nH]2)s1 ZINC000425479620 566646823 /nfs/dbraw/zinc/64/68/23/566646823.db2.gz DJTZTQFOPGFLFF-MRVPVSSYSA-N 0 1 395.282 3.419 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)CN(C)[C@@H]1CCSC1 ZINC000487093678 566648350 /nfs/dbraw/zinc/64/83/50/566648350.db2.gz NSMFLVXOMMJAPJ-LLVKDONJSA-N 0 1 398.575 3.193 10 0 GGAEMN COc1cccc(OC(F)(F)F)c1S(=O)(=O)Nc1cc(C)cnc1C ZINC000629351625 566649685 /nfs/dbraw/zinc/64/96/85/566649685.db2.gz ASSHVBKMOQYTPX-UHFFFAOYSA-N 0 1 376.356 3.406 10 0 GGAEMN O=C(CSCc1ccc(Cl)cc1Cl)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000540423934 566650598 /nfs/dbraw/zinc/65/05/98/566650598.db2.gz UKTBPXQUSVTTLE-JTQLQIEISA-N 0 1 386.308 3.146 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)[C@H]2CCC[C@H]21 ZINC000629372740 566652639 /nfs/dbraw/zinc/65/26/39/566652639.db2.gz GSINYRHNFMCHGX-AYDFFVQHSA-N 0 1 388.291 3.308 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)[C@H]2CCC[C@H]21 ZINC000629373930 566652932 /nfs/dbraw/zinc/65/29/32/566652932.db2.gz QFMCHYWFMDKALG-AYDFFVQHSA-N 0 1 388.291 3.308 10 0 GGAEMN Cn1c(C[N@@H+]2CC[C@H](C(=O)[O-])[C@H]3CCC[C@@H]32)nc2ccc(Br)cc21 ZINC000629377129 566653336 /nfs/dbraw/zinc/65/33/36/566653336.db2.gz LJHCRJHOWVNQPK-IPYPFGDCSA-N 0 1 392.297 3.411 10 0 GGAEMN Cn1c(C[N@H+]2CC[C@H](C(=O)[O-])[C@H]3CCC[C@@H]32)nc2ccc(Br)cc21 ZINC000629377129 566653339 /nfs/dbraw/zinc/65/33/39/566653339.db2.gz LJHCRJHOWVNQPK-IPYPFGDCSA-N 0 1 392.297 3.411 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)[C@H]2CCC[C@@H]21 ZINC000629371512 566653409 /nfs/dbraw/zinc/65/34/09/566653409.db2.gz ABNBDBWPUOUOAQ-VLXAULBPSA-N 0 1 388.291 3.308 10 0 GGAEMN CCOC(=O)c1csc(N[C@@H]2CCN(c3cc(Cl)ccc3OC)C2)n1 ZINC000450299509 566654007 /nfs/dbraw/zinc/65/40/07/566654007.db2.gz BBYQQMFJIURXIE-GFCCVEGCSA-N 0 1 381.885 3.095 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cc(Oc3cccc(Br)c3)ccn2)C1 ZINC000675565859 566653918 /nfs/dbraw/zinc/65/39/18/566653918.db2.gz ZSHDEUNVINDJBE-CQSZACIVSA-N 0 1 390.281 3.460 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cccc(Br)c2F)CC1 ZINC000629416461 566654397 /nfs/dbraw/zinc/65/43/97/566654397.db2.gz PPTBVLBSTWVRPA-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(C)cc(Br)c2)CC1 ZINC000629416030 566654610 /nfs/dbraw/zinc/65/46/10/566654610.db2.gz FASKEBFFAFSHOK-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(C)cc2Br)CC1 ZINC000629419035 566655224 /nfs/dbraw/zinc/65/52/24/566655224.db2.gz XGICGHLLNJHDMQ-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cscc2Br)CC1 ZINC000629415279 566655333 /nfs/dbraw/zinc/65/53/33/566655333.db2.gz OIDPQJQNDSHFGH-UHFFFAOYSA-N 0 1 387.343 3.228 10 0 GGAEMN O=C([O-])[C@H]1Cc2c(Br)cccc2C[N@@H+]1C[C@@H](O)C1CCCCC1 ZINC000579968202 566655950 /nfs/dbraw/zinc/65/59/50/566655950.db2.gz LWSHUUSJQPGDAJ-IAGOWNOFSA-N 0 1 382.298 3.202 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)Cc2cc(Br)ccc2C)n[nH]1 ZINC000450314784 566657528 /nfs/dbraw/zinc/65/75/28/566657528.db2.gz NNGISUKTCQLUNL-OAHLLOKOSA-N 0 1 377.286 3.480 10 0 GGAEMN CCC(=O)N[C@@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)C1 ZINC000450327855 566659149 /nfs/dbraw/zinc/65/91/49/566659149.db2.gz NHTIOBRSVJOEJI-MRXNPFEDSA-N 0 1 381.314 3.403 10 0 GGAEMN C[C@@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)c1ncc(Br)cn1 ZINC000560788939 566660140 /nfs/dbraw/zinc/66/01/40/566660140.db2.gz LUZSGYWYDMXOHN-CJNGLKHVSA-N 0 1 389.297 3.081 10 0 GGAEMN C[C@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)c1ncc(Br)cn1 ZINC000560788942 566660195 /nfs/dbraw/zinc/66/01/95/566660195.db2.gz LUZSGYWYDMXOHN-XJKSGUPXSA-N 0 1 389.297 3.081 10 0 GGAEMN Cn1ncc(Br)c1CN[C@H]1CCCN(Cc2c(F)cccc2F)C1 ZINC000487279385 566660444 /nfs/dbraw/zinc/66/04/44/566660444.db2.gz VSPKIUAJNWMIKO-LBPRGKRZSA-N 0 1 399.283 3.215 10 0 GGAEMN CCSc1ccc(C[N@H+]2C[C@@H]3COC[C@]3(C(=O)[O-])C2)c(Br)c1 ZINC000629489152 566661637 /nfs/dbraw/zinc/66/16/37/566661637.db2.gz CTBHRVYTUDYHTL-MLGOLLRUSA-N 0 1 386.311 3.094 10 0 GGAEMN COc1cc(Br)ccc1[C@H]1CCCN1Cc1nc(C(C)(C)N)no1 ZINC000629558170 566666448 /nfs/dbraw/zinc/66/64/48/566666448.db2.gz CHVRNUZZGIMGLF-CYBMUJFWSA-N 0 1 395.301 3.372 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@H](O)COc1c(Cl)cccc1Cl ZINC000629587318 566669350 /nfs/dbraw/zinc/66/93/50/566669350.db2.gz HTOSXZGNXKWENO-VIFPVBQESA-N 0 1 398.212 3.275 10 0 GGAEMN Cc1cc(Br)cc(NC(=O)c2cccc(N3CCN(C)CC3)n2)c1 ZINC000487398089 566670298 /nfs/dbraw/zinc/67/02/98/566670298.db2.gz PHXRULSTJPTPCG-UHFFFAOYSA-N 0 1 389.297 3.157 10 0 GGAEMN Cc1ccc2nc(CNC(=O)C(=O)Nc3cc(Cl)cc(Cl)c3)[nH]c2c1 ZINC000467823412 566670911 /nfs/dbraw/zinc/67/09/11/566670911.db2.gz OMPFDWSBFMIHQF-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN O=C(c1csc(=NC2CC2)[nH]1)N1CC(Cc2ccccc2Br)C1 ZINC000629604998 566672508 /nfs/dbraw/zinc/67/25/08/566672508.db2.gz FFGBQGUHDXXZOC-UHFFFAOYSA-N 0 1 392.322 3.217 10 0 GGAEMN O=C([O-])C[C@H]([NH2+]Cc1cc2n(n1)CCCC2)c1cccc(Br)c1 ZINC000653502654 566673138 /nfs/dbraw/zinc/67/31/38/566673138.db2.gz KXPBEPHNFVWVQY-INIZCTEOSA-N 0 1 378.270 3.288 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3c(F)cc(Br)cc3C2)n[nH]1 ZINC000676051146 566673723 /nfs/dbraw/zinc/67/37/23/566673723.db2.gz MXKKAHQMQKKRGC-SNVBAGLBSA-N 0 1 395.276 3.319 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CC(Cc3ccccc3Br)C2)[nH]1 ZINC000629607348 566674440 /nfs/dbraw/zinc/67/44/40/566674440.db2.gz MBPAWLVRSNQMGP-UHFFFAOYSA-N 0 1 395.326 3.059 10 0 GGAEMN Cn1ncc(Br)c1CN[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000487555910 566679635 /nfs/dbraw/zinc/67/96/35/566679635.db2.gz HIJUUUJXQICYLH-HOCLYGCPSA-N 0 1 383.721 3.371 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC[C@@H](C)Oc2cccc(Br)c2)n[nH]1 ZINC000487546037 566679810 /nfs/dbraw/zinc/67/98/10/566679810.db2.gz ZTZJYOVKYYNOBR-WCQYABFASA-N 0 1 395.301 3.178 10 0 GGAEMN C[C@@H]1CN(Cc2cccc(NCc3c(Br)cnn3C)c2)C[C@@H](C)O1 ZINC000487553234 566680020 /nfs/dbraw/zinc/68/00/20/566680020.db2.gz PUIJMIOUZNWZPO-ZIAGYGMSSA-N 0 1 393.329 3.404 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCc2cc(F)cc(Br)c2C1 ZINC000629741577 566681650 /nfs/dbraw/zinc/68/16/50/566681650.db2.gz XVAMLWFWCLITJI-UHFFFAOYSA-N 0 1 378.245 3.248 10 0 GGAEMN Cc1c(C(=O)NCC2(N3CCSCC3)CCCCC2)sc2nccn12 ZINC000487558892 566681680 /nfs/dbraw/zinc/68/16/80/566681680.db2.gz QCXIJYRKAMGOKI-UHFFFAOYSA-N 0 1 378.567 3.186 10 0 GGAEMN Cn1ncc(Br)c1CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000487575649 566681957 /nfs/dbraw/zinc/68/19/57/566681957.db2.gz RBWHJRLEKZIUNB-JTQLQIEISA-N 0 1 387.684 3.344 10 0 GGAEMN CC(C)(CNC(=O)c1ncsc1Br)N1CCc2ccccc2C1 ZINC000561182658 566682966 /nfs/dbraw/zinc/68/29/66/566682966.db2.gz NLHRZQPRYUPBBA-UHFFFAOYSA-N 0 1 394.338 3.472 10 0 GGAEMN Cn1cc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)c(C(F)(F)F)n1 ZINC000580315758 566683564 /nfs/dbraw/zinc/68/35/64/566683564.db2.gz KJDIDGYSAGKFIQ-NSHDSACASA-N 0 1 398.212 3.275 10 0 GGAEMN O=C(COc1ccc(Cl)cc1Cl)N1CCN(C[C@@H]2CCSC2)CC1 ZINC000425989271 566686067 /nfs/dbraw/zinc/68/60/67/566686067.db2.gz JPMLNVAHBCQCKV-ZDUSSCGKSA-N 0 1 389.348 3.270 10 0 GGAEMN O=S(=O)(Nc1c(O)cccc1F)c1cc(Br)c(F)cc1F ZINC000608004305 566689241 /nfs/dbraw/zinc/68/92/41/566689241.db2.gz FICGDFUTLOJOTH-UHFFFAOYSA-N 0 1 382.157 3.373 10 0 GGAEMN Cc1c(Br)ccc(C(=O)NCCCN2C[C@@H](C)O[C@@H](C)C2)c1F ZINC000468226167 566691478 /nfs/dbraw/zinc/69/14/78/566691478.db2.gz ZLDQTTVDBMPDTL-TXEJJXNPSA-N 0 1 387.293 3.126 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)C1 ZINC000676420641 566692680 /nfs/dbraw/zinc/69/26/80/566692680.db2.gz MXSGMIPLCOANLN-NEPJUHHUSA-N 0 1 376.448 3.145 10 0 GGAEMN CC[C@@]1(C)CCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000468242433 566692886 /nfs/dbraw/zinc/69/28/86/566692886.db2.gz VMPNUXABSHNSOB-HNNXBMFYSA-N 0 1 383.233 3.430 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cc(COc3ccc(Cl)cc3Cl)on2)C1 ZINC000676424401 566693640 /nfs/dbraw/zinc/69/36/40/566693640.db2.gz PCQPXZRJGINATP-GFCCVEGCSA-N 0 1 384.263 3.384 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3sc(Br)cc3C2)n[nH]1 ZINC000676423001 566694124 /nfs/dbraw/zinc/69/41/24/566694124.db2.gz YJSPRAPKDBGKTK-SECBINFHSA-N 0 1 383.315 3.241 10 0 GGAEMN CO[C@H](C)[C@H](C)NC(=O)c1sccc1S(=O)(=O)Nc1ccc(C)cc1 ZINC000468270015 566694367 /nfs/dbraw/zinc/69/43/67/566694367.db2.gz JMXHWPMUAOAAHT-QWHCGFSZSA-N 0 1 382.507 3.011 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1CC[C@H](C)[C@H](C(=O)[O-])C1 ZINC000515176336 566695417 /nfs/dbraw/zinc/69/54/17/566695417.db2.gz JCSIDGGIZRRRGH-YVEFUNNKSA-N 0 1 392.297 3.486 10 0 GGAEMN O=C(N[C@H]1CCOc2ccc(Br)cc21)c1csc(=NC2CC2)[nH]1 ZINC000426158906 566696075 /nfs/dbraw/zinc/69/60/75/566696075.db2.gz CMIGKLVICVQEMH-LBPRGKRZSA-N 0 1 394.294 3.155 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000515176335 566696226 /nfs/dbraw/zinc/69/62/26/566696226.db2.gz JCSIDGGIZRRRGH-SJKOYZFVSA-N 0 1 392.297 3.486 10 0 GGAEMN O=S1(=O)CC[C@@H](CN2CCC(c3ccc(OC(F)(F)F)cc3)CC2)C1 ZINC000515168175 566696264 /nfs/dbraw/zinc/69/62/64/566696264.db2.gz RSDXKOCRRGSIRW-ZDUSSCGKSA-N 0 1 377.428 3.199 10 0 GGAEMN O=C(CN[C@@H](CCO)c1ccc(Cl)cc1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000561350413 566698405 /nfs/dbraw/zinc/69/84/05/566698405.db2.gz RMYKJTXPORUIMJ-HIFRSBDPSA-N 0 1 378.822 3.154 10 0 GGAEMN Cc1c[nH+]cn1C1CCN(C(=O)c2cc(Br)c(F)cc2[O-])CC1 ZINC000450711851 566699198 /nfs/dbraw/zinc/69/91/98/566699198.db2.gz HYVMYCZQTOEVQK-UHFFFAOYSA-N 0 1 382.233 3.276 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)[C@@H]1CCCN1C1CC1 ZINC000426375538 566707134 /nfs/dbraw/zinc/70/71/34/566707134.db2.gz DTZHGXLNTGLFOG-ZDUSSCGKSA-N 0 1 378.519 3.383 10 0 GGAEMN CCOC(=O)[C@H]1CCCN1[C@@H](C)CC(=O)Nc1cccc(Br)c1 ZINC000468534909 566707756 /nfs/dbraw/zinc/70/77/56/566707756.db2.gz FHALZGLBLRHTRP-SWLSCSKDSA-N 0 1 383.286 3.194 10 0 GGAEMN CCn1cc(S(=O)(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)nc1C ZINC000541308732 566713257 /nfs/dbraw/zinc/71/32/57/566713257.db2.gz OZQRFNXPLQUSML-ZDUSSCGKSA-N 0 1 383.342 3.072 10 0 GGAEMN C[N@@H+]1CC[C@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@H]1c1ccccc1 ZINC000561538270 566717052 /nfs/dbraw/zinc/71/70/52/566717052.db2.gz KOPHVOFFLFZHLR-GOEBONIOSA-N 0 1 386.851 3.342 10 0 GGAEMN C[N@H+]1CC[C@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@H]1c1ccccc1 ZINC000561538270 566717057 /nfs/dbraw/zinc/71/70/57/566717057.db2.gz KOPHVOFFLFZHLR-GOEBONIOSA-N 0 1 386.851 3.342 10 0 GGAEMN COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@@H](C2N=NC(=O)O2)C1 ZINC000450896726 566717208 /nfs/dbraw/zinc/71/72/08/566717208.db2.gz OBRKBXWTIKZPBI-RNCFNFMXSA-N 0 1 386.235 3.176 10 0 GGAEMN COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@@H](c2n[nH]c(=O)o2)C1 ZINC000450896726 566717218 /nfs/dbraw/zinc/71/72/18/566717218.db2.gz OBRKBXWTIKZPBI-RNCFNFMXSA-N 0 1 386.235 3.176 10 0 GGAEMN COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@@H](C2N=NC(=O)O2)C1 ZINC000450896725 566717557 /nfs/dbraw/zinc/71/75/57/566717557.db2.gz OBRKBXWTIKZPBI-NOZJJQNGSA-N 0 1 386.235 3.176 10 0 GGAEMN COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@@H](c2n[nH]c(=O)o2)C1 ZINC000450896725 566717564 /nfs/dbraw/zinc/71/75/64/566717564.db2.gz OBRKBXWTIKZPBI-NOZJJQNGSA-N 0 1 386.235 3.176 10 0 GGAEMN CN(C)c1cccc(CN2CCN(c3ccc(Br)cn3)CC2)c1 ZINC000608491859 566719899 /nfs/dbraw/zinc/71/98/99/566719899.db2.gz AQIREOPQOGZKRO-UHFFFAOYSA-N 0 1 375.314 3.232 10 0 GGAEMN COC(=O)c1cn([C@H]2CCCN(CCc3cc(Cl)ccc3Cl)C2)nn1 ZINC000488319796 566721380 /nfs/dbraw/zinc/72/13/80/566721380.db2.gz ZGUXXWIBKGRGOV-AWEZNQCLSA-N 0 1 383.279 3.251 10 0 GGAEMN CC(C)C1CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000677092490 566724115 /nfs/dbraw/zinc/72/41/15/566724115.db2.gz AJGARLMHAMLFSE-UHFFFAOYSA-N 0 1 378.274 3.032 10 0 GGAEMN CC(C)C1CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000677092490 566724119 /nfs/dbraw/zinc/72/41/19/566724119.db2.gz AJGARLMHAMLFSE-UHFFFAOYSA-N 0 1 378.274 3.032 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1ccsc1 ZINC000654288923 566726064 /nfs/dbraw/zinc/72/60/64/566726064.db2.gz VTFITEPHIPUSEN-MCIONIFRSA-N 0 1 379.448 3.150 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN(C2CCC2)CC1 ZINC000468803481 566731085 /nfs/dbraw/zinc/73/10/85/566731085.db2.gz BZFJHBOVSCNTRX-CYBMUJFWSA-N 0 1 396.329 3.398 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3cccc(Br)c3F)[nH]c21 ZINC000541537563 566732260 /nfs/dbraw/zinc/73/22/60/566732260.db2.gz UMFRQRUHKLXBOL-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)N[C@@H]1CCCc2cn[nH]c21 ZINC000488544450 566733582 /nfs/dbraw/zinc/73/35/82/566733582.db2.gz MKCHDKMFRBNBFW-CYBMUJFWSA-N 0 1 379.258 3.058 10 0 GGAEMN CN(C)c1ncc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)s1 ZINC000677245355 566734603 /nfs/dbraw/zinc/73/46/03/566734603.db2.gz GWIPTKHNFRJBTC-ZBFHGGJFSA-N 0 1 382.892 3.063 10 0 GGAEMN CC(C)(C(=O)NCCc1c[nH]c2cccc(Br)c12)c1cnc[nH]1 ZINC000426844421 566734622 /nfs/dbraw/zinc/73/46/22/566734622.db2.gz ZVCNCPCVQIMKRP-UHFFFAOYSA-N 0 1 375.270 3.290 10 0 GGAEMN COc1ccc([C@@H](CN2CCCC2)Nc2ncncc2Br)cc1 ZINC000541575862 566735160 /nfs/dbraw/zinc/73/51/60/566735160.db2.gz HKIIMRUFRJUUOG-MRXNPFEDSA-N 0 1 377.286 3.497 10 0 GGAEMN O=C([O-])[C@H]([NH2+]Cc1ccc(-c2cccc(Br)c2)o1)[C@H]1CCCO1 ZINC000630470721 566736412 /nfs/dbraw/zinc/73/64/12/566736412.db2.gz WIHYOCFDATUKPA-HZPDHXFCSA-N 0 1 380.238 3.431 10 0 GGAEMN COc1ccccc1SC[C@@H](C)CNC(=O)CCSc1nnc(C)[nH]1 ZINC000468849901 566737015 /nfs/dbraw/zinc/73/70/15/566737015.db2.gz GRDZXADNSBUCEQ-LBPRGKRZSA-N 0 1 380.539 3.149 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@H]2CCCCN2S(=O)(=O)c2cccs2)n1 ZINC000580951959 566737945 /nfs/dbraw/zinc/73/79/45/566737945.db2.gz YHJCTNMCZOYAME-QWHCGFSZSA-N 0 1 384.527 3.093 10 0 GGAEMN COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(C)(C)C(F)(F)F ZINC000451030201 566739172 /nfs/dbraw/zinc/73/91/72/566739172.db2.gz IGVUSNAYSQACDP-SECBINFHSA-N 0 1 389.823 3.373 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@@H](C(C)(C)C)[C@H](O)C1)c1ccc(Br)cc1 ZINC000541625272 566739345 /nfs/dbraw/zinc/73/93/45/566739345.db2.gz NRJTUUMWRRUGBV-IAOVAPTHSA-N 0 1 397.357 3.355 10 0 GGAEMN O=C(NCc1n[nH]c([C@@H]2CCCO2)n1)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000654571387 566742388 /nfs/dbraw/zinc/74/23/88/566742388.db2.gz YHJBBGXLGRVADP-MNOVXSKESA-N 0 1 381.889 3.248 10 0 GGAEMN Brc1ccc(OCCN2CCC(Oc3cnccn3)CC2)cc1 ZINC000488734111 566744894 /nfs/dbraw/zinc/74/48/94/566744894.db2.gz QGIQTRNCEMYWAY-UHFFFAOYSA-N 0 1 378.270 3.161 10 0 GGAEMN O=C(Cc1csc(CCC(F)(F)F)n1)N1CCN(C2CCCC2)CC1 ZINC000630690851 566746662 /nfs/dbraw/zinc/74/66/62/566746662.db2.gz FXQYAXZXHLQIJV-UHFFFAOYSA-N 0 1 375.460 3.267 10 0 GGAEMN Cc1ccc2nc(CNC(=O)c3n[nH]c4ccc(Br)cc43)cn2c1 ZINC000561901727 566747812 /nfs/dbraw/zinc/74/78/12/566747812.db2.gz DXCBCIGBYFASKM-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN Cc1cnc(OC(C)C)c(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)c1 ZINC000451069676 566748578 /nfs/dbraw/zinc/74/85/78/566748578.db2.gz MHAVKEQMXCSPKO-UHFFFAOYSA-N 0 1 375.372 3.392 10 0 GGAEMN O=C(CC1CSC1)Nc1ccc(F)c(NS(=O)(=O)c2cccs2)c1 ZINC000630759094 566750159 /nfs/dbraw/zinc/75/01/59/566750159.db2.gz COXYWOIWJDRLIW-UHFFFAOYSA-N 0 1 386.495 3.380 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(OC(C)C)c2)cc1 ZINC000451093346 566753966 /nfs/dbraw/zinc/75/39/66/566753966.db2.gz VOQGSPRJUKNRMT-UHFFFAOYSA-N 0 1 383.491 3.068 10 0 GGAEMN CN(CCc1nccs1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000581157909 566754383 /nfs/dbraw/zinc/75/43/83/566754383.db2.gz QIEDTFZUOZUYJV-UHFFFAOYSA-N 0 1 392.278 3.062 10 0 GGAEMN O=C(Cc1ccccc1I)Nc1nc2ccc(F)cc2[nH]1 ZINC000488896711 566755540 /nfs/dbraw/zinc/75/55/40/566755540.db2.gz ZNDHTRDTKSHEAH-UHFFFAOYSA-N 0 1 395.175 3.488 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccc2c(c1)C[C@@H](C)O2 ZINC000609264200 566755960 /nfs/dbraw/zinc/75/59/60/566755960.db2.gz NYYYYTPIQMKIEW-SNVBAGLBSA-N 0 1 381.837 3.251 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccccc2C(C)C)c(S(C)(=O)=O)c1 ZINC000451097796 566756675 /nfs/dbraw/zinc/75/66/75/566756675.db2.gz FOAGKVPJWJAWJO-UHFFFAOYSA-N 0 1 383.491 3.023 10 0 GGAEMN O=C(Cc1cccc(I)c1)Nc1nc2ccc(F)cc2[nH]1 ZINC000488929380 566756580 /nfs/dbraw/zinc/75/65/80/566756580.db2.gz HCNHVWLBXDOAOI-UHFFFAOYSA-N 0 1 395.175 3.488 10 0 GGAEMN CC(C)c1nc(CS(=O)(=O)Cc2c(F)ccc(Br)c2F)n[nH]1 ZINC000427188556 566756570 /nfs/dbraw/zinc/75/65/70/566756570.db2.gz BGZUIWUYYJIWJD-UHFFFAOYSA-N 0 1 394.241 3.084 10 0 GGAEMN O=C(CCS(=O)(=O)c1ccc(Cl)cc1)Nc1nc2ccc(F)cc2[nH]1 ZINC000488900062 566756925 /nfs/dbraw/zinc/75/69/25/566756925.db2.gz MEHWYGDVXVXDAQ-UHFFFAOYSA-N 0 1 381.816 3.158 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cccc(C(C)C)c2)c(S(C)(=O)=O)c1 ZINC000451097318 566757030 /nfs/dbraw/zinc/75/70/30/566757030.db2.gz DHZGOISSUWAUPY-UHFFFAOYSA-N 0 1 383.491 3.023 10 0 GGAEMN Cn1cc(-c2c[nH]cc2C(=O)Nc2nc3ccc(Br)cc3[nH]2)cn1 ZINC000427228529 566759095 /nfs/dbraw/zinc/75/90/95/566759095.db2.gz WYUQJKBRZDTWBK-UHFFFAOYSA-N 0 1 385.225 3.306 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1csc(I)c1 ZINC000609343199 566759330 /nfs/dbraw/zinc/75/93/30/566759330.db2.gz CYNROTZGIZEGGO-UHFFFAOYSA-N 0 1 396.213 3.186 10 0 GGAEMN Cc1c(Br)ccc(C(=O)N2CCN(CC3CCOCC3)CC2)c1F ZINC000469090203 566760339 /nfs/dbraw/zinc/76/03/39/566760339.db2.gz RJCZARQXZBSEIO-UHFFFAOYSA-N 0 1 399.304 3.081 10 0 GGAEMN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@H](C(F)F)C1 ZINC000677729195 566761824 /nfs/dbraw/zinc/76/18/24/566761824.db2.gz AIVRILYPIHWSRY-WCQYABFASA-N 0 1 375.257 3.383 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@@H]2CCN(c3cccc(Br)c3)C2=O)n1 ZINC000581251078 566761822 /nfs/dbraw/zinc/76/18/22/566761822.db2.gz XHMROBKFCYAYNM-KBPBESRZSA-N 0 1 393.285 3.399 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@@H]2CCN(c3cccc(Br)c3)C2=O)n1 ZINC000581251080 566762839 /nfs/dbraw/zinc/76/28/39/566762839.db2.gz XHMROBKFCYAYNM-UONOGXRCSA-N 0 1 393.285 3.399 10 0 GGAEMN Cc1cc(I)cc(NC(=O)c2ccc(CN(C)C)nc2)c1 ZINC000516438575 566763089 /nfs/dbraw/zinc/76/30/89/566763089.db2.gz YURWWKBZBUBSRC-UHFFFAOYSA-N 0 1 395.244 3.309 10 0 GGAEMN COC(=O)[C@@H](NS(=O)(=O)c1c(F)cccc1Cl)c1ccc(C)c(C)c1 ZINC000469117337 566763428 /nfs/dbraw/zinc/76/34/28/566763428.db2.gz SWXPIUJVEZQUJD-HNNXBMFYSA-N 0 1 385.844 3.289 10 0 GGAEMN COC(=O)CCS(=O)(=O)Nc1ccccc1-c1nc2ccccc2s1 ZINC000609393451 566763937 /nfs/dbraw/zinc/76/39/37/566763937.db2.gz UOYIAUOYTLWIIO-UHFFFAOYSA-N 0 1 376.459 3.268 10 0 GGAEMN CCOC(=O)C1CCC(NC(=O)c2n[nH]c3ccc(Br)cc32)CC1 ZINC000609521503 566768691 /nfs/dbraw/zinc/76/86/91/566768691.db2.gz KZUWVAOMBZLVAR-UHFFFAOYSA-N 0 1 394.269 3.177 10 0 GGAEMN CN(CC(=O)NCc1cc2cccnc2cc1Br)[C@@H]1CCSC1 ZINC000677920632 566769394 /nfs/dbraw/zinc/76/93/94/566769394.db2.gz NIUHLYXMKKRCTH-CQSZACIVSA-N 0 1 394.338 3.051 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)Nc2cnn(C)c2C(F)F)c1 ZINC000677958702 566770671 /nfs/dbraw/zinc/77/06/71/566770671.db2.gz DNJOGNCENITTCW-UHFFFAOYSA-N 0 1 380.214 3.229 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(COc2ccc(I)cc2)n1 ZINC000581369122 566772347 /nfs/dbraw/zinc/77/23/47/566772347.db2.gz GAUNGKKMSQQCGW-GFCCVEGCSA-N 0 1 387.221 3.299 10 0 GGAEMN C[C@H](c1nncn1C)N1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000451186148 566772839 /nfs/dbraw/zinc/77/28/39/566772839.db2.gz DMHXUTCBTOCTKG-OCCSQVGLSA-N 0 1 396.276 3.045 10 0 GGAEMN Cc1nnc(CN2CC[C@@H](Cc3cccc(I)c3)C2)o1 ZINC000451185497 566773397 /nfs/dbraw/zinc/77/33/97/566773397.db2.gz CQPMMPXIOYIVOM-ZDUSSCGKSA-N 0 1 383.233 3.047 10 0 GGAEMN Cn1ccc(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)cc1=O ZINC000677989830 566774006 /nfs/dbraw/zinc/77/40/06/566774006.db2.gz KZXULUOKMCKLCT-UHFFFAOYSA-N 0 1 380.319 3.052 10 0 GGAEMN Cc1cnc(CN2CC[C@@H](Cc3cccc(I)c3)C2)nc1 ZINC000451184032 566774060 /nfs/dbraw/zinc/77/40/60/566774060.db2.gz AAHPLGWRSLOGCT-HNNXBMFYSA-N 0 1 393.272 3.454 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2Br)n[nH]1)c1ccnc2ccncc21 ZINC000562243168 566773951 /nfs/dbraw/zinc/77/39/51/566773951.db2.gz JEHOPUJZSDWWOV-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN Cc1nnc(CN2CC[C@H](Cc3cccc(I)c3)C2)o1 ZINC000451185495 566774167 /nfs/dbraw/zinc/77/41/67/566774167.db2.gz CQPMMPXIOYIVOM-CYBMUJFWSA-N 0 1 383.233 3.047 10 0 GGAEMN CC(C)n1ncnc1CNC[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000631049049 566774215 /nfs/dbraw/zinc/77/42/15/566774215.db2.gz RPFXKTASLVGRNP-AWEZNQCLSA-N 0 1 378.318 3.238 10 0 GGAEMN CCc1nnc(CN2CC[C@H](Cc3cccc(I)c3)C2)o1 ZINC000451194799 566774778 /nfs/dbraw/zinc/77/47/78/566774778.db2.gz SGGZPYLJFSLLED-CYBMUJFWSA-N 0 1 397.260 3.301 10 0 GGAEMN O=C(CNC1(c2cccc(Br)c2)CCC1)N1CCOC[C@H]1C1CC1 ZINC000678008694 566775119 /nfs/dbraw/zinc/77/51/19/566775119.db2.gz VTEVHSKDERWPCY-KRWDZBQOSA-N 0 1 393.325 3.055 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)C(=O)c2ccc(Br)cc2)n[nH]1 ZINC000489262994 566777604 /nfs/dbraw/zinc/77/76/04/566777604.db2.gz VTIVFKNSWIMGEG-NXEZZACHSA-N 0 1 379.258 3.141 10 0 GGAEMN O=C(Nc1cc(Br)cc(Cl)c1O)c1cc2c(=O)[nH]cnc2cn1 ZINC000427547350 566779105 /nfs/dbraw/zinc/77/91/05/566779105.db2.gz RMKSRSMLFZXBLF-UHFFFAOYSA-N 0 1 395.600 3.104 10 0 GGAEMN COCCc1ncc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000631103539 566779282 /nfs/dbraw/zinc/77/92/82/566779282.db2.gz IVFNNPVDDOOBAE-QAPCUYQASA-N 0 1 379.913 3.047 10 0 GGAEMN O=S(=O)(Cc1cccc(C(F)(F)F)c1)Nc1cc([C@@H]2CCCO2)[nH]n1 ZINC000581463694 566779978 /nfs/dbraw/zinc/77/99/78/566779978.db2.gz DKHYNMUBMNHNGF-ZDUSSCGKSA-N 0 1 375.372 3.222 10 0 GGAEMN C[C@@H]1CCC[C@H]1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000542187093 566781716 /nfs/dbraw/zinc/78/17/16/566781716.db2.gz YTOQYPJCAAUOCT-YPMHNXCESA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@@H]1CCC[C@H]1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000542187093 566781725 /nfs/dbraw/zinc/78/17/25/566781725.db2.gz YTOQYPJCAAUOCT-YPMHNXCESA-N 0 1 392.301 3.470 10 0 GGAEMN Cn1cc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)c(C(F)(F)F)n1 ZINC000516761697 566781993 /nfs/dbraw/zinc/78/19/93/566781993.db2.gz LFIMUGNREVPACQ-SNVBAGLBSA-N 0 1 398.212 3.275 10 0 GGAEMN CC[C@H]1CN(C)CCN1C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000655143144 566782535 /nfs/dbraw/zinc/78/25/35/566782535.db2.gz NCDAWLHFWPIXNI-ZFWWWQNUSA-N 0 1 382.302 3.008 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)[C@H](C)Cc2cnc[nH]2)CC1 ZINC000655156712 566782732 /nfs/dbraw/zinc/78/27/32/566782732.db2.gz IHYHSUUITLIZLW-LLVKDONJSA-N 0 1 378.270 3.165 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@H](C)c2ccc(Br)cc2OC)n[nH]1 ZINC000469339730 566783392 /nfs/dbraw/zinc/78/33/92/566783392.db2.gz NJLWLBMAXCAMEI-NXEZZACHSA-N 0 1 396.289 3.260 10 0 GGAEMN COc1cc(Cl)c(CNC[C@H]2CS(=O)(=O)c3ccccc32)cc1OC ZINC000631149174 566785299 /nfs/dbraw/zinc/78/52/99/566785299.db2.gz ZEBNDRPLXCCYPF-ZDUSSCGKSA-N 0 1 381.881 3.018 10 0 GGAEMN COc1cccc2c1CCN(C(=O)c1cccc(Br)c1O)CC2 ZINC000562375146 566785601 /nfs/dbraw/zinc/78/56/01/566785601.db2.gz QUJTXIIXYKIQFN-UHFFFAOYSA-N 0 1 376.250 3.404 10 0 GGAEMN Cc1nnsc1CNC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000562366534 566785674 /nfs/dbraw/zinc/78/56/74/566785674.db2.gz KDJXRKIVLGUGDY-ZDUSSCGKSA-N 0 1 376.873 3.423 10 0 GGAEMN COc1cc(Cl)c(CNC[C@@H]2CS(=O)(=O)c3ccccc32)cc1OC ZINC000631149172 566785645 /nfs/dbraw/zinc/78/56/45/566785645.db2.gz ZEBNDRPLXCCYPF-CYBMUJFWSA-N 0 1 381.881 3.018 10 0 GGAEMN O=C(Nc1c[nH]cc(Br)c1=O)c1cn[nH]c1-c1ccc(Cl)s1 ZINC000427655935 566787377 /nfs/dbraw/zinc/78/73/77/566787377.db2.gz UMMFIXDSVZHFQW-UHFFFAOYSA-N 0 1 399.657 3.495 10 0 GGAEMN O=C(N[C@@H](C1CC1)[C@H]1CCCCO1)c1cc(Br)cc2nc[nH]c21 ZINC000655221111 566787613 /nfs/dbraw/zinc/78/76/13/566787613.db2.gz DPOBXWXORRPYHG-CABCVRRESA-N 0 1 378.270 3.403 10 0 GGAEMN Cc1ccc([C@H](CN2CCOCC2)NCc2cncc(Br)c2)cc1 ZINC000542256412 566788878 /nfs/dbraw/zinc/78/88/78/566788878.db2.gz NPAJNLDYACZGKF-IBGZPJMESA-N 0 1 390.325 3.316 10 0 GGAEMN CC(C)(C(=O)NCc1n[nH]c([C@H]2CCCO2)n1)c1cccc(Br)c1 ZINC000655235588 566789504 /nfs/dbraw/zinc/78/95/04/566789504.db2.gz KAAIPYDXGFGEOX-CYBMUJFWSA-N 0 1 393.285 3.013 10 0 GGAEMN Clc1cc(Br)ccc1CNCc1n[nH]c(C2CCOCC2)n1 ZINC000631213517 566790483 /nfs/dbraw/zinc/79/04/83/566790483.db2.gz MVAXCVAOTIRGDK-UHFFFAOYSA-N 0 1 385.693 3.404 10 0 GGAEMN O=C(c1cc(Cl)ccc1SC1CCCC1)N1CCN2C[C@H](O)C[C@H]2C1 ZINC000655295199 566792001 /nfs/dbraw/zinc/79/20/01/566792001.db2.gz AWEBJJSJLIFPLZ-LSDHHAIUSA-N 0 1 380.941 3.266 10 0 GGAEMN CN(C)C(=O)CCN1CCN(Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC000678283022 566792104 /nfs/dbraw/zinc/79/21/04/566792104.db2.gz VTDXQWPLSCOFTR-UHFFFAOYSA-N 0 1 378.731 3.243 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H](OC2CCC2)C1 ZINC000655279312 566792332 /nfs/dbraw/zinc/79/23/32/566792332.db2.gz GWJYTFYFCGYNKO-ZDUSSCGKSA-N 0 1 378.270 3.499 10 0 GGAEMN O[C@@H]1C[C@H](O)CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1 ZINC000678297932 566793067 /nfs/dbraw/zinc/79/30/67/566793067.db2.gz LIXFWLCJHKNBBL-IYBDPMFKSA-N 0 1 382.287 3.500 10 0 GGAEMN O=C(N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1cccc(Br)c1O ZINC000655337839 566795627 /nfs/dbraw/zinc/79/56/27/566795627.db2.gz WGDSWWUTMCBTNN-KCJUWKMLSA-N 0 1 382.176 3.385 10 0 GGAEMN O=C(N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1cccc(Br)c1O ZINC000655337838 566795661 /nfs/dbraw/zinc/79/56/61/566795661.db2.gz WGDSWWUTMCBTNN-GZMMTYOYSA-N 0 1 382.176 3.385 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCc1nnc([C@H]2CCOC2)[nH]1 ZINC000631374479 566799595 /nfs/dbraw/zinc/79/95/95/566799595.db2.gz MNDNBTGDUAMODU-ZETCQYMHSA-N 0 1 392.179 3.097 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCc1n[nH]c([C@H]2CCOC2)n1 ZINC000631374479 566799601 /nfs/dbraw/zinc/79/96/01/566799601.db2.gz MNDNBTGDUAMODU-ZETCQYMHSA-N 0 1 392.179 3.097 10 0 GGAEMN COc1ccc(F)cc1CNC[C@@H](O)COc1ccc(Br)cc1 ZINC000517025861 566801503 /nfs/dbraw/zinc/80/15/03/566801503.db2.gz PCRKPXLPMAQKQW-OAHLLOKOSA-N 0 1 384.245 3.126 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccccc1 ZINC000451351230 566802315 /nfs/dbraw/zinc/80/23/15/566802315.db2.gz INDATWUIHHEXOA-MSOLQXFVSA-N 0 1 382.888 3.344 10 0 GGAEMN Cc1nc(-c2cc3c(s2)CCN(C(=O)N[C@H]2CCCN(C)C2)C3)cs1 ZINC000678508000 566804410 /nfs/dbraw/zinc/80/44/10/566804410.db2.gz WLQSHECSMJUEMM-AWEZNQCLSA-N 0 1 376.551 3.342 10 0 GGAEMN Cc1ccccc1[C@H](N)C(=O)N1CCOc2cccc(Br)c2C1 ZINC000655503081 566805422 /nfs/dbraw/zinc/80/54/22/566805422.db2.gz BTELKYPFNLQQDK-KRWDZBQOSA-N 0 1 375.266 3.179 10 0 GGAEMN COCCN1CCCN(CC/C=C/c2ccc(Br)cc2)CC1=O ZINC000469689066 566807627 /nfs/dbraw/zinc/80/76/27/566807627.db2.gz DSCUNCLMZLOBSB-GORDUTHDSA-N 0 1 381.314 3.033 10 0 GGAEMN Cc1csc(-c2ccc(S(=O)(=O)N(C)[C@@H]3CCN(C)[C@@H](C)C3)cc2)n1 ZINC000655523363 566808375 /nfs/dbraw/zinc/80/83/75/566808375.db2.gz HMQPAWFQOXSWCJ-GOEBONIOSA-N 0 1 379.551 3.222 10 0 GGAEMN Cc1csc(-c2ccc(S(=O)(=O)N(C)[C@H]3CCN(C)[C@H](C)C3)cc2)n1 ZINC000655523365 566808751 /nfs/dbraw/zinc/80/87/51/566808751.db2.gz HMQPAWFQOXSWCJ-ZBFHGGJFSA-N 0 1 379.551 3.222 10 0 GGAEMN O=C(c1ccc(Br)cc1)N1CCN(CC[C@@H]2CCCCO2)CC1 ZINC000542520234 566808801 /nfs/dbraw/zinc/80/88/01/566808801.db2.gz WYADPHMTQSCADH-KRWDZBQOSA-N 0 1 381.314 3.166 10 0 GGAEMN NCc1cc(C(=O)N2CCN(c3cc(Cl)c(Cl)c(Cl)c3)CC2)ccn1 ZINC000655524443 566808856 /nfs/dbraw/zinc/80/88/56/566808856.db2.gz BISQBAIPGJGQSK-UHFFFAOYSA-N 0 1 399.709 3.463 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1ccccc1C(F)(F)F)C1CC1 ZINC000581853718 566809705 /nfs/dbraw/zinc/80/97/05/566809705.db2.gz SMFCXMDWHAUOMQ-UHFFFAOYSA-N 0 1 378.460 3.341 10 0 GGAEMN CC[C@H](NCC(=O)Nc1ccccc1Br)c1c(C)nn(C)c1C ZINC000542530537 566810346 /nfs/dbraw/zinc/81/03/46/566810346.db2.gz DYXVZCQBJLNZFQ-AWEZNQCLSA-N 0 1 379.302 3.479 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccccc3Br)o2)C1 ZINC000517241426 566814481 /nfs/dbraw/zinc/81/44/81/566814481.db2.gz NGQRFAFBLPFBEN-RYUDHWBXSA-N 0 1 395.253 3.168 10 0 GGAEMN C[C@H](NCc1n[nH]c(C2CCOCC2)n1)c1ccc(Br)cc1F ZINC000631693104 566816566 /nfs/dbraw/zinc/81/65/66/566816566.db2.gz IQEBDCNGCLGVTL-JTQLQIEISA-N 0 1 383.265 3.451 10 0 GGAEMN Brc1cccc(C2CC(NCc3nnc(C4CCOCC4)[nH]3)C2)c1 ZINC000631693629 566816593 /nfs/dbraw/zinc/81/65/93/566816593.db2.gz LZVMXEUHDMVNQV-UHFFFAOYSA-N 0 1 391.313 3.497 10 0 GGAEMN O[C@@]1(C(F)F)CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000451434871 566816880 /nfs/dbraw/zinc/81/68/80/566816880.db2.gz QLTAPJOMUHATOR-INIZCTEOSA-N 0 1 384.224 3.108 10 0 GGAEMN Brc1ccc2c(c1)CC[C@@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631694419 566818331 /nfs/dbraw/zinc/81/83/31/566818331.db2.gz BJRVUPXRQSJBHS-HNNXBMFYSA-N 0 1 377.286 3.238 10 0 GGAEMN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)c1ncsc1Br ZINC000581962754 566818485 /nfs/dbraw/zinc/81/84/85/566818485.db2.gz FGBWBMMBTYDRTC-CYBMUJFWSA-N 0 1 380.311 3.300 10 0 GGAEMN Cc1c([C@@H](C)NCC[C@@H](O)C(F)F)nnn1-c1cccc(Br)c1 ZINC000631695587 566818660 /nfs/dbraw/zinc/81/86/60/566818660.db2.gz AILLPIFDGANJHH-NOZJJQNGSA-N 0 1 389.244 3.005 10 0 GGAEMN Fc1ccc(Br)c2c1CC[C@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631695154 566818771 /nfs/dbraw/zinc/81/87/71/566818771.db2.gz ZBIWXBQTSRJCIU-CQSZACIVSA-N 0 1 395.276 3.377 10 0 GGAEMN Brc1ccc2c(c1)[C@H](NCc1n[nH]c(C3CCOCC3)n1)CC2 ZINC000631695842 566819137 /nfs/dbraw/zinc/81/91/37/566819137.db2.gz MZJSUZDBCCSLJH-OAHLLOKOSA-N 0 1 377.286 3.238 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)C(=O)Nc1ccc(Cl)cc1Cl ZINC000678791827 566819303 /nfs/dbraw/zinc/81/93/03/566819303.db2.gz FTHYNLCDUMAESS-UHFFFAOYSA-N 0 1 376.203 3.151 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)NCc3n[nH]c(C4CC4)n3)coc21 ZINC000562758249 566820009 /nfs/dbraw/zinc/82/00/09/566820009.db2.gz DTYFEPWMKLBWTA-UHFFFAOYSA-N 0 1 375.226 3.429 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Br)cc3ccccc32)CC1 ZINC000517338124 566820376 /nfs/dbraw/zinc/82/03/76/566820376.db2.gz ACQKGRMGYGOKGD-UHFFFAOYSA-N 0 1 391.309 3.397 10 0 GGAEMN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2nc3c(s2)CCC3)C1 ZINC000678838732 566820938 /nfs/dbraw/zinc/82/09/38/566820938.db2.gz XKCZWTHTSLRTGC-GFCCVEGCSA-N 0 1 375.460 3.255 10 0 GGAEMN Cc1sc([C@H](C)NC(=O)CCc2nn[nH]n2)nc1-c1ccc(Cl)cc1 ZINC000631744267 566821888 /nfs/dbraw/zinc/82/18/88/566821888.db2.gz AHEGAUVFUXDIIA-VIFPVBQESA-N 0 1 376.873 3.095 10 0 GGAEMN OCc1ccc(CN2CCN(Cc3ccc(Br)cc3)CC2)cc1 ZINC000490003014 566823303 /nfs/dbraw/zinc/82/33/03/566823303.db2.gz HWUQGVNNMJXGBP-UHFFFAOYSA-N 0 1 375.310 3.259 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@H]1CSc2ccc(Br)cc21 ZINC000428198347 566823342 /nfs/dbraw/zinc/82/33/42/566823342.db2.gz JREXDKDKFMNZDT-ZDUSSCGKSA-N 0 1 378.295 3.487 10 0 GGAEMN COc1cccc(F)c1[C@H](C)N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000428229205 566824875 /nfs/dbraw/zinc/82/48/75/566824875.db2.gz NTUPNLXQQKQYMF-RYUDHWBXSA-N 0 1 383.261 3.498 10 0 GGAEMN CCc1nc(CNC(=O)N2CCC[C@@H]2c2ccc(Br)s2)n[nH]1 ZINC000582047878 566827124 /nfs/dbraw/zinc/82/71/24/566827124.db2.gz QCFAXCSSTKUUIF-SECBINFHSA-N 0 1 384.303 3.238 10 0 GGAEMN Brc1ccc2nc(CN[C@H](c3nnc[nH]3)c3ccccc3)cn2c1 ZINC000428247651 566827332 /nfs/dbraw/zinc/82/73/32/566827332.db2.gz UTFDSYVZYXMIJO-INIZCTEOSA-N 0 1 383.253 3.094 10 0 GGAEMN CC[C@H](N[C@H]1CCCn2nccc21)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000631809369 566828537 /nfs/dbraw/zinc/82/85/37/566828537.db2.gz ICEUXKSALOVCBL-GJZGRUSLSA-N 0 1 382.917 3.020 10 0 GGAEMN C[C@H]1[C@@H](C(F)(F)F)CCN1S(=O)(=O)c1cc(C(F)(F)F)ccc1O ZINC000451512728 566829984 /nfs/dbraw/zinc/82/99/84/566829984.db2.gz XXTFOJBUSGKQET-CBAPKCEASA-N 0 1 377.306 3.372 10 0 GGAEMN O=C(COc1ccc(Cl)cc1Cl)N1CCN(CC[C@H]2CCCO2)CC1 ZINC000469982174 566833417 /nfs/dbraw/zinc/83/34/17/566833417.db2.gz NGAGSIWVZCSFQN-OAHLLOKOSA-N 0 1 387.307 3.086 10 0 GGAEMN COCCCCCN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1 ZINC000469986566 566833432 /nfs/dbraw/zinc/83/34/32/566833432.db2.gz BLLXYCJWWKULQB-UHFFFAOYSA-N 0 1 389.323 3.333 10 0 GGAEMN O=C(Nc1cc(I)ccc1O)c1cc(-c2ccco2)n[nH]1 ZINC000610485638 566834457 /nfs/dbraw/zinc/83/44/57/566834457.db2.gz STABSWCLGOMEOG-UHFFFAOYSA-N 0 1 395.156 3.232 10 0 GGAEMN CCCN(C)[C@H](CNS(=O)(=O)[C@H]1CCO[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000451540688 566835910 /nfs/dbraw/zinc/83/59/10/566835910.db2.gz ZMTWKFTXJKZJTK-JCGIZDLHSA-N 0 1 388.961 3.210 10 0 GGAEMN O=C(Nc1cc(I)ccc1O)c1cc(F)cc2[nH]cnc21 ZINC000610491077 566836298 /nfs/dbraw/zinc/83/62/98/566836298.db2.gz QVJSUTAFPUYBKV-UHFFFAOYSA-N 0 1 397.147 3.265 10 0 GGAEMN C[N@H+]1CCCN(C(=O)NCc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000490226328 566836616 /nfs/dbraw/zinc/83/66/16/566836616.db2.gz ZGYZWJSDLRYISO-UHFFFAOYSA-N 0 1 394.235 3.315 10 0 GGAEMN Cc1cc2cn[nH]c2c(C(=O)Nc2cc(I)ccc2O)c1 ZINC000610491142 566836689 /nfs/dbraw/zinc/83/66/89/566836689.db2.gz UPKGKMVHBLDDMH-UHFFFAOYSA-N 0 1 393.184 3.434 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000490223493 566837258 /nfs/dbraw/zinc/83/72/58/566837258.db2.gz OJNQNQBSAJNUQY-FZKQIMNGSA-N 0 1 396.329 3.256 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@@H]2CCC2(F)F)[C@H]1c1cccs1 ZINC000632027621 566841507 /nfs/dbraw/zinc/84/15/07/566841507.db2.gz IZXQJWORZQEVIF-IPYPFGDCSA-N 0 1 378.510 3.096 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)cn1 ZINC000542940569 566841782 /nfs/dbraw/zinc/84/17/82/566841782.db2.gz AGPMUMZIZTVINF-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN COC1CCN(CCNC(=O)c2c(C)cc(Br)cc2Cl)CC1 ZINC000679236142 566842006 /nfs/dbraw/zinc/84/20/06/566842006.db2.gz GBNYAOSDTPKJDD-UHFFFAOYSA-N 0 1 389.721 3.252 10 0 GGAEMN C[C@@H](c1ccccc1)[C@H](CO)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000679277853 566845460 /nfs/dbraw/zinc/84/54/60/566845460.db2.gz XPMNQZMMRRTAAK-ZBEGNZNMSA-N 0 1 388.265 3.220 10 0 GGAEMN C[C@H](c1ccccc1)[C@@H](CO)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000679277835 566845543 /nfs/dbraw/zinc/84/55/43/566845543.db2.gz XPMNQZMMRRTAAK-BDJLRTHQSA-N 0 1 388.265 3.220 10 0 GGAEMN CC(C)C[C@H](N)c1noc(-c2sccc2S(=O)(=O)N2CCCCC2)n1 ZINC000582301220 566848852 /nfs/dbraw/zinc/84/88/52/566848852.db2.gz XQTWTMZKUJQZJN-LBPRGKRZSA-N 0 1 384.527 3.019 10 0 GGAEMN CCOC(=O)c1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)o1 ZINC000610626662 566850140 /nfs/dbraw/zinc/85/01/40/566850140.db2.gz LUOIQVPCCBRMDG-UHFFFAOYSA-N 0 1 392.209 3.025 10 0 GGAEMN Fc1ccc([C@@H](NCCCn2cc(Br)cn2)c2cnccn2)cc1 ZINC000490433801 566850112 /nfs/dbraw/zinc/85/01/12/566850112.db2.gz OTXPJRWZDIMUTP-QGZVFWFLSA-N 0 1 390.260 3.344 10 0 GGAEMN CC[C@H]1CN(C)CCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000563064776 566850312 /nfs/dbraw/zinc/85/03/12/566850312.db2.gz WFXQVCGPIKVQDH-SWLSCSKDSA-N 0 1 382.302 3.008 10 0 GGAEMN C[C@@H](CN1CCOCC1)C(=O)NCCOc1c(Cl)cc(Cl)cc1Cl ZINC000543094809 566850505 /nfs/dbraw/zinc/85/05/05/566850505.db2.gz MZOSUOGHPUULRT-NSHDSACASA-N 0 1 395.714 3.110 10 0 GGAEMN Fc1ccc([C@H](NCCCn2cc(Br)cn2)c2cnccn2)cc1 ZINC000490433800 566851066 /nfs/dbraw/zinc/85/10/66/566851066.db2.gz OTXPJRWZDIMUTP-KRWDZBQOSA-N 0 1 390.260 3.344 10 0 GGAEMN CC[C@H]1CN(C)CCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000563064778 566851371 /nfs/dbraw/zinc/85/13/71/566851371.db2.gz WFXQVCGPIKVQDH-WFASDCNBSA-N 0 1 382.302 3.008 10 0 GGAEMN Brc1ccccc1-n1cc(CN[C@H](C2CC2)[C@H]2CCCCO2)nn1 ZINC000655812647 566851439 /nfs/dbraw/zinc/85/14/39/566851439.db2.gz QJEFNWUFJNLFJG-QZTJIDSGSA-N 0 1 391.313 3.467 10 0 GGAEMN Cn1nnnc1CCN[C@@H](c1ccc(Br)cc1)c1ccccc1F ZINC000679352703 566851878 /nfs/dbraw/zinc/85/18/78/566851878.db2.gz VBWPHNAYQKAHEM-KRWDZBQOSA-N 0 1 390.260 3.033 10 0 GGAEMN CC[C@@H](NCc1cn(-c2ccccc2Br)nn1)[C@@H]1CCCCO1 ZINC000655856321 566854115 /nfs/dbraw/zinc/85/41/15/566854115.db2.gz MQUGHLFWSYSARU-WBVHZDCISA-N 0 1 379.302 3.467 10 0 GGAEMN COc1ccc(F)cc1CNC[C@H](O)COc1cccc(Br)c1 ZINC000582356318 566854759 /nfs/dbraw/zinc/85/47/59/566854759.db2.gz NLJWYOAVJIHRFY-HNNXBMFYSA-N 0 1 384.245 3.126 10 0 GGAEMN Cc1cc(CNC[C@@H]2CS(=O)(=O)c3ccccc3O2)ccc1Br ZINC000563122211 566855850 /nfs/dbraw/zinc/85/58/50/566855850.db2.gz LNKRQMHYKRBKQT-CQSZACIVSA-N 0 1 396.306 3.082 10 0 GGAEMN CCOc1cc(C[N@H+]2CC[C@H](C)[C@@H](C(=O)[O-])C2)cc(Br)c1OC ZINC000563131493 566857865 /nfs/dbraw/zinc/85/78/65/566857865.db2.gz LAKQKRHNHLXWCH-AAEUAGOBSA-N 0 1 386.286 3.399 10 0 GGAEMN COc1cc(Br)c(F)cc1S(=O)(=O)Nc1c(O)cccc1F ZINC000679464846 566858199 /nfs/dbraw/zinc/85/81/99/566858199.db2.gz MPHCJROWAXKOFL-UHFFFAOYSA-N 0 1 394.193 3.242 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000679511925 566859361 /nfs/dbraw/zinc/85/93/61/566859361.db2.gz RCQNDMSAFMGZBA-UHFFFAOYSA-N 0 1 376.203 3.151 10 0 GGAEMN O[C@H](COC[C@@H]1CCCO1)CN1CCC[C@H]1c1ccc(Br)s1 ZINC000543176822 566859660 /nfs/dbraw/zinc/85/96/60/566859660.db2.gz MIXSCPBMMBXNPN-IHRRRGAJSA-N 0 1 390.343 3.204 10 0 GGAEMN COC(=O)c1ccc(CNC[C@H]2COc3ccccc3O2)c(Br)c1 ZINC000582435670 566860822 /nfs/dbraw/zinc/86/08/22/566860822.db2.gz ATJVHAAQKNGPPE-AWEZNQCLSA-N 0 1 392.249 3.165 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)Cc2csc(CCC(F)(F)F)n2)n[nH]1 ZINC000632198912 566861158 /nfs/dbraw/zinc/86/11/58/566861158.db2.gz QTAUJFKICXWGKA-SECBINFHSA-N 0 1 375.420 3.299 10 0 GGAEMN Cn1c2ccc(CNc3nc4ccc(Br)cc4[nH]3)cc2sc1=O ZINC000582435496 566861514 /nfs/dbraw/zinc/86/15/14/566861514.db2.gz QZPSFLUVRMTFSA-UHFFFAOYSA-N 0 1 389.278 3.273 10 0 GGAEMN CC[C@H](NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)[C@@H](O)C(F)F ZINC000451709352 566867814 /nfs/dbraw/zinc/86/78/14/566867814.db2.gz KLMQGBWPULDPPM-DTWKUNHWSA-N 0 1 382.643 3.330 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1cccc(OC(F)(F)F)c1 ZINC000518089254 566865484 /nfs/dbraw/zinc/86/54/84/566865484.db2.gz FHLZPISFLRXQQV-CHWSQXEVSA-N 0 1 380.432 3.126 10 0 GGAEMN O=C(Nc1nc(SCCO)n[nH]1)c1cc(Br)cc2ccccc21 ZINC000490582502 566865795 /nfs/dbraw/zinc/86/57/95/566865795.db2.gz DYRSSKYTQLIZPT-UHFFFAOYSA-N 0 1 393.266 3.057 10 0 GGAEMN CCC[C@H](C)[C@@H](CO)NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000563219731 566865999 /nfs/dbraw/zinc/86/59/99/566865999.db2.gz WKIORTQYVZCILN-SUMWQHHRSA-N 0 1 382.551 3.100 10 0 GGAEMN NC(=O)CCN(Cc1cncc(Br)c1)[C@@H]1CCOc2ccccc21 ZINC000451707311 566866801 /nfs/dbraw/zinc/86/68/01/566866801.db2.gz HWIDHVKDYVPQHA-MRXNPFEDSA-N 0 1 390.281 3.045 10 0 GGAEMN CC[C@@H](NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)[C@@H](O)C(F)F ZINC000451709356 566867808 /nfs/dbraw/zinc/86/78/08/566867808.db2.gz KLMQGBWPULDPPM-RKDXNWHRSA-N 0 1 382.643 3.330 10 0 GGAEMN Cn1cc(S(=O)(=O)N[C@H]2CCCC[C@H]2CC(F)(F)F)c(C(F)(F)F)n1 ZINC000451718491 566868468 /nfs/dbraw/zinc/86/84/68/566868468.db2.gz GKKJXMOWCGMBCS-IUCAKERBSA-N 0 1 393.353 3.228 10 0 GGAEMN O=C1C[C@H]([C@@H]2CCCCN2CC[S@@](=O)c2cc(Cl)ccc2Cl)CN1 ZINC000490613877 566871106 /nfs/dbraw/zinc/87/11/06/566871106.db2.gz ZWZGJJRQZMVZBM-DWEJFXLMSA-N 0 1 389.348 3.092 10 0 GGAEMN Cc1ccc(C[N@@H+]2CC[C@@H](CN(C)C(=O)c3s[n-]c(=O)c3Cl)C2)s1 ZINC000563264509 566871365 /nfs/dbraw/zinc/87/13/65/566871365.db2.gz JFHFGFJGJRWVPT-NSHDSACASA-N 0 1 385.942 3.466 10 0 GGAEMN O=C(Nc1nc2c(cccc2Br)s1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000518341269 566877245 /nfs/dbraw/zinc/87/72/45/566877245.db2.gz JCMSOEALCVHXPC-AOOOYVTPSA-N 0 1 381.299 3.417 10 0 GGAEMN CSc1ccc([C@@H](C)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)cc1F ZINC000582605525 566878986 /nfs/dbraw/zinc/87/89/86/566878986.db2.gz CSEPBFWULOWEBE-TZMCWYRMSA-N 0 1 381.494 3.433 10 0 GGAEMN Cc1cc(C[C@H](C)NS(=O)(=O)c2c(Cl)cccc2Br)n[nH]1 ZINC000632395351 566880684 /nfs/dbraw/zinc/88/06/84/566880684.db2.gz LWSWPVXVMOJQLQ-VIFPVBQESA-N 0 1 392.706 3.044 10 0 GGAEMN Cc1cnc([C@@H](C)[N@@H+]2C[C@@H](c3ccc(Br)cc3)[C@H](C(=O)[O-])C2)cn1 ZINC000518385978 566880836 /nfs/dbraw/zinc/88/08/36/566880836.db2.gz APFMSEQTHSWBCI-UHOFOFEASA-N 0 1 390.281 3.409 10 0 GGAEMN Cc1cc(Br)ccc1SCC(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000518431730 566883181 /nfs/dbraw/zinc/88/31/81/566883181.db2.gz IUQOGVGTHFHNKX-HNNXBMFYSA-N 0 1 383.355 3.402 10 0 GGAEMN CC(C)Oc1cncc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)n1 ZINC000656187346 566883429 /nfs/dbraw/zinc/88/34/29/566883429.db2.gz VZJSVUXVXNFHTF-UHFFFAOYSA-N 0 1 375.372 3.225 10 0 GGAEMN CCN(C1CCN(C)CC1)S(=O)(=O)c1cccc(Br)c1Cl ZINC000632408915 566883591 /nfs/dbraw/zinc/88/35/91/566883591.db2.gz ZKOGCLBMYWPGSL-UHFFFAOYSA-N 0 1 395.750 3.207 10 0 GGAEMN CC1(C)COC[C@@H]1NCc1coc(-c2ccc(I)cc2)n1 ZINC000451810351 566885737 /nfs/dbraw/zinc/88/57/37/566885737.db2.gz LAKPZURIXSBWDB-AWEZNQCLSA-N 0 1 398.244 3.461 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1c(F)cncc1F ZINC000563467673 566887907 /nfs/dbraw/zinc/88/79/07/566887907.db2.gz CKCDAVXWNRLCQH-ZETCQYMHSA-N 0 1 381.180 3.490 10 0 GGAEMN Cc1nn(C)c(C)c1-c1cc(C(=O)N2CCc3sc(Cl)cc3C2)n[nH]1 ZINC000582728691 566889434 /nfs/dbraw/zinc/88/94/34/566889434.db2.gz ZXAUTRLCTWDKPV-UHFFFAOYSA-N 0 1 375.885 3.340 10 0 GGAEMN COC(=O)C[C@@](C)(NCc1n[nH]c(C(C)C)n1)c1ccc(Br)cc1 ZINC000428941625 566891406 /nfs/dbraw/zinc/89/14/06/566891406.db2.gz JRXNWIXIDSAANQ-QGZVFWFLSA-N 0 1 395.301 3.259 10 0 GGAEMN C[C@@H](Oc1cccc(CO)c1)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000491064966 566892476 /nfs/dbraw/zinc/89/24/76/566892476.db2.gz ZRKDYTSFULBUSV-SNVBAGLBSA-N 0 1 390.237 3.224 10 0 GGAEMN Brc1ccc(-c2ccc(CN3CCN4CCOC[C@@H]4C3)o2)cc1 ZINC000543621119 566893088 /nfs/dbraw/zinc/89/30/88/566893088.db2.gz FSYIAAHZDBCZOY-INIZCTEOSA-N 0 1 377.282 3.226 10 0 GGAEMN COc1ccc(Br)c(CN(C)C(=O)NCCN2CC=C(C)CC2)c1 ZINC000428991195 566894375 /nfs/dbraw/zinc/89/43/75/566894375.db2.gz IYCOZDPQBDAELT-UHFFFAOYSA-N 0 1 396.329 3.251 10 0 GGAEMN COc1ccc([C@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C(C)C)cc1 ZINC000582803292 566894844 /nfs/dbraw/zinc/89/48/44/566894844.db2.gz WDFIEMYYBIJUCT-GOSISDBHSA-N 0 1 382.551 3.494 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccc(F)cc1Br ZINC000518620467 566895238 /nfs/dbraw/zinc/89/52/38/566895238.db2.gz RVYKVHLDGGSCNW-VXGBXAGGSA-N 0 1 393.322 3.129 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(F)cc1Br ZINC000518620465 566895267 /nfs/dbraw/zinc/89/52/67/566895267.db2.gz RVYKVHLDGGSCNW-RYUDHWBXSA-N 0 1 393.322 3.129 10 0 GGAEMN CS(=O)(=O)c1cccc(Cl)c1CNCCc1cc(F)c(F)c(F)c1 ZINC000543639949 566896555 /nfs/dbraw/zinc/89/65/55/566896555.db2.gz OACUPNLLCXHRNG-UHFFFAOYSA-N 0 1 377.815 3.493 10 0 GGAEMN COCCCn1cnnc1SCc1nc2ccc(Br)cc2[nH]1 ZINC000543640105 566896647 /nfs/dbraw/zinc/89/66/47/566896647.db2.gz SJIKYJRBJBWNKH-UHFFFAOYSA-N 0 1 382.287 3.246 10 0 GGAEMN C[C@@]1(O)C[C@H](N[C@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C1 ZINC000563569881 566896871 /nfs/dbraw/zinc/89/68/71/566896871.db2.gz CHYZNSLSZIJHBJ-QRQLOZEOSA-N 0 1 379.909 3.336 10 0 GGAEMN CCc1nc(Cn2cc([C@H](N)c3ccc(Br)cc3)nn2)cs1 ZINC000656449258 566903488 /nfs/dbraw/zinc/90/34/88/566903488.db2.gz ASCHLSRFXYDZIL-OAHLLOKOSA-N 0 1 378.299 3.156 10 0 GGAEMN C[C@@](N)(C(=O)NC[C@H]1CC12CCSCC2)c1ccc(Br)cc1 ZINC000582903635 566903742 /nfs/dbraw/zinc/90/37/42/566903742.db2.gz LKTCSYNBXRCFLK-CJNGLKHVSA-N 0 1 383.355 3.273 10 0 GGAEMN O=C(c1cc(-c2ccoc2)[nH]n1)N1CCC(n2cc(Br)cn2)CC1 ZINC000518817770 566904527 /nfs/dbraw/zinc/90/45/27/566904527.db2.gz FYFRQILOQBHQHB-UHFFFAOYSA-N 0 1 390.241 3.106 10 0 GGAEMN CCOC(=O)C[C@@H](O)CN1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000611238011 566904427 /nfs/dbraw/zinc/90/44/27/566904427.db2.gz WXYZFGDIJNXGEB-TZMCWYRMSA-N 0 1 376.280 3.151 10 0 GGAEMN CC(C)(CNC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccccc1Br ZINC000518850431 566906951 /nfs/dbraw/zinc/90/69/51/566906951.db2.gz FQKQZOFQXCNTBM-LBPRGKRZSA-N 0 1 391.313 3.307 10 0 GGAEMN C[C@H](NCC(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(Cl)s1 ZINC000680406885 566907987 /nfs/dbraw/zinc/90/79/87/566907987.db2.gz HDKJWXXFZVYBSE-ZDUSSCGKSA-N 0 1 383.970 3.458 10 0 GGAEMN COC(=O)c1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cc1 ZINC000518889014 566908527 /nfs/dbraw/zinc/90/85/27/566908527.db2.gz UCEALXHBGPBEPC-UHFFFAOYSA-N 0 1 388.221 3.042 10 0 GGAEMN O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1n[nH]c2ccc(Br)cc21 ZINC000518919237 566909481 /nfs/dbraw/zinc/90/94/81/566909481.db2.gz LWHXBOHXTADIKJ-ZDUSSCGKSA-N 0 1 387.237 3.233 10 0 GGAEMN Brc1ccc(-n2cc(CN3CC[C@H](Nc4ncccn4)C3)cn2)cc1 ZINC000563713337 566910820 /nfs/dbraw/zinc/91/08/20/566910820.db2.gz MGFCDWHYZCORHG-INIZCTEOSA-N 0 1 399.296 3.111 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@H](C)[C@H]1OCCc2sccc21 ZINC000429167374 566913226 /nfs/dbraw/zinc/91/32/26/566913226.db2.gz LGNPRFQZZAKALB-MLGOLLRUSA-N 0 1 378.460 3.387 10 0 GGAEMN O=C(NCCCCN1CCOCC1)NC1(c2c(Cl)cccc2Cl)CC1 ZINC000470909327 566914509 /nfs/dbraw/zinc/91/45/09/566914509.db2.gz QFIGGBUARGLMHJ-UHFFFAOYSA-N 0 1 386.323 3.394 10 0 GGAEMN CCc1ncc(CNS(=O)(=O)c2cc(Br)sc2Cl)o1 ZINC000451961362 566914685 /nfs/dbraw/zinc/91/46/85/566914685.db2.gz SERXETSDXVSQMW-UHFFFAOYSA-N 0 1 385.692 3.193 10 0 GGAEMN CCc1nc([C@@H](C)S(=O)(=O)c2nccn2-c2cccc(Cl)c2C)n[nH]1 ZINC000656555551 566915790 /nfs/dbraw/zinc/91/57/90/566915790.db2.gz GUZMPDQVIKFTAI-LLVKDONJSA-N 0 1 379.873 3.050 10 0 GGAEMN Cc1ccncc1CCCN1CCN(c2ccc(Br)cn2)CC1 ZINC000563778879 566916014 /nfs/dbraw/zinc/91/60/14/566916014.db2.gz ZZGKWGZMDGORHO-UHFFFAOYSA-N 0 1 375.314 3.302 10 0 GGAEMN C[N@@H+]1CC[C@H](N=c2[n-]nc(-c3ccon3)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000583042775 566916969 /nfs/dbraw/zinc/91/69/69/566916969.db2.gz ZZEMGYHMVULUCS-GXTWGEPZSA-N 0 1 379.848 3.265 10 0 GGAEMN C[N@H+]1CC[C@H](N=c2[n-]nc(-c3ccon3)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000583042775 566916978 /nfs/dbraw/zinc/91/69/78/566916978.db2.gz ZZEMGYHMVULUCS-GXTWGEPZSA-N 0 1 379.848 3.265 10 0 GGAEMN O=C([O-])C[C@H]([NH2+]Cc1cn(C2CCC2)nn1)c1cccc(Br)c1 ZINC000656564988 566917428 /nfs/dbraw/zinc/91/74/28/566917428.db2.gz BYVGUXFKRYFHPH-HNNXBMFYSA-N 0 1 379.258 3.071 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC(Oc3cccc(Br)c3)CC2)C1 ZINC000680555737 566918513 /nfs/dbraw/zinc/91/85/13/566918513.db2.gz XJZJUMPYFDCDNR-OAHLLOKOSA-N 0 1 396.329 3.096 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2c(C)cc(Br)cc2C)cn1 ZINC000543871512 566919468 /nfs/dbraw/zinc/91/94/68/566919468.db2.gz PPVYTUPFYQESLN-UHFFFAOYSA-N 0 1 399.266 3.048 10 0 GGAEMN Cn1nc(CNC(=O)c2n[nH]c3ccc(Br)cc32)c2ccccc21 ZINC000680563691 566919452 /nfs/dbraw/zinc/91/94/52/566919452.db2.gz TUAFWGNATAVTBO-UHFFFAOYSA-N 0 1 384.237 3.142 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCC[C@H](N2CCOCC2)CC1 ZINC000632877229 566920703 /nfs/dbraw/zinc/92/07/03/566920703.db2.gz DLTJZALBPPXBSZ-ZDUSSCGKSA-N 0 1 387.343 3.146 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCc2c(F)cc(Br)cc2C1 ZINC000680587602 566920974 /nfs/dbraw/zinc/92/09/74/566920974.db2.gz VIUOCRRMEQRXPR-UHFFFAOYSA-N 0 1 378.245 3.248 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000543908148 566921138 /nfs/dbraw/zinc/92/11/38/566921138.db2.gz DYTHMISOWNWDIE-SHZVTRLKSA-N 0 1 378.460 3.122 10 0 GGAEMN C[C@@H]1COCC[C@@H]1c1nc(-c2nc(-c3cccc(Br)c3)n[nH]2)no1 ZINC000519129803 566922318 /nfs/dbraw/zinc/92/23/18/566922318.db2.gz NYMHBOYUTMTODV-SKDRFNHKSA-N 0 1 390.241 3.424 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000563842294 566923833 /nfs/dbraw/zinc/92/38/33/566923833.db2.gz OZNRUMUSIWPODW-MRXNPFEDSA-N 0 1 395.352 3.038 10 0 GGAEMN CN(CC(=O)Nc1cc(Cl)ccc1F)C1CCN(CC(F)(F)F)CC1 ZINC000452028614 566924445 /nfs/dbraw/zinc/92/44/45/566924445.db2.gz CGRXJFFNHDEPJO-UHFFFAOYSA-N 0 1 381.801 3.376 10 0 GGAEMN CSc1cccc(NC(=O)CN(C)C2CCN(CC(F)(F)F)CC2)c1 ZINC000452037370 566926213 /nfs/dbraw/zinc/92/62/13/566926213.db2.gz LENHMXDHGCYINW-UHFFFAOYSA-N 0 1 375.460 3.306 10 0 GGAEMN C[C@@H](N[C@@H](CO)c1ccc(Cl)cc1)C(=O)N1CCSc2ccccc21 ZINC000583173079 566926548 /nfs/dbraw/zinc/92/65/48/566926548.db2.gz UYPHGVFPGVUEOH-CJNGLKHVSA-N 0 1 376.909 3.490 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccc(Cl)cc1SC)C1CCOCC1 ZINC000656633090 566927550 /nfs/dbraw/zinc/92/75/50/566927550.db2.gz TWDYXXVTOWPUDW-CQSZACIVSA-N 0 1 379.931 3.245 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccc(Cl)cc1SC)C1CCOCC1 ZINC000656633089 566928925 /nfs/dbraw/zinc/92/89/25/566928925.db2.gz TWDYXXVTOWPUDW-AWEZNQCLSA-N 0 1 379.931 3.245 10 0 GGAEMN CC(C)CN(Cc1ccccc1Br)C(=O)[C@@H](C)CN1CCOCC1 ZINC000544022587 566930426 /nfs/dbraw/zinc/93/04/26/566930426.db2.gz FVYFPZCWLCJFKS-INIZCTEOSA-N 0 1 397.357 3.402 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(Cl)c(C(N)=O)c2)c(Cl)cc1F ZINC000471123728 566930829 /nfs/dbraw/zinc/93/08/29/566930829.db2.gz HMKMIEWLSRATDD-UHFFFAOYSA-N 0 1 377.224 3.341 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(Cn3cncn3)c2)c(Cl)cc1F ZINC000471134745 566931575 /nfs/dbraw/zinc/93/15/75/566931575.db2.gz YXODVHFDRUMIGX-UHFFFAOYSA-N 0 1 380.832 3.228 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccc(OC(F)F)cc1OC(F)F)C1CC1 ZINC000563958000 566931742 /nfs/dbraw/zinc/93/17/42/566931742.db2.gz WXIBFRLXYXZNSG-LBPRGKRZSA-N 0 1 387.351 3.056 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CC=C(c3cccc(Br)c3)CC2)C1 ZINC000680814625 566932818 /nfs/dbraw/zinc/93/28/18/566932818.db2.gz PYTJYVHJESGDBM-KRWDZBQOSA-N 0 1 378.314 3.342 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)sc1Br ZINC000583254305 566934153 /nfs/dbraw/zinc/93/41/53/566934153.db2.gz DPURVDQPBDIEMU-MNOVXSKESA-N 0 1 391.287 3.188 10 0 GGAEMN NC(=O)[C@H](N[C@H]1C[C@H](Oc2ccccc2)C1)c1ccc(Br)cc1 ZINC000656685668 566934545 /nfs/dbraw/zinc/93/45/45/566934545.db2.gz XGJWOBCVRHIWLU-DJIMGWMZSA-N 0 1 375.266 3.175 10 0 GGAEMN CN(C)C(=O)CCN1CCN(c2nc(-c3ccccc3Cl)cs2)CC1 ZINC000544068317 566934643 /nfs/dbraw/zinc/93/46/43/566934643.db2.gz HZHJCQUUZBXJBA-UHFFFAOYSA-N 0 1 378.929 3.064 10 0 GGAEMN O[C@H](CNCc1cnc(C(F)(F)F)nc1)COc1ccc(Cl)c(Cl)c1 ZINC000656704147 566935290 /nfs/dbraw/zinc/93/52/90/566935290.db2.gz GLKPTHNJQRPHOZ-SNVBAGLBSA-N 0 1 396.196 3.332 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CNc2cc(Cl)c(F)c(Cl)c2)C1 ZINC000492763544 566937251 /nfs/dbraw/zinc/93/72/51/566937251.db2.gz ABFZZVULODLNGK-CYBMUJFWSA-N 0 1 392.302 3.017 10 0 GGAEMN O=C(Nc1cc(Br)ccc1NC1CC1)[C@H]1CCc2[nH]cnc2C1 ZINC000611752201 566938088 /nfs/dbraw/zinc/93/80/88/566938088.db2.gz VRYMNYQSEZMKTC-JTQLQIEISA-N 0 1 375.270 3.490 10 0 GGAEMN CC(C)[C@H](NCC(F)(F)F)C(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C ZINC000611799126 566939208 /nfs/dbraw/zinc/93/92/08/566939208.db2.gz KPCLSNNCLSHFRS-GJZGRUSLSA-N 0 1 379.854 3.235 10 0 GGAEMN CN(C)[C@@H](CNC(=O)C1(C(F)(F)F)CCOCC1)c1ccc(Cl)cc1 ZINC000611799561 566939599 /nfs/dbraw/zinc/93/95/99/566939599.db2.gz QAPQBZAQHLKLAA-AWEZNQCLSA-N 0 1 378.822 3.418 10 0 GGAEMN CSC[C@@H](O)CN1CCC[C@@H]1c1ccccc1I ZINC000493163273 566945665 /nfs/dbraw/zinc/94/56/65/566945665.db2.gz XNGPSSLKWIQNTG-SMDDNHRTSA-N 0 1 377.291 3.152 10 0 GGAEMN O=C(CCOc1cccc(Br)c1)Nc1nc(-c2ccncc2)n[nH]1 ZINC000519510726 566943468 /nfs/dbraw/zinc/94/34/68/566943468.db2.gz CNRYGYMZFPHVQO-UHFFFAOYSA-N 0 1 388.225 3.037 10 0 GGAEMN Cc1ccc(Br)c(NS(=O)(=O)c2cn3c(n2)CCC[C@H]3C)n1 ZINC000656739342 566944301 /nfs/dbraw/zinc/94/43/01/566944301.db2.gz LZYHUFZJBBJTPL-SNVBAGLBSA-N 0 1 385.287 3.047 10 0 GGAEMN CCC[C@H](NC(=O)c1ccc2scc(Br)c2c1)c1nn[nH]n1 ZINC000519521861 566944618 /nfs/dbraw/zinc/94/46/18/566944618.db2.gz JNUGQZBSVYDUAT-NSHDSACASA-N 0 1 380.271 3.448 10 0 GGAEMN CC(C)c1nc(CNC(=O)[C@H]2C[C@@]2(C)c2cccc(Br)c2)n[nH]1 ZINC000633258281 566946239 /nfs/dbraw/zinc/94/62/39/566946239.db2.gz AONAGHRQKGOHLQ-DYVFJYSZSA-N 0 1 377.286 3.285 10 0 GGAEMN Cc1cc(Br)c2c(c1)CCN(C(=O)N[C@@H]1CCc3nc[nH]c3C1)C2 ZINC000633251485 566946443 /nfs/dbraw/zinc/94/64/43/566946443.db2.gz UMQJCKDSIPTZRL-CYBMUJFWSA-N 0 1 389.297 3.106 10 0 GGAEMN CCn1ncc(C)c1NS(=O)(=O)c1c(Cl)cccc1Br ZINC000656741714 566946487 /nfs/dbraw/zinc/94/64/87/566946487.db2.gz VATXVOQRVAUVAZ-UHFFFAOYSA-N 0 1 378.679 3.428 10 0 GGAEMN C[C@]1(c2cccc(Br)c2)C[C@H]1C(=O)NCc1n[nH]c(C2CC2)n1 ZINC000633258659 566946545 /nfs/dbraw/zinc/94/65/45/566946545.db2.gz GPJLPASCQXNDSZ-SUMWQHHRSA-N 0 1 375.270 3.039 10 0 GGAEMN CCN(CC)CCN(c1ccc(Cl)cc1)S(=O)(=O)c1ccnn1CC ZINC000656741569 566946741 /nfs/dbraw/zinc/94/67/41/566946741.db2.gz QVKGDVXTAVYXCH-UHFFFAOYSA-N 0 1 384.933 3.094 10 0 GGAEMN CC(C)c1nc(CNC(=O)[C@@H]2C[C@]2(C)c2cccc(Br)c2)n[nH]1 ZINC000633258283 566947085 /nfs/dbraw/zinc/94/70/85/566947085.db2.gz AONAGHRQKGOHLQ-SUMWQHHRSA-N 0 1 377.286 3.285 10 0 GGAEMN CC(C)c1nc(CNC(=O)[C@@H]2C[C@@]2(C)c2cccc(Br)c2)n[nH]1 ZINC000633258282 566947577 /nfs/dbraw/zinc/94/75/77/566947577.db2.gz AONAGHRQKGOHLQ-GUYCJALGSA-N 0 1 377.286 3.285 10 0 GGAEMN CN(Cc1ccc(Br)cc1F)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000633250570 566947614 /nfs/dbraw/zinc/94/76/14/566947614.db2.gz MONFFWDLASDYFJ-LBPRGKRZSA-N 0 1 381.249 3.010 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCc2c(F)ccc(Br)c2C1 ZINC000452199243 566949964 /nfs/dbraw/zinc/94/99/64/566949964.db2.gz VDGZXDPDUYIRCT-UHFFFAOYSA-N 0 1 378.245 3.248 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1cc(Cl)ccc1Br ZINC000429814962 566950850 /nfs/dbraw/zinc/95/08/50/566950850.db2.gz OHQRNUIFKDUOEG-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN C[C@H]1C[C@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CN1C1CC1 ZINC000612103525 566952376 /nfs/dbraw/zinc/95/23/76/566952376.db2.gz IUBIEMNGUQWVLZ-BQBZGAKWSA-N 0 1 395.194 3.361 10 0 GGAEMN CC(C)(C)n1cnc(=NC(=O)c2cc3c(cc(Br)cc3F)[nH]2)[nH]1 ZINC000544339807 566954018 /nfs/dbraw/zinc/95/40/18/566954018.db2.gz VFOAALSQJBPORI-UHFFFAOYSA-N 0 1 380.221 3.090 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Cl)cc2)n[nH]1)c1cc[nH]c(=O)c1Br ZINC000583479708 566953973 /nfs/dbraw/zinc/95/39/73/566953973.db2.gz GUMSQHQJDSWOAZ-UHFFFAOYSA-N 0 1 394.616 3.241 10 0 GGAEMN Cc1nc(C(C)C)sc1[C@@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564209729 566954734 /nfs/dbraw/zinc/95/47/34/566954734.db2.gz DMYDOEMRQZKBKT-TZMCWYRMSA-N 0 1 380.535 3.460 10 0 GGAEMN Cn1c(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)[O-])nc2ccc(Br)cc21 ZINC000519648494 566955294 /nfs/dbraw/zinc/95/52/94/566955294.db2.gz WGLRUAYGPPOEDG-PKWAYOAASA-N 0 1 378.270 3.021 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@@H]2[C@@H]3Cc4cc(Br)ccc4[C@@H]32)n[nH]1 ZINC000633396822 566956270 /nfs/dbraw/zinc/95/62/70/566956270.db2.gz FZVJGYDYMHKBFH-VHDGCEQUSA-N 0 1 389.297 3.067 10 0 GGAEMN O=C(N[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12)N[C@@H]1CCCc2cn[nH]c21 ZINC000633408344 566957549 /nfs/dbraw/zinc/95/75/49/566957549.db2.gz MUWLZTWHJOOVCT-DPAVQSFQSA-N 0 1 387.281 3.187 10 0 GGAEMN O=C(NCc1cc2c(c(Br)c1)OCO2)c1cc2[nH]cnc2cc1F ZINC000583516779 566958202 /nfs/dbraw/zinc/95/82/02/566958202.db2.gz NJDAPDHCPZGUBH-UHFFFAOYSA-N 0 1 392.184 3.123 10 0 GGAEMN C[C@@H]1SCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)[C@H]1C ZINC000544389679 566959372 /nfs/dbraw/zinc/95/93/72/566959372.db2.gz ATCSQXCVYHZQRA-UWVGGRQHSA-N 0 1 381.295 3.257 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N(Cc1ccncc1)C1CC1 ZINC000544389003 566959582 /nfs/dbraw/zinc/95/95/82/566959582.db2.gz GWBDSIPDSZCVIX-UHFFFAOYSA-N 0 1 398.260 3.490 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)ccc1F ZINC000471582035 566962367 /nfs/dbraw/zinc/96/23/67/566962367.db2.gz SAAFCNPWHPEIJI-UHFFFAOYSA-N 0 1 381.303 3.239 10 0 GGAEMN C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000612303490 566963489 /nfs/dbraw/zinc/96/34/89/566963489.db2.gz HUUZAQMKFISLPO-POYBYMJQSA-N 0 1 395.194 3.218 10 0 GGAEMN COCCOc1c(Cl)cccc1NS(=O)(=O)c1ccc(F)c(OC)c1 ZINC000471607418 566964154 /nfs/dbraw/zinc/96/41/54/566964154.db2.gz ZLQBWLJHGUWQGR-UHFFFAOYSA-N 0 1 389.832 3.314 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cc3c(cc2SC)OCCO3)ccc1F ZINC000471604580 566964196 /nfs/dbraw/zinc/96/41/96/566964196.db2.gz YAKDGCZJOGYJHQ-UHFFFAOYSA-N 0 1 385.438 3.128 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N(CCN(C)C)Cc1ccccc1F ZINC000656880581 566964994 /nfs/dbraw/zinc/96/49/94/566964994.db2.gz LFQUYHYZZNPUTR-ZDUSSCGKSA-N 0 1 384.439 3.108 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2c(F)cc(Br)cc2C1 ZINC000612336178 566965008 /nfs/dbraw/zinc/96/50/08/566965008.db2.gz BEQFVMNAHAUTER-SNVBAGLBSA-N 0 1 378.245 3.001 10 0 GGAEMN COc1ccc(OC(F)F)c(NS(=O)(=O)c2ccc(F)c(OC)c2)c1 ZINC000471614535 566965648 /nfs/dbraw/zinc/96/56/48/566965648.db2.gz MOAQQNNOKIWJLG-UHFFFAOYSA-N 0 1 377.340 3.245 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000656889896 566967413 /nfs/dbraw/zinc/96/74/13/566967413.db2.gz PGPWQNGRXKTCDE-KBPBESRZSA-N 0 1 398.516 3.468 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000656889898 566967541 /nfs/dbraw/zinc/96/75/41/566967541.db2.gz PGPWQNGRXKTCDE-UONOGXRCSA-N 0 1 398.516 3.468 10 0 GGAEMN Cc1cc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)c(Br)s1 ZINC000633526152 566968622 /nfs/dbraw/zinc/96/86/22/566968622.db2.gz NSZIIJPXIHDWOB-UHFFFAOYSA-N 0 1 396.310 3.246 10 0 GGAEMN Cc1ncc(C(=O)N2CC[C@H](Cc3cccc(I)c3)C2)[nH]1 ZINC000452366158 566969288 /nfs/dbraw/zinc/96/92/88/566969288.db2.gz IHPIWUICDPEGMK-CYBMUJFWSA-N 0 1 395.244 3.028 10 0 GGAEMN Cc1n[nH]c(C(=O)N[C@@H](C)c2ccc(Br)cc2OCCCO)c1C ZINC000519799595 566970115 /nfs/dbraw/zinc/97/01/15/566970115.db2.gz DUXLQGZQZXYBLN-LBPRGKRZSA-N 0 1 396.285 3.041 10 0 GGAEMN O=C(c1n[nH]cc1C(F)(F)F)N1CCO[C@@H](c2c(F)cccc2Cl)C1 ZINC000633564041 566970149 /nfs/dbraw/zinc/97/01/49/566970149.db2.gz LKBZEGCPXUXXFJ-LLVKDONJSA-N 0 1 377.725 3.435 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H]1CCCN1Cc1ccccc1 ZINC000656904663 566970342 /nfs/dbraw/zinc/97/03/42/566970342.db2.gz KSFCJWUTFLDCBI-HOCLYGCPSA-N 0 1 378.460 3.159 10 0 GGAEMN Cc1cc(C(=O)N2CC[C@@H](Cc3cccc(I)c3)C2)n[nH]1 ZINC000452373998 566970680 /nfs/dbraw/zinc/97/06/80/566970680.db2.gz WZJMNOOMPUXTSB-ZDUSSCGKSA-N 0 1 395.244 3.028 10 0 GGAEMN Cc1c2cc(Br)ccc2oc1C(=O)NC[C@@H]1CCCCN1CCO ZINC000452375286 566971384 /nfs/dbraw/zinc/97/13/84/566971384.db2.gz MFCLACIGWHOIGI-AWEZNQCLSA-N 0 1 395.297 3.080 10 0 GGAEMN Cc1cc(C(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)c(Br)s1 ZINC000544581211 566971409 /nfs/dbraw/zinc/97/14/09/566971409.db2.gz JVSNPNBDIACEJE-GFCCVEGCSA-N 0 1 377.267 3.457 10 0 GGAEMN Cc1cc(C(=O)N[C@H](c2nnc[nH]2)c2ccccc2)c(Br)s1 ZINC000544581212 566971718 /nfs/dbraw/zinc/97/17/18/566971718.db2.gz JVSNPNBDIACEJE-LBPRGKRZSA-N 0 1 377.267 3.457 10 0 GGAEMN CCCC(=O)NC1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000681399351 566973563 /nfs/dbraw/zinc/97/35/63/566973563.db2.gz SZBTYPSRUSJHSR-UHFFFAOYSA-N 0 1 379.302 3.206 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)cc(Br)c2)CCN1C ZINC000656915669 566973882 /nfs/dbraw/zinc/97/38/82/566973882.db2.gz NLWWFWHKAKBJTJ-GWCFXTLKSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@H](C(F)(F)F)O1 ZINC000681405286 566974173 /nfs/dbraw/zinc/97/41/73/566974173.db2.gz WRWAFDHBUCFTCZ-UFBFGSQYSA-N 0 1 378.192 3.477 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000656936232 566977807 /nfs/dbraw/zinc/97/78/07/566977807.db2.gz XRJHXPPAJHGFHV-GDBMZVCRSA-N 0 1 378.460 3.111 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000612515623 566977898 /nfs/dbraw/zinc/97/78/98/566977898.db2.gz LYGHHBIGWQICKC-ZYHUDNBSSA-N 0 1 380.261 3.164 10 0 GGAEMN O=C(CCc1nc2cc(Cl)ccc2s1)NCCCCN1CCOCC1 ZINC000519930373 566978389 /nfs/dbraw/zinc/97/83/89/566978389.db2.gz PRTKCHNRKDBHHE-UHFFFAOYSA-N 0 1 381.929 3.111 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000612515622 566978590 /nfs/dbraw/zinc/97/85/90/566978590.db2.gz LYGHHBIGWQICKC-PWSUYJOCSA-N 0 1 380.261 3.164 10 0 GGAEMN COCCN1CCCN(C(=O)CCc2nc3cc(Cl)ccc3s2)CC1 ZINC000519928884 566979760 /nfs/dbraw/zinc/97/97/60/566979760.db2.gz CNQVROLPPHJHPD-UHFFFAOYSA-N 0 1 381.929 3.063 10 0 GGAEMN O=S(=O)(N[C@H]1CCCc2cn[nH]c21)c1cc(Cl)cc(Br)c1 ZINC000656939347 566980227 /nfs/dbraw/zinc/98/02/27/566980227.db2.gz VFSAAJOBUHCYPR-LBPRGKRZSA-N 0 1 390.690 3.182 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC(C)(C)CN(C)Cc1ccccc1 ZINC000656944585 566981048 /nfs/dbraw/zinc/98/10/48/566981048.db2.gz VWAPFYGSRYVSCA-CQSZACIVSA-N 0 1 380.476 3.405 10 0 GGAEMN C[N@H+]1CC[C@@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@H]1c1ccccc1 ZINC000656945203 566981513 /nfs/dbraw/zinc/98/15/13/566981513.db2.gz LZARZFVAMAAMFU-QZTJIDSGSA-N 0 1 382.888 3.344 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@H]1c1ccccc1 ZINC000656945203 566981520 /nfs/dbraw/zinc/98/15/20/566981520.db2.gz LZARZFVAMAAMFU-QZTJIDSGSA-N 0 1 382.888 3.344 10 0 GGAEMN C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)[C@@H]1CCN(S(C)(=O)=O)C1 ZINC000430100312 566982031 /nfs/dbraw/zinc/98/20/31/566982031.db2.gz ASLQCIZPZSNBIW-RCBBPTIPSA-N 0 1 376.444 3.074 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2c(F)c(F)c(Br)c(F)c2F)n[nH]1 ZINC000612601869 566983459 /nfs/dbraw/zinc/98/34/59/566983459.db2.gz UBAKAFULTWKUJT-YFKPBYRVSA-N 0 1 394.166 3.398 10 0 GGAEMN CCN(CC)[C@H](CNC(=O)Nc1ccnc(C)c1Br)c1ccco1 ZINC000583791956 566983399 /nfs/dbraw/zinc/98/33/99/566983399.db2.gz MCHAFRAWMAGXAZ-CQSZACIVSA-N 0 1 395.301 3.372 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2c(F)c(F)c(Br)c(F)c2F)n[nH]1 ZINC000612601865 566984071 /nfs/dbraw/zinc/98/40/71/566984071.db2.gz UBAKAFULTWKUJT-RXMQYKEDSA-N 0 1 394.166 3.398 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000656960924 566984516 /nfs/dbraw/zinc/98/45/16/566984516.db2.gz QJZNKSHKXZRLOF-YCPHGPKFSA-N 0 1 378.460 3.015 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@@H](CO)Cc1ccc(Br)cc1 ZINC000430140438 566989413 /nfs/dbraw/zinc/98/94/13/566989413.db2.gz UDGAFSVJHOIKPT-AWEZNQCLSA-N 0 1 394.313 3.185 10 0 GGAEMN C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C[C@@H]1C(=O)[O-] ZINC000520229629 566990227 /nfs/dbraw/zinc/99/02/27/566990227.db2.gz ZNKFKUQQEMJORD-KOLCDFICSA-N 0 1 378.778 3.340 10 0 GGAEMN COC(=O)c1cc(F)c(C)c(S(=O)(=O)Nc2cc(F)c(F)c(F)c2)c1 ZINC000471953992 566990993 /nfs/dbraw/zinc/99/09/93/566990993.db2.gz LBYDCQXUXLQRLB-UHFFFAOYSA-N 0 1 377.315 3.139 10 0 GGAEMN CC(C)(CNC(=O)[C@H]1CCc2[nH]cnc2C1)c1ccccc1Br ZINC000612723628 566991329 /nfs/dbraw/zinc/99/13/29/566991329.db2.gz PMOACHJFLBZNDZ-LBPRGKRZSA-N 0 1 376.298 3.371 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)c1conc1C(C)(C)N)CC2 ZINC000583881904 566992893 /nfs/dbraw/zinc/99/28/93/566992893.db2.gz OMWDBQFEIYPIPV-UHFFFAOYSA-N 0 1 378.270 3.138 10 0 GGAEMN CC[C@H](NCC(=O)N1CCOC[C@H]1C1CC1)c1cc(F)cc(Br)c1 ZINC000681596388 566993198 /nfs/dbraw/zinc/99/31/98/566993198.db2.gz KCOZCBSMWOIBQT-IRXDYDNUSA-N 0 1 399.304 3.266 10 0 GGAEMN O=C(Cc1[nH]nc2ccccc21)N[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000633773029 566993807 /nfs/dbraw/zinc/99/38/07/566993807.db2.gz DEVMLWAOSXRURJ-ZNZDAUKMSA-N 0 1 382.261 3.322 10 0 GGAEMN O=C(c1ncccc1O)N1CC2(CCOCC2)c2ccc(Br)cc21 ZINC000633847010 566997438 /nfs/dbraw/zinc/99/74/38/566997438.db2.gz BKBQURXXMJFKIW-UHFFFAOYSA-N 0 1 389.249 3.258 10 0 GGAEMN CCc1[nH]ncc1C(=O)N1CC2(CCOCC2)c2ccc(Br)cc21 ZINC000633847070 566997686 /nfs/dbraw/zinc/99/76/86/566997686.db2.gz CKMHAINOMJJVHD-UHFFFAOYSA-N 0 1 390.281 3.443 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000583963958 566998773 /nfs/dbraw/zinc/99/87/73/566998773.db2.gz LIGGJTRALZIZAQ-UHFFFAOYSA-N 0 1 378.460 3.341 10 0 GGAEMN COc1ccc(Br)c(CN(C)C(=O)c2cnccc2N(C)C)c1 ZINC000430201948 567000375 /nfs/dbraw/zinc/00/03/75/567000375.db2.gz KWHFQZMKFPKIJI-UHFFFAOYSA-N 0 1 378.270 3.191 10 0 GGAEMN C[C@@H](Sc1ccc(Br)cc1)C(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000520372176 567001911 /nfs/dbraw/zinc/00/19/11/567001911.db2.gz DSJICVLFMWKDTM-WBMJQRKESA-N 0 1 383.355 3.482 10 0 GGAEMN COc1cc(Br)ccc1CNCc1ccc(-n2cncn2)c(F)c1 ZINC000681697545 567001967 /nfs/dbraw/zinc/00/19/67/567001967.db2.gz QCKPFNCDRXUFBI-UHFFFAOYSA-N 0 1 391.244 3.467 10 0 GGAEMN C[C@@H](NC[C@@H]1CS(=O)(=O)c2ccccc2O1)c1cccc(Br)c1 ZINC000520406505 567003339 /nfs/dbraw/zinc/00/33/39/567003339.db2.gz JECBWYHEFMSVAW-IUODEOHRSA-N 0 1 396.306 3.335 10 0 GGAEMN O=C(NCc1noc2c1CCCC2)c1n[nH]c2ccc(Br)cc21 ZINC000520449280 567006165 /nfs/dbraw/zinc/00/61/65/567006165.db2.gz BSPTZYWHYFBVEY-UHFFFAOYSA-N 0 1 375.226 3.122 10 0 GGAEMN C[C@H](NC[C@@H]1CS(=O)(=O)c2ccccc21)c1ccc(Br)cn1 ZINC000584035582 567006409 /nfs/dbraw/zinc/00/64/09/567006409.db2.gz LPSGHAWJNQYOHW-NWDGAFQWSA-N 0 1 381.295 3.066 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000520463063 567006659 /nfs/dbraw/zinc/00/66/59/567006659.db2.gz OSHPKCVBMQOCHA-KOMQPUFPSA-N 0 1 378.460 3.213 10 0 GGAEMN C[C@@H](NC[C@@H]1CS(=O)(=O)c2ccccc21)c1ccc(Br)cn1 ZINC000584035584 567006841 /nfs/dbraw/zinc/00/68/41/567006841.db2.gz LPSGHAWJNQYOHW-VXGBXAGGSA-N 0 1 381.295 3.066 10 0 GGAEMN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)cn1 ZINC000564779542 567007453 /nfs/dbraw/zinc/00/74/53/567007453.db2.gz VKQBXUSIOKBYDP-CXAGYDPISA-N 0 1 376.298 3.194 10 0 GGAEMN C[C@H](Cc1cc(Br)ccc1F)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000612987733 567008981 /nfs/dbraw/zinc/00/89/81/567008981.db2.gz NMBKZMAAFIIELW-GHMZBOCLSA-N 0 1 380.261 3.164 10 0 GGAEMN O=C(CCSc1ccccc1Cl)NCc1n[nH]c(C2CCOCC2)n1 ZINC000634009884 567010279 /nfs/dbraw/zinc/01/02/79/567010279.db2.gz WAGYUFYAJBYYFI-UHFFFAOYSA-N 0 1 380.901 3.151 10 0 GGAEMN Cc1ccc(Cl)c(OC[C@H](O)CNCc2cn3cc(Cl)ccc3n2)c1 ZINC000564843824 567012926 /nfs/dbraw/zinc/01/29/26/567012926.db2.gz FIAWKLNBLXVUBZ-OAHLLOKOSA-N 0 1 380.275 3.479 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)N[C@@H](C)c1ccc(Br)cc1 ZINC000494644544 567013244 /nfs/dbraw/zinc/01/32/44/567013244.db2.gz CGOZBANWQCMJML-WFASDCNBSA-N 0 1 397.338 3.319 10 0 GGAEMN CC1(C)Cc2ccc(Cl)c(NS(=O)(=O)c3cn4c(n3)CCCC4)c2O1 ZINC000430379061 567014517 /nfs/dbraw/zinc/01/45/17/567014517.db2.gz ULCSUEHBCGDIHP-UHFFFAOYSA-N 0 1 381.885 3.387 10 0 GGAEMN CCN(C(=O)CN[C@H](CO)c1sccc1C)c1nc2ccccc2s1 ZINC000494651082 567015114 /nfs/dbraw/zinc/01/51/14/567015114.db2.gz AIURRJOHIPWANV-CQSZACIVSA-N 0 1 375.519 3.342 10 0 GGAEMN C[C@H](O)C[C@@H]1CCCCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000584130039 567015999 /nfs/dbraw/zinc/01/59/99/567015999.db2.gz DYKNXCPHBDPMQV-AAEUAGOBSA-N 0 1 380.286 3.481 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)c1cn[nH]c1 ZINC000494706132 567016651 /nfs/dbraw/zinc/01/66/51/567016651.db2.gz DCWLOPQMZCAXTJ-MRVPVSSYSA-N 0 1 391.191 3.480 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1 ZINC000494684730 567016663 /nfs/dbraw/zinc/01/66/63/567016663.db2.gz GAEGLZOXBJFZNU-QGZVFWFLSA-N 0 1 381.563 3.451 10 0 GGAEMN CN1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)C(C)(C)C1 ZINC000613157980 567018398 /nfs/dbraw/zinc/01/83/98/567018398.db2.gz IEIKPDWNGWWZGI-UHFFFAOYSA-N 0 1 380.330 3.216 10 0 GGAEMN CCn1c2ccc(Br)cc2nc1NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613196052 567019543 /nfs/dbraw/zinc/01/95/43/567019543.db2.gz NHQMFYVMDOSQFT-SNVBAGLBSA-N 0 1 388.269 3.285 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(Br)cc(N3CCCC3)c2)[C@@H](C)CN1C ZINC000613190966 567020035 /nfs/dbraw/zinc/02/00/35/567020035.db2.gz KNERVKXKMKVREW-KGLIPLIRSA-N 0 1 380.330 3.214 10 0 GGAEMN CC(C)[C@H]1C[N@@H+](C)CCN1c1ncnc2cccc(I)c21 ZINC000545164032 567023774 /nfs/dbraw/zinc/02/37/74/567023774.db2.gz HFXJGNDSVJZZPK-CQSZACIVSA-N 0 1 396.276 3.011 10 0 GGAEMN COCCOc1c(Cl)cc(NC(=O)[C@H]2CCc3[nH]cnc3C2)cc1Cl ZINC000613246006 567024886 /nfs/dbraw/zinc/02/48/86/567024886.db2.gz DLAAWFIATKPWCF-JTQLQIEISA-N 0 1 384.263 3.485 10 0 GGAEMN CCS(=O)(=O)N1CCC([C@H](C)N(C)Cc2nc(C(C)(C)C)cs2)CC1 ZINC000584255802 567025819 /nfs/dbraw/zinc/02/58/19/567025819.db2.gz XWFQDBOAIAWVFY-AWEZNQCLSA-N 0 1 387.615 3.323 10 0 GGAEMN C[C@H](O)[C@@H](NC[C@H](O)COc1cccc(Br)c1)c1ccccc1F ZINC000564980100 567026209 /nfs/dbraw/zinc/02/62/09/567026209.db2.gz YQJBFHNVENMLJG-XAYKYTGQSA-N 0 1 398.272 3.040 10 0 GGAEMN COc1ccc(Br)cc1CN(C)C(=O)NCCN1CC=C(C)CC1 ZINC000545175770 567026252 /nfs/dbraw/zinc/02/62/52/567026252.db2.gz RFICKULOKXTBBE-UHFFFAOYSA-N 0 1 396.329 3.251 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N(C)Cc2ccc(Br)c(F)c2)n[nH]1 ZINC000494830011 567027018 /nfs/dbraw/zinc/02/70/18/567027018.db2.gz RVOIBEMQJQBFQS-JTQLQIEISA-N 0 1 383.265 3.392 10 0 GGAEMN C[C@@H](NCc1cccs1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430690725 567029310 /nfs/dbraw/zinc/02/93/10/567029310.db2.gz JJEUJBMBCWWFJP-SECBINFHSA-N 0 1 375.313 3.009 10 0 GGAEMN COc1nc(N2CCN([C@H]3CCc4ccccc43)CC2)ncc1Br ZINC000682071742 567029874 /nfs/dbraw/zinc/02/98/74/567029874.db2.gz FUVZIRMIANTKQU-INIZCTEOSA-N 0 1 389.297 3.057 10 0 GGAEMN C[C@H](NCc1cccc(F)c1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430702799 567030407 /nfs/dbraw/zinc/03/04/07/567030407.db2.gz ZYOPPJZIAVYLLB-JTQLQIEISA-N 0 1 387.274 3.086 10 0 GGAEMN C[C@H](CC(F)(F)F)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430742973 567032930 /nfs/dbraw/zinc/03/29/30/567032930.db2.gz QKIBWWDAMREDJL-SFYZADRCSA-N 0 1 389.237 3.088 10 0 GGAEMN O[C@H](CCNCc1c(Br)cncc1Br)C(F)(F)F ZINC000584323526 567033510 /nfs/dbraw/zinc/03/35/10/567033510.db2.gz SKVUKGDCGVKVFG-SECBINFHSA-N 0 1 392.013 3.010 10 0 GGAEMN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H](c2ccncn2)C1 ZINC000613380590 567034741 /nfs/dbraw/zinc/03/47/41/567034741.db2.gz JTRXGTWCMCMSGA-ZFWWWQNUSA-N 0 1 382.291 3.403 10 0 GGAEMN O[C@H](COc1ccc(Cl)c(Cl)c1)CN1CCC[C@@H](c2ccncn2)C1 ZINC000613380938 567035451 /nfs/dbraw/zinc/03/54/51/567035451.db2.gz RCAVZCNJBPMQFQ-KGLIPLIRSA-N 0 1 382.291 3.403 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)N2CCc3c2cccc3Br)n[nH]1 ZINC000521024227 567035838 /nfs/dbraw/zinc/03/58/38/567035838.db2.gz BMNIDEPEWAAPMW-UHFFFAOYSA-N 0 1 378.274 3.137 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](O)[C@@H]2CCCC[C@@H]21 ZINC000634492703 567035990 /nfs/dbraw/zinc/03/59/90/567035990.db2.gz KHIPWHLJWWYEMW-UGFHNGPFSA-N 0 1 378.270 3.091 10 0 GGAEMN CN(C)c1ccnc(NC(=O)[C@@H]2CCO[C@H]2c2cncc(Br)c2)c1 ZINC000613439651 567037405 /nfs/dbraw/zinc/03/74/05/567037405.db2.gz CDSSAAATOBHKTC-ZBFHGGJFSA-N 0 1 391.269 3.021 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CC1 ZINC000430898931 567039257 /nfs/dbraw/zinc/03/92/57/567039257.db2.gz GAAAPWGFHHQKTJ-DOTOQJQBSA-N 0 1 378.314 3.256 10 0 GGAEMN CO[C@H](CSc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCOC1 ZINC000657233020 567039605 /nfs/dbraw/zinc/03/96/05/567039605.db2.gz PRLAXTXKGGODQQ-WCQYABFASA-N 0 1 384.299 3.378 10 0 GGAEMN COc1ccc(CCC(=O)Nc2nc(C3CCC3)n[nH]2)c(Br)c1 ZINC000613495809 567039789 /nfs/dbraw/zinc/03/97/89/567039789.db2.gz NSCPKDGMCQNQDY-UHFFFAOYSA-N 0 1 379.258 3.415 10 0 GGAEMN COc1ccc(CCC(=O)Nc2n[nH]c(C3CCC3)n2)c(Br)c1 ZINC000613495809 567039796 /nfs/dbraw/zinc/03/97/96/567039796.db2.gz NSCPKDGMCQNQDY-UHFFFAOYSA-N 0 1 379.258 3.415 10 0 GGAEMN O=c1n2ccccc2nn1CCN(Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000613496934 567039960 /nfs/dbraw/zinc/03/99/60/567039960.db2.gz YTFVDTDMKAFPDQ-UHFFFAOYSA-N 0 1 377.275 3.467 10 0 GGAEMN NC(=O)[C@H](N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12)c1ccc(F)cc1 ZINC000634577448 567040858 /nfs/dbraw/zinc/04/08/58/567040858.db2.gz MJPLTJPCUQGKGG-YLFCFFPRSA-N 0 1 375.241 3.043 10 0 GGAEMN C[C@@H](C1CC1)n1nccc1NS(=O)(=O)c1cscc1Br ZINC000634656746 567044295 /nfs/dbraw/zinc/04/42/95/567044295.db2.gz DSWZYZMOMVJCSC-QMMMGPOBSA-N 0 1 376.301 3.479 10 0 GGAEMN O=C(c1ccccc1)N1CCC(NCc2c(F)cncc2Br)CC1 ZINC000657297558 567045271 /nfs/dbraw/zinc/04/52/71/567045271.db2.gz ODVPZAVEOWWNQP-UHFFFAOYSA-N 0 1 392.272 3.378 10 0 GGAEMN Cc1cc2c[nH]nc2c(C(=O)N(CCO)Cc2cc(Br)cs2)c1 ZINC000521158556 567045491 /nfs/dbraw/zinc/04/54/91/567045491.db2.gz KUKQSIRLOYXXKL-UHFFFAOYSA-N 0 1 394.294 3.330 10 0 GGAEMN CCc1nn(C)cc1NS(=O)(=O)c1cc(Br)cc2cccnc21 ZINC000584491506 567047317 /nfs/dbraw/zinc/04/73/17/567047317.db2.gz OCEUOZZROVXOKO-UHFFFAOYSA-N 0 1 395.282 3.094 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1 ZINC000545418677 567048147 /nfs/dbraw/zinc/04/81/47/567048147.db2.gz PAZJVABHDYDUOZ-LBPRGKRZSA-N 0 1 379.291 3.463 10 0 GGAEMN CCC[C@@H]1CN(C(=O)Cc2cscc2Br)CCN1CCOC ZINC000495132387 567048177 /nfs/dbraw/zinc/04/81/77/567048177.db2.gz WDHYEJBCIUYNKX-CQSZACIVSA-N 0 1 389.359 3.012 10 0 GGAEMN O=S(=O)(Nc1ccnn1CC1CCC1)c1cc(F)ccc1OC(F)F ZINC000634664064 567049830 /nfs/dbraw/zinc/04/98/30/567049830.db2.gz MNJYUFPYKIANGS-UHFFFAOYSA-N 0 1 375.372 3.225 10 0 GGAEMN Brc1ccccc1N1CC[C@@H](NCc2cn(C3CCC3)nn2)C1 ZINC000657356753 567051000 /nfs/dbraw/zinc/05/10/00/567051000.db2.gz NNPXWNFOPRWAPL-CYBMUJFWSA-N 0 1 376.302 3.134 10 0 GGAEMN O=C(NCCCNCc1c(F)cncc1Br)c1ccc(F)cc1 ZINC000657357210 567051071 /nfs/dbraw/zinc/05/10/71/567051071.db2.gz ZEGAUFMUNQRKEP-UHFFFAOYSA-N 0 1 384.224 3.032 10 0 GGAEMN CCCn1nccc1CNCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000657390462 567053145 /nfs/dbraw/zinc/05/31/45/567053145.db2.gz YDQJSEDFTOJASU-UHFFFAOYSA-N 0 1 375.274 3.131 10 0 GGAEMN CCCn1nccc1CNCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000657390462 567053149 /nfs/dbraw/zinc/05/31/49/567053149.db2.gz YDQJSEDFTOJASU-UHFFFAOYSA-N 0 1 375.274 3.131 10 0 GGAEMN Fc1cncc(Br)c1CNCCCc1ccc2c(c1)OCCO2 ZINC000657393728 567053374 /nfs/dbraw/zinc/05/33/74/567053374.db2.gz FPBRYFOMHOWXIN-UHFFFAOYSA-N 0 1 381.245 3.477 10 0 GGAEMN O=C1C[C@@H](CNCc2c(F)cncc2Br)CN1Cc1ccccc1 ZINC000657419271 567053775 /nfs/dbraw/zinc/05/37/75/567053775.db2.gz LRACVJIUQZKHRR-AWEZNQCLSA-N 0 1 392.272 3.122 10 0 GGAEMN OC[C@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Br)c1 ZINC000657398708 567054839 /nfs/dbraw/zinc/05/48/39/567054839.db2.gz FOJUKCNUQSMHQM-OALUTQOASA-N 0 1 392.293 3.440 10 0 GGAEMN CN(C)Cc1cc(-c2noc(-c3c(Br)cnn3C)n2)ccc1F ZINC000453114202 567054908 /nfs/dbraw/zinc/05/49/08/567054908.db2.gz SPCUHQZKYWALMI-UHFFFAOYSA-N 0 1 380.221 3.100 10 0 GGAEMN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NC[C@@H]1CCCCN1CCO ZINC000584571793 567056481 /nfs/dbraw/zinc/05/64/81/567056481.db2.gz XHFIWTQNFSHWQC-LBPRGKRZSA-N 0 1 399.969 3.410 10 0 GGAEMN Cc1c(Br)cncc1CN[C@@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000657449053 567058079 /nfs/dbraw/zinc/05/80/79/567058079.db2.gz YGUAVVAXAFGTIC-QGZVFWFLSA-N 0 1 392.272 3.182 10 0 GGAEMN COc1cc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)cc(OC)c1C ZINC000431146470 567059524 /nfs/dbraw/zinc/05/95/24/567059524.db2.gz PGPVYHKOYKOHIW-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNCCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000657476725 567060369 /nfs/dbraw/zinc/06/03/69/567060369.db2.gz SMHMUYZDOOJPNV-UHFFFAOYSA-N 0 1 395.834 3.046 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@@H](c2cccc(F)c2)N(C)C)c1Br ZINC000584700189 567061441 /nfs/dbraw/zinc/06/14/41/567061441.db2.gz QJWFTGGPBNHOPD-HNNXBMFYSA-N 0 1 395.276 3.138 10 0 GGAEMN C[C@@H](NCc1cnn2c1CCC2)c1ccc(Br)cc1OCCCO ZINC000657472206 567061497 /nfs/dbraw/zinc/06/14/97/567061497.db2.gz JEVDLFDNSUAORR-CYBMUJFWSA-N 0 1 394.313 3.204 10 0 GGAEMN CCOC(=O)c1nn(C)cc1CNCCc1nc2cc(Cl)ccc2s1 ZINC000473125137 567064165 /nfs/dbraw/zinc/06/41/65/567064165.db2.gz FIZGOCYOOWKTTJ-UHFFFAOYSA-N 0 1 378.885 3.192 10 0 GGAEMN CC(C)(C)CCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000521543904 567065125 /nfs/dbraw/zinc/06/51/25/567065125.db2.gz BGKLSKVKCWSFTQ-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN CC(C)(C)CCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000521543904 567065133 /nfs/dbraw/zinc/06/51/33/567065133.db2.gz BGKLSKVKCWSFTQ-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN C[C@@H]1CCN(CC(=O)Nc2ccc(CCn3cc(Br)cn3)cc2)C1 ZINC000584731006 567065799 /nfs/dbraw/zinc/06/57/99/567065799.db2.gz VUTZXSJFKGFEON-CQSZACIVSA-N 0 1 391.313 3.169 10 0 GGAEMN CN1CCC[C@H](NC(=O)N(Cc2cccc(Br)c2)CC2CC2)C1 ZINC000682702225 567067353 /nfs/dbraw/zinc/06/73/53/567067353.db2.gz FUACZGHEAMFRGO-KRWDZBQOSA-N 0 1 380.330 3.465 10 0 GGAEMN CO[C@@H](CCNCc1cn(-c2ccccc2Br)nn1)C(F)(F)F ZINC000565449964 567069218 /nfs/dbraw/zinc/06/92/18/567069218.db2.gz JAORLBRJJZNFAO-ZDUSSCGKSA-N 0 1 393.207 3.087 10 0 GGAEMN O=C(NCc1cc(Cl)ccc1Br)N[C@@H]1CCc2nc[nH]c2C1 ZINC000521617320 567069148 /nfs/dbraw/zinc/06/91/48/567069148.db2.gz BBCMFQXFLITZDC-LLVKDONJSA-N 0 1 383.677 3.182 10 0 GGAEMN CNC(=O)[C@@H](CNCc1ncc(CSC)s1)Cc1ccc(F)cc1C ZINC000521624579 567070439 /nfs/dbraw/zinc/07/04/39/567070439.db2.gz DKFTXVQKENJJPR-CQSZACIVSA-N 0 1 381.542 3.148 10 0 GGAEMN COC[C@@H](NCc1cn(-c2ccc(Cl)cc2Cl)nn1)C1CCOCC1 ZINC000657564775 567070567 /nfs/dbraw/zinc/07/05/67/567070567.db2.gz AEJVWLNWNXMCIE-MRXNPFEDSA-N 0 1 385.295 3.105 10 0 GGAEMN CC[C@@H](CNS(C)(=O)=O)N[C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000453272578 567071157 /nfs/dbraw/zinc/07/11/57/567071157.db2.gz BAEDRLUNUQOEDN-GWCFXTLKSA-N 0 1 389.315 3.174 10 0 GGAEMN CN(C)C[C@H](Cc1ccccc1)NS(=O)(=O)Cc1cc(Cl)ccc1F ZINC000431294096 567072029 /nfs/dbraw/zinc/07/20/29/567072029.db2.gz YGWWZJSDEUGALN-KRWDZBQOSA-N 0 1 384.904 3.071 10 0 GGAEMN COc1ccc(CN[C@@H]2Cc3ccccc3N(C)C2=O)cc1Br ZINC000657573564 567072609 /nfs/dbraw/zinc/07/26/09/567072609.db2.gz DYHJSPMKLQQMAK-OAHLLOKOSA-N 0 1 375.266 3.135 10 0 GGAEMN Cc1cc(Br)cn2c(CN[C@H]3Cc4ccccc4N(C)C3=O)cnc12 ZINC000657574812 567072845 /nfs/dbraw/zinc/07/28/45/567072845.db2.gz OARFDOKZXZZBFX-INIZCTEOSA-N 0 1 399.292 3.083 10 0 GGAEMN COCc1nc(CNCc2ccc(-c3cccc(Br)c3)o2)n[nH]1 ZINC000657607068 567074973 /nfs/dbraw/zinc/07/49/73/567074973.db2.gz AJPMWRQDDIJPJY-UHFFFAOYSA-N 0 1 377.242 3.263 10 0 GGAEMN COCc1nc(CNCc2ccc(Br)cc2C(F)(F)F)n[nH]1 ZINC000657608973 567075533 /nfs/dbraw/zinc/07/55/33/567075533.db2.gz GXEAJXFIGUSFFK-UHFFFAOYSA-N 0 1 379.180 3.022 10 0 GGAEMN Cc1ccc(C(=O)NC[C@H]2CN(CC(C)C)CCO2)c(C)c1Br ZINC000682854141 567076288 /nfs/dbraw/zinc/07/62/88/567076288.db2.gz SGPDBCZWEQYPRC-HNNXBMFYSA-N 0 1 383.330 3.153 10 0 GGAEMN CCCOc1c(Cl)cc(CN[C@H]2CC[C@H](C)S(=O)(=O)C2)cc1OC ZINC000657634600 567078461 /nfs/dbraw/zinc/07/84/61/567078461.db2.gz JIHDGNGVWBBGLZ-JSGCOSHPSA-N 0 1 375.918 3.193 10 0 GGAEMN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN[C@@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657639659 567078482 /nfs/dbraw/zinc/07/84/82/567078482.db2.gz SZIUZAMYRULXBY-BLLLJJGKSA-N 0 1 381.929 3.198 10 0 GGAEMN CSc1cc(Br)ccc1CN[C@@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657639184 567079106 /nfs/dbraw/zinc/07/91/06/567079106.db2.gz QQQGTDONIXSNSJ-ZWNOBZJWSA-N 0 1 378.357 3.226 10 0 GGAEMN C[C@@H]1CC[C@H](NCC2=Cc3cc(Cl)cc(Cl)c3OC2)CS1(=O)=O ZINC000657640068 567080734 /nfs/dbraw/zinc/08/07/34/567080734.db2.gz WXMAUPAYWPWEAR-YGRLFVJLSA-N 0 1 376.305 3.325 10 0 GGAEMN Ic1cccc2ncnc(N[C@H]3CCCc4cn[nH]c43)c12 ZINC000545875729 567083397 /nfs/dbraw/zinc/08/33/97/567083397.db2.gz XZZCRIGVZJIJLQ-LBPRGKRZSA-N 0 1 391.216 3.447 10 0 GGAEMN C[C@H](NCc1nn(C)cc1I)[C@@H]1C[C@H]1c1ccccc1 ZINC000453379791 567083912 /nfs/dbraw/zinc/08/39/12/567083912.db2.gz QZVKKRCRGNTBIZ-UBHSHLNASA-N 0 1 381.261 3.307 10 0 GGAEMN Ic1cccc(CNc2cnn(-c3ccncc3)c2)c1 ZINC000585741938 567085528 /nfs/dbraw/zinc/08/55/28/567085528.db2.gz CAJUPBQXKQSKNK-UHFFFAOYSA-N 0 1 376.201 3.484 10 0 GGAEMN CC(C)(C)n1nnnc1CSc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000545914147 567087049 /nfs/dbraw/zinc/08/70/49/567087049.db2.gz ZWFQKKGHNQGWKH-UHFFFAOYSA-N 0 1 394.302 3.268 10 0 GGAEMN C[C@@H](c1ccccc1Br)N(C)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000521947944 567088621 /nfs/dbraw/zinc/08/86/21/567088621.db2.gz OHFFWKUKOZFUAG-NWDGAFQWSA-N 0 1 377.286 3.432 10 0 GGAEMN O=C(N[C@H]1CSc2ccc(Br)cc21)[C@H]1CCc2[nH]cnc2C1 ZINC000614150837 567090129 /nfs/dbraw/zinc/09/01/29/567090129.db2.gz SQNYUGQXMDJDMJ-XPTSAGLGSA-N 0 1 378.295 3.240 10 0 GGAEMN O=C1CO[C@H]2CCN(Cc3ccc(-c4ccc(Cl)c(Cl)c4)o3)C[C@@H]2N1 ZINC000453572744 567092321 /nfs/dbraw/zinc/09/23/21/567092321.db2.gz HPPKZMOZJCVMHW-RDJZCZTQSA-N 0 1 381.259 3.343 10 0 GGAEMN CCc1n[nH]c(C2CCN(Cc3cn4cc(Br)ccc4n3)CC2)n1 ZINC000683039420 567092707 /nfs/dbraw/zinc/09/27/07/567092707.db2.gz OEBGVSRUISHFTI-UHFFFAOYSA-N 0 1 389.301 3.157 10 0 GGAEMN CC(C)[C@@]1(C(=O)[O-])CC[N@@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000565722109 567092950 /nfs/dbraw/zinc/09/29/50/567092950.db2.gz GVBXMUQSHQLGJF-SJKOYZFVSA-N 0 1 376.280 3.166 10 0 GGAEMN Fc1cccc(Br)c1CN[C@@H]1C[C@@H](N2CCOCC2)C12CCC2 ZINC000657747836 567093114 /nfs/dbraw/zinc/09/31/14/567093114.db2.gz RVZMZMRUMPXARY-IAGOWNOFSA-N 0 1 383.305 3.321 10 0 GGAEMN CCS(=O)(=O)C1(CNCc2cccc(Br)c2OC(F)F)CC1 ZINC000657758578 567093701 /nfs/dbraw/zinc/09/37/01/567093701.db2.gz FOSDGXGJXJKAOC-UHFFFAOYSA-N 0 1 398.269 3.107 10 0 GGAEMN Cc1nccc(NCc2c[nH]nc2-c2ccc3c(c2)OCO3)c1Br ZINC000683071410 567094712 /nfs/dbraw/zinc/09/47/12/567094712.db2.gz WIXMSMBVABVJAU-UHFFFAOYSA-N 0 1 387.237 3.305 10 0 GGAEMN Brc1scnc1-c1nc(Cc2nnc(-c3ccccc3)[nH]2)no1 ZINC000565741340 567094705 /nfs/dbraw/zinc/09/47/05/567094705.db2.gz LJHOLJBULYTZHG-UHFFFAOYSA-N 0 1 389.238 3.332 10 0 GGAEMN Cn1ncc(Br)c1CN[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1 ZINC000657799916 567096863 /nfs/dbraw/zinc/09/68/63/567096863.db2.gz BGPYYKRPWGXRLJ-HZPDHXFCSA-N 0 1 391.313 3.013 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)N2CCC[N@H+](C(C)(C)C)CC2)s[n-]1 ZINC000546037794 567097316 /nfs/dbraw/zinc/09/73/16/567097316.db2.gz YQYSDFKVLHIXRG-UHFFFAOYSA-N 0 1 379.555 3.335 10 0 GGAEMN C[C@@H](O)[C@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccccc1 ZINC000657819953 567097684 /nfs/dbraw/zinc/09/76/84/567097684.db2.gz VBMWQAVHGHHVAF-PXAZEXFGSA-N 0 1 378.266 3.432 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)[C@@H](C)C1 ZINC000497479572 567099481 /nfs/dbraw/zinc/09/94/81/567099481.db2.gz QIIUPLHHBREGNV-MQIPJXDCSA-N 0 1 386.323 3.077 10 0 GGAEMN O=C(NC1(c2cccc(Br)c2)CCOCC1)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635443126 567100241 /nfs/dbraw/zinc/10/02/41/567100241.db2.gz DZTWMNXQAZQBHM-HUUCEWRRSA-N 0 1 390.281 3.098 10 0 GGAEMN COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)N[C@@H]1CCCN(C)C1 ZINC000586853205 567100784 /nfs/dbraw/zinc/10/07/84/567100784.db2.gz UEPMHZYPXUUCFQ-ZBFHGGJFSA-N 0 1 396.329 3.398 10 0 GGAEMN CCCc1cc(C(=O)N(CCOC)Cc2ccc(Br)s2)n[nH]1 ZINC000683183082 567102435 /nfs/dbraw/zinc/10/24/35/567102435.db2.gz VESQDQXPWJUQEN-UHFFFAOYSA-N 0 1 386.315 3.475 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)s[n-]1 ZINC000473827418 567105026 /nfs/dbraw/zinc/10/50/26/567105026.db2.gz HUJPUPYGHVBRMJ-DGCLKSJQSA-N 0 1 379.555 3.239 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)s[n-]1 ZINC000473824028 567105238 /nfs/dbraw/zinc/10/52/38/567105238.db2.gz NPVXYNJPQHWGTH-ZDUSSCGKSA-N 0 1 379.555 3.096 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC[C@@H](N3CCOCC3)CC2)c(Br)c1 ZINC000614431795 567110489 /nfs/dbraw/zinc/11/04/89/567110489.db2.gz FZGXMDRIJHHHFR-QGZVFWFLSA-N 0 1 395.341 3.013 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1ccc(-n2cc(Br)cn2)cc1 ZINC000546159619 567110686 /nfs/dbraw/zinc/11/06/86/567110686.db2.gz ZGUBKUGQCXTFGC-UHFFFAOYSA-N 0 1 387.241 3.273 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1ccc(-n2cc(Br)cn2)cc1 ZINC000546159619 567110689 /nfs/dbraw/zinc/11/06/89/567110689.db2.gz ZGUBKUGQCXTFGC-UHFFFAOYSA-N 0 1 387.241 3.273 10 0 GGAEMN CN(C)[C@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccc(Cl)cc1 ZINC000565926144 567111301 /nfs/dbraw/zinc/11/13/01/567111301.db2.gz RAFIHVINOQLOKU-CYBMUJFWSA-N 0 1 398.688 3.236 10 0 GGAEMN COC(=O)c1c(C)oc(C)c1S(=O)(=O)NC1(C(F)(F)F)CCCCC1 ZINC000546177642 567112826 /nfs/dbraw/zinc/11/28/26/567112826.db2.gz QTPFTBMNCLEFOO-UHFFFAOYSA-N 0 1 383.388 3.227 10 0 GGAEMN O=C(c1c(Cl)cc(F)cc1Cl)N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000683311675 567114043 /nfs/dbraw/zinc/11/40/43/567114043.db2.gz YZIQQINOLONQON-ZDUSSCGKSA-N 0 1 375.271 3.459 10 0 GGAEMN C[C@@H](NC[C@H]1CC[N@H+]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060170 567118973 /nfs/dbraw/zinc/11/89/73/567118973.db2.gz KGVZBSUNOKEYBM-GHMZBOCLSA-N 0 1 394.368 3.164 10 0 GGAEMN O=C1NCC[C@@H]1N[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000658056820 567119164 /nfs/dbraw/zinc/11/91/64/567119164.db2.gz ZPEBDQKZDDCNJS-OCCSQVGLSA-N 0 1 392.322 3.428 10 0 GGAEMN O=C1NCC[C@@H]1N[C@@H]1CCCc2c(Br)cc(Br)cc21 ZINC000658053365 567119414 /nfs/dbraw/zinc/11/94/14/567119414.db2.gz WTNTYCFHVXZIFW-OLZOCXBDSA-N 0 1 388.103 3.067 10 0 GGAEMN Cc1c([C@H](C)N[C@@H](CO)C2CCC2)nnn1-c1cccc(Br)c1 ZINC000658086717 567120275 /nfs/dbraw/zinc/12/02/75/567120275.db2.gz FAPAUUYVCHGNNX-ZBEGNZNMSA-N 0 1 379.302 3.150 10 0 GGAEMN C[C@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc(Br)cc2O)C1 ZINC000431992417 567121482 /nfs/dbraw/zinc/12/14/82/567121482.db2.gz NQXGNSQQZFNROU-AWEZNQCLSA-N 0 1 383.330 3.326 10 0 GGAEMN C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cc2ccc(Br)cc2O)C1 ZINC000431992418 567121853 /nfs/dbraw/zinc/12/18/53/567121853.db2.gz NQXGNSQQZFNROU-CQSZACIVSA-N 0 1 383.330 3.326 10 0 GGAEMN O=C(NCc1c(F)c(F)c(Br)c(F)c1F)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000636057274 567123419 /nfs/dbraw/zinc/12/34/19/567123419.db2.gz AEVAIADWGNDOSH-PHDIDXHHSA-N 0 1 392.150 3.149 10 0 GGAEMN CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CCCN(CCOC)CC1 ZINC000522668621 567124345 /nfs/dbraw/zinc/12/43/45/567124345.db2.gz KCPLWGBQZDQEQB-KRWDZBQOSA-N 0 1 397.357 3.199 10 0 GGAEMN CCOC(=O)c1csc(CCNCc2nc3ccc(OC)cc3s2)n1 ZINC000474000797 567124750 /nfs/dbraw/zinc/12/47/50/567124750.db2.gz KRLPESDHPFCSRX-UHFFFAOYSA-N 0 1 377.491 3.270 10 0 GGAEMN CC[C@H](Cc1cccc(Br)c1)C(=O)N1CCCN(CCOC)CC1 ZINC000522668622 567125123 /nfs/dbraw/zinc/12/51/23/567125123.db2.gz KCPLWGBQZDQEQB-QGZVFWFLSA-N 0 1 397.357 3.199 10 0 GGAEMN Cn1ccnc1CN1CCN(CC/C=C\c2ccc(Br)cc2)CC1 ZINC000522713814 567126552 /nfs/dbraw/zinc/12/65/52/567126552.db2.gz RXSDFMRNQSQOBH-RQOWECAXSA-N 0 1 389.341 3.404 10 0 GGAEMN COCc1n[nH]c(CN[C@@H]2CCCc3c4cc(Br)ccc4[nH]c32)n1 ZINC000658157994 567126829 /nfs/dbraw/zinc/12/68/29/567126829.db2.gz WTIDKEOKJFAAEX-CQSZACIVSA-N 0 1 390.285 3.362 10 0 GGAEMN CN(CCOC(C)(C)C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000683494924 567127575 /nfs/dbraw/zinc/12/75/75/567127575.db2.gz IRQDAJARFXTBOC-UHFFFAOYSA-N 0 1 381.270 3.178 10 0 GGAEMN COCCN(C(=O)c1c[nH]c2ccc(Br)cc2c1=O)C1CCCC1 ZINC000683470769 567128423 /nfs/dbraw/zinc/12/84/23/567128423.db2.gz VMPJAEVRGJLZAZ-UHFFFAOYSA-N 0 1 393.281 3.322 10 0 GGAEMN C[C@@H](NC[C@H]1CCC[C@@H](C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658216150 567129354 /nfs/dbraw/zinc/12/93/54/567129354.db2.gz PRJMEEQAUZMCHE-GMTAPVOTSA-N 0 1 381.325 3.249 10 0 GGAEMN COc1c(F)cc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cc1F ZINC000588626745 567130297 /nfs/dbraw/zinc/13/02/97/567130297.db2.gz NRLFOBLJARLLOK-UHFFFAOYSA-N 0 1 391.779 3.199 10 0 GGAEMN C[C@@H]1CCC[C@H](CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)O1 ZINC000658216138 567130245 /nfs/dbraw/zinc/13/02/45/567130245.db2.gz PLZUWCVJOQSHRX-KYOSRNDESA-N 0 1 388.327 3.215 10 0 GGAEMN CCc1ncc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)s1 ZINC000588651344 567132357 /nfs/dbraw/zinc/13/23/57/567132357.db2.gz CAGBKXJGWCHLBC-UHFFFAOYSA-N 0 1 392.282 3.183 10 0 GGAEMN CCc1ncc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)s1 ZINC000588651344 567132362 /nfs/dbraw/zinc/13/23/62/567132362.db2.gz CAGBKXJGWCHLBC-UHFFFAOYSA-N 0 1 392.282 3.183 10 0 GGAEMN C[C@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1ncc(Br)s1 ZINC000658290660 567133181 /nfs/dbraw/zinc/13/31/81/567133181.db2.gz HSQSJIAZGMNOSE-YNEHKIRRSA-N 0 1 386.359 3.200 10 0 GGAEMN C[C@@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1ncc(Br)s1 ZINC000658290657 567134020 /nfs/dbraw/zinc/13/40/20/567134020.db2.gz HSQSJIAZGMNOSE-JHJVBQTASA-N 0 1 386.359 3.200 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2cc(F)ccc2Br)[nH]n1 ZINC000432144647 567134105 /nfs/dbraw/zinc/13/41/05/567134105.db2.gz JJGSUNLKLVAOFI-UHFFFAOYSA-N 0 1 393.260 3.085 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@H](C)c2ccc(OC)c(Br)c2)CC1 ZINC000658301945 567134548 /nfs/dbraw/zinc/13/45/48/567134548.db2.gz NKDQWXNUZOIYQJ-LLVKDONJSA-N 0 1 376.316 3.076 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@H]2CCCOc3c(Br)cccc32)CC1 ZINC000658299250 567134561 /nfs/dbraw/zinc/13/45/61/567134561.db2.gz NTTAXGRZHPBRDP-AWEZNQCLSA-N 0 1 388.327 3.220 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@@H](C)[C@H](C)O1 ZINC000474110213 567135470 /nfs/dbraw/zinc/13/54/70/567135470.db2.gz NNQJFMVZQHNUDG-WOPDTQHZSA-N 0 1 378.270 3.477 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@H](C)[C@@H](C)O1 ZINC000474110211 567135656 /nfs/dbraw/zinc/13/56/56/567135656.db2.gz NNQJFMVZQHNUDG-IJLUTSLNSA-N 0 1 378.270 3.477 10 0 GGAEMN C[C@H](Sc1ccc(Br)cc1)C(=O)NC1(c2nn[n-]n2)CCCC1 ZINC000522931633 567137066 /nfs/dbraw/zinc/13/70/66/567137066.db2.gz WVESDDSXZZJYRJ-JTQLQIEISA-N 0 1 396.314 3.029 10 0 GGAEMN C[C@H](Sc1ccc(Br)cc1)C(=O)NC1(c2nn[nH]n2)CCCC1 ZINC000522931633 567137074 /nfs/dbraw/zinc/13/70/74/567137074.db2.gz WVESDDSXZZJYRJ-JTQLQIEISA-N 0 1 396.314 3.029 10 0 GGAEMN O=C(COc1cc(Cl)c(Cl)cc1Cl)NC1(c2nn[n-]n2)CCCC1 ZINC000522927831 567137277 /nfs/dbraw/zinc/13/72/77/567137277.db2.gz FMYRGOHNFLLHOD-UHFFFAOYSA-N 0 1 390.658 3.124 10 0 GGAEMN O=C(COc1cc(Cl)c(Cl)cc1Cl)NC1(c2nn[nH]n2)CCCC1 ZINC000522927831 567137283 /nfs/dbraw/zinc/13/72/83/567137283.db2.gz FMYRGOHNFLLHOD-UHFFFAOYSA-N 0 1 390.658 3.124 10 0 GGAEMN C[C@H]1CC[N@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@@H]1C(=O)[O-] ZINC000566221320 567138613 /nfs/dbraw/zinc/13/86/13/567138613.db2.gz NOQLYWALGMBXDR-ONGXEEELSA-N 0 1 389.677 3.084 10 0 GGAEMN C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@@H]1C(=O)[O-] ZINC000566221320 567138616 /nfs/dbraw/zinc/13/86/16/567138616.db2.gz NOQLYWALGMBXDR-ONGXEEELSA-N 0 1 389.677 3.084 10 0 GGAEMN O=C(NCc1nc2ccc(Cl)cc2[nH]1)c1cc[nH]c(=O)c1Br ZINC000683620460 567139059 /nfs/dbraw/zinc/13/90/59/567139059.db2.gz OMLJGQZNJGAMOR-UHFFFAOYSA-N 0 1 381.617 3.009 10 0 GGAEMN COc1ccc(Br)c(OC[C@H](O)CN2CCc3ccccc3C2)c1 ZINC000432255766 567141502 /nfs/dbraw/zinc/14/15/02/567141502.db2.gz QSWLFZPRMWZSNB-MRXNPFEDSA-N 0 1 392.293 3.256 10 0 GGAEMN COC(=O)Cc1ccc(NS(=O)(=O)c2cc(C)ccc2Br)cc1 ZINC000498034100 567145639 /nfs/dbraw/zinc/14/56/39/567145639.db2.gz QNGSUXFOWZITAT-UHFFFAOYSA-N 0 1 398.278 3.274 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cscc1Br ZINC000566359729 567151718 /nfs/dbraw/zinc/15/17/18/567151718.db2.gz LYFILXVUZKEQRW-UHFFFAOYSA-N 0 1 377.267 3.268 10 0 GGAEMN OC[C@@H]1c2ccccc2CC[N@@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000474264956 567151936 /nfs/dbraw/zinc/15/19/36/567151936.db2.gz GZSUAOLLXOZGLI-KBXCAEBGSA-N 0 1 382.287 3.325 10 0 GGAEMN OC[C@@H]1c2ccccc2CCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000474264956 567151941 /nfs/dbraw/zinc/15/19/41/567151941.db2.gz GZSUAOLLXOZGLI-KBXCAEBGSA-N 0 1 382.287 3.325 10 0 GGAEMN CN(Cc1c(F)ccc(I)c1F)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000474264486 567152268 /nfs/dbraw/zinc/15/22/68/567152268.db2.gz HVZPKECDIPACJB-LLVKDONJSA-N 0 1 392.231 3.238 10 0 GGAEMN OC[C@H]1c2ccccc2CC[N@@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000474264959 567152581 /nfs/dbraw/zinc/15/25/81/567152581.db2.gz GZSUAOLLXOZGLI-KSSFIOAISA-N 0 1 382.287 3.325 10 0 GGAEMN OC[C@H]1c2ccccc2CCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000474264959 567152587 /nfs/dbraw/zinc/15/25/87/567152587.db2.gz GZSUAOLLXOZGLI-KSSFIOAISA-N 0 1 382.287 3.325 10 0 GGAEMN Cc1ccc(C(=O)N2CCN(C3CCOCC3)C[C@H]2C)c(C)c1Br ZINC000683766179 567153581 /nfs/dbraw/zinc/15/35/81/567153581.db2.gz BJJSVCPQAKSCQH-CQSZACIVSA-N 0 1 395.341 3.391 10 0 GGAEMN O=C(Cc1ccc(F)c(Br)c1)Nc1cnn(-c2ccncc2)c1 ZINC000589076431 567155472 /nfs/dbraw/zinc/15/54/72/567155472.db2.gz FAOMXUKXHULPCW-UHFFFAOYSA-N 0 1 375.201 3.350 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC(N3CCOC[C@H]3C)CC2)c(Br)c1 ZINC000615083547 567156895 /nfs/dbraw/zinc/15/68/95/567156895.db2.gz IZMADPCTNACJTM-OAHLLOKOSA-N 0 1 395.341 3.012 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)N1CC[C@@H](Oc2cncc(Br)c2)C1 ZINC000615125957 567160778 /nfs/dbraw/zinc/16/07/78/567160778.db2.gz DMEGJXUJVSJFEY-CYBMUJFWSA-N 0 1 393.285 3.293 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1[nH]nc2c1CCCCC2 ZINC000474352320 567162513 /nfs/dbraw/zinc/16/25/13/567162513.db2.gz MBPJLEKZYNQMIH-UHFFFAOYSA-N 0 1 378.270 3.380 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cnccc1N(C)C ZINC000546830443 567163755 /nfs/dbraw/zinc/16/37/55/567163755.db2.gz JVOMYMZKDPUABA-NSHDSACASA-N 0 1 380.261 3.410 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c(Cl)c1 ZINC000432489786 567164544 /nfs/dbraw/zinc/16/45/44/567164544.db2.gz ADPFFXQOMYMSJQ-UHFFFAOYSA-N 0 1 382.869 3.335 10 0 GGAEMN O=C(NCc1c[nH]nn1)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 ZINC000683964440 567165433 /nfs/dbraw/zinc/16/54/33/567165433.db2.gz GMEUUBKIUJWREC-UHFFFAOYSA-N 0 1 380.195 3.016 10 0 GGAEMN CCn1cc(CN(C)CCCOc2cccc(I)c2)cn1 ZINC000523671146 567165944 /nfs/dbraw/zinc/16/59/44/567165944.db2.gz FGPJPHWWOVSDQN-UHFFFAOYSA-N 0 1 399.276 3.409 10 0 GGAEMN O=C(N[C@H]1CCCN(c2ccccc2)C1=O)c1cccc(Br)c1O ZINC000523702283 567167787 /nfs/dbraw/zinc/16/77/87/567167787.db2.gz QSUBACSFUKILSV-HNNXBMFYSA-N 0 1 389.249 3.080 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1C[C@H](OC)C[C@@H]1CC(=O)[O-] ZINC000566566415 567168378 /nfs/dbraw/zinc/16/83/78/567168378.db2.gz IKWGZXCEUVCBLD-HUUCEWRRSA-N 0 1 386.286 3.302 10 0 GGAEMN O=S(=O)(N[C@]1(C(F)(F)F)CCc2ccccc21)c1cncc(Cl)c1 ZINC000546878912 567168512 /nfs/dbraw/zinc/16/85/12/567168512.db2.gz OLHGQIRKQMCZQY-CQSZACIVSA-N 0 1 376.787 3.417 10 0 GGAEMN COc1ccsc1S(=O)(=O)N[C@]1(C(F)(F)F)CCc2ccccc21 ZINC000546879985 567168790 /nfs/dbraw/zinc/16/87/90/567168790.db2.gz QNFGARBWJIZJSX-CQSZACIVSA-N 0 1 377.409 3.439 10 0 GGAEMN Cc1c(Br)ccc(C(=O)N2CCCN(C[C@@H]3CCCO3)CC2)c1F ZINC000684045908 567173057 /nfs/dbraw/zinc/17/30/57/567173057.db2.gz ARISBTVUYSIVJG-AWEZNQCLSA-N 0 1 399.304 3.224 10 0 GGAEMN CN1CC[C@@H](NC(=O)c2cn3ccc(Br)cc3n2)[C@H]1c1ccccc1 ZINC000566635554 567174424 /nfs/dbraw/zinc/17/44/24/567174424.db2.gz GREPLGCNHIULDW-CRAIPNDOSA-N 0 1 399.292 3.272 10 0 GGAEMN C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277547 567175924 /nfs/dbraw/zinc/17/59/24/567175924.db2.gz WLSULDHXXSAZRS-MJSCVDMRSA-N 0 1 383.319 3.419 10 0 GGAEMN Cc1cc(C2CCN(S(=O)(=O)c3ccc4nc(C)sc4c3)CC2)n[nH]1 ZINC000566654866 567176583 /nfs/dbraw/zinc/17/65/83/567176583.db2.gz FDGNXQNDZRVICZ-UHFFFAOYSA-N 0 1 376.507 3.205 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3ccncc3Br)cccc21 ZINC000684089765 567176468 /nfs/dbraw/zinc/17/64/68/567176468.db2.gz RCDHRHZTRDOJPE-OAHLLOKOSA-N 0 1 376.254 3.482 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)CCn3cc(Br)cn3)cccc21 ZINC000684089363 567177105 /nfs/dbraw/zinc/17/71/05/567177105.db2.gz MZLYVDDBRJMDPU-OAHLLOKOSA-N 0 1 393.285 3.060 10 0 GGAEMN Cc1nc(CS(=O)(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)cs1 ZINC000684101322 567178061 /nfs/dbraw/zinc/17/80/61/567178061.db2.gz ZYOSIKWHIIIDOD-CJNGLKHVSA-N 0 1 385.580 3.016 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)Nc1cnn(CC(F)F)c1 ZINC000523958185 567178125 /nfs/dbraw/zinc/17/81/25/567178125.db2.gz PGWZQIQBHHMKHC-UHFFFAOYSA-N 0 1 394.241 3.328 10 0 GGAEMN O=C(Nc1cnoc1)c1cc(Cl)ccc1NS(=O)(=O)c1ccccc1 ZINC000589481274 567179824 /nfs/dbraw/zinc/17/98/24/567179824.db2.gz KBMUZADBSVXHIP-UHFFFAOYSA-N 0 1 377.809 3.381 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C(=O)Nc3cc(Cl)ccc3Cl)[nH]c21 ZINC000498470019 567179820 /nfs/dbraw/zinc/17/98/20/567179820.db2.gz XGVXSFRZILYHOU-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC[C@H](Nc3cccc(Br)c3)C2)C1 ZINC000684135017 567182779 /nfs/dbraw/zinc/18/27/79/567182779.db2.gz NDYMKVCBBIURAH-IRXDYDNUSA-N 0 1 395.345 3.129 10 0 GGAEMN O=C(Nc1nc(CC(F)(F)F)cs1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000615410920 567183873 /nfs/dbraw/zinc/18/38/73/567183873.db2.gz QKIYUGYJGOWPTF-RKDXNWHRSA-N 0 1 392.321 3.170 10 0 GGAEMN O=C(N=c1cc(-c2ccccc2)[nH][nH]1)c1cc(Br)cc2[nH]cnc21 ZINC000566742793 567184258 /nfs/dbraw/zinc/18/42/58/567184258.db2.gz YOSUFESFALBVKU-UHFFFAOYSA-N 0 1 382.221 3.390 10 0 GGAEMN C[C@H](NC[C@H](O)COc1ccccc1Br)c1cn2ccccc2n1 ZINC000566746826 567184627 /nfs/dbraw/zinc/18/46/27/567184627.db2.gz AXKOAELMGLXIRK-KBPBESRZSA-N 0 1 390.281 3.187 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C[C@H]1C ZINC000498567226 567186356 /nfs/dbraw/zinc/18/63/56/567186356.db2.gz MSCVLSJJTBSYIQ-VXGBXAGGSA-N 0 1 392.297 3.258 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@@H]1C ZINC000498570883 567188079 /nfs/dbraw/zinc/18/80/79/567188079.db2.gz HVZZHORZYGJVHJ-STQMWFEESA-N 0 1 386.277 3.154 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1c[nH]c2ncccc12 ZINC000524272596 567190467 /nfs/dbraw/zinc/19/04/67/567190467.db2.gz DZAHAGFTDOLDLW-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1c[nH]c2ncccc12 ZINC000524272596 567190474 /nfs/dbraw/zinc/19/04/74/567190474.db2.gz DZAHAGFTDOLDLW-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN Cn1cncc1Cc1noc(-c2cc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000547255193 567193234 /nfs/dbraw/zinc/19/32/34/567193234.db2.gz LZOKQFSJCAXTHK-UHFFFAOYSA-N 0 1 385.225 3.214 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)NCCCCSc1ccccc1Br ZINC000659254793 567193280 /nfs/dbraw/zinc/19/32/80/567193280.db2.gz FWAIDWRCJBSOTM-AWEZNQCLSA-N 0 1 389.359 3.190 10 0 GGAEMN CC1=CCN(CCNC(=O)NCCc2nc3cc(Cl)ccc3s2)CC1 ZINC000547272977 567194931 /nfs/dbraw/zinc/19/49/31/567194931.db2.gz SIIAFHAYNSIOIP-UHFFFAOYSA-N 0 1 378.929 3.443 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1cc2n[nH]cc2cc1C ZINC000524346623 567195186 /nfs/dbraw/zinc/19/51/86/567195186.db2.gz AWQSBQZXEQZFMU-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCC=C(F)C1 ZINC000547311911 567197914 /nfs/dbraw/zinc/19/79/14/567197914.db2.gz FPFQXUAVRHTTQX-UHFFFAOYSA-N 0 1 380.221 3.003 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCC=C(F)C1 ZINC000547311911 567197926 /nfs/dbraw/zinc/19/79/26/567197926.db2.gz FPFQXUAVRHTTQX-UHFFFAOYSA-N 0 1 380.221 3.003 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC/C=C\c2ccc(Br)cc2)n[nH]1 ZINC000454707892 567198449 /nfs/dbraw/zinc/19/84/49/567198449.db2.gz MAACFLWSWJWBRZ-VSQXVHSFSA-N 0 1 377.286 3.424 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCCC2(CC2)C1 ZINC000474784472 567198911 /nfs/dbraw/zinc/19/89/11/567198911.db2.gz LNPQZGRUKJBXSZ-UHFFFAOYSA-N 0 1 381.217 3.184 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000659299856 567201561 /nfs/dbraw/zinc/20/15/61/567201561.db2.gz GOJIADYIAXXNKG-BBRMVZONSA-N 0 1 375.296 3.116 10 0 GGAEMN O=C(CCCOc1cccc(Cl)c1Cl)NC1(c2nn[nH]n2)CCCC1 ZINC000524577032 567203986 /nfs/dbraw/zinc/20/39/86/567203986.db2.gz AFDJFLXXUKSYMJ-UHFFFAOYSA-N 0 1 384.267 3.251 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@@H](CO)c3ccc(Br)cc3)ccc21 ZINC000684389791 567205787 /nfs/dbraw/zinc/20/57/87/567205787.db2.gz PVPLCSGLYFUMKJ-AWEZNQCLSA-N 0 1 393.306 3.186 10 0 GGAEMN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@@H]1CCCN(C)C1 ZINC000684432883 567207188 /nfs/dbraw/zinc/20/71/88/567207188.db2.gz OKENYUOEDYBWOL-CQSZACIVSA-N 0 1 392.297 3.491 10 0 GGAEMN CCC(=O)N1CSC[C@H]1C(=O)N(C)[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000615816699 567208420 /nfs/dbraw/zinc/20/84/20/567208420.db2.gz OSEXRLFQNHNIBI-HZMBPMFUSA-N 0 1 380.901 3.047 10 0 GGAEMN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N[C@H]1CCCN(C)C1 ZINC000684432881 567208478 /nfs/dbraw/zinc/20/84/78/567208478.db2.gz OKENYUOEDYBWOL-AWEZNQCLSA-N 0 1 392.297 3.491 10 0 GGAEMN Cc1ccc(O[C@H](C)C(=O)N(C)[C@H]2CN3CCC2CC3)c(Br)c1 ZINC000524694388 567209770 /nfs/dbraw/zinc/20/97/70/567209770.db2.gz MPZONJAKYVXJME-CJNGLKHVSA-N 0 1 381.314 3.077 10 0 GGAEMN Cc1ccc(O[C@@H](C)C(=O)N(C)[C@H]2CN3CCC2CC3)c(Br)c1 ZINC000524694387 567209996 /nfs/dbraw/zinc/20/99/96/567209996.db2.gz MPZONJAKYVXJME-BBRMVZONSA-N 0 1 381.314 3.077 10 0 GGAEMN O=C(N[C@H]1CCc2c1ccc(F)c2Br)[C@@H]1CCc2[nH]cnc2C1 ZINC000615871001 567210888 /nfs/dbraw/zinc/21/08/88/567210888.db2.gz IGLFMJKQUCXZOZ-RNCFNFMXSA-N 0 1 378.245 3.220 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCCc2occc2C1 ZINC000567037876 567212316 /nfs/dbraw/zinc/21/23/16/567212316.db2.gz GJULUJBOUQNXJD-UHFFFAOYSA-N 0 1 387.233 3.472 10 0 GGAEMN C[C@@H]1CN(C(=O)N[C@H]2CCOc3c(Br)cccc32)C[C@H](C)N1C ZINC000454917543 567212861 /nfs/dbraw/zinc/21/28/61/567212861.db2.gz ZFHIYVCARSRPQS-ZOWXZIJZSA-N 0 1 382.302 3.007 10 0 GGAEMN C[C@@H](NCC1CCN(C(=O)C(C)(C)C)CC1)c1ncc(Br)cn1 ZINC000432997281 567214393 /nfs/dbraw/zinc/21/43/93/567214393.db2.gz KYVVSQJEFQELPQ-GFCCVEGCSA-N 0 1 383.334 3.174 10 0 GGAEMN CN1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000474961704 567214536 /nfs/dbraw/zinc/21/45/36/567214536.db2.gz HRHFROXOFAUWSB-ZWKOTPCHSA-N 0 1 388.309 3.338 10 0 GGAEMN [O-]c1cccc2c(N3CCN(c4ccc(Br)cn4)CC3)cc[nH+]c12 ZINC000684569155 567217870 /nfs/dbraw/zinc/21/78/70/567217870.db2.gz NRQCSLZXIKYSIE-UHFFFAOYSA-N 0 1 385.265 3.425 10 0 GGAEMN O=C(NCCN1CCCOCC1)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000454998234 567221445 /nfs/dbraw/zinc/22/14/45/567221445.db2.gz JTFLITPJEMTEGX-QGZVFWFLSA-N 0 1 396.329 3.018 10 0 GGAEMN CC[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C[C@@]2(CCOC2)O1 ZINC000684626370 567221826 /nfs/dbraw/zinc/22/18/26/567221826.db2.gz XRWBOQPXSNWDMV-HBUWYVDXSA-N 0 1 390.307 3.003 10 0 GGAEMN CC[C@@H]1CN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C[C@]2(CCOC2)O1 ZINC000684626372 567222426 /nfs/dbraw/zinc/22/24/26/567222426.db2.gz XRWBOQPXSNWDMV-IYOUNJFTSA-N 0 1 390.307 3.003 10 0 GGAEMN O=C(Nc1nc(-c2ccncc2)n[nH]1)C1=Cc2cc(Br)ccc2OC1 ZINC000433101486 567222703 /nfs/dbraw/zinc/22/27/03/567222703.db2.gz BOTPDROJSQDUIF-UHFFFAOYSA-N 0 1 398.220 3.044 10 0 GGAEMN CC1(C)CN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C[C@]2(CCOC2)O1 ZINC000684627198 567223820 /nfs/dbraw/zinc/22/38/20/567223820.db2.gz RDDZLDKQNAKJLV-KDOFPFPSSA-N 0 1 390.307 3.003 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@](C)(CO)c2cc(Cl)cc(Cl)c2)cn1 ZINC000616074685 567223907 /nfs/dbraw/zinc/22/39/07/567223907.db2.gz CTZWXMZJMNVZGM-GOSISDBHSA-N 0 1 382.291 3.088 10 0 GGAEMN CN(Cc1ccoc1)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000524995103 567223960 /nfs/dbraw/zinc/22/39/60/567223960.db2.gz INJQZVGYKSDGTL-UHFFFAOYSA-N 0 1 390.241 3.169 10 0 GGAEMN CN(Cc1ccoc1)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000524995103 567223966 /nfs/dbraw/zinc/22/39/66/567223966.db2.gz INJQZVGYKSDGTL-UHFFFAOYSA-N 0 1 390.241 3.169 10 0 GGAEMN O=C([O-])[C@H](C1CC1)[N@@H+]1CCc2cc(Br)c(Br)cc2C1 ZINC000659803217 567225949 /nfs/dbraw/zinc/22/59/49/567225949.db2.gz DFLDMMRJOABQRN-ZDUSSCGKSA-N 0 1 389.087 3.433 10 0 GGAEMN O=C([O-])[C@H](C1CC1)[N@H+]1CCc2cc(Br)c(Br)cc2C1 ZINC000659803217 567225958 /nfs/dbraw/zinc/22/59/58/567225958.db2.gz DFLDMMRJOABQRN-ZDUSSCGKSA-N 0 1 389.087 3.433 10 0 GGAEMN O=c1[nH]nc2n1CCN(Cc1ccc(-c3ccc(Br)cc3)o1)C2 ZINC000475105106 567226315 /nfs/dbraw/zinc/22/63/15/567226315.db2.gz AHMYATUBIBVRHT-UHFFFAOYSA-N 0 1 375.226 3.022 10 0 GGAEMN CO[C@H]1CN(Cc2ccc(Br)cc2N2CCOCC2)CC[C@H]1C ZINC000475127657 567226908 /nfs/dbraw/zinc/22/69/08/567226908.db2.gz DEGWVSDTPWPFTH-KDOFPFPSSA-N 0 1 383.330 3.143 10 0 GGAEMN Cc1ccncc1[C@H](C)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000684677154 567228565 /nfs/dbraw/zinc/22/85/65/567228565.db2.gz QATRCTQSMQLWOI-RYUDHWBXSA-N 0 1 398.326 3.212 10 0 GGAEMN Cc1ccncc1[C@@H](C)N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000684677155 567228585 /nfs/dbraw/zinc/22/85/85/567228585.db2.gz QATRCTQSMQLWOI-VXGBXAGGSA-N 0 1 398.326 3.212 10 0 GGAEMN C[C@@H](NC(=O)Nc1cnn(-c2ccncc2)c1)c1ccc(Br)cn1 ZINC000684687249 567228712 /nfs/dbraw/zinc/22/87/12/567228712.db2.gz GFJQNZOHRHDULX-LLVKDONJSA-N 0 1 387.241 3.308 10 0 GGAEMN CC[C@H]1CN(CC)CCN1C(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000455078706 567231590 /nfs/dbraw/zinc/23/15/90/567231590.db2.gz RVQZRTOKSIJORX-ZDUSSCGKSA-N 0 1 398.301 3.184 10 0 GGAEMN Cc1cc(N2CCC[C@H](NCc3c(F)cccc3Br)C2)n(C)n1 ZINC000475214491 567233417 /nfs/dbraw/zinc/23/34/17/567233417.db2.gz ZJHJHTQTIQABGC-ZDUSSCGKSA-N 0 1 381.293 3.389 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000433245158 567235127 /nfs/dbraw/zinc/23/51/27/567235127.db2.gz IMSBEWJCPRQTJV-HUUCEWRRSA-N 0 1 395.322 3.248 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000433245156 567235508 /nfs/dbraw/zinc/23/55/08/567235508.db2.gz IMSBEWJCPRQTJV-CABCVRRESA-N 0 1 395.322 3.248 10 0 GGAEMN CCc1c(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)ccn1C ZINC000567316853 567237240 /nfs/dbraw/zinc/23/72/40/567237240.db2.gz YDNLTIYUCLMKIV-UHFFFAOYSA-N 0 1 388.269 3.065 10 0 GGAEMN CCc1c(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)ccn1C ZINC000567316853 567237244 /nfs/dbraw/zinc/23/72/44/567237244.db2.gz YDNLTIYUCLMKIV-UHFFFAOYSA-N 0 1 388.269 3.065 10 0 GGAEMN Cn1cc(I)c(CN[C@@H]2CCCc3ccccc3C2)n1 ZINC000590661363 567237600 /nfs/dbraw/zinc/23/76/00/567237600.db2.gz ZBQWPVOSEUDGGM-CQSZACIVSA-N 0 1 381.261 3.062 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H](OCC2CC2)C1 ZINC000547670149 567238918 /nfs/dbraw/zinc/23/89/18/567238918.db2.gz YAHNJJNALTUESY-ZDUSSCGKSA-N 0 1 378.270 3.357 10 0 GGAEMN CC1(C)CCc2sc(NC(=O)C(C[C@@H]3COCCO3)C(F)(F)F)nc21 ZINC000616372764 567241831 /nfs/dbraw/zinc/24/18/31/567241831.db2.gz WHAOCIJKLQBIKL-NXEZZACHSA-N 0 1 378.416 3.289 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(Cc3ccc(Br)c(F)c3)CC2)n[nH]1 ZINC000660011567 567247097 /nfs/dbraw/zinc/24/70/97/567247097.db2.gz HITSIPLVPCKWFK-LBPRGKRZSA-N 0 1 396.308 3.148 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000660010855 567247860 /nfs/dbraw/zinc/24/78/60/567247860.db2.gz QTNMQUMUOWGREX-CYBMUJFWSA-N 0 1 378.318 3.008 10 0 GGAEMN O=C(NC1(c2ccccc2Br)CCC1)[C@@H]1CCCc2n[nH]nc21 ZINC000616510305 567248820 /nfs/dbraw/zinc/24/88/20/567248820.db2.gz NPKYJYBZSDJHOL-LLVKDONJSA-N 0 1 375.270 3.183 10 0 GGAEMN CC(C)n1cnc(NC(=O)c2c(F)c(F)c(Br)c(F)c2F)n1 ZINC000616519571 567250877 /nfs/dbraw/zinc/25/08/77/567250877.db2.gz QPTXEGHGVQUTHE-UHFFFAOYSA-N 0 1 381.127 3.430 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1C2CCC1CC2 ZINC000525512970 567251178 /nfs/dbraw/zinc/25/11/78/567251178.db2.gz SMHBXIPPLBIEBL-UHFFFAOYSA-N 0 1 376.258 3.071 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1C2CCC1CC2 ZINC000525512970 567251188 /nfs/dbraw/zinc/25/11/88/567251188.db2.gz SMHBXIPPLBIEBL-UHFFFAOYSA-N 0 1 376.258 3.071 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C1(CO)CCC1 ZINC000567523055 567253198 /nfs/dbraw/zinc/25/31/98/567253198.db2.gz JJNFNFRWYGQBBZ-OAHLLOKOSA-N 0 1 380.286 3.242 10 0 GGAEMN Cc1ncc(NS(=O)(=O)c2ccc(F)c(Br)c2)c(C2CC2)n1 ZINC000685007861 567253901 /nfs/dbraw/zinc/25/39/01/567253901.db2.gz UYQLOOUIEZIXHM-UHFFFAOYSA-N 0 1 386.246 3.365 10 0 GGAEMN COc1ccc(NC(=O)c2cc(-c3ccn(C)c3)n[nH]2)cc1Br ZINC000567534023 567254485 /nfs/dbraw/zinc/25/44/85/567254485.db2.gz CTTDKGACCRYVOW-UHFFFAOYSA-N 0 1 375.226 3.439 10 0 GGAEMN CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)c(C3CC3)c2)cc1F ZINC000525703699 567260029 /nfs/dbraw/zinc/26/00/29/567260029.db2.gz UAPAJNDXQCQZAW-UHFFFAOYSA-N 0 1 387.429 3.047 10 0 GGAEMN C[C@@H](C(=O)Nc1cccc(Br)c1)N1CCC[C@H](n2ccnc2)C1 ZINC000591081503 567262973 /nfs/dbraw/zinc/26/29/73/567262973.db2.gz DKGWYNGNAIVOMM-BBRMVZONSA-N 0 1 377.286 3.310 10 0 GGAEMN Ic1ccc(CN2CCC[C@@H]2CNCc2cocn2)cc1 ZINC000475631985 567263822 /nfs/dbraw/zinc/26/38/22/567263822.db2.gz CYQNUACQFAXLFN-MRXNPFEDSA-N 0 1 397.260 3.033 10 0 GGAEMN CN(Cc1ncc(Br)cc1Cl)CC(C)(C)CN1CCOCC1 ZINC000660121958 567263883 /nfs/dbraw/zinc/26/38/83/567263883.db2.gz REEQJVGRMWVFSX-UHFFFAOYSA-N 0 1 390.753 3.288 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@@H](C2CC2)C1 ZINC000547927845 567265334 /nfs/dbraw/zinc/26/53/34/567265334.db2.gz SEVJFBXVDAKVRI-CYBMUJFWSA-N 0 1 376.254 3.090 10 0 GGAEMN Cc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2Br)n1 ZINC000567678887 567266961 /nfs/dbraw/zinc/26/69/61/567266961.db2.gz DLQCSDXIDBEUPF-AWEZNQCLSA-N 0 1 385.689 3.335 10 0 GGAEMN CC[C@H]1CN(CC)CCN1C(=O)Nc1ccc2nccnc2c1Br ZINC000455418186 567272853 /nfs/dbraw/zinc/27/28/53/567272853.db2.gz XYWGNVBORVEYQO-LBPRGKRZSA-N 0 1 392.301 3.340 10 0 GGAEMN COc1cc(CNCc2ccc(Br)cc2OC)cc(OC)c1O ZINC000685427825 567274408 /nfs/dbraw/zinc/27/44/08/567274408.db2.gz NWSYMMLPPOLELN-UHFFFAOYSA-N 0 1 382.254 3.470 10 0 GGAEMN O[C@H](CCNCc1nc(-c2cccc(Br)c2)c[nH]1)C(F)(F)F ZINC000685458260 567275769 /nfs/dbraw/zinc/27/57/69/567275769.db2.gz MWZDWMSNXKOULF-GFCCVEGCSA-N 0 1 378.192 3.242 10 0 GGAEMN COc1nsc(CNC[C@H](c2cccs2)N(C)C)c1Br ZINC000638861870 567276782 /nfs/dbraw/zinc/27/67/82/567276782.db2.gz AXARELDOULDYIS-SECBINFHSA-N 0 1 376.345 3.368 10 0 GGAEMN C[C@@H](NCCO[C@H]1CC1(F)F)c1cc2c(cc1Br)OCCO2 ZINC000660188644 567278771 /nfs/dbraw/zinc/27/87/71/567278771.db2.gz UZHWAUCAFGWJNE-OTYXRUKQSA-N 0 1 378.213 3.295 10 0 GGAEMN CCc1nc([C@@H](C)N[C@H](C)c2cc3c(cc2Br)OCCO3)n[nH]1 ZINC000660189148 567278600 /nfs/dbraw/zinc/27/86/00/567278600.db2.gz XZGUODJJYTWVQM-NXEZZACHSA-N 0 1 381.274 3.313 10 0 GGAEMN NS(=O)(=O)c1cc(CN[C@@H](c2ccc(Br)cc2)C2CCC2)co1 ZINC000660191313 567278707 /nfs/dbraw/zinc/27/87/07/567278707.db2.gz ZSTIMLUKNQFLEK-MRXNPFEDSA-N 0 1 399.310 3.321 10 0 GGAEMN Cc1c(CN(C)C(=O)c2n[nH]c(-c3ccccc3)c2Br)cnn1C ZINC000548069953 567278843 /nfs/dbraw/zinc/27/88/43/567278843.db2.gz FFILIWMATWRCTI-UHFFFAOYSA-N 0 1 388.269 3.153 10 0 GGAEMN C[C@H](NCCO[C@@H]1CC1(F)F)c1cc2c(cc1Br)OCCO2 ZINC000660188641 567279136 /nfs/dbraw/zinc/27/91/36/567279136.db2.gz UZHWAUCAFGWJNE-LKFCYVNXSA-N 0 1 378.213 3.295 10 0 GGAEMN CO[C@H](C(=O)Nc1nc2ccc(Br)cc2[nH]1)c1ccc(O)cc1 ZINC000499871779 567279539 /nfs/dbraw/zinc/27/95/39/567279539.db2.gz DTZVZECJHHXSHX-AWEZNQCLSA-N 0 1 376.210 3.357 10 0 GGAEMN C[C@@H](NCCOc1ccc(Br)cc1)c1nnc2n1CCCCC2 ZINC000660259731 567283336 /nfs/dbraw/zinc/28/33/36/567283336.db2.gz OTDLXBQSSFVJLW-CYBMUJFWSA-N 0 1 379.302 3.497 10 0 GGAEMN C[C@@H](NC[C@H]1CS(=O)(=O)c2ccccc2O1)c1ccc(Br)cc1 ZINC000567858088 567284523 /nfs/dbraw/zinc/28/45/23/567284523.db2.gz VBFSWRAACXXSHN-DOMZBBRYSA-N 0 1 396.306 3.335 10 0 GGAEMN COc1ccc([C@H](C)NC[C@H]2CS(=O)(=O)c3ccccc3O2)c(Cl)c1 ZINC000567857556 567284537 /nfs/dbraw/zinc/28/45/37/567284537.db2.gz IOLXIQUWAKPEFI-JSGCOSHPSA-N 0 1 381.881 3.234 10 0 GGAEMN C[C@H]1CCCCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000475883891 567284780 /nfs/dbraw/zinc/28/47/80/567284780.db2.gz PGMFZFYKJRKRBL-JTQLQIEISA-N 0 1 383.233 3.430 10 0 GGAEMN C[C@H](NC[C@@H]1CS(=O)(=O)c2ccccc2O1)c1ccc(Br)cc1 ZINC000567858090 567285023 /nfs/dbraw/zinc/28/50/23/567285023.db2.gz VBFSWRAACXXSHN-SWLSCSKDSA-N 0 1 396.306 3.335 10 0 GGAEMN CCc1nc([C@H](C)N2CCO[C@@H](c3ccc(F)c(Br)c3)C2)n[nH]1 ZINC000660312500 567286858 /nfs/dbraw/zinc/28/68/58/567286858.db2.gz HAUYKUGKEAYZBF-IINYFYTJSA-N 0 1 383.265 3.403 10 0 GGAEMN CN(C(=O)c1cc(F)c(Br)cc1Cl)[C@H]1CN2CCC1CC2 ZINC000475932997 567288154 /nfs/dbraw/zinc/28/81/54/567288154.db2.gz QREHWDOKXOKNOS-AWEZNQCLSA-N 0 1 375.669 3.408 10 0 GGAEMN O=C(NCCCn1cnc2ccccc21)c1cc(Br)cc2nc[nH]c21 ZINC000499978238 567289203 /nfs/dbraw/zinc/28/92/03/567289203.db2.gz WGVVQUFEMHNDLV-UHFFFAOYSA-N 0 1 398.264 3.495 10 0 GGAEMN CC(C)C[C@@H](CO)N(C)C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1 ZINC000475944076 567289273 /nfs/dbraw/zinc/28/92/73/567289273.db2.gz CISRVJXLDPDFSK-AWEZNQCLSA-N 0 1 380.286 3.318 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@H](c1nccs1)C(F)(F)F)c1ccsc1 ZINC000455664998 567294078 /nfs/dbraw/zinc/29/40/78/567294078.db2.gz USPWVUZBZKGRBE-WDEREUQCSA-N 0 1 378.445 3.410 10 0 GGAEMN CCOc1cc(Br)c(F)cc1NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000567971586 567295269 /nfs/dbraw/zinc/29/52/69/567295269.db2.gz CNOAYLCBRTVBTD-VIFPVBQESA-N 0 1 397.248 3.389 10 0 GGAEMN CC[C@H](C)[C@H](C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000591769621 567295444 /nfs/dbraw/zinc/29/54/44/567295444.db2.gz BTEVJMUCSFDGRR-QWRGUYRKSA-N 0 1 380.290 3.468 10 0 GGAEMN CC[C@H](C)[C@H](C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000591769621 567295448 /nfs/dbraw/zinc/29/54/48/567295448.db2.gz BTEVJMUCSFDGRR-QWRGUYRKSA-N 0 1 380.290 3.468 10 0 GGAEMN CC1(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCCC1 ZINC000591771341 567297123 /nfs/dbraw/zinc/29/71/23/567297123.db2.gz UVTDIWSPTLYTSC-UHFFFAOYSA-N 0 1 378.274 3.366 10 0 GGAEMN CC1(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCCC1 ZINC000591771341 567297130 /nfs/dbraw/zinc/29/71/30/567297130.db2.gz UVTDIWSPTLYTSC-UHFFFAOYSA-N 0 1 378.274 3.366 10 0 GGAEMN Cc1cc(C(C)(C)C(=O)N[C@H]2CCc3nc[nH]c3C2)ccc1Br ZINC000685790797 567298037 /nfs/dbraw/zinc/29/80/37/567298037.db2.gz KGVBQBCCRXGFDV-ZDUSSCGKSA-N 0 1 376.298 3.432 10 0 GGAEMN COC(=O)CC1(NCc2cn(-c3ccc(Br)cc3)nc2C)CC1 ZINC000568036811 567299625 /nfs/dbraw/zinc/29/96/25/567299625.db2.gz YLNFNVMERBYHQS-UHFFFAOYSA-N 0 1 378.270 3.129 10 0 GGAEMN C[C@@H](NCc1nnc(C(F)(F)F)s1)C1CCN(CC(F)(F)F)CC1 ZINC000660487079 567300712 /nfs/dbraw/zinc/30/07/12/567300712.db2.gz OJPLQVQOUQWWLB-MRVPVSSYSA-N 0 1 376.370 3.309 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074490 567303064 /nfs/dbraw/zinc/30/30/64/567303064.db2.gz KINIYCXCDJSBIG-CVEARBPZSA-N 0 1 380.897 3.451 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074490 567303069 /nfs/dbraw/zinc/30/30/69/567303069.db2.gz KINIYCXCDJSBIG-CVEARBPZSA-N 0 1 380.897 3.451 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000568074511 567303080 /nfs/dbraw/zinc/30/30/80/567303080.db2.gz KTHXGFKLXVIIPL-UONOGXRCSA-N 0 1 395.253 3.168 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000568074510 567303127 /nfs/dbraw/zinc/30/31/27/567303127.db2.gz KTHXGFKLXVIIPL-KGLIPLIRSA-N 0 1 395.253 3.168 10 0 GGAEMN C[C@H]1CN(C(=O)c2[nH]nc3ccc(I)cc32)CC[C@@H]1C ZINC000500165655 567304036 /nfs/dbraw/zinc/30/40/36/567304036.db2.gz CTNCQGRTHINSLR-UWVGGRQHSA-N 0 1 383.233 3.286 10 0 GGAEMN C[C@@H]1CCN(C(=O)c2[nH]nc3ccc(I)cc32)C[C@H]1C ZINC000500165654 567304062 /nfs/dbraw/zinc/30/40/62/567304062.db2.gz CTNCQGRTHINSLR-NXEZZACHSA-N 0 1 383.233 3.286 10 0 GGAEMN OCC[C@H]1CCCCCN1Cc1cn(-c2ccccc2Br)nn1 ZINC000685846866 567304409 /nfs/dbraw/zinc/30/44/09/567304409.db2.gz RPCUVHMDPLCFCK-OAHLLOKOSA-N 0 1 379.302 3.157 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)c1csc(=NC2CC2)[nH]1 ZINC000434347297 567305095 /nfs/dbraw/zinc/30/50/95/567305095.db2.gz UPUTUOXHQGYOTM-UHFFFAOYSA-N 0 1 380.311 3.482 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(COc3cccc(Br)c3)o2)C1 ZINC000617415616 567305869 /nfs/dbraw/zinc/30/58/69/567305869.db2.gz JDWYSLVNGKUCOU-AWEZNQCLSA-N 0 1 393.281 3.445 10 0 GGAEMN CCCOc1c(Br)cc(C(=O)N[C@H]2CCCN(C)C2)cc1OC ZINC000617411573 567305902 /nfs/dbraw/zinc/30/59/02/567305902.db2.gz ORIKEJBREBDRMJ-ZDUSSCGKSA-N 0 1 385.302 3.071 10 0 GGAEMN CC(C)[C@H](N[C@H](C)C(=O)N1CCSc2ccccc21)[C@H](O)C(F)(F)F ZINC000660526390 567305856 /nfs/dbraw/zinc/30/58/56/567305856.db2.gz UTQKHOFNXWPVHT-UGFHNGPFSA-N 0 1 376.444 3.051 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(COc3cccc(Br)c3)o2)C1 ZINC000617415617 567306187 /nfs/dbraw/zinc/30/61/87/567306187.db2.gz JDWYSLVNGKUCOU-CQSZACIVSA-N 0 1 393.281 3.445 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000617412843 567306311 /nfs/dbraw/zinc/30/63/11/567306311.db2.gz WDIXPYOXAFJTJM-CYBMUJFWSA-N 0 1 377.897 3.478 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cccnc2Oc2cccc(Br)c2)C1 ZINC000617414140 567306918 /nfs/dbraw/zinc/30/69/18/567306918.db2.gz ANXFALUUSQWBDG-AWEZNQCLSA-N 0 1 390.281 3.460 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cccnc2Oc2ccc(Br)cc2)C1 ZINC000617414636 567307058 /nfs/dbraw/zinc/30/70/58/567307058.db2.gz NKKUBMPWGOZOJI-AWEZNQCLSA-N 0 1 390.281 3.460 10 0 GGAEMN C[C@@H]1COCCN1C1CCN(Cc2ncc(Br)cc2Cl)CC1 ZINC000660588806 567310106 /nfs/dbraw/zinc/31/01/06/567310106.db2.gz BOTRMGBRYHMWKK-GFCCVEGCSA-N 0 1 388.737 3.183 10 0 GGAEMN Cc1c(Br)cccc1CN[C@H](c1cnn(C)c1)C1(CO)CCC1 ZINC000660602535 567310909 /nfs/dbraw/zinc/31/09/09/567310909.db2.gz SYEXNOFDWCCQDA-QGZVFWFLSA-N 0 1 378.314 3.485 10 0 GGAEMN Cc1cc(CN[C@H](c2cnn(C)c2)C2(CO)CCC2)ccc1Br ZINC000660597538 567311005 /nfs/dbraw/zinc/31/10/05/567311005.db2.gz CJWVDCNUTHWQCR-QGZVFWFLSA-N 0 1 378.314 3.485 10 0 GGAEMN CCc1nc([C@H](C)N[C@@H](C)c2ccc(Br)cc2OCCCO)n[nH]1 ZINC000660595013 567311996 /nfs/dbraw/zinc/31/19/96/567311996.db2.gz BKNRRFNSNRSUIX-RYUDHWBXSA-N 0 1 397.317 3.303 10 0 GGAEMN C[C@H](NC[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ncc(Br)cn1 ZINC000660624713 567312742 /nfs/dbraw/zinc/31/27/42/567312742.db2.gz GCJZOPGYNLSKTR-STQMWFEESA-N 0 1 383.334 3.174 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000476311306 567313671 /nfs/dbraw/zinc/31/36/71/567313671.db2.gz WYYDPZYKSVJEOD-LLVKDONJSA-N 0 1 381.217 3.381 10 0 GGAEMN C[C@H](NC[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ncc(Br)cn1 ZINC000660624712 567313749 /nfs/dbraw/zinc/31/37/49/567313749.db2.gz GCJZOPGYNLSKTR-QWHCGFSZSA-N 0 1 383.334 3.174 10 0 GGAEMN NCc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2I)o1 ZINC000592141191 567317433 /nfs/dbraw/zinc/31/74/33/567317433.db2.gz IOAUCMYMAKRPFW-CQSZACIVSA-N 0 1 396.228 3.320 10 0 GGAEMN C[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)C(=O)NCCF ZINC000500422384 567319377 /nfs/dbraw/zinc/31/93/77/567319377.db2.gz IPCAOGFXUQIYAT-SNVBAGLBSA-N 0 1 386.290 3.136 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCCS(=O)(=O)c2cc(Cl)ccc2Cl)[C@@H]1SC ZINC000592169155 567319963 /nfs/dbraw/zinc/31/99/63/567319963.db2.gz WSWVLABUUPEICO-NFAWXSAZSA-N 0 1 398.377 3.266 10 0 GGAEMN CNC(=O)Cc1nc(CN(C)[C@H](C)c2nc3ccc(Cl)cc3[nH]2)cs1 ZINC000660710066 567320378 /nfs/dbraw/zinc/32/03/78/567320378.db2.gz OFFLAKUGYOVYSJ-SNVBAGLBSA-N 0 1 377.901 3.154 10 0 GGAEMN CCN(C(=O)c1ccc(Sc2ccccc2Cl)nn1)[C@@H]1CCN(C)C1 ZINC000617554929 567321658 /nfs/dbraw/zinc/32/16/58/567321658.db2.gz MUJMBJJLSWKUHP-CYBMUJFWSA-N 0 1 376.913 3.447 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)Cc2noc3ccc(Br)cc23)n[nH]1 ZINC000568383436 567324121 /nfs/dbraw/zinc/32/41/21/567324121.db2.gz KCORHBSAMLQFDA-VIFPVBQESA-N 0 1 392.257 3.252 10 0 GGAEMN O=C(NCc1noc(-c2cccc(F)c2)n1)c1cccc(Br)c1O ZINC000527259390 567324861 /nfs/dbraw/zinc/32/48/61/567324861.db2.gz NTBRXIYUZVCYJS-UHFFFAOYSA-N 0 1 392.184 3.274 10 0 GGAEMN CN(C)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2Br)cn1 ZINC000500495357 567326122 /nfs/dbraw/zinc/32/61/22/567326122.db2.gz IMSDXUCKEKHYMV-UHFFFAOYSA-N 0 1 390.690 3.364 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)cc1Cl)NC[C@H]1CCCCN1C1CC1 ZINC000434769327 567327506 /nfs/dbraw/zinc/32/75/06/567327506.db2.gz YQCYPQTVZYAAHC-OAHLLOKOSA-N 0 1 377.337 3.430 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CCOc2cc(Br)ccc2C1 ZINC000660817433 567328009 /nfs/dbraw/zinc/32/80/09/567328009.db2.gz BHGWRJRHMKRAJZ-UHFFFAOYSA-N 0 1 393.285 3.017 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(Br)cc3F)[nH]c21 ZINC000476538614 567333918 /nfs/dbraw/zinc/33/39/18/567333918.db2.gz RKODUXQOKCBYLV-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN CC(C)(C)OC(=O)C1(CNCc2ncc(Br)s2)CCOCC1 ZINC000592372685 567333977 /nfs/dbraw/zinc/33/39/77/567333977.db2.gz KSGQVHXKNNWLQU-UHFFFAOYSA-N 0 1 391.331 3.134 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](CCOc2ccc(Cl)cc2Br)C1 ZINC000568521638 567335103 /nfs/dbraw/zinc/33/51/03/567335103.db2.gz JWRYWHRVRCESMF-NEPJUHHUSA-N 0 1 392.677 3.045 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCOc3cc(Br)ccc3C2)n[nH]1 ZINC000660930237 567335749 /nfs/dbraw/zinc/33/57/49/567335749.db2.gz LQVFPEVLSUBWMI-LLVKDONJSA-N 0 1 393.285 3.016 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2Cc3ccc(C)c(Br)c3C2)n[nH]1 ZINC000660929076 567335959 /nfs/dbraw/zinc/33/59/59/567335959.db2.gz DNJJHEHCMUPDIM-NSHDSACASA-N 0 1 377.286 3.445 10 0 GGAEMN Cc1cn2cc([N-]S(=O)(=O)c3cc(F)ccc3Br)ccc2[nH+]1 ZINC000434968186 567337990 /nfs/dbraw/zinc/33/79/90/567337990.db2.gz KTBRKEJMNRRHOI-UHFFFAOYSA-N 0 1 384.230 3.345 10 0 GGAEMN OC[C@@H]1CN(CCc2cc(Cl)c3c(c2)OCCCO3)C[C@H]1C(F)(F)F ZINC000640043133 567339836 /nfs/dbraw/zinc/33/98/36/567339836.db2.gz CIZOQRQSJVAQOV-QWHCGFSZSA-N 0 1 379.806 3.146 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000568582448 567340066 /nfs/dbraw/zinc/34/00/66/567340066.db2.gz SBXPXRHIFYJCMR-HIFRSBDPSA-N 0 1 376.913 3.497 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000592504809 567341569 /nfs/dbraw/zinc/34/15/69/567341569.db2.gz ZFDVYQGZRCFURO-BZNIZROVSA-N 0 1 390.286 3.310 10 0 GGAEMN O=C1C[C@@H](c2cccc(NS(=O)(=O)c3cccc(Cl)c3Cl)c2)CN1 ZINC000435146295 567343952 /nfs/dbraw/zinc/34/39/52/567343952.db2.gz KPXRPCKZLMPTFI-LLVKDONJSA-N 0 1 385.272 3.398 10 0 GGAEMN CCN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@@H]1CC[N@H+](CC)C1 ZINC000617923697 567346468 /nfs/dbraw/zinc/34/64/68/567346468.db2.gz HUZXPAHASHGZRY-GFCCVEGCSA-N 0 1 392.297 3.259 10 0 GGAEMN CCN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@@H]1CC[N@@H+](CC)C1 ZINC000617923697 567346472 /nfs/dbraw/zinc/34/64/72/567346472.db2.gz HUZXPAHASHGZRY-GFCCVEGCSA-N 0 1 392.297 3.259 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CC(Oc3cccc(Cl)c3Cl)C2)cn1 ZINC000617965384 567348565 /nfs/dbraw/zinc/34/85/65/567348565.db2.gz HRUJKQAMNHDGPO-UHFFFAOYSA-N 0 1 380.275 3.353 10 0 GGAEMN Cc1ccccc1[C@@H](N)C(=O)N1CCc2ccc(F)c(Br)c2C1 ZINC000527616582 567349231 /nfs/dbraw/zinc/34/92/31/567349231.db2.gz GWNMUIBAKHAYLC-QGZVFWFLSA-N 0 1 377.257 3.481 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1noc2c1COCC2)c1ccc(Cl)c(Cl)c1 ZINC000527615193 567349458 /nfs/dbraw/zinc/34/94/58/567349458.db2.gz RMPAIGCJWGLDFH-CQSZACIVSA-N 0 1 384.263 3.087 10 0 GGAEMN CN(C)C[C@@H]1CCCN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000435215773 567349531 /nfs/dbraw/zinc/34/95/31/567349531.db2.gz HSCIAGYHIKDSSJ-AWEZNQCLSA-N 0 1 385.942 3.178 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N3CCN(C4CCC4)C[C@@H](C)C3)cc2s1 ZINC000568706285 567349906 /nfs/dbraw/zinc/34/99/06/567349906.db2.gz OSFPQUSGOMGLQC-CYBMUJFWSA-N 0 1 379.551 3.100 10 0 GGAEMN O=C(Cc1ccc(Br)s1)N[C@H](Cc1nc[nH]n1)c1ccccc1 ZINC000476820807 567350492 /nfs/dbraw/zinc/35/04/92/567350492.db2.gz JONMIJNCEOGKDU-CYBMUJFWSA-N 0 1 391.294 3.271 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cccc(C)c3Br)[nH]c2c1 ZINC000435224943 567350919 /nfs/dbraw/zinc/35/09/19/567350919.db2.gz GQPIARCYVQTLCD-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1cc(F)ccc1Br ZINC000435227691 567351070 /nfs/dbraw/zinc/35/10/70/567351070.db2.gz UXPZBTLDEHCBTB-RYUDHWBXSA-N 0 1 393.322 3.129 10 0 GGAEMN O=C(c1csc(=NC2CC2)[nH]1)N1CCc2ccc(F)c(Br)c2C1 ZINC000527627924 567351718 /nfs/dbraw/zinc/35/17/18/567351718.db2.gz JGYWHMPBOCVNFU-UHFFFAOYSA-N 0 1 396.285 3.239 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCc2ccc(F)c(Br)c2C1 ZINC000527627887 567351854 /nfs/dbraw/zinc/35/18/54/567351854.db2.gz IRSOAXQEEYBDRC-LLVKDONJSA-N 0 1 378.245 3.316 10 0 GGAEMN C[C@@]12COC[C@]1(C)CN(C(=O)c1cc(-c3ccc(Br)cc3)[nH]n1)C2 ZINC000618023920 567352934 /nfs/dbraw/zinc/35/29/34/567352934.db2.gz CJPYGNVPBGGKAH-HDICACEKSA-N 0 1 390.281 3.338 10 0 GGAEMN CCOC(=O)c1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cn1 ZINC000548801633 567352957 /nfs/dbraw/zinc/35/29/57/567352957.db2.gz WAPHKGQESMKWNY-UHFFFAOYSA-N 0 1 389.209 3.149 10 0 GGAEMN Brc1ccc(-c2cnc(CN3CC[C@H](Cn4ccnn4)C3)o2)cc1 ZINC000661145945 567353126 /nfs/dbraw/zinc/35/31/26/567353126.db2.gz WIKSRFRETDFCTJ-ZDUSSCGKSA-N 0 1 388.269 3.218 10 0 GGAEMN Cc1cc(Br)c(CNC[C@@H]2COCCO2)cc1Br ZINC000527640503 567354868 /nfs/dbraw/zinc/35/48/68/567354868.db2.gz FNJLOIZDMYMIPI-LLVKDONJSA-N 0 1 379.092 3.025 10 0 GGAEMN Cc1cc(Br)c(CN[C@H](C)Cn2cncn2)cc1Br ZINC000527650743 567355241 /nfs/dbraw/zinc/35/52/41/567355241.db2.gz WJUDHXMLWYABAV-SNVBAGLBSA-N 0 1 388.107 3.290 10 0 GGAEMN CC(C)Oc1cc(Cl)c(CN[C@H]2CCCN(S(C)(=O)=O)C2)cc1Cl ZINC000527649502 567355458 /nfs/dbraw/zinc/35/54/58/567355458.db2.gz QMEYMSBROYTYBV-ZDUSSCGKSA-N 0 1 395.352 3.294 10 0 GGAEMN O=C(NCc1cc(Br)ccc1F)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000527660452 567355921 /nfs/dbraw/zinc/35/59/21/567355921.db2.gz QLBHVENOGCXTTK-OAHLLOKOSA-N 0 1 384.293 3.404 10 0 GGAEMN CC[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccc(Br)c(F)c1F ZINC000527653473 567356244 /nfs/dbraw/zinc/35/62/44/567356244.db2.gz UKKQPQPCGXIZOE-LLVKDONJSA-N 0 1 376.245 3.011 10 0 GGAEMN COC[C@@](C)(CCO)NCc1cc(Br)c(C)cc1Br ZINC000527670623 567357748 /nfs/dbraw/zinc/35/77/48/567357748.db2.gz PADZDVYPAUWQCM-CQSZACIVSA-N 0 1 395.135 3.397 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)N1CC[C@@H]1c1ccc(Br)cc1 ZINC000661204303 567358008 /nfs/dbraw/zinc/35/80/08/567358008.db2.gz HTDDZLMFVLHMFC-XJKSGUPXSA-N 0 1 375.270 3.186 10 0 GGAEMN Fc1cc(Br)cnc1CN[C@@H]1CCN(c2ncccc2Cl)C1 ZINC000527672499 567359727 /nfs/dbraw/zinc/35/97/27/567359727.db2.gz JTJPLZDQHJDZTF-LLVKDONJSA-N 0 1 385.668 3.400 10 0 GGAEMN Fc1cc(Br)cnc1CN[C@H]1CCN(c2ncccc2Cl)C1 ZINC000527672500 567359823 /nfs/dbraw/zinc/35/98/23/567359823.db2.gz JTJPLZDQHJDZTF-NSHDSACASA-N 0 1 385.668 3.400 10 0 GGAEMN COc1ccccc1[C@H](CNC(=O)[C@@H]1C[C@@]1(C)Br)N1CCCC1 ZINC000527682965 567361424 /nfs/dbraw/zinc/36/14/24/567361424.db2.gz MQOMTCDTGKVRTL-RLFYNMQTSA-N 0 1 381.314 3.122 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1cc(Oc2cccc(Br)c2)ccn1 ZINC000618192666 567362155 /nfs/dbraw/zinc/36/21/55/567362155.db2.gz WKVKSHWGYUOMRK-UHFFFAOYSA-N 0 1 390.281 3.270 10 0 GGAEMN CNS(=O)(=O)CCCN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000476989890 567362211 /nfs/dbraw/zinc/36/22/11/567362211.db2.gz YIMCLYOQDBEUPV-UHFFFAOYSA-N 0 1 377.337 3.412 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1ccc(Oc2ccc(Br)cc2)nc1 ZINC000618194754 567362346 /nfs/dbraw/zinc/36/23/46/567362346.db2.gz IPFKSFFHMPNBIU-UHFFFAOYSA-N 0 1 390.281 3.270 10 0 GGAEMN CCc1onc(-c2ccc(Br)cc2)c1C(=O)N(C)CC1CN(C)C1 ZINC000618189983 567362658 /nfs/dbraw/zinc/36/26/58/567362658.db2.gz CJXNCTVDXJJTJA-UHFFFAOYSA-N 0 1 392.297 3.300 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1cccnc1Oc1ccc(Br)cc1 ZINC000618195342 567363082 /nfs/dbraw/zinc/36/30/82/567363082.db2.gz DVMFUDXCAIZHGY-UHFFFAOYSA-N 0 1 390.281 3.270 10 0 GGAEMN CCc1nc(CNCc2cc(Br)c(C)cc2Br)n[nH]1 ZINC000527711642 567365945 /nfs/dbraw/zinc/36/59/45/567365945.db2.gz AGEAJQOVIJUMIY-UHFFFAOYSA-N 0 1 388.107 3.490 10 0 GGAEMN CO[C@H](CCNS(=O)(=O)c1c(Cl)cc(F)cc1Cl)C(F)(F)F ZINC000435436309 567366445 /nfs/dbraw/zinc/36/64/45/567366445.db2.gz FEOGPTWNOSJWIO-SECBINFHSA-N 0 1 384.178 3.378 10 0 GGAEMN C[C@@H](CCNS(=O)(=O)c1ccccc1)NCc1ncc(C(F)(F)F)s1 ZINC000548991238 567366577 /nfs/dbraw/zinc/36/65/77/567366577.db2.gz KNDGDRMVNBJDLC-NSHDSACASA-N 0 1 393.456 3.009 10 0 GGAEMN CO[C@@H](CCNS(=O)(=O)c1c(Cl)cc(F)cc1Cl)C(F)(F)F ZINC000435436311 567366812 /nfs/dbraw/zinc/36/68/12/567366812.db2.gz FEOGPTWNOSJWIO-VIFPVBQESA-N 0 1 384.178 3.378 10 0 GGAEMN CC[C@H]1CN(CC)CCN1C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000456372116 567367618 /nfs/dbraw/zinc/36/76/18/567367618.db2.gz HHKXWTSYKRGFCC-ZDUSSCGKSA-N 0 1 392.297 3.259 10 0 GGAEMN COC(=O)[C@@H](CC(C)(C)C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000592831562 567368017 /nfs/dbraw/zinc/36/80/17/567368017.db2.gz NONBFPZXORULRJ-GFCCVEGCSA-N 0 1 382.258 3.033 10 0 GGAEMN CCn1c(NC(=O)c2cc(Br)cc3nc[nH]c32)nc2cccnc21 ZINC000477090056 567370265 /nfs/dbraw/zinc/37/02/65/567370265.db2.gz MIQFVMLGBJDPDA-UHFFFAOYSA-N 0 1 385.225 3.342 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2ccsc2C(F)(F)F)Oc2ccccc21 ZINC000527723718 567370503 /nfs/dbraw/zinc/37/05/03/567370503.db2.gz GIJKCQHKQUMNLZ-NSHDSACASA-N 0 1 377.409 3.091 10 0 GGAEMN CN(C)[C@@H](CNC(=O)NC[C@@H]1CSc2ccccc2O1)c1ccsc1 ZINC000568979046 567370719 /nfs/dbraw/zinc/37/07/19/567370719.db2.gz QFHGMJUPUUDFKT-CABCVRRESA-N 0 1 377.535 3.203 10 0 GGAEMN CCN(CCSC)C(=O)c1cccc(C(=O)N(CC)CCSC)c1O ZINC000592916205 567372973 /nfs/dbraw/zinc/37/29/73/567372973.db2.gz AGMDYQVYSVAXEQ-UHFFFAOYSA-N 0 1 384.567 3.042 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)[C@@H](CO)c2cccc(Cl)c2Cl)[nH]1 ZINC000618340063 567373537 /nfs/dbraw/zinc/37/35/37/567373537.db2.gz GRVGXHRWMXZYIO-LBPRGKRZSA-N 0 1 389.308 3.094 10 0 GGAEMN CS[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@@H]1N1CCCC1 ZINC000477135906 567373616 /nfs/dbraw/zinc/37/36/16/567373616.db2.gz BTCYNHOZJZFGKQ-UONOGXRCSA-N 0 1 395.377 3.194 10 0 GGAEMN CCn1c(-c2ccc(Br)cc2)nnc1N1CCN(C(C)C)CC1 ZINC000549106410 567373827 /nfs/dbraw/zinc/37/38/27/567373827.db2.gz YKXQQYQPFUNJCY-UHFFFAOYSA-N 0 1 378.318 3.258 10 0 GGAEMN COc1ccc(Br)c(CNC[C@@H]2c3ccccc3C(=O)N2C)c1 ZINC000527805025 567374889 /nfs/dbraw/zinc/37/48/89/567374889.db2.gz HJVKBKLODGGVSK-QGZVFWFLSA-N 0 1 375.266 3.374 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N(C)[C@@H](CO)c2cccc(Cl)c2Cl)cn1 ZINC000618341278 567374885 /nfs/dbraw/zinc/37/48/85/567374885.db2.gz DDSSTUYNKMYBFP-INIZCTEOSA-N 0 1 382.291 3.256 10 0 GGAEMN C[N@H+]1CCC[C@@H](CN=c2[n-]nc(C3CCOCC3)s2)[C@H]1c1cccs1 ZINC000549142528 567374926 /nfs/dbraw/zinc/37/49/26/567374926.db2.gz MDDTXDKLBABKHJ-HOCLYGCPSA-N 0 1 378.567 3.411 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)Nc1cccc2[nH]c(=O)[nH]c21 ZINC000569047151 567375011 /nfs/dbraw/zinc/37/50/11/567375011.db2.gz RNEJRCQLUIZNOZ-UHFFFAOYSA-N 0 1 396.266 3.449 10 0 GGAEMN COc1c(Br)cccc1CNC[C@H]1c2ccccc2C(=O)N1C ZINC000527807845 567375104 /nfs/dbraw/zinc/37/51/04/567375104.db2.gz OXJMCPNPALZMSC-INIZCTEOSA-N 0 1 375.266 3.374 10 0 GGAEMN COc1ccc(CNC[C@H]2c3ccccc3C(=O)N2C)c(Br)c1 ZINC000527807565 567375335 /nfs/dbraw/zinc/37/53/35/567375335.db2.gz LHAWOZHEGJERLB-KRWDZBQOSA-N 0 1 375.266 3.374 10 0 GGAEMN C[N@H+]1CCC[C@H](CN=c2[n-]nc(C3CCOCC3)s2)[C@@H]1c1cccs1 ZINC000549142526 567375276 /nfs/dbraw/zinc/37/52/76/567375276.db2.gz MDDTXDKLBABKHJ-GDBMZVCRSA-N 0 1 378.567 3.411 10 0 GGAEMN COc1cc(Br)ccc1CNC[C@H]1c2ccccc2C(=O)N1C ZINC000527807895 567375726 /nfs/dbraw/zinc/37/57/26/567375726.db2.gz QBOPDTCWLGCHLD-INIZCTEOSA-N 0 1 375.266 3.374 10 0 GGAEMN COc1ccc(Br)cc1CNC[C@H]1c2ccccc2C(=O)N1C ZINC000527804930 567375865 /nfs/dbraw/zinc/37/58/65/567375865.db2.gz GWTKZZNBCDPPJA-INIZCTEOSA-N 0 1 375.266 3.374 10 0 GGAEMN CC(C)(CO)[C@H](NCC(=O)N1CCC[C@H](C(F)(F)F)C1)c1cccs1 ZINC000569054908 567376420 /nfs/dbraw/zinc/37/64/20/567376420.db2.gz RDLASZMPAKSDCC-SWLSCSKDSA-N 0 1 378.460 3.198 10 0 GGAEMN O=C(N[C@@H]1CSCc2ccc(Br)cc21)[C@H]1CCCc2n[nH]nc21 ZINC000618359919 567377463 /nfs/dbraw/zinc/37/74/63/567377463.db2.gz ICGPIUTYXGGVFH-SMDDNHRTSA-N 0 1 393.310 3.091 10 0 GGAEMN O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@H]1CCc2[nH]cnc2C1 ZINC000618359858 567377756 /nfs/dbraw/zinc/37/77/56/567377756.db2.gz GJWIOVYGISNTTL-QFYYESIMSA-N 0 1 392.322 3.381 10 0 GGAEMN O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@@H]1CCCc2n[nH]nc21 ZINC000618359918 567378041 /nfs/dbraw/zinc/37/80/41/567378041.db2.gz ICGPIUTYXGGVFH-RISCZKNCSA-N 0 1 393.310 3.091 10 0 GGAEMN CN(C(=O)CCCC(=O)c1ccc(Br)cc1)[C@H]1CCN(C2CC2)C1 ZINC000501288887 567378299 /nfs/dbraw/zinc/37/82/99/567378299.db2.gz NYEJIEIISHITIW-KRWDZBQOSA-N 0 1 393.325 3.497 10 0 GGAEMN COCCOc1ccc(Br)cc1NS(=O)(=O)c1ccccc1 ZINC000477185091 567378780 /nfs/dbraw/zinc/37/87/80/567378780.db2.gz FKMNTQDBNQZIMW-UHFFFAOYSA-N 0 1 386.267 3.275 10 0 GGAEMN CO[C@H](CN1CCO[C@H](c2ccc(Br)cc2)[C@H]1C)[C@H]1CCOC1 ZINC000661517986 567379037 /nfs/dbraw/zinc/37/90/37/567379037.db2.gz ZXJTXDLCTJJJLM-SIUPPRGNSA-N 0 1 384.314 3.262 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000618361781 567380161 /nfs/dbraw/zinc/38/01/61/567380161.db2.gz SNYHFVUMZHXJLP-OAHLLOKOSA-N 0 1 395.326 3.384 10 0 GGAEMN C[C@H](NC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(Br)cn1 ZINC000527893888 567381551 /nfs/dbraw/zinc/38/15/51/567381551.db2.gz LBLCOTCFAXVTFG-WFASDCNBSA-N 0 1 381.318 3.221 10 0 GGAEMN CN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@@H]1CN2CCC1CC2 ZINC000569155650 567381967 /nfs/dbraw/zinc/38/19/67/567381967.db2.gz KKSDZACSUPOFGV-CQSZACIVSA-N 0 1 389.297 3.005 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOC[C@@H]1c1ccc(Br)cc1 ZINC000618364265 567382831 /nfs/dbraw/zinc/38/28/31/567382831.db2.gz FWNXKQXKCZQNGP-WMLDXEAASA-N 0 1 390.281 3.192 10 0 GGAEMN CN(C(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)[C@@H]1CN2CCC1CC2 ZINC000435678994 567383407 /nfs/dbraw/zinc/38/34/07/567383407.db2.gz UYIPWEFNMYOBQK-QGZVFWFLSA-N 0 1 379.291 3.345 10 0 GGAEMN O[C@]1(C2CC2)CCCN(Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000661635565 567384016 /nfs/dbraw/zinc/38/40/16/567384016.db2.gz PLSMWTHOKPFQPI-QGZVFWFLSA-N 0 1 378.270 3.236 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)CCCSc2ccc(Cl)cc2)[nH][nH]1 ZINC000435709824 567384606 /nfs/dbraw/zinc/38/46/06/567384606.db2.gz GKQQFPHPYRHVGI-UHFFFAOYSA-N 0 1 375.885 3.397 10 0 GGAEMN Cc1cc(Cl)c(NC(=O)C(=O)N2CCC(c3cnc[nH]3)CC2)cc1Cl ZINC000501404027 567386040 /nfs/dbraw/zinc/38/60/40/567386040.db2.gz FKSPAYDHJZPENN-UHFFFAOYSA-N 0 1 381.263 3.370 10 0 GGAEMN CN(C)[C@@H](CNC(=O)Cc1ccc(Br)cc1O)c1cccc(F)c1 ZINC000477310691 567388213 /nfs/dbraw/zinc/38/82/13/567388213.db2.gz MJTXKVTZDFCWDV-INIZCTEOSA-N 0 1 395.272 3.255 10 0 GGAEMN CCn1c(-c2ccc(Br)s2)nnc1N1CCN(C2CC2)CC1 ZINC000549399202 567389248 /nfs/dbraw/zinc/38/92/48/567389248.db2.gz IHBXWMPEHCRCFM-UHFFFAOYSA-N 0 1 382.331 3.073 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)CSCc2cc(-c3cccs3)on2)n[nH]1 ZINC000477338518 567389536 /nfs/dbraw/zinc/38/95/36/567389536.db2.gz NKQQEGRXQNQTPM-JTQLQIEISA-N 0 1 377.495 3.194 10 0 GGAEMN O=C(c1sc2ncccc2c1Cl)N1CCC(CN2CCOCC2)CC1 ZINC000528012690 567390279 /nfs/dbraw/zinc/39/02/79/567390279.db2.gz UDTMPUZMDJWQAO-UHFFFAOYSA-N 0 1 379.913 3.134 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000528004412 567390321 /nfs/dbraw/zinc/39/03/21/567390321.db2.gz GEMNFTUUJNMCEA-LGDVELKSSA-N 0 1 388.327 3.069 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000528004861 567390483 /nfs/dbraw/zinc/39/04/83/567390483.db2.gz GEMNFTUUJNMCEA-UBSBXFKZSA-N 0 1 388.327 3.069 10 0 GGAEMN C[C@@H]1Cc2cn[nH]c2[C@@H](C(=O)Nc2nnc(C(F)(F)C(F)(F)F)s2)C1 ZINC000640737877 567390531 /nfs/dbraw/zinc/39/05/31/567390531.db2.gz DGHMQRVVLXHAEO-VDTYLAMSSA-N 0 1 381.330 3.220 10 0 GGAEMN CC(=O)Nc1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000501503659 567392658 /nfs/dbraw/zinc/39/26/58/567392658.db2.gz LXBDERKHZWCQCA-UHFFFAOYSA-N 0 1 387.237 3.214 10 0 GGAEMN CNC(=O)c1cccc(CN[C@@H]2CCOc3c(Br)cccc32)c1 ZINC000501561648 567396517 /nfs/dbraw/zinc/39/65/17/567396517.db2.gz MPNHIGIHQJKJLY-MRXNPFEDSA-N 0 1 375.266 3.422 10 0 GGAEMN CN(CC(=O)NCC1(Cc2ccc(Br)cc2)CC1)[C@H]1CCSC1 ZINC000618537086 567396907 /nfs/dbraw/zinc/39/69/07/567396907.db2.gz CPLDAUKYWKBOFF-INIZCTEOSA-N 0 1 397.382 3.325 10 0 GGAEMN O=C(NCC1(Cc2ccc(Br)cc2)CC1)[C@H]1CCCc2n[nH]nc21 ZINC000618540599 567398354 /nfs/dbraw/zinc/39/83/54/567398354.db2.gz XIRNEJGJLYBEDL-AWEZNQCLSA-N 0 1 389.297 3.126 10 0 GGAEMN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@H](C)O[C@@H](C)C1 ZINC000661858170 567398795 /nfs/dbraw/zinc/39/87/95/567398795.db2.gz ZKPIRLICOQWLSD-ILXRZTDVSA-N 0 1 383.330 3.295 10 0 GGAEMN CC1(N2CCOCC2)CCN(c2ncc3scc(Br)c3n2)CC1 ZINC000528189667 567400712 /nfs/dbraw/zinc/40/07/12/567400712.db2.gz FOQXMPPPYPCZPX-UHFFFAOYSA-N 0 1 397.342 3.145 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC[C@]2(CCOC2)C1 ZINC000456697905 567402744 /nfs/dbraw/zinc/40/27/44/567402744.db2.gz BYQFQUNDSUZVEP-SFHVURJKSA-N 0 1 390.281 3.482 10 0 GGAEMN CCN(CC)[C@@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccco1 ZINC000477616855 567404844 /nfs/dbraw/zinc/40/48/44/567404844.db2.gz KPCUSUBESDGVTM-HNNXBMFYSA-N 0 1 395.297 3.490 10 0 GGAEMN O[C@H](COc1cc(F)cc(Br)c1)CN1CCC(c2ccon2)CC1 ZINC000662048514 567405847 /nfs/dbraw/zinc/40/58/47/567405847.db2.gz YIHCTVMQYVOQND-HNNXBMFYSA-N 0 1 399.260 3.196 10 0 GGAEMN O[C@@H](COc1cc(F)cc(Br)c1)CN1CCC(c2ccon2)CC1 ZINC000662048515 567406324 /nfs/dbraw/zinc/40/63/24/567406324.db2.gz YIHCTVMQYVOQND-OAHLLOKOSA-N 0 1 399.260 3.196 10 0 GGAEMN Cc1n[nH]c(C(=O)N[C@H](C)CCc2ccc(I)cc2)c1C ZINC000477662563 567407892 /nfs/dbraw/zinc/40/78/92/567407892.db2.gz KDOSPZRFSZGLJX-SNVBAGLBSA-N 0 1 397.260 3.382 10 0 GGAEMN CN(Cc1nnc[nH]1)C(=O)N[C@@H]1CCCCc2cc(Br)ccc21 ZINC000662081285 567409555 /nfs/dbraw/zinc/40/95/55/567409555.db2.gz WTYHTQMALDOJNA-CQSZACIVSA-N 0 1 378.274 3.176 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1F)CN1CCc2ccccc2C1 ZINC000549784444 567410496 /nfs/dbraw/zinc/41/04/96/567410496.db2.gz ACHJSYXPYWRWII-INIZCTEOSA-N 0 1 380.257 3.386 10 0 GGAEMN CN(Cc1ccccc1)C1CN(C(=O)c2cc(Br)cc3nc[nH]c32)C1 ZINC000569518921 567411025 /nfs/dbraw/zinc/41/10/25/567411025.db2.gz UYMSMLZROSUGFS-UHFFFAOYSA-N 0 1 399.292 3.282 10 0 GGAEMN COC(=O)[C@@H](NS(=O)(=O)Cc1ccc(Cl)cc1Cl)c1cccs1 ZINC000501896460 567411619 /nfs/dbraw/zinc/41/16/19/567411619.db2.gz ZTFDITZUPDMELP-ZDUSSCGKSA-N 0 1 394.301 3.389 10 0 GGAEMN Brc1ccccc1-n1nnnc1CN(CCC1CC1)CC1CC1 ZINC000662179148 567414770 /nfs/dbraw/zinc/41/47/70/567414770.db2.gz JSTONVQEPQTNHM-UHFFFAOYSA-N 0 1 376.302 3.437 10 0 GGAEMN CSc1ccc(NC(=O)c2cccc(N3CCN(C)CC3)n2)cc1Cl ZINC000502031857 567416660 /nfs/dbraw/zinc/41/66/60/567416660.db2.gz LTSFXOABOYPWIG-UHFFFAOYSA-N 0 1 376.913 3.461 10 0 GGAEMN Cc1ccc(Br)cc1NC(=O)c1cccc(N2CCN(C)CC2)n1 ZINC000502056368 567417758 /nfs/dbraw/zinc/41/77/58/567417758.db2.gz JSWRQWADGDWFKJ-UHFFFAOYSA-N 0 1 389.297 3.157 10 0 GGAEMN CC[C@@H]1C[C@H](N=c2nc[nH]c3cc(I)sc32)CCO1 ZINC000593480924 567418370 /nfs/dbraw/zinc/41/83/70/567418370.db2.gz ZBWJKYDBXYUPIV-RKDXNWHRSA-N 0 1 389.262 3.087 10 0 GGAEMN O=C(N[C@@H]1CCOc2ccc(Br)cc21)c1[nH]nc2c1CCCC2 ZINC000618870555 567419216 /nfs/dbraw/zinc/41/92/16/567419216.db2.gz PEVXVADDUYDNQQ-CYBMUJFWSA-N 0 1 376.254 3.305 10 0 GGAEMN CC(C)Nc1cc(Br)ccc1NC(=O)[C@@H]1CCCc2n[nH]nc21 ZINC000618885487 567422157 /nfs/dbraw/zinc/42/21/57/567422157.db2.gz NMBAEMKYAYDZJI-LLVKDONJSA-N 0 1 378.274 3.446 10 0 GGAEMN O=C(c1scc(Br)c1Br)N1CCN2CCC[C@H]2C1 ZINC000528439028 567423169 /nfs/dbraw/zinc/42/31/69/567423169.db2.gz CDAQLUOXBRRQBV-QMMMGPOBSA-N 0 1 394.132 3.193 10 0 GGAEMN COc1cc(NC(=O)c2c[n-]c3[nH+]c(C)ccc3c2=O)ncc1Br ZINC000477846700 567423412 /nfs/dbraw/zinc/42/34/12/567423412.db2.gz QZUPHKBWKDYXLC-UHFFFAOYSA-N 0 1 389.209 3.062 10 0 GGAEMN Cn1cc(C[C@H]2CCC[C@@H]2NC(=O)c2cccc(Br)c2O)cn1 ZINC000618928772 567424706 /nfs/dbraw/zinc/42/47/06/567424706.db2.gz BSPRWZGYMWOQAO-DOMZBBRYSA-N 0 1 378.270 3.029 10 0 GGAEMN O=S(=O)(NC[C@@H](n1cccn1)C(F)(F)F)c1cc(Cl)sc1Cl ZINC000528457909 567425154 /nfs/dbraw/zinc/42/51/54/567425154.db2.gz QLXJJGWSUHLXDS-SSDOTTSWSA-N 0 1 394.227 3.333 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)N2CCC[C@@H](C)C2)c2cccs2)CC1 ZINC000502322300 567428342 /nfs/dbraw/zinc/42/83/42/567428342.db2.gz YDJMMRLQHWLCNQ-IAGOWNOFSA-N 0 1 385.599 3.087 10 0 GGAEMN COc1ccc(N2CCN(C(=O)c3c(O)cc(Cl)cc3Cl)CC2)nc1 ZINC000457009510 567432393 /nfs/dbraw/zinc/43/23/93/567432393.db2.gz DKCKQHQOMGHEKS-UHFFFAOYSA-N 0 1 382.247 3.065 10 0 GGAEMN O=C(NCc1nnc(-c2ccc(Br)cc2)[nH]1)c1ccc(F)cc1O ZINC000436536388 567433500 /nfs/dbraw/zinc/43/35/00/567433500.db2.gz PZHSXNRPTRXCGS-UHFFFAOYSA-N 0 1 391.200 3.009 10 0 GGAEMN O=S(=O)(Cc1cccc(C(F)(F)F)c1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000528547802 567435366 /nfs/dbraw/zinc/43/53/66/567435366.db2.gz IXQIYWJPEBZNDS-INIZCTEOSA-N 0 1 376.444 3.142 10 0 GGAEMN O=S(=O)(Cc1cccc(C(F)(F)F)c1)NC[C@@H]1CCN1C1CCCC1 ZINC000528547802 567435371 /nfs/dbraw/zinc/43/53/71/567435371.db2.gz IXQIYWJPEBZNDS-INIZCTEOSA-N 0 1 376.444 3.142 10 0 GGAEMN O=C(c1c(O)cccc1F)N1CCN(Cc2ccc(Br)cc2)CC1 ZINC000436567354 567435402 /nfs/dbraw/zinc/43/54/02/567435402.db2.gz SIFCFMSIXSRANL-UHFFFAOYSA-N 0 1 393.256 3.252 10 0 GGAEMN OCC1(CCNCc2c(F)ccc(I)c2F)CCC1 ZINC000593692825 567435983 /nfs/dbraw/zinc/43/59/83/567435983.db2.gz FQQKCJPOHZYMTD-UHFFFAOYSA-N 0 1 381.204 3.212 10 0 GGAEMN O=C(c1ccc(F)cc1O)N1CCN(Cc2ccc(Br)cc2)CC1 ZINC000436597862 567437039 /nfs/dbraw/zinc/43/70/39/567437039.db2.gz RNDHPHFPXUQKLO-UHFFFAOYSA-N 0 1 393.256 3.252 10 0 GGAEMN O=S(=O)(Cc1ccccc1C(F)(F)F)NC[C@@H]1CCN1C1CCCC1 ZINC000528555093 567437180 /nfs/dbraw/zinc/43/71/80/567437180.db2.gz VQTPSMNEVFRTDT-HNNXBMFYSA-N 0 1 376.444 3.142 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)c2cc(C(C)(C)N)no2)cc1Br ZINC000662455286 567438302 /nfs/dbraw/zinc/43/83/02/567438302.db2.gz XLXCJCPZIMOGPQ-VIFPVBQESA-N 0 1 382.258 3.131 10 0 GGAEMN COc1ncc(C(=O)N(C)C2CCN(CCC(F)(F)F)CC2)cc1Cl ZINC000457077273 567438355 /nfs/dbraw/zinc/43/83/55/567438355.db2.gz ZTZLMHAMJQOFEB-UHFFFAOYSA-N 0 1 379.810 3.232 10 0 GGAEMN CN1CCC[C@H]1CNC(=O)c1scc(Br)c1Br ZINC000528563514 567438363 /nfs/dbraw/zinc/43/83/63/567438363.db2.gz ZEYBMYQFCAKRBQ-ZETCQYMHSA-N 0 1 382.121 3.097 10 0 GGAEMN O=C(Nc1cccc([C@H]2CNC(=O)C2)c1)c1ccc(Br)cc1O ZINC000436605694 567438840 /nfs/dbraw/zinc/43/88/40/567438840.db2.gz PVFBRGFYRINYNM-LLVKDONJSA-N 0 1 375.222 3.011 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC12CCCC2 ZINC000593759787 567439478 /nfs/dbraw/zinc/43/94/78/567439478.db2.gz AAPSJULYDFMSNV-UHFFFAOYSA-N 0 1 381.217 3.326 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N1CCC(COc2cc(Cl)cc(Cl)c2)CC1 ZINC000662475041 567439644 /nfs/dbraw/zinc/43/96/44/567439644.db2.gz HWQVPOBTEGJIMP-KRWDZBQOSA-N 0 1 389.323 3.363 10 0 GGAEMN COc1ccc(Br)cc1CN1CC2(CCOCC2)CC[C@H]1CO ZINC000528642444 567444221 /nfs/dbraw/zinc/44/42/21/567444221.db2.gz YEMNHYNCVSTUES-INIZCTEOSA-N 0 1 384.314 3.211 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC2(c3cccc(Br)c3)CCC2)on1 ZINC000662523380 567444755 /nfs/dbraw/zinc/44/47/55/567444755.db2.gz AZHOFAWWZDJJBN-UHFFFAOYSA-N 0 1 392.297 3.483 10 0 GGAEMN NC(=O)Nc1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)ccc1F ZINC000478261545 567444865 /nfs/dbraw/zinc/44/48/65/567444865.db2.gz XJBMCVWBOIZLGP-UHFFFAOYSA-N 0 1 392.188 3.207 10 0 GGAEMN OC[C@H]1CCC2(CCOCC2)CN1CCOc1ccccc1Br ZINC000528646525 567445289 /nfs/dbraw/zinc/44/52/89/567445289.db2.gz WFXYIPRLMJKEGY-OAHLLOKOSA-N 0 1 384.314 3.081 10 0 GGAEMN CSc1c(C(=O)NC[C@@H](c2cccs2)N2CCC(C)CC2)cnn1C ZINC000478283627 567445563 /nfs/dbraw/zinc/44/55/63/567445563.db2.gz OAXFWJMFOIQMOZ-HNNXBMFYSA-N 0 1 378.567 3.407 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(Br)c(Cl)c3)[C@H]2C1 ZINC000502646750 567445694 /nfs/dbraw/zinc/44/56/94/567445694.db2.gz HZXILISVHNGZDL-LSDHHAIUSA-N 0 1 387.705 3.038 10 0 GGAEMN NC(=O)[C@@H](NCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1 ZINC000502657318 567445773 /nfs/dbraw/zinc/44/57/73/567445773.db2.gz YOQOCLSPZLUXOT-HNNXBMFYSA-N 0 1 387.199 3.225 10 0 GGAEMN CCc1cc(Br)cc2sc(NC(=O)[C@@H](N)COC(C)C)nc21 ZINC000662535929 567446515 /nfs/dbraw/zinc/44/65/15/567446515.db2.gz PKCWYHCYGJGGIX-NSHDSACASA-N 0 1 386.315 3.312 10 0 GGAEMN O=C(CN[C@H](c1ccccn1)C1CCC1)Nc1ccc(Br)cn1 ZINC000528657680 567446687 /nfs/dbraw/zinc/44/66/87/567446687.db2.gz KIKRXINVLDWJMM-KRWDZBQOSA-N 0 1 375.270 3.309 10 0 GGAEMN Cc1ccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(O)c1 ZINC000436733766 567447537 /nfs/dbraw/zinc/44/75/37/567447537.db2.gz YTECYLRJDJYRPD-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN Cc1ccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(O)c1 ZINC000436733766 567447542 /nfs/dbraw/zinc/44/75/42/567447542.db2.gz YTECYLRJDJYRPD-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN C[C@@H](c1ncc(Br)cn1)[N@@H+]1C[C@H](C(=O)[O-])[C@@H](c2ccccc2)C1 ZINC000569971021 567447692 /nfs/dbraw/zinc/44/76/92/567447692.db2.gz BLURCTSKECNURZ-GLQYFDAESA-N 0 1 376.254 3.100 10 0 GGAEMN C[C@@H](c1ncc(Br)cn1)[N@H+]1C[C@H](C(=O)[O-])[C@@H](c2ccccc2)C1 ZINC000569971021 567447696 /nfs/dbraw/zinc/44/76/96/567447696.db2.gz BLURCTSKECNURZ-GLQYFDAESA-N 0 1 376.254 3.100 10 0 GGAEMN CC(C)CN1CCN(C(=O)N[C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000619377099 567448458 /nfs/dbraw/zinc/44/84/58/567448458.db2.gz CJKFYBRYDLRCNP-QGZVFWFLSA-N 0 1 380.330 3.420 10 0 GGAEMN CO[C@@H]1CCC[C@@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000550471286 567449358 /nfs/dbraw/zinc/44/93/58/567449358.db2.gz HFDIBLOVNRMPMC-TZMCWYRMSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@@H]1CCC[C@@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000550471286 567449365 /nfs/dbraw/zinc/44/93/65/567449365.db2.gz HFDIBLOVNRMPMC-TZMCWYRMSA-N 0 1 393.285 3.056 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC(C)(C)c2cccc(Br)c2)on1 ZINC000662559048 567449598 /nfs/dbraw/zinc/44/95/98/567449598.db2.gz PNRADKFZMXSUHA-UHFFFAOYSA-N 0 1 380.286 3.339 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)c2cc(Br)ccc2O)ccc1F ZINC000436746267 567450141 /nfs/dbraw/zinc/45/01/41/567450141.db2.gz XKISOCRIIBRNBP-UHFFFAOYSA-N 0 1 381.245 3.285 10 0 GGAEMN Cc1cc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3Cl)[C@H](C)C2)n[nH]1 ZINC000457253929 567451333 /nfs/dbraw/zinc/45/13/33/567451333.db2.gz BTRQDNOJABOXPM-LLVKDONJSA-N 0 1 381.263 3.012 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC2(c3cccc(Br)c3)CC2)on1 ZINC000662601368 567452470 /nfs/dbraw/zinc/45/24/70/567452470.db2.gz JXCPZVXPZXGVLE-UHFFFAOYSA-N 0 1 378.270 3.093 10 0 GGAEMN CN(C)C[C@@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000528766529 567453096 /nfs/dbraw/zinc/45/30/96/567453096.db2.gz NLFAIIFPJLPOKJ-UONOGXRCSA-N 0 1 398.256 3.349 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000528751404 567453196 /nfs/dbraw/zinc/45/31/96/567453196.db2.gz CONVIWDYNNFOSY-ZHRONYKTSA-N 0 1 380.535 3.115 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000528751396 567453262 /nfs/dbraw/zinc/45/32/62/567453262.db2.gz CONVIWDYNNFOSY-IPJQOSJUSA-N 0 1 380.535 3.115 10 0 GGAEMN Cc1cc(C(=O)N2CCN(C(=O)c3cccc(Cl)c3Cl)[C@H](C)C2)n[nH]1 ZINC000457282192 567453950 /nfs/dbraw/zinc/45/39/50/567453950.db2.gz LDWOZWPQNFQQPD-LLVKDONJSA-N 0 1 381.263 3.012 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662644091 567454198 /nfs/dbraw/zinc/45/41/98/567454198.db2.gz VFSAJHPXOKUYNS-VIFPVBQESA-N 0 1 384.249 3.131 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2CCOc2cc(F)cc(Br)c2)n[nH]1 ZINC000528790171 567457127 /nfs/dbraw/zinc/45/71/27/567457127.db2.gz UZYNDDUIHNZSBB-HNNXBMFYSA-N 0 1 382.233 3.300 10 0 GGAEMN CC(C)(N)c1cc(C(=O)Nc2cc(Cl)ccc2N2CCSCC2)on1 ZINC000662700428 567457483 /nfs/dbraw/zinc/45/74/83/567457483.db2.gz HXHJWIWPZMMUKC-UHFFFAOYSA-N 0 1 380.901 3.327 10 0 GGAEMN CCOc1ccc(NC(=O)[C@](C)(N)c2ccc(Br)cc2)nc1C ZINC000662737706 567459006 /nfs/dbraw/zinc/45/90/06/567459006.db2.gz BAECMGSQGFIKPG-QGZVFWFLSA-N 0 1 378.270 3.364 10 0 GGAEMN C[C@](N)(C(=O)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21)c1ccc(Br)cc1 ZINC000662740169 567459351 /nfs/dbraw/zinc/45/93/51/567459351.db2.gz RYQLPIWWADNIRY-SFNKJDCFSA-N 0 1 389.268 3.217 10 0 GGAEMN CCOc1ccc(NC(=O)[C@@](C)(N)c2ccc(Br)cc2)nc1C ZINC000662737704 567459608 /nfs/dbraw/zinc/45/96/08/567459608.db2.gz BAECMGSQGFIKPG-KRWDZBQOSA-N 0 1 378.270 3.364 10 0 GGAEMN COC(=O)C1(CNC(=O)c2cc(Br)cc3nc[nH]c32)CCCCC1 ZINC000502863814 567459575 /nfs/dbraw/zinc/45/95/75/567459575.db2.gz RPGVQRGPDSVFOE-UHFFFAOYSA-N 0 1 394.269 3.179 10 0 GGAEMN CCc1cnc(CCNC(=O)c2cc(Br)cc3nc[nH]c32)s1 ZINC000502969504 567462154 /nfs/dbraw/zinc/46/21/54/567462154.db2.gz MGIJMAOHJSCJKA-UHFFFAOYSA-N 0 1 379.283 3.317 10 0 GGAEMN CN1CCOc2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc21 ZINC000502992522 567463674 /nfs/dbraw/zinc/46/36/74/567463674.db2.gz SQSPJJIHJFXPJL-UHFFFAOYSA-N 0 1 387.237 3.406 10 0 GGAEMN COC[C@](C)(NC(=O)c1cc(Br)cc2nc[nH]c21)C(F)(F)F ZINC000502982488 567463920 /nfs/dbraw/zinc/46/39/20/567463920.db2.gz MVDGNYPFEOBPMX-LBPRGKRZSA-N 0 1 380.164 3.023 10 0 GGAEMN C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1nc(C(C)(C)C)no1 ZINC000502972945 567463968 /nfs/dbraw/zinc/46/39/68/567463968.db2.gz XJDOYXJYMGFMNE-QMMMGPOBSA-N 0 1 392.257 3.497 10 0 GGAEMN COCCN1CCCN(C(=O)c2oc3ccc(Br)cc3c2C)CC1 ZINC000478517040 567464181 /nfs/dbraw/zinc/46/41/81/567464181.db2.gz ZBEXWLGLPZXCGM-UHFFFAOYSA-N 0 1 395.297 3.298 10 0 GGAEMN C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(Br)cc(Cl)c1[O-] ZINC000436911377 567465137 /nfs/dbraw/zinc/46/51/37/567465137.db2.gz QGDJTZOYEDTOER-JTQLQIEISA-N 0 1 375.694 3.412 10 0 GGAEMN Cc1ccc(NC(=O)N2CCC(C)(N3CCOCC3)CC2)cc1Br ZINC000528892225 567466789 /nfs/dbraw/zinc/46/67/89/567466789.db2.gz NQKIKIVBWUTTLS-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1ccc2c(c1)CC(=O)N2 ZINC000503138892 567469245 /nfs/dbraw/zinc/46/92/45/567469245.db2.gz HTAAVFFKYDDRFP-SECBINFHSA-N 0 1 399.248 3.311 10 0 GGAEMN C[N@@H+]1CC[C@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000550952571 567469470 /nfs/dbraw/zinc/46/94/70/567469470.db2.gz UBPHDYWEKHGSDL-UONOGXRCSA-N 0 1 377.901 3.058 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000550952571 567469473 /nfs/dbraw/zinc/46/94/73/567469473.db2.gz UBPHDYWEKHGSDL-UONOGXRCSA-N 0 1 377.901 3.058 10 0 GGAEMN Cc1nc(NC(=O)c2cc(-c3ccoc3)n[nH]2)ccc1I ZINC000619619875 567469521 /nfs/dbraw/zinc/46/95/21/567469521.db2.gz BFMOLZQNBBUSGY-UHFFFAOYSA-N 0 1 394.172 3.230 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@H]1c1cccc(Br)c1 ZINC000570250168 567470084 /nfs/dbraw/zinc/47/00/84/567470084.db2.gz LMAPZIVLSAFRHC-MRXNPFEDSA-N 0 1 389.359 3.258 10 0 GGAEMN CCNC(=O)c1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000503172845 567471029 /nfs/dbraw/zinc/47/10/29/567471029.db2.gz OKUORQCXCYRJCI-UHFFFAOYSA-N 0 1 387.237 3.327 10 0 GGAEMN O=C(NCc1ccc(-n2cccn2)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000503163760 567471093 /nfs/dbraw/zinc/47/10/93/567471093.db2.gz DKFVIQCATKLEIW-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN C[C@@](N)(C(=O)N1C[C@]23COC[C@@]2(C1)CCCC3)c1ccc(Br)cc1 ZINC000662980354 567472014 /nfs/dbraw/zinc/47/20/14/567472014.db2.gz ONDPECUATWBJTE-GBESFXJTSA-N 0 1 393.325 3.042 10 0 GGAEMN C[C@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC(C)(C)C ZINC000594388303 567473175 /nfs/dbraw/zinc/47/31/75/567473175.db2.gz BAGRSKHYRZCJAA-SECBINFHSA-N 0 1 382.258 3.033 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)N1CCC[C@@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000528977741 567474246 /nfs/dbraw/zinc/47/42/46/567474246.db2.gz BTTCBQSIUBEALP-GLJUWKHASA-N 0 1 389.297 3.351 10 0 GGAEMN CCOC(=O)CCN(C(=O)c1[nH]nc2ccc(Br)cc21)C(C)C ZINC000594413778 567474262 /nfs/dbraw/zinc/47/42/62/567474262.db2.gz PZNUNWRZQGXYLC-UHFFFAOYSA-N 0 1 382.258 3.129 10 0 GGAEMN COc1cccc([C@@H]2[C@H](NC(=O)[C@H]3C[C@]3(C)Br)CCN2C2CC2)c1 ZINC000528983310 567475172 /nfs/dbraw/zinc/47/51/72/567475172.db2.gz UMAZMVKOLJEKKC-MTNOOBJLSA-N 0 1 393.325 3.263 10 0 GGAEMN COC[C@](C)([NH2+]Cc1cnc(-c2ccc(Br)cc2)s1)C(=O)[O-] ZINC000551055977 567475165 /nfs/dbraw/zinc/47/51/65/567475165.db2.gz YPIYIWIRRURQGK-HNNXBMFYSA-N 0 1 385.283 3.152 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2ccccc2C[S@](C)=O)c2ccccc2n1C ZINC000551118080 567479452 /nfs/dbraw/zinc/47/94/52/567479452.db2.gz DWUJNBCLCAULRN-DEOSSOPVSA-N 0 1 376.503 3.166 10 0 GGAEMN CCCOc1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cn1 ZINC000503325466 567480418 /nfs/dbraw/zinc/48/04/18/567480418.db2.gz UATVQOVKVWZALQ-UHFFFAOYSA-N 0 1 389.253 3.439 10 0 GGAEMN CCOC(=O)c1csc(NC(=O)c2cc(Br)cc3nc[nH]c32)n1 ZINC000503335488 567482140 /nfs/dbraw/zinc/48/21/40/567482140.db2.gz IUPFEOGKYTUBKT-UHFFFAOYSA-N 0 1 395.238 3.211 10 0 GGAEMN Cc1cc(Br)cc(NC(=O)N2CCC(C)(N3CCOCC3)CC2)c1 ZINC000529066198 567483731 /nfs/dbraw/zinc/48/37/31/567483731.db2.gz BKUBUXJUAYRUTH-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N(C)C)C[C@@H](CC(F)(F)F)O1 ZINC000663238637 567484212 /nfs/dbraw/zinc/48/42/12/567484212.db2.gz GNIYFXDZALCDKY-UPJWGTAASA-N 0 1 379.448 3.102 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N(C)C)C[C@@H](CC(F)(F)F)O1 ZINC000663238636 567485388 /nfs/dbraw/zinc/48/53/88/567485388.db2.gz GNIYFXDZALCDKY-JHJVBQTASA-N 0 1 379.448 3.102 10 0 GGAEMN O=C(N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2)c1c([O-])cc(Cl)cc1Cl ZINC000619968710 567488149 /nfs/dbraw/zinc/48/81/49/567488149.db2.gz CBHISLCAKOBXJF-HUUCEWRRSA-N 0 1 385.291 3.072 10 0 GGAEMN COC(=O)c1cc(C(C)(C)NCc2nc3ccc(Br)cc3[nH]2)no1 ZINC000570487585 567488918 /nfs/dbraw/zinc/48/89/18/567488918.db2.gz KYFVHPJUKSOACW-UHFFFAOYSA-N 0 1 393.241 3.125 10 0 GGAEMN CSc1cc(CNC(=O)c2cc(Br)cc3nc[nH]c32)ccn1 ZINC000503524971 567491168 /nfs/dbraw/zinc/49/11/68/567491168.db2.gz WVUHIZCGVZVIDS-UHFFFAOYSA-N 0 1 377.267 3.372 10 0 GGAEMN CC[C@@H](C)n1[nH]c(=NC(=O)c2cc(Br)cc3[nH]cnc32)cc1C ZINC000503539403 567492725 /nfs/dbraw/zinc/49/27/25/567492725.db2.gz VHXMECIWEONDKM-SECBINFHSA-N 0 1 376.258 3.476 10 0 GGAEMN CC[C@@H](Cn1cncn1)NCc1cc(Br)ccc1Br ZINC000551283921 567493072 /nfs/dbraw/zinc/49/30/72/567493072.db2.gz BTDMXJUCOXDNCV-LBPRGKRZSA-N 0 1 388.107 3.372 10 0 GGAEMN COC(=O)CCN1CCC[C@H](N[C@H]2CCSc3ccc(Cl)cc32)C1=O ZINC000594661036 567493481 /nfs/dbraw/zinc/49/34/81/567493481.db2.gz KKLYZOMWIAHDRL-GJZGRUSLSA-N 0 1 382.913 3.021 10 0 GGAEMN CCc1nn(C)c(CC)c1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503548157 567494134 /nfs/dbraw/zinc/49/41/34/567494134.db2.gz IHDRDEKXWLGKCS-UHFFFAOYSA-N 0 1 390.285 3.114 10 0 GGAEMN CN1CCN(C(=O)Cc2ccc(Br)cc2O)C2(CCCCC2)C1 ZINC000551276040 567494094 /nfs/dbraw/zinc/49/40/94/567494094.db2.gz VQNCIRXDQFUMEV-UHFFFAOYSA-N 0 1 381.314 3.174 10 0 GGAEMN CCOC(=O)[C@@H]1CC[C@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000437341732 567494188 /nfs/dbraw/zinc/49/41/88/567494188.db2.gz HOHVNCHDIWSFFT-YPMHNXCESA-N 0 1 383.279 3.396 10 0 GGAEMN CC[C@H](NCc1cc(Cl)ccc1I)[C@H](O)C(F)F ZINC000594957025 567528835 /nfs/dbraw/zinc/52/88/35/567528835.db2.gz MPBQONUFRHARFF-QWRGUYRKSA-N 0 1 389.611 3.439 10 0 GGAEMN COCC[N@H+]1CCC[C@H]1CNC(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437467817 567496058 /nfs/dbraw/zinc/49/60/58/567496058.db2.gz NKLPZLKLONFXBS-HNNXBMFYSA-N 0 1 386.323 3.172 10 0 GGAEMN C[C@H](CC(=O)OC(C)(C)C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503594339 567496192 /nfs/dbraw/zinc/49/61/92/567496192.db2.gz MJVQPDFISKZJMI-SECBINFHSA-N 0 1 382.258 3.176 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)Nc1ccccc1 ZINC000503594204 567496729 /nfs/dbraw/zinc/49/67/29/567496729.db2.gz KLXQHBYJZDRONU-SNVBAGLBSA-N 0 1 387.237 3.082 10 0 GGAEMN C[S@](=O)c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503595326 567496987 /nfs/dbraw/zinc/49/69/87/567496987.db2.gz XPRFXRGFRATIDN-QFIPXVFZSA-N 0 1 378.251 3.315 10 0 GGAEMN C[S@@](=O)Cc1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503632425 567498001 /nfs/dbraw/zinc/49/80/01/567498001.db2.gz BFQYQLVCKCTGKA-HSZRJFAPSA-N 0 1 392.278 3.456 10 0 GGAEMN CC(C)CCn1ccc(=NC(=O)c2cc(Br)cc3[nH]cnc32)[nH]1 ZINC000503684197 567500097 /nfs/dbraw/zinc/50/00/97/567500097.db2.gz IGLGQDOMSFPNPL-UHFFFAOYSA-N 0 1 376.258 3.242 10 0 GGAEMN O=C(Nc1cccc([C@H]2CNC(=O)C2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503684806 567501098 /nfs/dbraw/zinc/50/10/98/567501098.db2.gz KPCYLMJMLBMSRB-LLVKDONJSA-N 0 1 399.248 3.181 10 0 GGAEMN C[C@H](CC(=O)c1ccco1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503691954 567501455 /nfs/dbraw/zinc/50/14/55/567501455.db2.gz GXEXYVROOXQJOW-SECBINFHSA-N 0 1 376.210 3.310 10 0 GGAEMN COC(=O)c1cccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503692241 567501567 /nfs/dbraw/zinc/50/15/67/567501567.db2.gz JZXROMIBTMYTRN-UHFFFAOYSA-N 0 1 388.221 3.042 10 0 GGAEMN C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)[C@H](O)Cc1ccccc1 ZINC000503694410 567501914 /nfs/dbraw/zinc/50/19/14/567501914.db2.gz GXNYXLHSWFYMRI-MEDUHNTESA-N 0 1 388.265 3.047 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000437631463 567502145 /nfs/dbraw/zinc/50/21/45/567502145.db2.gz RRTAICMZCDDYPF-DOTOQJQBSA-N 0 1 386.323 3.261 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC(c2ccon2)CC1 ZINC000620223801 567504390 /nfs/dbraw/zinc/50/43/90/567504390.db2.gz VNNUEMGPPPCEIC-UHFFFAOYSA-N 0 1 375.226 3.333 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCNC[C@@H]1C(C)C ZINC000529326121 567506082 /nfs/dbraw/zinc/50/60/82/567506082.db2.gz XHRPXSBWWGDEII-SWLSCSKDSA-N 0 1 384.318 3.158 10 0 GGAEMN COC[C@@](C)(NS(=O)(=O)c1ccc(OC)c(Cl)c1Cl)C(F)(F)F ZINC000479155378 567510200 /nfs/dbraw/zinc/51/02/00/567510200.db2.gz MONAEQWNWZZQMH-LLVKDONJSA-N 0 1 396.214 3.248 10 0 GGAEMN CCn1nnc(C)c1CNC1(c2ccc(Br)cc2)CCOCC1 ZINC000570771171 567512167 /nfs/dbraw/zinc/51/21/67/567512167.db2.gz NNPTWUQXQRCBEK-UHFFFAOYSA-N 0 1 379.302 3.164 10 0 GGAEMN CCN(CC)CC(=O)Nc1cccc(NC(=O)[C@H]2C[C@]2(C)Br)c1 ZINC000529395429 567512985 /nfs/dbraw/zinc/51/29/85/567512985.db2.gz TVELSWFTYOSFEQ-PBHICJAKSA-N 0 1 382.302 3.079 10 0 GGAEMN CC(C)N1CCC[C@H](NS(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000551510658 567513192 /nfs/dbraw/zinc/51/31/92/567513192.db2.gz IJTMXHIQKCXKJL-NSHDSACASA-N 0 1 395.750 3.254 10 0 GGAEMN CCOc1cc(CN2CC[C@H](Cc3cnn(C)c3)C2)cc(Br)c1O ZINC000570799734 567515519 /nfs/dbraw/zinc/51/55/19/567515519.db2.gz LWMOEKUQPPDWAA-CYBMUJFWSA-N 0 1 394.313 3.352 10 0 GGAEMN NC(=O)c1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)ccc1Cl ZINC000504004162 567518289 /nfs/dbraw/zinc/51/82/89/567518289.db2.gz HAOKZOSDJKWGOM-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN O=C(Cc1ccn[nH]1)N1CCc2cc(Br)c(Br)cc2C1 ZINC000620359643 567519179 /nfs/dbraw/zinc/51/91/79/567519179.db2.gz BWTCYTSNNBERNE-UHFFFAOYSA-N 0 1 399.086 3.062 10 0 GGAEMN CCN1CCN(CC(C)(C)NC(=O)c2sc3ncccc3c2Cl)CC1 ZINC000529470096 567519483 /nfs/dbraw/zinc/51/94/83/567519483.db2.gz URLAOMVFFMLJHY-UHFFFAOYSA-N 0 1 380.945 3.096 10 0 GGAEMN CC(C)(C(=O)N1CC[C@H](c2nc[nH]n2)C1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000529509236 567522129 /nfs/dbraw/zinc/52/21/29/567522129.db2.gz WPNGTJKEGRPGNE-IINYFYTJSA-N 0 1 383.279 3.187 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000570932435 567523746 /nfs/dbraw/zinc/52/37/46/567523746.db2.gz MWAQTUQPWQRFOW-UHFFFAOYSA-N 0 1 389.670 3.366 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)Nc1cccnc1N(C)C ZINC000438227701 567523808 /nfs/dbraw/zinc/52/38/08/567523808.db2.gz FAVVNHUAONEQND-UHFFFAOYSA-N 0 1 384.299 3.328 10 0 GGAEMN COC(=O)[C@@H]1C[C@@H]1[C@H](C)N[C@@H](C)c1cc2c(cc1Br)OCCO2 ZINC000594922653 567524889 /nfs/dbraw/zinc/52/48/89/567524889.db2.gz GYYRJHRVLSSBPW-MEWQQHAOSA-N 0 1 384.270 3.069 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)c1ccc(-c2nnc[nH]2)cc1 ZINC000504302166 567528014 /nfs/dbraw/zinc/52/80/14/567528014.db2.gz IWJNEMQBEWNVPB-OAHLLOKOSA-N 0 1 399.248 3.488 10 0 GGAEMN CC[C@H](NCc1cc(Cl)ccc1I)[C@@H](O)C(F)F ZINC000594957027 567528401 /nfs/dbraw/zinc/52/84/01/567528401.db2.gz MPBQONUFRHARFF-WDEREUQCSA-N 0 1 389.611 3.439 10 0 GGAEMN Brc1cnc(C2CC2)nc1N1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000663758972 567529442 /nfs/dbraw/zinc/52/94/42/567529442.db2.gz BVNGMDWHABNXPW-GFCCVEGCSA-N 0 1 389.301 3.496 10 0 GGAEMN Brc1cnc(C2CC2)nc1N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000663758972 567529447 /nfs/dbraw/zinc/52/94/47/567529447.db2.gz BVNGMDWHABNXPW-GFCCVEGCSA-N 0 1 389.301 3.496 10 0 GGAEMN FC1(F)C[C@@H]1OCCNCc1cc(Cl)ccc1I ZINC000594972107 567531533 /nfs/dbraw/zinc/53/15/33/567531533.db2.gz YYEOEEABPDQNJO-NSHDSACASA-N 0 1 387.595 3.458 10 0 GGAEMN CCOC(=O)C1CCC(O)(CN2CCc3ccc(Br)cc3C2)CC1 ZINC000551747890 567532501 /nfs/dbraw/zinc/53/25/01/567532501.db2.gz HTWCLHVAWBAZPU-UHFFFAOYSA-N 0 1 396.325 3.292 10 0 GGAEMN OC[C@@H](Cc1ccccc1)NCc1cn(-c2ccc(Cl)cc2Cl)nn1 ZINC000479434444 567534196 /nfs/dbraw/zinc/53/41/96/567534196.db2.gz CWRCJVQVGHDAMX-OAHLLOKOSA-N 0 1 377.275 3.267 10 0 GGAEMN Cc1cc(Br)c(CN2CCc3n[nH]nc3C2)cc1Br ZINC000529621804 567536639 /nfs/dbraw/zinc/53/66/39/567536639.db2.gz MXEJFQYVLTXUAS-UHFFFAOYSA-N 0 1 386.091 3.196 10 0 GGAEMN CCNC(=O)c1ccc(=N[C@@H]2c3cccc(Br)c3CC2(C)C)[nH]n1 ZINC000644143552 567536681 /nfs/dbraw/zinc/53/66/81/567536681.db2.gz XXJMEDUWUJWTPK-MRXNPFEDSA-N 0 1 389.297 3.146 10 0 GGAEMN CCOc1cc(CN[C@@H]2Cc3ccccc3NC2=O)cc(Br)c1O ZINC000529669948 567539460 /nfs/dbraw/zinc/53/94/60/567539460.db2.gz XYCHHDLHFDRGEX-OAHLLOKOSA-N 0 1 391.265 3.206 10 0 GGAEMN CCOc1cc(CN[C@H]2Cc3ccccc3NC2=O)cc(Br)c1O ZINC000529669947 567539565 /nfs/dbraw/zinc/53/95/65/567539565.db2.gz XYCHHDLHFDRGEX-HNNXBMFYSA-N 0 1 391.265 3.206 10 0 GGAEMN O=S(=O)(Nc1ccccc1O[C@@H]1CCOC1)c1ccc2ncsc2c1 ZINC000479494770 567539938 /nfs/dbraw/zinc/53/99/38/567539938.db2.gz HKFCTFZHXCBWSF-GFCCVEGCSA-N 0 1 376.459 3.265 10 0 GGAEMN O=C(NCCCc1nc[nH]n1)Nc1ccc(C(F)(F)F)c(Br)c1 ZINC000551865798 567540600 /nfs/dbraw/zinc/54/06/00/567540600.db2.gz KJTGFANICHOSGZ-UHFFFAOYSA-N 0 1 392.179 3.340 10 0 GGAEMN O=S(=O)(Nc1ccccc1O[C@H]1CCOC1)c1ccc2ncsc2c1 ZINC000479494772 567541055 /nfs/dbraw/zinc/54/10/55/567541055.db2.gz HKFCTFZHXCBWSF-LBPRGKRZSA-N 0 1 376.459 3.265 10 0 GGAEMN O=C(Cc1sccc1Br)NC[C@H]1CCN1Cc1ccccc1 ZINC000620777098 567541461 /nfs/dbraw/zinc/54/14/61/567541461.db2.gz CWOIDNYGDRTBKT-CQSZACIVSA-N 0 1 379.323 3.444 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)Nc2cnc3c(Br)cccn23)n[nH]1 ZINC000571160345 567541522 /nfs/dbraw/zinc/54/15/22/567541522.db2.gz AGUGVSHEYVMBEX-VIFPVBQESA-N 0 1 392.261 3.221 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)Nc2cnc3c(Br)cccn23)n[nH]1 ZINC000571160344 567542410 /nfs/dbraw/zinc/54/24/10/567542410.db2.gz AGUGVSHEYVMBEX-SECBINFHSA-N 0 1 392.261 3.221 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000571184438 567543000 /nfs/dbraw/zinc/54/30/00/567543000.db2.gz ZBPSPJIDGCCRQA-VZEFYGNVSA-N 0 1 396.329 3.061 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000551921894 567543858 /nfs/dbraw/zinc/54/38/58/567543858.db2.gz HOTUVJDTFDCQMQ-GXSJLCMTSA-N 0 1 398.688 3.267 10 0 GGAEMN CO[C@H](C)c1cccc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)c1 ZINC000438769008 567544123 /nfs/dbraw/zinc/54/41/23/567544123.db2.gz FYWMEINTZKWSPK-SECBINFHSA-N 0 1 382.825 3.283 10 0 GGAEMN C[C@H](NC(=O)[C@@H]1CCc2[nH]cnc2C1)c1cc(F)c(Br)cc1F ZINC000529750531 567544551 /nfs/dbraw/zinc/54/45/51/567544551.db2.gz MJSDRKFHOSYMIJ-DTWKUNHWSA-N 0 1 384.224 3.433 10 0 GGAEMN C[C@@]1(F)CCCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000458426033 567546066 /nfs/dbraw/zinc/54/60/66/567546066.db2.gz MSUADAGOOUOFBK-MRXNPFEDSA-N 0 1 396.264 3.268 10 0 GGAEMN C[C@@]1(F)CCCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000458426033 567546073 /nfs/dbraw/zinc/54/60/73/567546073.db2.gz MSUADAGOOUOFBK-MRXNPFEDSA-N 0 1 396.264 3.268 10 0 GGAEMN CC[C@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(F)F ZINC000458416814 567546611 /nfs/dbraw/zinc/54/66/11/567546611.db2.gz FMLZSNXQTYCBRA-JTQLQIEISA-N 0 1 388.216 3.077 10 0 GGAEMN CC[C@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(F)F ZINC000458416814 567546615 /nfs/dbraw/zinc/54/66/15/567546615.db2.gz FMLZSNXQTYCBRA-JTQLQIEISA-N 0 1 388.216 3.077 10 0 GGAEMN Cc1cc(CNCc2cccc(N3CCOCC3)n2)sc1Br ZINC000479606382 567547200 /nfs/dbraw/zinc/54/72/00/567547200.db2.gz PQGIHCCAQDDWNP-UHFFFAOYSA-N 0 1 382.327 3.340 10 0 GGAEMN O=C(NC/C=C\c1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000571278306 567550223 /nfs/dbraw/zinc/55/02/23/567550223.db2.gz IJGQFOOAHLZZRM-DDGIKZQJSA-N 0 1 375.270 3.042 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000571330912 567554300 /nfs/dbraw/zinc/55/43/00/567554300.db2.gz OZLNDOLWBJSHGT-KGLIPLIRSA-N 0 1 380.476 3.459 10 0 GGAEMN C[C@@H](C(=O)N1CCC(C)(N2CCOCC2)CC1)c1ccc(Br)cc1 ZINC000529911620 567554432 /nfs/dbraw/zinc/55/44/32/567554432.db2.gz VPMMBXUFDQDQCB-OAHLLOKOSA-N 0 1 395.341 3.266 10 0 GGAEMN O[C@H](CNCc1ccc(Cl)o1)COc1cc(F)cc(Br)c1 ZINC000644519209 567554435 /nfs/dbraw/zinc/55/44/35/567554435.db2.gz HMJBSXACENIISL-LLVKDONJSA-N 0 1 378.625 3.364 10 0 GGAEMN COC[C@@H](CN1CCC[C@@H]1c1ccc(I)cc1)OC ZINC000595333576 567554547 /nfs/dbraw/zinc/55/45/47/567554547.db2.gz KMUGHOSHGMTNGI-HUUCEWRRSA-N 0 1 375.250 3.090 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(C)(N3CCOCC3)CC2)cc1Br ZINC000529913638 567554788 /nfs/dbraw/zinc/55/47/88/567554788.db2.gz KJQJLCHJHNOKBW-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN Cc1c(Br)ccc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1F ZINC000529911023 567555337 /nfs/dbraw/zinc/55/53/37/567555337.db2.gz YTTATUYCIBEFAK-UHFFFAOYSA-N 0 1 399.304 3.224 10 0 GGAEMN Cc1cc(Br)c(C(=O)N2CCC(C)(N3CCOCC3)CC2)s1 ZINC000529910575 567555485 /nfs/dbraw/zinc/55/54/85/567555485.db2.gz VIKFWZUARSHUCB-UHFFFAOYSA-N 0 1 387.343 3.146 10 0 GGAEMN C[C@H](C(=O)N1CCC(C)(N2CCOCC2)CC1)c1cccc(Br)c1 ZINC000529908977 567555512 /nfs/dbraw/zinc/55/55/12/567555512.db2.gz PBBUTVXPQWOQAD-HNNXBMFYSA-N 0 1 395.341 3.266 10 0 GGAEMN O=C(N[C@@H](c1ccncc1)C1(CO)CCC1)c1cccc(Br)c1O ZINC000621032871 567556801 /nfs/dbraw/zinc/55/68/01/567556801.db2.gz AJYAEYBBFAJECS-INIZCTEOSA-N 0 1 391.265 3.183 10 0 GGAEMN CC1(C)C[C@]1(C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000664202885 567557162 /nfs/dbraw/zinc/55/71/62/567557162.db2.gz QSXUYRLGGODGHX-INIZCTEOSA-N 0 1 378.274 3.222 10 0 GGAEMN CC1(C)C[C@]1(C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000664202885 567557170 /nfs/dbraw/zinc/55/71/70/567557170.db2.gz QSXUYRLGGODGHX-INIZCTEOSA-N 0 1 378.274 3.222 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)c2cc(Br)cc3[nH]cnc32)n[nH]1 ZINC000505079458 567557210 /nfs/dbraw/zinc/55/72/10/567557210.db2.gz FVWSKJZQKHGZGK-IUCAKERBSA-N 0 1 391.273 3.448 10 0 GGAEMN CC[C@@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000664200781 567557358 /nfs/dbraw/zinc/55/73/58/567557358.db2.gz DCUZAWVGONLVQX-CYBMUJFWSA-N 0 1 378.274 3.222 10 0 GGAEMN CC[C@@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000664200781 567557363 /nfs/dbraw/zinc/55/73/63/567557363.db2.gz DCUZAWVGONLVQX-CYBMUJFWSA-N 0 1 378.274 3.222 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1C[C@@H]2CCCC[C@@H]21 ZINC000664203631 567558017 /nfs/dbraw/zinc/55/80/17/567558017.db2.gz YGFCFXCIUNBMJO-JSGCOSHPSA-N 0 1 390.285 3.318 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1C[C@@H]2CCCC[C@@H]21 ZINC000664203631 567558021 /nfs/dbraw/zinc/55/80/21/567558021.db2.gz YGFCFXCIUNBMJO-JSGCOSHPSA-N 0 1 390.285 3.318 10 0 GGAEMN O=C(Nc1cccc(N2CCC2=O)c1)c1cc(Br)cc2nc[nH]c21 ZINC000505084757 567558498 /nfs/dbraw/zinc/55/84/98/567558498.db2.gz DCQDSHJXHCIJQA-UHFFFAOYSA-N 0 1 385.221 3.314 10 0 GGAEMN C[C@](O)(CNC(=O)c1cc(Br)cc2nc[nH]c21)C1CCCCC1 ZINC000505110019 567560061 /nfs/dbraw/zinc/56/00/61/567560061.db2.gz YADSMITVIXXKIT-KRWDZBQOSA-N 0 1 380.286 3.387 10 0 GGAEMN C[C@@](O)(CNC(=O)c1cc(Br)cc2nc[nH]c21)C1CCCCC1 ZINC000505110020 567560238 /nfs/dbraw/zinc/56/02/38/567560238.db2.gz YADSMITVIXXKIT-QGZVFWFLSA-N 0 1 380.286 3.387 10 0 GGAEMN CN1CC[C@H](CNC(=O)N2C[C@@H]3C[C@H]2CS3)[C@H]1c1ccc(Cl)c(F)c1 ZINC000458628114 567560110 /nfs/dbraw/zinc/56/01/10/567560110.db2.gz WFWSMIUKRZPUBG-XJIUQZFPSA-N 0 1 383.920 3.371 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000552124577 567560979 /nfs/dbraw/zinc/56/09/79/567560979.db2.gz YVAVOCUVJKHKQX-OAHLLOKOSA-N 0 1 382.291 3.256 10 0 GGAEMN CN(Cc1ccccc1)C1CN(C(=O)Cc2ccc(Br)cc2O)C1 ZINC000552119026 567561070 /nfs/dbraw/zinc/56/10/70/567561070.db2.gz HXNLTNWDFJEMRO-UHFFFAOYSA-N 0 1 389.293 3.040 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2cc(Br)cnc2OCC2CC2)n[nH]1 ZINC000552127092 567561840 /nfs/dbraw/zinc/56/18/40/567561840.db2.gz RNIFWDDHVGAVPA-SNVBAGLBSA-N 0 1 393.285 3.025 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031412 567562111 /nfs/dbraw/zinc/56/21/11/567562111.db2.gz IKLNZILZZVMENS-SJKOYZFVSA-N 0 1 381.307 3.241 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCO[C@](C)(C(F)F)C1)c1ccc(Cl)cc1 ZINC000664291842 567562559 /nfs/dbraw/zinc/56/25/59/567562559.db2.gz JIRVJEUUJJKHCD-YOEHRIQHSA-N 0 1 375.847 3.008 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1ccc(C(N)=O)s1)c1ccc(Cl)c(Cl)c1 ZINC000530032692 567563275 /nfs/dbraw/zinc/56/32/75/567563275.db2.gz VRMYUNYFNHCDGT-LBPRGKRZSA-N 0 1 386.304 3.187 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032722 567563321 /nfs/dbraw/zinc/56/33/21/567563321.db2.gz WNFAMXUERDXUAD-SJKOYZFVSA-N 0 1 381.307 3.241 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1ncn(C(C)(C)C)n1)c1ccc(Cl)c(Cl)c1 ZINC000530034312 567563566 /nfs/dbraw/zinc/56/35/66/567563566.db2.gz UTOWTWMPMCUBFB-CQSZACIVSA-N 0 1 384.311 3.373 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1cc2n(n1)CCCO2)c1ccc(Cl)c(Cl)c1 ZINC000530033204 567563787 /nfs/dbraw/zinc/56/37/87/567563787.db2.gz NADRBCKYZIJVKK-OAHLLOKOSA-N 0 1 383.279 3.005 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1cc2n(n1)CCCO2)c1ccc(Cl)c(Cl)c1 ZINC000530033202 567563968 /nfs/dbraw/zinc/56/39/68/567563968.db2.gz NADRBCKYZIJVKK-HNNXBMFYSA-N 0 1 383.279 3.005 10 0 GGAEMN Cn1nc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)c2ccccc21 ZINC000644622654 567564987 /nfs/dbraw/zinc/56/49/87/567564987.db2.gz HUSKJDUXFPEIOQ-GFCCVEGCSA-N 0 1 380.275 3.410 10 0 GGAEMN O[C@H](CNCc1ccc(Cl)cn1)COc1cc(F)cc(Br)c1 ZINC000644615960 567565095 /nfs/dbraw/zinc/56/50/95/567565095.db2.gz ZSTRUFDGUBUGLB-CQSZACIVSA-N 0 1 389.652 3.166 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@H]1CCC(F)(F)C1 ZINC000479932140 567568565 /nfs/dbraw/zinc/56/85/65/567568565.db2.gz PMMNJUNWFAQCBA-JTQLQIEISA-N 0 1 385.212 3.286 10 0 GGAEMN C[C@@H](CN1CCN(C)CC1)NC(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000571526825 567568688 /nfs/dbraw/zinc/56/86/88/567568688.db2.gz AISHUMAIGJWDLA-JTQLQIEISA-N 0 1 379.719 3.404 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCC(F)(F)C1 ZINC000479932140 567568571 /nfs/dbraw/zinc/56/85/71/567568571.db2.gz PMMNJUNWFAQCBA-JTQLQIEISA-N 0 1 385.212 3.286 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CCC(F)(F)C1 ZINC000479932144 567568632 /nfs/dbraw/zinc/56/86/32/567568632.db2.gz PMMNJUNWFAQCBA-SNVBAGLBSA-N 0 1 385.212 3.286 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCC(F)(F)C1 ZINC000479932144 567568637 /nfs/dbraw/zinc/56/86/37/567568637.db2.gz PMMNJUNWFAQCBA-SNVBAGLBSA-N 0 1 385.212 3.286 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1cccc(C(=O)NC2CC2)c1 ZINC000439164359 567568809 /nfs/dbraw/zinc/56/88/09/567568809.db2.gz IFZZOQKIIHBQQU-UHFFFAOYSA-N 0 1 399.248 3.470 10 0 GGAEMN CSc1c(C(=O)Nc2cc(CN3CCSCC3)ccc2C)cnn1C ZINC000479920414 567569320 /nfs/dbraw/zinc/56/93/20/567569320.db2.gz AXRXYDFQDLLDAV-UHFFFAOYSA-N 0 1 376.551 3.252 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)N[C@@H](Cc1nc[nH]n1)c1ccccc1 ZINC000439195571 567570316 /nfs/dbraw/zinc/57/03/16/567570316.db2.gz AVGBODFQRMFTTM-HNNXBMFYSA-N 0 1 376.869 3.029 10 0 GGAEMN Cc1[nH]c2nc(S(=O)(=O)CCCc3ccccc3)nc-2cc1Br ZINC000479967845 567571356 /nfs/dbraw/zinc/57/13/56/567571356.db2.gz KCLQAAKXMVUVGP-UHFFFAOYSA-N 0 1 394.294 3.435 10 0 GGAEMN CN(C(=O)NCCCc1nccs1)C1CCN(CCC(F)(F)F)CC1 ZINC000458799266 567575717 /nfs/dbraw/zinc/57/57/17/567575717.db2.gz ZPEZYEPETYHJAC-UHFFFAOYSA-N 0 1 378.464 3.134 10 0 GGAEMN COc1cccc(OC(F)(F)F)c1S(=O)(=O)Nc1c(C)ccnc1C ZINC000530155838 567575875 /nfs/dbraw/zinc/57/58/75/567575875.db2.gz KXXOKOVEPGMNKP-UHFFFAOYSA-N 0 1 376.356 3.406 10 0 GGAEMN CC(=O)N1CCc2cc(S(=O)(=O)Nc3ccc(C)nc3C)c(Cl)cc21 ZINC000530154970 567576674 /nfs/dbraw/zinc/57/66/74/567576674.db2.gz VSCIJQBLYIHUGS-UHFFFAOYSA-N 0 1 379.869 3.062 10 0 GGAEMN C[C@H]1C[C@@H](S(=O)(=O)NCC(F)(F)c2ccc(Br)cc2)CCO1 ZINC000621304924 567576812 /nfs/dbraw/zinc/57/68/12/567576812.db2.gz LILKDWGRKWNHSF-GWCFXTLKSA-N 0 1 398.269 3.028 10 0 GGAEMN O=S(=O)(NCC[C@@H]1CC1(F)F)c1cc(Br)c(F)cc1F ZINC000621303369 567576926 /nfs/dbraw/zinc/57/69/26/567576926.db2.gz DOJHJVQFMNJIGA-ZCFIWIBFSA-N 0 1 376.169 3.051 10 0 GGAEMN C[C@](N)(C(=O)NCCCNc1ccccc1F)c1ccc(Br)cc1 ZINC000571638920 567578247 /nfs/dbraw/zinc/57/82/47/567578247.db2.gz FTNOLBWJSLKFPB-GOSISDBHSA-N 0 1 394.288 3.381 10 0 GGAEMN O=C([O-])[C@H]1c2ccoc2CC[N@@H+]1CCOc1cc(F)cc(Br)c1 ZINC000530163758 567578709 /nfs/dbraw/zinc/57/87/09/567578709.db2.gz FZUKVNIAHMFAMY-OAHLLOKOSA-N 0 1 384.201 3.244 10 0 GGAEMN Cc1ccc(OC(F)F)c([C@@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)c1 ZINC000552338443 567579038 /nfs/dbraw/zinc/57/90/38/567579038.db2.gz FSEHMGLXRSMWPM-ZIAGYGMSSA-N 0 1 376.469 3.061 10 0 GGAEMN Cc1ccc(OC(F)F)c([C@H](C)NC[C@H]2CCCCN2S(C)(=O)=O)c1 ZINC000552338442 567579251 /nfs/dbraw/zinc/57/92/51/567579251.db2.gz FSEHMGLXRSMWPM-UONOGXRCSA-N 0 1 376.469 3.061 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@H+](C[C@H](O)c1cccc(Br)c1)CC2 ZINC000530167681 567579429 /nfs/dbraw/zinc/57/94/29/567579429.db2.gz HHNSZDKSUVOFCX-KRWDZBQOSA-N 0 1 394.240 3.378 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@@H+](C[C@H](O)c1cccc(Br)c1)CC2 ZINC000530167681 567579431 /nfs/dbraw/zinc/57/94/31/567579431.db2.gz HHNSZDKSUVOFCX-KRWDZBQOSA-N 0 1 394.240 3.378 10 0 GGAEMN O=C([O-])[C@@H]1c2ccoc2CC[N@@H+]1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000530170627 567579446 /nfs/dbraw/zinc/57/94/46/567579446.db2.gz UJPAXUOPXTXUJP-BZNIZROVSA-N 0 1 386.231 3.010 10 0 GGAEMN O=C([O-])[C@H]1c2ccoc2CC[N@@H+]1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000530169715 567579641 /nfs/dbraw/zinc/57/96/41/567579641.db2.gz RRHAJYZLWPBFBX-MEBBXXQBSA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1F ZINC000552340435 567580116 /nfs/dbraw/zinc/58/01/16/567580116.db2.gz URTNLDSVGIWHDA-DGCLKSJQSA-N 0 1 393.322 3.053 10 0 GGAEMN C[C@H](CC(=O)Nc1nc(-c2ccccc2Br)n[nH]1)[C@H]1CCCO1 ZINC000621413711 567582756 /nfs/dbraw/zinc/58/27/56/567582756.db2.gz SJYLCSLVYDICOK-ZWNOBZJWSA-N 0 1 379.258 3.378 10 0 GGAEMN C[C@H](CC(=O)Nc1nc(-c2ccccc2Br)n[nH]1)[C@@H]1CCCO1 ZINC000621413710 567582904 /nfs/dbraw/zinc/58/29/04/567582904.db2.gz SJYLCSLVYDICOK-MFKMUULPSA-N 0 1 379.258 3.378 10 0 GGAEMN CO[C@@H](C(=O)Nc1nc(-c2ccccc2Br)n[nH]1)C1CCCC1 ZINC000621413339 567582987 /nfs/dbraw/zinc/58/29/87/567582987.db2.gz GQYAQMZCWMLTHN-CYBMUJFWSA-N 0 1 379.258 3.378 10 0 GGAEMN COC(=O)[C@H]1C[C@@H](N(C)Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000595849524 567586408 /nfs/dbraw/zinc/58/64/08/567586408.db2.gz NJIXFUYOIBZHFE-AKAXFMLLSA-N 0 1 390.281 3.290 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)NCc1n[nH]c(C(C)C)n1)CC2 ZINC000458920952 567586780 /nfs/dbraw/zinc/58/67/80/567586780.db2.gz HPINTIBOFLGLPF-UHFFFAOYSA-N 0 1 392.301 3.267 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC[C@H](c2ccncc2)C1 ZINC000552396324 567587645 /nfs/dbraw/zinc/58/76/45/567587645.db2.gz MVFQRZOZWKHGTL-ZDUSSCGKSA-N 0 1 398.260 3.315 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(c3n[nH]c(=O)o3)CC2)c(C)c1Br ZINC000644887190 567588802 /nfs/dbraw/zinc/58/88/02/567588802.db2.gz HKYCZOLCGLRUAT-UHFFFAOYSA-N 0 1 380.242 3.174 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000571811447 567590721 /nfs/dbraw/zinc/59/07/21/567590721.db2.gz XUFRQPTXRYVRRB-OJDYBEQGSA-N 0 1 388.291 3.451 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000571811450 567591163 /nfs/dbraw/zinc/59/11/63/567591163.db2.gz XUFRQPTXRYVRRB-VZAMPYOESA-N 0 1 388.291 3.451 10 0 GGAEMN NC(=O)[C@H](N[C@@H]1CCc2ccccc2C1)c1ccc(Br)cc1F ZINC000439547630 567591443 /nfs/dbraw/zinc/59/14/43/567591443.db2.gz HRFHHNNKUHBHGX-RHSMWYFYSA-N 0 1 377.257 3.262 10 0 GGAEMN Cc1nccc(NC(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1Br ZINC000530354406 567595183 /nfs/dbraw/zinc/59/51/83/567595183.db2.gz CXCSHUWXWIKKSM-RDJZCZTQSA-N 0 1 389.297 3.141 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)Nc1cncc(F)c1 ZINC000439633145 567597346 /nfs/dbraw/zinc/59/73/46/567597346.db2.gz LAKBYIDEYOEUIX-UHFFFAOYSA-N 0 1 391.204 3.090 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)Nc1cncc(F)c1 ZINC000439633145 567597351 /nfs/dbraw/zinc/59/73/51/567597351.db2.gz LAKBYIDEYOEUIX-UHFFFAOYSA-N 0 1 391.204 3.090 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Br)c3ccccc3c2)CC1 ZINC000644994851 567598424 /nfs/dbraw/zinc/59/84/24/567598424.db2.gz XXNZEZSDASICJF-UHFFFAOYSA-N 0 1 391.309 3.397 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2ccc(O[C@@H]3CC3(F)F)cc2)cs1 ZINC000596022870 567599486 /nfs/dbraw/zinc/59/94/86/567599486.db2.gz UNKHAZLQRBTXGP-CYBMUJFWSA-N 0 1 389.401 3.122 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000530413856 567599928 /nfs/dbraw/zinc/59/99/28/567599928.db2.gz MUNTYMOPIRUVKA-UKRRQHHQSA-N 0 1 379.917 3.133 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000530413856 567599933 /nfs/dbraw/zinc/59/99/33/567599933.db2.gz MUNTYMOPIRUVKA-UKRRQHHQSA-N 0 1 379.917 3.133 10 0 GGAEMN COC(=O)c1sc(NC(=O)c2cc(Br)cc3nc[nH]c32)nc1C ZINC000571963016 567602237 /nfs/dbraw/zinc/60/22/37/567602237.db2.gz NBYVUBHVHOPWIB-UHFFFAOYSA-N 0 1 395.238 3.129 10 0 GGAEMN CCc1nc(CNC(=O)N[C@H]2CCCCc3cc(Br)ccc32)n[nH]1 ZINC000664972002 567603387 /nfs/dbraw/zinc/60/33/87/567603387.db2.gz ZLKKXSJTVXFMNA-AWEZNQCLSA-N 0 1 392.301 3.397 10 0 GGAEMN O=C(NCCc1cccc(Br)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000459156029 567603730 /nfs/dbraw/zinc/60/37/30/567603730.db2.gz WHDJQBAZFLYNEF-UHFFFAOYSA-N 0 1 377.286 3.304 10 0 GGAEMN Cc1ccc(CNC[C@H]2CS(=O)(=O)c3ccccc3O2)cc1Br ZINC000572000676 567604989 /nfs/dbraw/zinc/60/49/89/567604989.db2.gz OXUFXEOZGZJVCT-AWEZNQCLSA-N 0 1 396.306 3.082 10 0 GGAEMN Cn1nc(CCNC(=O)c2cc(Br)cc3nc[nH]c32)c2ccccc21 ZINC000505973133 567605169 /nfs/dbraw/zinc/60/51/69/567605169.db2.gz FOWAPLDVZJJUIW-UHFFFAOYSA-N 0 1 398.264 3.185 10 0 GGAEMN Cc1ccc(Cc2noc(CNS(=O)(=O)c3ccc(Cl)s3)n2)cc1C ZINC000665018426 567605156 /nfs/dbraw/zinc/60/51/56/567605156.db2.gz OBYCZQIYSBHZOM-UHFFFAOYSA-N 0 1 397.909 3.471 10 0 GGAEMN Cc1nn(C)c(CNC[C@@H](C(=O)OC(C)(C)C)C2CCC2)c1Br ZINC000596062074 567605643 /nfs/dbraw/zinc/60/56/43/567605643.db2.gz FARBIWCWWFAKMW-CYBMUJFWSA-N 0 1 386.334 3.339 10 0 GGAEMN O=C(Nc1ccc(OC2COC2)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000506010847 567606857 /nfs/dbraw/zinc/60/68/57/567606857.db2.gz XLZNKNGIJNHFIW-UHFFFAOYSA-N 0 1 388.221 3.355 10 0 GGAEMN CC(C)(C(=O)NC[C@@H]1CCN(c2cccc(Br)c2)C1)c1cnc[nH]1 ZINC000621720916 567607690 /nfs/dbraw/zinc/60/76/90/567607690.db2.gz UWXMSWRPPULOMJ-ZDUSSCGKSA-N 0 1 391.313 3.093 10 0 GGAEMN Cc1ccc2c(c1)nc(CNC(=O)c1cc(Br)cc3nc[nH]c31)n2C ZINC000506032899 567607696 /nfs/dbraw/zinc/60/76/96/567607696.db2.gz PBQOAZAUXDNPIZ-UHFFFAOYSA-N 0 1 398.264 3.451 10 0 GGAEMN CC(C)OC[C@@H](O)CN1CCC[C@H]1c1ccccc1I ZINC000506597379 567632863 /nfs/dbraw/zinc/63/28/63/567632863.db2.gz VJABKZMFHKHQMT-BBRMVZONSA-N 0 1 389.277 3.214 10 0 GGAEMN CC[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)OC(C)(C)C ZINC000572064769 567610069 /nfs/dbraw/zinc/61/00/69/567610069.db2.gz SNZVNNFSHFNLFL-LLVKDONJSA-N 0 1 382.258 3.176 10 0 GGAEMN COC(=O)[C@H]1CC12CCN(Cc1nc3cc(Br)ccc3[nH]1)CC2 ZINC000480561895 567612315 /nfs/dbraw/zinc/61/23/15/567612315.db2.gz ZJQMKRRGKAGLNH-GFCCVEGCSA-N 0 1 378.270 3.101 10 0 GGAEMN CC(C)[C@H](NCC(F)(F)F)C(=O)Nc1nc(-c2ccc(Cl)cc2)n[nH]1 ZINC000621823377 567613084 /nfs/dbraw/zinc/61/30/84/567613084.db2.gz BEQDAMWIJMINPG-NSHDSACASA-N 0 1 375.782 3.240 10 0 GGAEMN COc1ccc(CCC(=O)NCCCc2cn[nH]c2C)c(Br)c1 ZINC000621820593 567613818 /nfs/dbraw/zinc/61/38/18/567613818.db2.gz CLQQUFAOTDZCCF-UHFFFAOYSA-N 0 1 380.286 3.171 10 0 GGAEMN CS[C@H]1CN(c2nc(C3CC3)ncc2Br)C[C@H]1N1CCCC1 ZINC000596195302 567614139 /nfs/dbraw/zinc/61/41/39/567614139.db2.gz KTSBNQZKRGVYPT-KGLIPLIRSA-N 0 1 383.359 3.133 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)NCc1n[nH]c(C2CC2)n1 ZINC000572119293 567614673 /nfs/dbraw/zinc/61/46/73/567614673.db2.gz NASMCBMTPOVYPN-UHFFFAOYSA-N 0 1 378.274 3.095 10 0 GGAEMN CN(C)c1ccccc1CN1CCN(c2ccc(Br)cn2)CC1 ZINC000506216529 567616029 /nfs/dbraw/zinc/61/60/29/567616029.db2.gz GRFHJEVCGATXPM-UHFFFAOYSA-N 0 1 375.314 3.232 10 0 GGAEMN O=C(NCC(F)(F)c1ccc(Br)cc1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000621851529 567616752 /nfs/dbraw/zinc/61/67/52/567616752.db2.gz WJJMQYZTINPVQL-OKILXGFUSA-N 0 1 388.256 3.077 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000645315554 567617352 /nfs/dbraw/zinc/61/73/52/567617352.db2.gz SLSZQUBPYUECCR-YRGRVCCFSA-N 0 1 390.285 3.222 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000645315554 567617361 /nfs/dbraw/zinc/61/73/61/567617361.db2.gz SLSZQUBPYUECCR-YRGRVCCFSA-N 0 1 390.285 3.222 10 0 GGAEMN CC(C)C[C@H](C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000506259774 567618378 /nfs/dbraw/zinc/61/83/78/567618378.db2.gz NLOZTVPUKWPPLY-NSHDSACASA-N 0 1 380.290 3.468 10 0 GGAEMN CC(C)C[C@H](C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000506259774 567618385 /nfs/dbraw/zinc/61/83/85/567618385.db2.gz NLOZTVPUKWPPLY-NSHDSACASA-N 0 1 380.290 3.468 10 0 GGAEMN O=C([O-])[C@]12COC[C@H]1C[N@@H+](Cc1ccc(-c3ccc(Br)cc3)o1)C2 ZINC000665344475 567619917 /nfs/dbraw/zinc/61/99/17/567619917.db2.gz KBZRXFLBRDFMPU-FZKQIMNGSA-N 0 1 392.249 3.242 10 0 GGAEMN O=C([O-])[C@]12COC[C@H]1C[N@@H+](Cc1ccc(Br)cc1C(F)(F)F)C2 ZINC000665345689 567620618 /nfs/dbraw/zinc/62/06/18/567620618.db2.gz ZYOAOIXFFYMEJJ-QMTHXVAHSA-N 0 1 394.187 3.001 10 0 GGAEMN COC(=O)[C@H]1CCCN(Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000506293716 567620808 /nfs/dbraw/zinc/62/08/08/567620808.db2.gz FWMGHXLVODUTNC-AWEZNQCLSA-N 0 1 392.297 3.328 10 0 GGAEMN CCOc1cc(CN[C@@H](C)C(=O)N2CCCC[C@@H]2C)cc(Br)c1O ZINC000459417216 567622379 /nfs/dbraw/zinc/62/23/79/567622379.db2.gz VWULJRVDGWXHQA-STQMWFEESA-N 0 1 399.329 3.433 10 0 GGAEMN CCOc1cc(CN[C@H](C)C(=O)N2CCCC[C@@H]2C)cc(Br)c1O ZINC000459417215 567622747 /nfs/dbraw/zinc/62/27/47/567622747.db2.gz VWULJRVDGWXHQA-QWHCGFSZSA-N 0 1 399.329 3.433 10 0 GGAEMN O=C(Nc1nc(-c2cccs2)ns1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000621947267 567624626 /nfs/dbraw/zinc/62/46/26/567624626.db2.gz QIMMARYELJLPJD-BDAKNGLRSA-N 0 1 393.412 3.189 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)C(C)(C)c1cnc[nH]1 ZINC000621951278 567624707 /nfs/dbraw/zinc/62/47/07/567624707.db2.gz SMWBZYYNRLIFSI-UHFFFAOYSA-N 0 1 380.286 3.207 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1cc(Br)ccc1Br ZINC000665454154 567625758 /nfs/dbraw/zinc/62/57/58/567625758.db2.gz CLODQRHMGQDCMM-UHFFFAOYSA-N 0 1 391.107 3.237 10 0 GGAEMN CN(C)[C@H](CNC(=O)CSCC(=O)OC(C)(C)C)c1ccc(Cl)cc1 ZINC000530830893 567626692 /nfs/dbraw/zinc/62/66/92/567626692.db2.gz UYDQDCQTLNQMFU-OAHLLOKOSA-N 0 1 386.945 3.134 10 0 GGAEMN Cc1cnc(N2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)s1 ZINC000480755298 567627589 /nfs/dbraw/zinc/62/75/89/567627589.db2.gz MBONASOZLGGYPP-UHFFFAOYSA-N 0 1 392.326 3.413 10 0 GGAEMN O=S(=O)(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cscn1 ZINC000645465375 567627936 /nfs/dbraw/zinc/62/79/36/567627936.db2.gz WIONJOMZRWUFJH-RNFRBKRXSA-N 0 1 382.351 3.331 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCN(C2CC2)CC1 ZINC000506494286 567627864 /nfs/dbraw/zinc/62/78/64/567627864.db2.gz DASKMFXTVZSKEI-UHFFFAOYSA-N 0 1 375.314 3.223 10 0 GGAEMN O=S(=O)(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cscn1 ZINC000645465337 567628445 /nfs/dbraw/zinc/62/84/45/567628445.db2.gz WIONJOMZRWUFJH-BQBZGAKWSA-N 0 1 382.351 3.331 10 0 GGAEMN Brc1ccc2nc(CN3CCN(Cc4cscn4)CC3)[nH]c2c1 ZINC000480773257 567630237 /nfs/dbraw/zinc/63/02/37/567630237.db2.gz IXGWZKQHEOYQEY-UHFFFAOYSA-N 0 1 392.326 3.100 10 0 GGAEMN C[C@@H](CN1CCC(C)(c2ccc(Br)cc2)CC1)CS(C)(=O)=O ZINC000440507725 567631827 /nfs/dbraw/zinc/63/18/27/567631827.db2.gz UKXGRXLINUTZJB-AWEZNQCLSA-N 0 1 388.371 3.483 10 0 GGAEMN [O-]c1cccc(C[NH2+]C[C@H](CO)Cc2ccc(F)c(F)c2)c1Br ZINC000459509056 567632068 /nfs/dbraw/zinc/63/20/68/567632068.db2.gz BGCSYBZNQDYNQM-GFCCVEGCSA-N 0 1 386.236 3.374 10 0 GGAEMN C[C@@H](NCCNC(=O)c1ccccc1)c1ccccc1I ZINC000480819183 567632532 /nfs/dbraw/zinc/63/25/32/567632532.db2.gz MYVPVZGZCFJLRJ-CYBMUJFWSA-N 0 1 394.256 3.372 10 0 GGAEMN CCn1nncc1CSc1nc(-c2ccc(OC)c(Br)c2)n[nH]1 ZINC000665686934 567635820 /nfs/dbraw/zinc/63/58/20/567635820.db2.gz JKGIRRDCGHHKLQ-UHFFFAOYSA-N 0 1 395.286 3.147 10 0 GGAEMN CC[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCN1CC(F)F ZINC000480857582 567636245 /nfs/dbraw/zinc/63/62/45/567636245.db2.gz ZCEORUGXRSZVHB-GFCCVEGCSA-N 0 1 387.272 3.487 10 0 GGAEMN Cc1cc(C(=O)N2CCN(Cc3cccc(Br)c3C)[C@H](C)C2)n[nH]1 ZINC000459588206 567641675 /nfs/dbraw/zinc/64/16/75/567641675.db2.gz LEYZUOUASIKEBX-CYBMUJFWSA-N 0 1 391.313 3.136 10 0 GGAEMN COC(=O)CSCCC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000440749545 567642287 /nfs/dbraw/zinc/64/22/87/567642287.db2.gz HFIJURLCQBKOOH-CQSZACIVSA-N 0 1 381.885 3.176 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCC[C@H]2c2nc3cc(Cl)ccc3[nH]2)[nH]1 ZINC000440733090 567642550 /nfs/dbraw/zinc/64/25/50/567642550.db2.gz IXICYMQFCPRXAT-ZDUSSCGKSA-N 0 1 376.873 3.099 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCC[C@@H]2c2nc3cc(Cl)ccc3[nH]2)[nH]1 ZINC000440733089 567642674 /nfs/dbraw/zinc/64/26/74/567642674.db2.gz IXICYMQFCPRXAT-CYBMUJFWSA-N 0 1 376.873 3.099 10 0 GGAEMN O=C(NCC(F)(F)c1ccc(Br)cc1)[C@@H]1CCc2[nH]cnc2C1 ZINC000622206645 567644160 /nfs/dbraw/zinc/64/41/60/567644160.db2.gz JQWAALDZAVGPCL-SNVBAGLBSA-N 0 1 384.224 3.185 10 0 GGAEMN Cc1cccc2nc(CNC[C@H](O)COc3c(Cl)cccc3Cl)cn21 ZINC000572512165 567644802 /nfs/dbraw/zinc/64/48/02/567644802.db2.gz IKHBCMRLQSUOIC-AWEZNQCLSA-N 0 1 380.275 3.479 10 0 GGAEMN CO[C@H](CS(=O)(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)C(C)C ZINC000645596056 567645660 /nfs/dbraw/zinc/64/56/60/567645660.db2.gz DWGJTIONQYTBBX-JKSUJKDBSA-N 0 1 385.917 3.354 10 0 GGAEMN CCNS(=O)(=O)c1cccc(CNCc2ccc3nc(C)sc3c2)c1 ZINC000459653792 567646053 /nfs/dbraw/zinc/64/60/53/567646053.db2.gz YQPJKFCLPGYWOO-UHFFFAOYSA-N 0 1 375.519 3.193 10 0 GGAEMN COc1nc(C)cc(C)c1CN(C)C(=O)c1cccc(Br)c1O ZINC000622263415 567646533 /nfs/dbraw/zinc/64/65/33/567646533.db2.gz AQYDTUHZBYLNBQ-UHFFFAOYSA-N 0 1 379.254 3.447 10 0 GGAEMN CCOC(=O)c1sc(NS(=O)(=O)Cc2ccccc2COC)cc1C ZINC000572557623 567649403 /nfs/dbraw/zinc/64/94/03/567649403.db2.gz AEQVNJIIAUXLAC-UHFFFAOYSA-N 0 1 383.491 3.322 10 0 GGAEMN C[C@H](C1CC1)N(C)S(=O)(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000531244991 567649672 /nfs/dbraw/zinc/64/96/72/567649672.db2.gz IOLAGVPRNPSZMQ-BZNIZROVSA-N 0 1 382.917 3.328 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000572570687 567649830 /nfs/dbraw/zinc/64/98/30/567649830.db2.gz XZSDQAFKJRKYHY-ZIAGYGMSSA-N 0 1 391.313 3.350 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000481014482 567652119 /nfs/dbraw/zinc/65/21/19/567652119.db2.gz ONUDSNOBOPXZFI-OKILXGFUSA-N 0 1 378.460 3.333 10 0 GGAEMN OC[C@H](NCc1nc2ccc(Br)cc2[nH]1)c1c(F)cccc1F ZINC000481068517 567655671 /nfs/dbraw/zinc/65/56/71/567655671.db2.gz IIFLJJLQKFDSQN-AWEZNQCLSA-N 0 1 382.208 3.427 10 0 GGAEMN COCc1nc(CNC(=O)N2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)n[nH]1 ZINC000666118889 567656275 /nfs/dbraw/zinc/65/62/75/567656275.db2.gz CHMSGHNYZAUEEB-VIFPVBQESA-N 0 1 384.267 3.087 10 0 GGAEMN COCc1nnc(CNC(=O)N2CCc3c(Cl)cc(Cl)cc3[C@@H]2C)[nH]1 ZINC000666118889 567656278 /nfs/dbraw/zinc/65/62/78/567656278.db2.gz CHMSGHNYZAUEEB-VIFPVBQESA-N 0 1 384.267 3.087 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000666167378 567657003 /nfs/dbraw/zinc/65/70/03/567657003.db2.gz SFORFPRPHJRTOY-LLVKDONJSA-N 0 1 399.292 3.343 10 0 GGAEMN CCN(CCNC(=O)Cc1ccc(Br)cc1O)CCC(F)(F)F ZINC000507088934 567658735 /nfs/dbraw/zinc/65/87/35/567658735.db2.gz STFNIZNIFGWULH-UHFFFAOYSA-N 0 1 397.235 3.088 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CN1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441284443 567658862 /nfs/dbraw/zinc/65/88/62/567658862.db2.gz XJLYRTTVMGYRCO-GJZGRUSLSA-N 0 1 381.314 3.445 10 0 GGAEMN Brc1cc2c(cc1CN1CCC[C@@H]([C@H]3CCOC3)C1)OCCO2 ZINC000441278639 567659137 /nfs/dbraw/zinc/65/91/37/567659137.db2.gz ATOOJKFQBLPDFH-KGLIPLIRSA-N 0 1 382.298 3.469 10 0 GGAEMN C[C@@H](C(=O)Nc1cccc(Cl)c1O)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000531460314 567660279 /nfs/dbraw/zinc/66/02/79/567660279.db2.gz CZYYCPGWRKWKRW-LLVKDONJSA-N 0 1 382.869 3.038 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCC[C@@H](c2nncn2C2CC2)C1 ZINC000531490630 567661504 /nfs/dbraw/zinc/66/15/04/567661504.db2.gz QBIDAVXCGGNKEJ-LLVKDONJSA-N 0 1 391.269 3.101 10 0 GGAEMN C[C@H]1CCNC(=O)[C@@H]1NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000441380525 567662395 /nfs/dbraw/zinc/66/23/95/567662395.db2.gz HJUUZUKKCPICQX-IINYFYTJSA-N 0 1 380.311 3.187 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)Cc3cccc(Br)c3)[nH]c21 ZINC000553535976 567662777 /nfs/dbraw/zinc/66/27/77/567662777.db2.gz BEKZHPZGOVXFKR-UHFFFAOYSA-N 0 1 394.294 3.253 10 0 GGAEMN Cc1cc(CCNS(=O)(=O)c2c(Cl)ccc(F)c2F)cc(C)c1O ZINC000553529329 567663101 /nfs/dbraw/zinc/66/31/01/567663101.db2.gz URCDFTGPNBTPQV-UHFFFAOYSA-N 0 1 375.824 3.462 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccccc2O[C@@H]2CCOC2)ccc1Cl ZINC000666302759 567664070 /nfs/dbraw/zinc/66/40/70/567664070.db2.gz HVMLKCLUBVWHFS-GFCCVEGCSA-N 0 1 383.853 3.317 10 0 GGAEMN Cc1nc([C@@H](C)NC(=O)N[C@H]2CSCc3ccc(Br)cc32)n[nH]1 ZINC000666400082 567672573 /nfs/dbraw/zinc/67/25/73/567672573.db2.gz AWJNMUKSESYFBS-OQPBUACISA-N 0 1 396.314 3.224 10 0 GGAEMN Cc1nn(C)c(C)c1NS(=O)(=O)c1cc(Br)cc2cccnc21 ZINC000572914413 567673604 /nfs/dbraw/zinc/67/36/04/567673604.db2.gz ORXGKZTXNWYSEF-UHFFFAOYSA-N 0 1 395.282 3.148 10 0 GGAEMN C[C@H]1CCC[N@@H+](CCCCNC(=O)N=c2nc(-c3ccsc3)[n-]s2)C1 ZINC000460131226 567673852 /nfs/dbraw/zinc/67/38/52/567673852.db2.gz XTYPCVQHAHXJBQ-ZDUSSCGKSA-N 0 1 379.555 3.322 10 0 GGAEMN O=C(NCCN1CC=CCC1)N[C@H]1CSCc2ccc(Br)cc21 ZINC000666402391 567675322 /nfs/dbraw/zinc/67/53/22/567675322.db2.gz XZZYQSJVIOGZJS-INIZCTEOSA-N 0 1 396.354 3.298 10 0 GGAEMN CCCN(C)[C@H](CNC(=O)NCC[C@H](C)[S@](C)=O)c1ccc(Cl)cc1 ZINC000553677712 567675275 /nfs/dbraw/zinc/67/52/75/567675275.db2.gz RVZNRMKSQAEDTK-AXUAAXHCSA-N 0 1 387.977 3.179 10 0 GGAEMN CCn1c(-c2ccc(F)cc2Br)nnc1N1CCN(CC)CC1 ZINC000460193084 567677923 /nfs/dbraw/zinc/67/79/23/567677923.db2.gz AJYZUPGJKLUJDR-UHFFFAOYSA-N 0 1 382.281 3.009 10 0 GGAEMN Cc1c2cc(C(=O)NCCCCN3CCOCC3)[nH]c2ccc1Br ZINC000666469592 567680238 /nfs/dbraw/zinc/68/02/38/567680238.db2.gz FLDWFMARVUBEQR-UHFFFAOYSA-N 0 1 394.313 3.081 10 0 GGAEMN C[C@@H](CSc1nc(-c2ccc(Br)cc2)n[nH]1)CS(C)(=O)=O ZINC000531813538 567680354 /nfs/dbraw/zinc/68/03/54/567680354.db2.gz NBFXGZQAIXFOAA-VIFPVBQESA-N 0 1 390.328 3.007 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc3cc(Br)cc(C)c3o2)CC1 ZINC000507478258 567682511 /nfs/dbraw/zinc/68/25/11/567682511.db2.gz LZVOWUKDOIKVFF-UHFFFAOYSA-N 0 1 395.297 3.298 10 0 GGAEMN O=S(=O)(NCc1cn2cc(Cl)ccc2n1)c1c(Cl)ccc(F)c1F ZINC000553776531 567683263 /nfs/dbraw/zinc/68/32/63/567683263.db2.gz QRUVEQIJJMPMAK-UHFFFAOYSA-N 0 1 392.214 3.398 10 0 GGAEMN COCC[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1ccco1 ZINC000507524998 567683609 /nfs/dbraw/zinc/68/36/09/567683609.db2.gz FLLZHKSPWDPFTN-CYBMUJFWSA-N 0 1 378.226 3.426 10 0 GGAEMN COc1cc(Br)c(CNC2(CO)Cc3ccccc3C2)cc1OC ZINC000553790474 567685447 /nfs/dbraw/zinc/68/54/47/567685447.db2.gz XBJJCUUBRGJDQP-UHFFFAOYSA-N 0 1 392.293 3.086 10 0 GGAEMN Brc1ccc2ncnc(N[C@@H]3CCCC[C@H]3N3CCOCC3)c2c1 ZINC000531911030 567686288 /nfs/dbraw/zinc/68/62/88/567686288.db2.gz JGUPFTONVAWSNR-IAGOWNOFSA-N 0 1 391.313 3.448 10 0 GGAEMN Brc1ccc2ncnc(N[C@@H]3CCCC[C@@H]3N3CCOCC3)c2c1 ZINC000531911032 567686565 /nfs/dbraw/zinc/68/65/65/567686565.db2.gz JGUPFTONVAWSNR-SJORKVTESA-N 0 1 391.313 3.448 10 0 GGAEMN C[C@@H]1CN(C)CCN1c1ccc2nnc(-c3cc(Cl)cc(Cl)c3)n2n1 ZINC000597182880 567687347 /nfs/dbraw/zinc/68/73/47/567687347.db2.gz LRFAZPZEEPEBTQ-LLVKDONJSA-N 0 1 377.279 3.238 10 0 GGAEMN O=S(=O)(NCc1ccccc1-n1cccn1)c1c(Cl)ccc(F)c1F ZINC000553808082 567687306 /nfs/dbraw/zinc/68/73/06/567687306.db2.gz ZFYQCXCDWANYSM-UHFFFAOYSA-N 0 1 383.807 3.282 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC2(C1)CCOCC2 ZINC000646009216 567689816 /nfs/dbraw/zinc/68/98/16/567689816.db2.gz VDOPIHLIQNCOQP-UHFFFAOYSA-N 0 1 376.254 3.092 10 0 GGAEMN C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)N2CCOc3cc(Br)ccc3C2)C1 ZINC000623226760 567692023 /nfs/dbraw/zinc/69/20/23/567692023.db2.gz LRULRCPFRUOQCY-IAQYHMDHSA-N 0 1 390.281 3.259 10 0 GGAEMN CN(C)[C@H]1CCc2cc(Br)ccc2N(S(=O)(=O)c2ccoc2)C1 ZINC000623230303 567692654 /nfs/dbraw/zinc/69/26/54/567692654.db2.gz WRUJQNZNPGYFHV-AWEZNQCLSA-N 0 1 399.310 3.114 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)n[nH]1 ZINC000532010072 567692884 /nfs/dbraw/zinc/69/28/84/567692884.db2.gz MHYFZXLCAKSMML-AMKSKSKJSA-N 0 1 377.286 3.267 10 0 GGAEMN Fc1ccc(I)c(F)c1CN1CCCc2[nH]ncc2C1 ZINC000597270034 567693236 /nfs/dbraw/zinc/69/32/36/567693236.db2.gz YPXUJZYRFMGYHC-UHFFFAOYSA-N 0 1 389.187 3.241 10 0 GGAEMN CC(C)n1ncc2c1C[C@H](NS(=O)(=O)c1c(Cl)ccc(F)c1F)CC2 ZINC000553867597 567693437 /nfs/dbraw/zinc/69/34/37/567693437.db2.gz QNSMDWJAGREMTK-LLVKDONJSA-N 0 1 389.855 3.231 10 0 GGAEMN Cn1cc(NC(=O)c2cc(=O)c3cc(Br)ccc3[nH]2)c(C2CC2)n1 ZINC000573184331 567693838 /nfs/dbraw/zinc/69/38/38/567693838.db2.gz GZOCKZGQHBHUMJ-UHFFFAOYSA-N 0 1 387.237 3.154 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccc(C)cc2Br)C1 ZINC000646112404 567695050 /nfs/dbraw/zinc/69/50/50/567695050.db2.gz ADZUXYRRLBMUGJ-AWEZNQCLSA-N 0 1 379.220 3.258 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(CCOc2ccc(Cl)cc2Cl)C1 ZINC000646108150 567695085 /nfs/dbraw/zinc/69/50/85/567695085.db2.gz PNCYWOBMQWWSMH-CQSZACIVSA-N 0 1 385.213 3.373 10 0 GGAEMN COc1ccc(-c2n[nH]c(Sc3ncncc3Br)n2)c(OC)c1 ZINC000481683676 567695680 /nfs/dbraw/zinc/69/56/80/567695680.db2.gz CMWDNSLJNMHMSA-UHFFFAOYSA-N 0 1 394.254 3.193 10 0 GGAEMN O=C(CCN1CCc2nccc(Br)c2C1)Nc1ccc(F)cc1 ZINC000623286334 567698323 /nfs/dbraw/zinc/69/83/23/567698323.db2.gz OHFFLAGXSIEDQL-UHFFFAOYSA-N 0 1 378.245 3.370 10 0 GGAEMN O=C(Nc1cc(Cl)c(O)cc1F)[C@@H]1CSCN1C(=O)c1ccccc1 ZINC000573275431 567701126 /nfs/dbraw/zinc/70/11/26/567701126.db2.gz LTZRTKKMPLTLED-AWEZNQCLSA-N 0 1 380.828 3.339 10 0 GGAEMN COCCOCCNCc1cc(Br)c(C)cc1Br ZINC000623376274 567704203 /nfs/dbraw/zinc/70/42/03/567704203.db2.gz MOFSCCLYVATPCI-UHFFFAOYSA-N 0 1 381.108 3.273 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)N1CCN(CC2CC2)CC1 ZINC000507777948 567704883 /nfs/dbraw/zinc/70/48/83/567704883.db2.gz JVMYDXMXMRNUMT-MRXNPFEDSA-N 0 1 394.313 3.010 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)N1CCN(C2CCC2)CC1 ZINC000507796103 567707078 /nfs/dbraw/zinc/70/70/78/567707078.db2.gz LQKIBSPTAUDHPC-MRXNPFEDSA-N 0 1 394.313 3.152 10 0 GGAEMN O[C@H](CNCc1ccsc1Br)COc1ccc(F)c(F)c1 ZINC000623406334 567707428 /nfs/dbraw/zinc/70/74/28/567707428.db2.gz UMVYXQGJPDDRSS-SNVBAGLBSA-N 0 1 378.238 3.318 10 0 GGAEMN CSc1ccc(CSCC(=O)NC[C@@H]2CN(CC(C)C)CCO2)cc1 ZINC000507821338 567708030 /nfs/dbraw/zinc/70/80/30/567708030.db2.gz NDJLYJJNHBKOHF-QGZVFWFLSA-N 0 1 382.595 3.115 10 0 GGAEMN CC(C)CN1CCN(C(=O)N[C@@H]2CCOc3c(Br)cccc32)CC1 ZINC000507814039 567708321 /nfs/dbraw/zinc/70/83/21/567708321.db2.gz MDDKDENGNPHRMR-MRXNPFEDSA-N 0 1 396.329 3.256 10 0 GGAEMN CC(C)[C@H]1CN(C)CCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507809705 567708718 /nfs/dbraw/zinc/70/87/18/567708718.db2.gz SFIIOJAHQQYCFF-HZPDHXFCSA-N 0 1 396.329 3.254 10 0 GGAEMN O=C(Nc1nc2c(s1)CCCCC2)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000666896420 567711282 /nfs/dbraw/zinc/71/12/82/567711282.db2.gz PFVRCQQDACVDEM-MNOVXSKESA-N 0 1 378.416 3.335 10 0 GGAEMN CS(=O)(=O)c1cccc([C@@H](NCCC2(O)CC2)c2ccc(Cl)cc2)c1 ZINC000442860983 567712536 /nfs/dbraw/zinc/71/25/36/567712536.db2.gz CRAZNLOHNMNCAT-SFHVURJKSA-N 0 1 379.909 3.338 10 0 GGAEMN CS(=O)(=O)c1cccc([C@H](NCCC2(O)CC2)c2ccc(Cl)cc2)c1 ZINC000442860982 567712652 /nfs/dbraw/zinc/71/26/52/567712652.db2.gz CRAZNLOHNMNCAT-GOSISDBHSA-N 0 1 379.909 3.338 10 0 GGAEMN CC1(C)CN(C(=O)c2[nH]nc3ccc(I)cc32)[C@H]1C1CC1 ZINC000460980965 567714552 /nfs/dbraw/zinc/71/45/52/567714552.db2.gz VDOZHABYZGGUOH-AWEZNQCLSA-N 0 1 395.244 3.428 10 0 GGAEMN O=C1CCc2cc(NS(=O)(=O)c3ccsc3)ccc2N1CC(F)(F)F ZINC000507910146 567714704 /nfs/dbraw/zinc/71/47/04/567714704.db2.gz VKYOOYQIYWVFGE-UHFFFAOYSA-N 0 1 390.408 3.390 10 0 GGAEMN COC[C@@H](CNCc1cc(Br)c(C)cc1Br)OC ZINC000623488276 567714957 /nfs/dbraw/zinc/71/49/57/567714957.db2.gz NQACYSYPJAAOJT-LLVKDONJSA-N 0 1 381.108 3.271 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2ccc(F)cc2Cl)C1 ZINC000507895917 567715136 /nfs/dbraw/zinc/71/51/36/567715136.db2.gz PWYMHQTVPHNKOU-MRXNPFEDSA-N 0 1 388.936 3.185 10 0 GGAEMN CCOc1cccc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)n1 ZINC000532427589 567715275 /nfs/dbraw/zinc/71/52/75/567715275.db2.gz CMQFRJMVHADGRQ-UHFFFAOYSA-N 0 1 388.269 3.318 10 0 GGAEMN CCOc1cccc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000532427589 567715278 /nfs/dbraw/zinc/71/52/78/567715278.db2.gz CMQFRJMVHADGRQ-UHFFFAOYSA-N 0 1 388.269 3.318 10 0 GGAEMN COCC[C@H](CO)NCc1cc(Br)c(C)cc1Br ZINC000623513573 567717042 /nfs/dbraw/zinc/71/70/42/567717042.db2.gz DJZKXMYZDFTPGS-LLVKDONJSA-N 0 1 381.108 3.007 10 0 GGAEMN Cc1cc(CN[C@@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)ncc1Br ZINC000623513631 567717469 /nfs/dbraw/zinc/71/74/69/567717469.db2.gz GLIARSRPWKLXEP-KBXCAEBGSA-N 0 1 388.309 3.432 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cn(-c2ccc(Cl)c(Cl)c2)cn1 ZINC000461091576 567719576 /nfs/dbraw/zinc/71/95/76/567719576.db2.gz WEGMXZYYARJGKY-SNVBAGLBSA-N 0 1 376.247 3.190 10 0 GGAEMN Cc1c(CN(C)CCCOc2cccc(I)c2)cnn1C ZINC000573531956 567720364 /nfs/dbraw/zinc/72/03/64/567720364.db2.gz ZXBOKLNKHBWPJM-UHFFFAOYSA-N 0 1 399.276 3.234 10 0 GGAEMN O[C@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3ccsc3Br)cc2)C1 ZINC000623564204 567722476 /nfs/dbraw/zinc/72/24/76/567722476.db2.gz VRUXSWCKEGEKLS-INIZCTEOSA-N 0 1 381.339 3.367 10 0 GGAEMN CS(=O)(=O)CC1(CNCc2cccc(F)c2OCC(F)(F)F)CCC1 ZINC000623551334 567722682 /nfs/dbraw/zinc/72/26/82/567722682.db2.gz UXXFWOVTOMNGPB-UHFFFAOYSA-N 0 1 383.407 3.071 10 0 GGAEMN COc1cccc(N2C[C@H](NCc3csc(Br)c3)CC2=O)c1 ZINC000508065688 567723682 /nfs/dbraw/zinc/72/36/82/567723682.db2.gz VZFOPWVGHDDFJQ-GFCCVEGCSA-N 0 1 381.295 3.414 10 0 GGAEMN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNCc1c[nH]nn1 ZINC000623577734 567723808 /nfs/dbraw/zinc/72/38/08/567723808.db2.gz BXPAEXCMGNKMCM-UHFFFAOYSA-N 0 1 375.274 3.166 10 0 GGAEMN Cc1cc(Br)c(CNC[C@H](O)[C@@H]2CCCO2)cc1Br ZINC000623620013 567725309 /nfs/dbraw/zinc/72/53/09/567725309.db2.gz CTLGNLMUJVVEJE-KBPBESRZSA-N 0 1 393.119 3.150 10 0 GGAEMN C[N@@H+]1CCC[C@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@H]1c1cccs1 ZINC000532640812 567725723 /nfs/dbraw/zinc/72/57/23/567725723.db2.gz HNLNWDJGIFTOQP-WBMJQRKESA-N 0 1 376.551 3.014 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@H]1c1cccs1 ZINC000532640812 567725729 /nfs/dbraw/zinc/72/57/29/567725729.db2.gz HNLNWDJGIFTOQP-WBMJQRKESA-N 0 1 376.551 3.014 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCO[C@H](c2cccc(O)c2)C1 ZINC000532621159 567725766 /nfs/dbraw/zinc/72/57/66/567725766.db2.gz GNOZVVRBVADHKL-HNNXBMFYSA-N 0 1 378.222 3.074 10 0 GGAEMN Cc1cc(C[C@H](C)Nc2ncnc3cccc(I)c32)[nH]n1 ZINC000573617328 567726021 /nfs/dbraw/zinc/72/60/21/567726021.db2.gz OHHRVZSSZKGEPS-VIFPVBQESA-N 0 1 393.232 3.309 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCO[C@@H](c2cccc(O)c2)C1 ZINC000532621160 567726146 /nfs/dbraw/zinc/72/61/46/567726146.db2.gz GNOZVVRBVADHKL-OAHLLOKOSA-N 0 1 378.222 3.074 10 0 GGAEMN COCc1cnc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000623645184 567727916 /nfs/dbraw/zinc/72/79/16/567727916.db2.gz QYCONICXLAMSPI-QGZVFWFLSA-N 0 1 397.338 3.062 10 0 GGAEMN COc1cccc(N2C[C@H](NCc3cc(Br)ccc3F)CC2=O)c1 ZINC000508089203 567727987 /nfs/dbraw/zinc/72/79/87/567727987.db2.gz RDABMRPXDSBOFX-CQSZACIVSA-N 0 1 393.256 3.492 10 0 GGAEMN CCc1nc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)cs1 ZINC000623644079 567728327 /nfs/dbraw/zinc/72/83/27/567728327.db2.gz LWYMFXQLCRSBOJ-QGZVFWFLSA-N 0 1 381.339 3.478 10 0 GGAEMN COCCOCc1ccc(CNCc2cc(Br)cnc2OC)cc1 ZINC000623664664 567729493 /nfs/dbraw/zinc/72/94/93/567729493.db2.gz KDRCUXVPGMRWAR-UHFFFAOYSA-N 0 1 395.297 3.306 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)c1cc(F)c(F)cc1Br ZINC000532725680 567730771 /nfs/dbraw/zinc/73/07/71/567730771.db2.gz WXMVZNFZAGTLFP-UHFFFAOYSA-N 0 1 388.168 3.188 10 0 GGAEMN O=C(c1cccc(F)c1I)N1CCC(c2cnc[nH]2)CC1 ZINC000532739485 567732213 /nfs/dbraw/zinc/73/22/13/567732213.db2.gz AMGLRSPSHRGFOU-UHFFFAOYSA-N 0 1 399.207 3.173 10 0 GGAEMN COC(=O)c1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000554544328 567734693 /nfs/dbraw/zinc/73/46/93/567734693.db2.gz PXAMFBJRSALJEB-UHFFFAOYSA-N 0 1 388.221 3.042 10 0 GGAEMN NC(=O)[C@H](NC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(Br)c1 ZINC000573769808 567735241 /nfs/dbraw/zinc/73/52/41/567735241.db2.gz FRGILTZMRKULDX-FGTMMUONSA-N 0 1 389.293 3.485 10 0 GGAEMN COc1sc(CNCc2ccc3oc(=O)n(C)c3c2)cc1Br ZINC000623742781 567735294 /nfs/dbraw/zinc/73/52/94/567735294.db2.gz CDKSXARHHYMRPX-UHFFFAOYSA-N 0 1 383.267 3.254 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2cc(Br)cc3nc[nH]c32)[C@H]2CCCO[C@H]21 ZINC000554562855 567735806 /nfs/dbraw/zinc/73/58/06/567735806.db2.gz CMQDPPOHWJXHKT-VCTAVGKDSA-N 0 1 378.270 3.259 10 0 GGAEMN C[C@H](NC(=O)N[C@H]1CCCCc2cc(Br)ccc21)c1nnc[nH]1 ZINC000667213168 567735969 /nfs/dbraw/zinc/73/59/69/567735969.db2.gz MTJONHXJTKNMNI-HZMBPMFUSA-N 0 1 378.274 3.395 10 0 GGAEMN O=C(NCCC1(F)CCC1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000554568152 567736847 /nfs/dbraw/zinc/73/68/47/567736847.db2.gz VSHPFXAHHCVIOI-UHFFFAOYSA-N 0 1 396.264 3.316 10 0 GGAEMN O=C(NCCC1(F)CCC1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000554568152 567736850 /nfs/dbraw/zinc/73/68/50/567736850.db2.gz VSHPFXAHHCVIOI-UHFFFAOYSA-N 0 1 396.264 3.316 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCc2ccc(Br)c(F)c2F)n[nH]1 ZINC000623779131 567737409 /nfs/dbraw/zinc/73/74/09/567737409.db2.gz OXKDWDYPYHAXDZ-QMMMGPOBSA-N 0 1 387.228 3.189 10 0 GGAEMN Cc1c([C@H](C)N[C@@H]2COCC2(C)C)nnn1-c1cccc(Br)c1 ZINC000573894642 567742381 /nfs/dbraw/zinc/74/23/81/567742381.db2.gz JAHRCVGJBNHQMC-XHDPSFHLSA-N 0 1 379.302 3.414 10 0 GGAEMN O=S(=O)(Nc1ncccc1F)c1cc(Br)cc2cccnc21 ZINC000554726200 567745314 /nfs/dbraw/zinc/74/53/14/567745314.db2.gz RQOJBERADGYQIO-UHFFFAOYSA-N 0 1 382.214 3.332 10 0 GGAEMN Cc1ccn([C@H](C)CC(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000667425857 567746915 /nfs/dbraw/zinc/74/69/15/567746915.db2.gz PEIALIRAMSTCHH-LLVKDONJSA-N 0 1 389.257 3.329 10 0 GGAEMN CN1CCN(C[C@@H](Nc2ncc(Br)cc2F)c2ccccc2)CC1 ZINC000623934418 567748455 /nfs/dbraw/zinc/74/84/55/567748455.db2.gz RQXSXPMCFQONFU-QGZVFWFLSA-N 0 1 393.304 3.384 10 0 GGAEMN CN1CCC[C@@H](NCc2cnc(-c3ccc(Br)cc3)s2)C1=O ZINC000533106682 567752915 /nfs/dbraw/zinc/75/29/15/567752915.db2.gz OXKRXXOQPMODLN-CQSZACIVSA-N 0 1 380.311 3.283 10 0 GGAEMN O=C(Nc1cnoc1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1 ZINC000624010912 567754458 /nfs/dbraw/zinc/75/44/58/567754458.db2.gz BTUBNXHHLXEMBC-UHFFFAOYSA-N 0 1 377.809 3.381 10 0 GGAEMN O=S(=O)(Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1cnc2n1CCC2 ZINC000443419547 567756412 /nfs/dbraw/zinc/75/64/12/567756412.db2.gz QRWPFQNLMYRLOO-UHFFFAOYSA-N 0 1 395.790 3.225 10 0 GGAEMN OC[C@H]1CCN(Cc2ccccc2)C[C@H]1Nc1ncc(Br)cc1F ZINC000624049032 567756821 /nfs/dbraw/zinc/75/68/21/567756821.db2.gz ZESLHEGYAOKPOO-RHSMWYFYSA-N 0 1 394.288 3.278 10 0 GGAEMN Cc1cnc(N)c(S(=O)(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)c1 ZINC000443416092 567756822 /nfs/dbraw/zinc/75/68/22/567756822.db2.gz MKCXBLYCRRFSNO-UHFFFAOYSA-N 0 1 395.790 3.368 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc3ccsc32)cc1 ZINC000443450603 567758786 /nfs/dbraw/zinc/75/87/86/567758786.db2.gz FINPBASNDCXBFP-UHFFFAOYSA-N 0 1 381.500 3.496 10 0 GGAEMN O=C(NCC/C=C/c1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000624087434 567759172 /nfs/dbraw/zinc/75/91/72/567759172.db2.gz WZZOBJCUYLMXPK-KZTTYJGESA-N 0 1 389.297 3.432 10 0 GGAEMN COc1c(C)cc(CN(C)Cc2cc(Cl)cc(S(N)(=O)=O)c2)cc1C ZINC000574161828 567759592 /nfs/dbraw/zinc/75/95/92/567759592.db2.gz AHLMSLZRGYCUET-UHFFFAOYSA-N 0 1 382.913 3.245 10 0 GGAEMN CCN(CC)Cc1ccc(C(=O)N[C@@H](C)c2ncc(Br)cn2)o1 ZINC000647118533 567759844 /nfs/dbraw/zinc/75/98/44/567759844.db2.gz YIHKQOJGRCMTAQ-NSHDSACASA-N 0 1 381.274 3.165 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(C)[C@H](C)Cc1ccccc1C(F)(F)F ZINC000554969214 567760227 /nfs/dbraw/zinc/76/02/27/567760227.db2.gz GUJRCRMONPRUPY-CQSZACIVSA-N 0 1 380.476 3.240 10 0 GGAEMN C[C@@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)sc1Cl ZINC000624113753 567760600 /nfs/dbraw/zinc/76/06/00/567760600.db2.gz MMNUYVQVTPAVCR-ZJUUUORDSA-N 0 1 383.308 3.422 10 0 GGAEMN Cn1ncc(C2CCC2)c1CN1CCC(n2cc(Br)cn2)CC1 ZINC000667622830 567761634 /nfs/dbraw/zinc/76/16/34/567761634.db2.gz ARLQQWOOHXEPDZ-UHFFFAOYSA-N 0 1 378.318 3.484 10 0 GGAEMN COc1ncc(Br)cc1CN[C@@H](C)CC(=O)N(C)c1ccccc1 ZINC000624133431 567761977 /nfs/dbraw/zinc/76/19/77/567761977.db2.gz NZHQRAOZUIGSNI-ZDUSSCGKSA-N 0 1 392.297 3.384 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NCCc1ccc(I)cc1 ZINC000598393262 567762355 /nfs/dbraw/zinc/76/23/55/567762355.db2.gz NLNBLMQGEJMLNO-UHFFFAOYSA-N 0 1 397.260 3.419 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cnc(OC)c(Cl)c2)cc1OC(C)C ZINC000647130181 567762965 /nfs/dbraw/zinc/76/29/65/567762965.db2.gz CNLCDYKRKIHVIH-UHFFFAOYSA-N 0 1 386.857 3.340 10 0 GGAEMN O=C(NCc1n[nH]c(C2CC2)n1)Nc1ccc(-c2ccc(Cl)s2)nn1 ZINC000667677454 567764165 /nfs/dbraw/zinc/76/41/65/567764165.db2.gz SFJOEWSNHGSATH-UHFFFAOYSA-N 0 1 375.845 3.176 10 0 GGAEMN O=S1(=O)NC(CN2CC[C@@H](c3cccc(Cl)c3)C2)=Nc2ccccc21 ZINC000574230815 567764968 /nfs/dbraw/zinc/76/49/68/567764968.db2.gz WSYWAPJMDLQNFA-CQSZACIVSA-N 0 1 375.881 3.151 10 0 GGAEMN O=C(CCCC(=O)C1CC1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598426344 567765983 /nfs/dbraw/zinc/76/59/83/567765983.db2.gz AEEPASZVFZHJDS-UHFFFAOYSA-N 0 1 397.216 3.255 10 0 GGAEMN CC[C@@H]1C[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCO1 ZINC000598428042 567766340 /nfs/dbraw/zinc/76/63/40/567766340.db2.gz LBOSJUBCMCKUJX-GXSJLCMTSA-N 0 1 399.232 3.311 10 0 GGAEMN Cc1cc(C)c(C(=O)NCCCCN2CCOCC2)c(C)c1Br ZINC000624176414 567766498 /nfs/dbraw/zinc/76/64/98/567766498.db2.gz KYMIJUWKVLTISN-UHFFFAOYSA-N 0 1 383.330 3.217 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cccc3c2ccn3C)cc1Cl ZINC000533391135 567767135 /nfs/dbraw/zinc/76/71/35/567767135.db2.gz HLXQGOLMPMWOHN-UHFFFAOYSA-N 0 1 378.837 3.419 10 0 GGAEMN COC[C@@H](C)[C@@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428236 567767305 /nfs/dbraw/zinc/76/73/05/567767305.db2.gz NMXDHLGLTISCCI-RKDXNWHRSA-N 0 1 387.221 3.025 10 0 GGAEMN COC[C@H](C)[C@@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428234 567767400 /nfs/dbraw/zinc/76/74/00/567767400.db2.gz NMXDHLGLTISCCI-DTWKUNHWSA-N 0 1 387.221 3.025 10 0 GGAEMN CC(C)Cn1nccc1CNCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000647190982 567769196 /nfs/dbraw/zinc/76/91/96/567769196.db2.gz YYTSCSCBCLQTTQ-UHFFFAOYSA-N 0 1 389.301 3.377 10 0 GGAEMN CC(C)Cn1nccc1CNCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000647190982 567769198 /nfs/dbraw/zinc/76/91/98/567769198.db2.gz YYTSCSCBCLQTTQ-UHFFFAOYSA-N 0 1 389.301 3.377 10 0 GGAEMN Fc1cncc(Br)c1CN1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000667712251 567770469 /nfs/dbraw/zinc/77/04/69/567770469.db2.gz AMXUCJXMONDVRC-NSHDSACASA-N 0 1 380.265 3.358 10 0 GGAEMN Fc1cncc(Br)c1CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000667712251 567770471 /nfs/dbraw/zinc/77/04/71/567770471.db2.gz AMXUCJXMONDVRC-NSHDSACASA-N 0 1 380.265 3.358 10 0 GGAEMN C[C@@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1sccc1Br ZINC000624266068 567771009 /nfs/dbraw/zinc/77/10/09/567771009.db2.gz FLFLJVUWEACKRK-HIFRSBDPSA-N 0 1 396.354 3.457 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1cc(OC(F)F)ccc1Br ZINC000647209396 567771811 /nfs/dbraw/zinc/77/18/11/567771811.db2.gz HEPUVWHJRUBZSU-FZMZJTMJSA-N 0 1 396.272 3.298 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@H](CO)NCc1cc(OC(F)F)ccc1Br ZINC000647209395 567771846 /nfs/dbraw/zinc/77/18/46/567771846.db2.gz HEPUVWHJRUBZSU-BXUZGUMPSA-N 0 1 396.272 3.298 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C1(CO)CCC1 ZINC000574338200 567772374 /nfs/dbraw/zinc/77/23/74/567772374.db2.gz QGXFVGWPLWAFGP-OAHLLOKOSA-N 0 1 380.286 3.242 10 0 GGAEMN CC(C)[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C1(CO)CCC1 ZINC000574338199 567772407 /nfs/dbraw/zinc/77/24/07/567772407.db2.gz QGXFVGWPLWAFGP-HNNXBMFYSA-N 0 1 380.286 3.242 10 0 GGAEMN Cn1cnc(CCCNCc2csc(COc3ccc(Cl)cc3)n2)n1 ZINC000647231178 567772473 /nfs/dbraw/zinc/77/24/73/567772473.db2.gz KQJIZDMLLOGIFD-UHFFFAOYSA-N 0 1 377.901 3.226 10 0 GGAEMN CN(C)C[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000462110012 567773246 /nfs/dbraw/zinc/77/32/46/567773246.db2.gz RWLNKUDYWGBOLW-CYBMUJFWSA-N 0 1 392.468 3.218 10 0 GGAEMN CN(C)C[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000462110013 567773772 /nfs/dbraw/zinc/77/37/72/567773772.db2.gz RWLNKUDYWGBOLW-ZDUSSCGKSA-N 0 1 392.468 3.218 10 0 GGAEMN C[C@H](C(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)N1CCSCC1 ZINC000533548449 567773901 /nfs/dbraw/zinc/77/39/01/567773901.db2.gz AVPUISCJQPMAKL-MLGOLLRUSA-N 0 1 378.929 3.317 10 0 GGAEMN C[C@@H](C(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)N1CCSCC1 ZINC000533548448 567774543 /nfs/dbraw/zinc/77/45/43/567774543.db2.gz AVPUISCJQPMAKL-LRDDRELGSA-N 0 1 378.929 3.317 10 0 GGAEMN CS(=O)(=O)c1cccc(Cl)c1CN[C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000647245608 567774507 /nfs/dbraw/zinc/77/45/07/567774507.db2.gz SDUWWBZSTXXDGL-RHSMWYFYSA-N 0 1 380.897 3.148 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccc(Br)cc3)o2)C1 ZINC000574407395 567776320 /nfs/dbraw/zinc/77/63/20/567776320.db2.gz NQBPYRWWOGMLJN-ZIAGYGMSSA-N 0 1 395.253 3.168 10 0 GGAEMN COc1ncc(S(=O)(=O)Nc2cccc3c2CN(C(C)C)C3)cc1Cl ZINC000647271322 567776381 /nfs/dbraw/zinc/77/63/81/567776381.db2.gz ZIBSERDUNABBIL-UHFFFAOYSA-N 0 1 381.885 3.268 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccc2cccc(Cl)c2n1)C1CCOCC1 ZINC000647271739 567776536 /nfs/dbraw/zinc/77/65/36/567776536.db2.gz GEAIDMUHZWDKTK-OAHLLOKOSA-N 0 1 384.885 3.072 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2nc(C)c(Cl)cc2Cl)coc1C(=O)N(C)C ZINC000647271253 567776917 /nfs/dbraw/zinc/77/69/17/567776917.db2.gz PTSMWLHWWLKCCF-UHFFFAOYSA-N 0 1 392.264 3.101 10 0 GGAEMN C[C@H](NC[C@H](O)COc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647295098 567777345 /nfs/dbraw/zinc/77/73/45/567777345.db2.gz ZRJGIBVPYBCRNR-ZFWWWQNUSA-N 0 1 394.313 3.072 10 0 GGAEMN C[C@H](NCCNC(=O)c1ccc(Br)cc1)c1cc2n(n1)CCCC2 ZINC000647283650 567777616 /nfs/dbraw/zinc/77/76/16/567777616.db2.gz ILGYBZIJYRQXEK-ZDUSSCGKSA-N 0 1 391.313 3.063 10 0 GGAEMN COc1ncc(S(=O)(=O)[N-]c2ccc3c(c2)CC[C@@H]3[NH+](C)C)cc1Cl ZINC000647277218 567777798 /nfs/dbraw/zinc/77/77/98/567777798.db2.gz OHRBLUHEHGTAGX-INIZCTEOSA-N 0 1 381.885 3.093 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NCC[C@H]1CC1(F)F ZINC000598622777 567780370 /nfs/dbraw/zinc/78/03/70/567780370.db2.gz RLAMEBHEGIFKNR-ZETCQYMHSA-N 0 1 388.219 3.104 10 0 GGAEMN CC(C)(CNC(=O)[C@@H]1CCc2[nH]cnc2C1)c1cccc(Br)c1 ZINC000667884731 567780368 /nfs/dbraw/zinc/78/03/68/567780368.db2.gz BIRZGRVKKBQAQI-GFCCVEGCSA-N 0 1 376.298 3.371 10 0 GGAEMN Cc1nc(S(=O)(=O)NC[C@@H]2C[C@H]2c2ccccc2)sc1Br ZINC000555413947 567782987 /nfs/dbraw/zinc/78/29/87/567782987.db2.gz SELACGJNSZTLOM-RYUDHWBXSA-N 0 1 387.324 3.296 10 0 GGAEMN C[C@@H](F)CCNS(=O)(=O)c1scc(Br)c1Br ZINC000555414952 567783526 /nfs/dbraw/zinc/78/35/26/567783526.db2.gz SPOFHKBKFWMLNH-RXMQYKEDSA-N 0 1 395.113 3.300 10 0 GGAEMN CN(Cc1cscn1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000443999604 567784596 /nfs/dbraw/zinc/78/45/96/567784596.db2.gz YQSXONRGZIQVMS-UHFFFAOYSA-N 0 1 378.251 3.019 10 0 GGAEMN CC(C)(C)O[C@@H]1C[C@H]1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000667947311 567784728 /nfs/dbraw/zinc/78/47/28/567784728.db2.gz MIKAUKFWFJQGRP-CHWSQXEVSA-N 0 1 393.285 3.054 10 0 GGAEMN CC(C)(C)O[C@@H]1C[C@H]1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000667947311 567784732 /nfs/dbraw/zinc/78/47/32/567784732.db2.gz MIKAUKFWFJQGRP-CHWSQXEVSA-N 0 1 393.285 3.054 10 0 GGAEMN CC1=CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000533732916 567785283 /nfs/dbraw/zinc/78/52/83/567785283.db2.gz XALPQABDNXRJKA-UHFFFAOYSA-N 0 1 376.258 3.096 10 0 GGAEMN CC1=CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000533732916 567785287 /nfs/dbraw/zinc/78/52/87/567785287.db2.gz XALPQABDNXRJKA-UHFFFAOYSA-N 0 1 376.258 3.096 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000667947672 567785890 /nfs/dbraw/zinc/78/58/90/567785890.db2.gz ZTADNDLDEIEQKE-IACUBPJLSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCC[C@H]2C[C@H]21 ZINC000667947672 567785895 /nfs/dbraw/zinc/78/58/95/567785895.db2.gz ZTADNDLDEIEQKE-IACUBPJLSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C([O-])c1cccnc1N1CC[NH+](CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000647452310 567786714 /nfs/dbraw/zinc/78/67/14/567786714.db2.gz VXPKUZLZWBGBQA-UHFFFAOYSA-N 0 1 380.275 3.451 10 0 GGAEMN O=C(Nc1nc(-c2ccc[nH]2)cs1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000668018340 567788812 /nfs/dbraw/zinc/78/88/12/567788812.db2.gz IOHCTTKRWXODJP-UWVGGRQHSA-N 0 1 375.372 3.061 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000668027381 567789717 /nfs/dbraw/zinc/78/97/17/567789717.db2.gz HZBQZMOSKGCPNK-YVEFUNNKSA-N 0 1 380.275 3.422 10 0 GGAEMN CSc1ccccc1S(=O)(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000444082282 567791100 /nfs/dbraw/zinc/79/11/00/567791100.db2.gz HMNDGYOEWABTHK-QGZVFWFLSA-N 0 1 376.547 3.304 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cc(C)cc(Br)c3)[nH]c2c1 ZINC000444081883 567791484 /nfs/dbraw/zinc/79/14/84/567791484.db2.gz VBWSGPBUVDVFSX-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN CC1(CC(F)F)CN(C[C@@H](O)COc2cc(F)cc(Br)c2)C1 ZINC000647614449 567793196 /nfs/dbraw/zinc/79/31/96/567793196.db2.gz YQBYUULCSMSXPI-GFCCVEGCSA-N 0 1 382.220 3.305 10 0 GGAEMN COc1ccc(Br)cc1CNC[C@H]1CS(=O)(=O)c2ccccc21 ZINC000574718940 567793541 /nfs/dbraw/zinc/79/35/41/567793541.db2.gz LTTYITRJIMZVRO-ZDUSSCGKSA-N 0 1 396.306 3.118 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc(Br)ccc2OC)[C@@H]1n1cccn1 ZINC000555646344 567793579 /nfs/dbraw/zinc/79/35/79/567793579.db2.gz VLFCRCAKLOXPQY-OIISXLGYSA-N 0 1 380.286 3.163 10 0 GGAEMN CCN(Cc1ccncc1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444143172 567793901 /nfs/dbraw/zinc/79/39/01/567793901.db2.gz LSSSAEQYHBUPPR-UHFFFAOYSA-N 0 1 386.249 3.348 10 0 GGAEMN COc1ccccc1[C@H](N)CNC(=O)[C@H]1CCc2cc(Br)ccc21 ZINC000647633768 567795217 /nfs/dbraw/zinc/79/52/17/567795217.db2.gz BORSCXPEPJXPKG-DOTOQJQBSA-N 0 1 389.293 3.304 10 0 GGAEMN Cc1ncsc1CN(C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444176054 567795425 /nfs/dbraw/zinc/79/54/25/567795425.db2.gz NDFOWYGXTFLIES-UHFFFAOYSA-N 0 1 392.278 3.328 10 0 GGAEMN CCCN1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CC1 ZINC000668176013 567799256 /nfs/dbraw/zinc/79/92/56/567799256.db2.gz GLEFNFFQRZLONH-UHFFFAOYSA-N 0 1 380.330 3.217 10 0 GGAEMN CN(C(=O)c1ccc(Br)c(Cl)c1F)[C@@H]1CN2CCC1CC2 ZINC000444268331 567799307 /nfs/dbraw/zinc/79/93/07/567799307.db2.gz NBUIBJTTZNSBFF-GFCCVEGCSA-N 0 1 375.669 3.408 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)c2c(F)cccc2F)[C@@H]1c1ccc(Cl)cc1 ZINC000534083687 567799352 /nfs/dbraw/zinc/79/93/52/567799352.db2.gz IFQAVLFBLOOTFW-CVEARBPZSA-N 0 1 386.851 3.342 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)c2c(F)cccc2F)[C@H]1c1ccc(Cl)cc1 ZINC000534083692 567799695 /nfs/dbraw/zinc/79/96/95/567799695.db2.gz IFQAVLFBLOOTFW-JKSUJKDBSA-N 0 1 386.851 3.342 10 0 GGAEMN CN(CCC1CCOCC1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444299929 567800107 /nfs/dbraw/zinc/80/01/07/567800107.db2.gz DRJHOXPOLFAZIZ-UHFFFAOYSA-N 0 1 393.281 3.179 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCc2ccc(O)cc2C1 ZINC000444334567 567801674 /nfs/dbraw/zinc/80/16/74/567801674.db2.gz HWUPZLZTZAKDLB-UHFFFAOYSA-N 0 1 399.244 3.195 10 0 GGAEMN CCn1nc(C)cc1C(=O)Nc1nc(-c2ccccc2Br)n[nH]1 ZINC000624826241 567802086 /nfs/dbraw/zinc/80/20/86/567802086.db2.gz AZEZEZRPUPZUDD-UHFFFAOYSA-N 0 1 375.230 3.011 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)Cc1ccccc1 ZINC000534202635 567803006 /nfs/dbraw/zinc/80/30/06/567803006.db2.gz GORXTPDYULJFHB-NSHDSACASA-N 0 1 386.249 3.256 10 0 GGAEMN C[C@@]1(CCCO)CCCN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444355711 567803118 /nfs/dbraw/zinc/80/31/18/567803118.db2.gz HLIYPDLAVPQLBD-SFHVURJKSA-N 0 1 393.281 3.058 10 0 GGAEMN COC[C@H]1CCCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000444364853 567803768 /nfs/dbraw/zinc/80/37/68/567803768.db2.gz MVWGSWYZFTXPMZ-LBPRGKRZSA-N 0 1 393.281 3.179 10 0 GGAEMN COC[C@@H]1CCCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000444364852 567804098 /nfs/dbraw/zinc/80/40/98/567804098.db2.gz MVWGSWYZFTXPMZ-GFCCVEGCSA-N 0 1 393.281 3.179 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@@H]2CCc3cc(Br)ccc32)n[nH]1 ZINC000574918279 567804734 /nfs/dbraw/zinc/80/47/34/567804734.db2.gz JHQBPBZDSPIIFY-CYBMUJFWSA-N 0 1 377.286 3.211 10 0 GGAEMN COC(=O)CCNC(=O)CCN[C@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000599090206 567804737 /nfs/dbraw/zinc/80/47/37/567804737.db2.gz YTMLDCJBZHWZDA-JTQLQIEISA-N 0 1 379.309 3.091 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@H]2CCN(c3ccccc3Br)C2=O)n1 ZINC000574988989 567807377 /nfs/dbraw/zinc/80/73/77/567807377.db2.gz ZHVXBAAKXAKHQY-YPMHNXCESA-N 0 1 393.285 3.399 10 0 GGAEMN Cn1cc([C@@H](NCc2cc(F)cc(Br)c2)C2(CO)CCC2)cn1 ZINC000647944398 567807741 /nfs/dbraw/zinc/80/77/41/567807741.db2.gz FGUXSIUZFRITAI-MRXNPFEDSA-N 0 1 382.277 3.315 10 0 GGAEMN Cn1cc([C@H](NCc2ccc(Br)c(F)c2)C2(CO)CCC2)cn1 ZINC000647944915 567807788 /nfs/dbraw/zinc/80/77/88/567807788.db2.gz PLYOPDUABIWMLR-INIZCTEOSA-N 0 1 382.277 3.315 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000444555361 567807989 /nfs/dbraw/zinc/80/79/89/567807989.db2.gz TXSYWAGQSAIMDJ-OLZOCXBDSA-N 0 1 389.323 3.064 10 0 GGAEMN Cc1nn(C)c(C)c1CCNCc1cn(-c2cccc(Cl)c2Cl)nn1 ZINC000534354807 567808337 /nfs/dbraw/zinc/80/83/37/567808337.db2.gz UBALJLIATDCNNB-UHFFFAOYSA-N 0 1 379.295 3.257 10 0 GGAEMN CCOCC[C@H](O)CN1CCC[C@H]1c1ccccc1I ZINC000444645870 567809754 /nfs/dbraw/zinc/80/97/54/567809754.db2.gz IHZNECXWKKOEGZ-BBRMVZONSA-N 0 1 389.277 3.216 10 0 GGAEMN FC(F)Oc1ccc(CN2CC[C@H](Cn3ccnn3)C2)cc1Br ZINC000668453329 567810018 /nfs/dbraw/zinc/81/00/18/567810018.db2.gz SIHLCJIUCKBIPF-LBPRGKRZSA-N 0 1 387.228 3.164 10 0 GGAEMN C[C@H]1CC[C@H](C(N)=O)CN1Cc1cc(OC(F)F)ccc1Br ZINC000648002410 567810564 /nfs/dbraw/zinc/81/05/64/567810564.db2.gz UUAJGIREIGUCMG-UWVGGRQHSA-N 0 1 377.229 3.136 10 0 GGAEMN CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(F)cc(Cl)c1 ZINC000534408986 567810731 /nfs/dbraw/zinc/81/07/31/567810731.db2.gz INSWKDWXZSAEEM-QGZVFWFLSA-N 0 1 382.888 3.374 10 0 GGAEMN Cc1cc(N2CC[C@@H](N(C)Cc3ccc(Br)cc3C)C2=O)n(C)n1 ZINC000444705122 567810923 /nfs/dbraw/zinc/81/09/23/567810923.db2.gz MBSWTELZTBMSIK-MRXNPFEDSA-N 0 1 391.313 3.037 10 0 GGAEMN CCOCC[C@H](O)CN1CCC[C@H]1c1ccc(I)cc1 ZINC000444647854 567810969 /nfs/dbraw/zinc/81/09/69/567810969.db2.gz GAFYVQGBTFMUBG-HOTGVXAUSA-N 0 1 389.277 3.216 10 0 GGAEMN C[C@@H](C(=O)Nc1nc(-c2ccccc2Br)n[nH]1)C1CCOCC1 ZINC000534432147 567811300 /nfs/dbraw/zinc/81/13/00/567811300.db2.gz ZHYQRSSBPSMAKG-SNVBAGLBSA-N 0 1 379.258 3.235 10 0 GGAEMN O=C(Nc1nc(-c2ccco2)cs1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000668474949 567811925 /nfs/dbraw/zinc/81/19/25/567811925.db2.gz IYBIULLQARUSHO-ZJUUUORDSA-N 0 1 376.356 3.326 10 0 GGAEMN C[C@H](NC(=O)c1cccc(Br)c1O)c1ccc(-n2ccnn2)cc1 ZINC000534493045 567812821 /nfs/dbraw/zinc/81/28/21/567812821.db2.gz KUTXKYCFGLHGII-NSHDSACASA-N 0 1 387.237 3.226 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2sc(C)cc2Br)C1 ZINC000648072967 567813455 /nfs/dbraw/zinc/81/34/55/567813455.db2.gz YBHAZGDKNZKPCI-LBPRGKRZSA-N 0 1 385.249 3.319 10 0 GGAEMN O[C@@]1(C2CC2)CCCN(Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000668557737 567813622 /nfs/dbraw/zinc/81/36/22/567813622.db2.gz MNYPTSVTOBVTNQ-IBGZPJMESA-N 0 1 395.341 3.023 10 0 GGAEMN O[C@]1(C2CC2)CCCN(Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000668557738 567813953 /nfs/dbraw/zinc/81/39/53/567813953.db2.gz MNYPTSVTOBVTNQ-LJQANCHMSA-N 0 1 395.341 3.023 10 0 GGAEMN C[C@]12COC[C@H]1C[N@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597589 567814294 /nfs/dbraw/zinc/81/42/94/567814294.db2.gz UPVSUAYCWXSKEI-YGRLFVJLSA-N 0 1 391.103 3.386 10 0 GGAEMN C[C@]12COC[C@H]1C[N@@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597589 567814296 /nfs/dbraw/zinc/81/42/96/567814296.db2.gz UPVSUAYCWXSKEI-YGRLFVJLSA-N 0 1 391.103 3.386 10 0 GGAEMN CN(C(=O)c1c(F)c(F)c(Br)c(F)c1F)[C@@H]1CCN(C2CC2)C1 ZINC000668599384 567814591 /nfs/dbraw/zinc/81/45/91/567814591.db2.gz WEFGYVJIXXYXIT-MRVPVSSYSA-N 0 1 395.194 3.314 10 0 GGAEMN COc1cc(C(=O)NC2CCN(Cc3ccccn3)CC2)cc(Cl)c1OC ZINC000048368052 570248046 /nfs/dbraw/zinc/24/80/46/570248046.db2.gz DISXKPYBAJLPHH-UHFFFAOYSA-N 0 1 389.883 3.147 10 0 GGAEMN CCNC(=O)NC(=O)[C@H](Sc1nc(-c2ccccc2)n[nH]1)c1ccccc1 ZINC000006178845 570282053 /nfs/dbraw/zinc/28/20/53/570282053.db2.gz XHSQNKFSUJULBG-OAHLLOKOSA-N 0 1 381.461 3.151 10 0 GGAEMN C[C@H](NC(=O)CN1CCC(C(=O)Nc2ccccc2)CC1)c1ccc(F)cc1 ZINC000012889978 570285916 /nfs/dbraw/zinc/28/59/16/570285916.db2.gz HVVYYHYPOQUUMV-INIZCTEOSA-N 0 1 383.467 3.354 10 0 GGAEMN Cc1ccc(N2CCN(Cc3ccc(C(=O)N4CCOCC4)cc3)CC2)cc1C ZINC000034668097 570292551 /nfs/dbraw/zinc/29/25/51/570292551.db2.gz NXCVFHVLWRRXBO-UHFFFAOYSA-N 0 1 393.531 3.098 10 0 GGAEMN O=C(NC[C@@H]1CCCO1)c1ccc(CN2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000034668729 570293050 /nfs/dbraw/zinc/29/30/50/570293050.db2.gz HYRXRZKFHHJDFP-QFIPXVFZSA-N 0 1 397.494 3.057 10 0 GGAEMN C[C@@H](Cc1ccc2c(c1)OCO2)CN1CCc2nc(-c3cccnc3)[nH]c2C1 ZINC000216368238 570300081 /nfs/dbraw/zinc/30/00/81/570300081.db2.gz MOIXHQRHEVNGOU-HNNXBMFYSA-N 0 1 376.460 3.437 10 0 GGAEMN C[C@@H](CC(=O)N1CCC([N@@H+](C)CC(=O)[O-])CC1)c1ccccc1C(F)(F)F ZINC000186624020 570306264 /nfs/dbraw/zinc/30/62/64/570306264.db2.gz HKGUDMGRMGNOSZ-ZDUSSCGKSA-N 0 1 386.414 3.206 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2cccc(Oc3ccccc3)c2)CC1 ZINC000186644804 570309293 /nfs/dbraw/zinc/30/92/93/570309293.db2.gz IAFPWZPXTNCNCF-UHFFFAOYSA-N 0 1 382.460 3.490 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000186670056 570311282 /nfs/dbraw/zinc/31/12/82/570311282.db2.gz ALUGUOZMQRMSNM-BRWVUGGUSA-N 0 1 398.425 3.206 10 0 GGAEMN CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2nc(-c3ccccn3)n[nH]2)cc1 ZINC000053525374 570324851 /nfs/dbraw/zinc/32/48/51/570324851.db2.gz JRUQFPAQTYEQNX-UHFFFAOYSA-N 0 1 394.435 3.144 10 0 GGAEMN O=C(CCC1CCN(C(=O)c2cn[nH]c2-c2ccccc2F)CC1)NC1CC1 ZINC000011936376 570376097 /nfs/dbraw/zinc/37/60/97/570376097.db2.gz QSXWICFVTURFHI-UHFFFAOYSA-N 0 1 384.455 3.127 10 0 GGAEMN Cc1n[nH]c(C2CC2)c1C(=O)N[C@H](c1cnc2ccccc2c1)C1CC(O)C1 ZINC000220731158 570390733 /nfs/dbraw/zinc/39/07/33/570390733.db2.gz LRARUWCXXJXIFX-LAGYLCCXSA-N 0 1 376.460 3.386 10 0 GGAEMN CC1(C)C(=O)Nc2ccccc2N1C(=O)CSc1nc(-c2cccs2)n[nH]1 ZINC000005017602 570397600 /nfs/dbraw/zinc/39/76/00/570397600.db2.gz JEVSZLCEIJQLBP-UHFFFAOYSA-N 0 1 399.501 3.389 10 0 GGAEMN CCCCN(CC)C(=O)c1sc2ncnc(N3CCN(C)CC3)c2c1C ZINC000033048215 570400773 /nfs/dbraw/zinc/40/07/73/570400773.db2.gz BVVBUFVIAZYRHQ-UHFFFAOYSA-N 0 1 375.542 3.014 10 0 GGAEMN C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)o1 ZINC000222007037 570405671 /nfs/dbraw/zinc/40/56/71/570405671.db2.gz OOIAGFVFXYNQEW-LYSIVYOWSA-N 0 1 382.504 3.087 10 0 GGAEMN CN(C)c1nc(CN2CCC[C@H](c3nc(C4CCCCC4)n[nH]3)C2)ns1 ZINC000095993109 570413996 /nfs/dbraw/zinc/41/39/96/570413996.db2.gz KZBCHKQYTNENIA-AWEZNQCLSA-N 0 1 375.546 3.150 10 0 GGAEMN CN(C)c1nc(CN2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)ns1 ZINC000095993109 570413999 /nfs/dbraw/zinc/41/39/99/570413999.db2.gz KZBCHKQYTNENIA-AWEZNQCLSA-N 0 1 375.546 3.150 10 0 GGAEMN COc1ccc(-c2n[nH]c(SCC(=O)c3cc(OC)ccc3OC)n2)cc1 ZINC000005086896 570414562 /nfs/dbraw/zinc/41/45/62/570414562.db2.gz JLAKCJDXSIZBGE-UHFFFAOYSA-N 0 1 385.445 3.473 10 0 GGAEMN COc1ccccc1[C@@H](C)N[C@H](C)C(=O)N1CCN(Cc2ccccc2)CC1 ZINC000005090400 570414913 /nfs/dbraw/zinc/41/49/13/570414913.db2.gz ILXNTVCVEYRCIO-RTBURBONSA-N 0 1 381.520 3.079 10 0 GGAEMN O=C([O-])C1(c2ccccc2)CCN(C(=O)[C@@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000238064115 570422731 /nfs/dbraw/zinc/42/27/31/570422731.db2.gz YHSXUBIRYXUJAN-NRFANRHFSA-N 0 1 392.499 3.296 10 0 GGAEMN C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[C@@H]2CCCC[C@H]2C1 ZINC000241965672 570431983 /nfs/dbraw/zinc/43/19/83/570431983.db2.gz UUXMTJVRWVBWBJ-RDBSUJKOSA-N 0 1 375.538 3.175 10 0 GGAEMN CCn1c(C)cc(O)c([C@@H](c2ccc(OC)c(OC)c2)N2CCCCC2)c1=O ZINC000038545836 570433191 /nfs/dbraw/zinc/43/31/91/570433191.db2.gz JDQIQOWZUNQAEF-OAQYLSRUSA-N 0 1 386.492 3.475 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)C(=O)Nc2ccccc2Oc2cccc(F)c2)n[nH]1 ZINC000130649347 570464970 /nfs/dbraw/zinc/46/49/70/570464970.db2.gz DJGKUORMWZZXCO-ZDUSSCGKSA-N 0 1 396.422 3.335 10 0 GGAEMN O=C(NCC1CC1)[C@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@@H]12 ZINC000035870021 570468438 /nfs/dbraw/zinc/46/84/38/570468438.db2.gz YCAAGSKTEKPAIL-GMAHTHKFSA-N 0 1 393.506 3.215 10 0 GGAEMN COCc1nc2scc(-c3ccccc3)c2c(Sc2nnc(CN)n2C)n1 ZINC000079063775 570510432 /nfs/dbraw/zinc/51/04/32/570510432.db2.gz POTFMCUQSWJVFQ-UHFFFAOYSA-N 0 1 398.517 3.243 10 0 GGAEMN COc1cccc(CN(Cc2ccc3c(c2)OCO3)C[C@H](O)COC(C)C)c1 ZINC000036098461 570536671 /nfs/dbraw/zinc/53/66/71/570536671.db2.gz ZVUFYJQAPWDBAM-IBGZPJMESA-N 0 1 387.476 3.212 10 0 GGAEMN CCOC(=O)c1[nH]c(CSC2=N[C@@H]3CCCC[C@H]3N2)c(C(=O)OCC)c1C ZINC000040007483 570542622 /nfs/dbraw/zinc/54/26/22/570542622.db2.gz RZNXRLUVIKAMLU-CHWSQXEVSA-N 0 1 393.509 3.180 10 0 GGAEMN Cc1cccc(CN(CCC(=O)N2CCNCC2)C(=O)c2cccc(Cl)c2)c1 ZINC000035422088 570553296 /nfs/dbraw/zinc/55/32/96/570553296.db2.gz FEIQGHVIRXBAMN-UHFFFAOYSA-N 0 1 399.922 3.113 10 0 GGAEMN COc1ccc(CNC(=O)C2=CCN(Cc3ccc(F)cc3)CC2)cc1OC ZINC000064818055 570553679 /nfs/dbraw/zinc/55/36/79/570553679.db2.gz ULLOBDKFGPBGAB-UHFFFAOYSA-N 0 1 384.451 3.291 10 0 GGAEMN COc1ccc(OC)c(CNC(=O)C2=CCN(Cc3cccc(F)c3)CC2)c1 ZINC000064818097 570553720 /nfs/dbraw/zinc/55/37/20/570553720.db2.gz PDQJYOKHXYIAGF-UHFFFAOYSA-N 0 1 384.451 3.291 10 0 GGAEMN CCC[C@H](O)CN[C@H](c1nc(-c2cc(OC)c(OC)c(OC)c2)no1)C(C)C ZINC000036160524 570555869 /nfs/dbraw/zinc/55/58/69/570555869.db2.gz KCWMBFSWRQOPTD-YOEHRIQHSA-N 0 1 393.484 3.210 10 0 GGAEMN Cc1ccc(C)c(Cc2c(C)nc(C)nc2N2CCN(C[C@H](O)C(C)C)CC2)c1 ZINC000036340290 570563529 /nfs/dbraw/zinc/56/35/29/570563529.db2.gz UYYAVJUWSNVTRF-QHCPKHFHSA-N 0 1 396.579 3.440 10 0 GGAEMN Cc1ccc2nc3c(c(C(=O)N4CCN(C[C@H]5CCOC5)CC4)c2c1)CCCC3 ZINC000225454278 570575807 /nfs/dbraw/zinc/57/58/07/570575807.db2.gz JVLGUCKMGBPAJJ-GOSISDBHSA-N 0 1 393.531 3.216 10 0 GGAEMN Cc1ccc2nc3c(c(C(=O)N4CCN(C[C@@H]5CCOC5)CC4)c2c1)CCCC3 ZINC000225454315 570575900 /nfs/dbraw/zinc/57/59/00/570575900.db2.gz JVLGUCKMGBPAJJ-SFHVURJKSA-N 0 1 393.531 3.216 10 0 GGAEMN C[C@@H](CN1CCN(C)CC1)NC(=O)N(CCc1ccccc1)c1ccccc1 ZINC000225505065 570581006 /nfs/dbraw/zinc/58/10/06/570581006.db2.gz XDPYDNZQDUXIPU-FQEVSTJZSA-N 0 1 380.536 3.081 10 0 GGAEMN CCOc1ccc2ccccc2c1[C@H]1NC(=O)N=C(C)C1C(=O)OCCOC ZINC000005445556 570595235 /nfs/dbraw/zinc/59/52/35/570595235.db2.gz HTQFMMLIVOVMFD-IBGZPJMESA-N 0 1 384.432 3.056 10 0 GGAEMN CC(C)CNC(=O)[C@@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@@H]12 ZINC000169681661 570602065 /nfs/dbraw/zinc/60/20/65/570602065.db2.gz ATJSGHZSKHAGRG-GGAORHGYSA-N 0 1 395.522 3.461 10 0 GGAEMN COc1ccc(-c2nnc(CCNC(=O)c3ccc(F)cc3Cl)[nH]2)cc1F ZINC000064969440 570619210 /nfs/dbraw/zinc/61/92/10/570619210.db2.gz LSAVLZMUXSXLBP-UHFFFAOYSA-N 0 1 392.793 3.384 10 0 GGAEMN COc1ccc(CCC(=O)NCCc2n[nH]c(Cc3ccc(C)cc3)n2)cc1 ZINC000064969370 570619219 /nfs/dbraw/zinc/61/92/19/570619219.db2.gz CIXIYFZSMYYFCR-UHFFFAOYSA-N 0 1 378.476 3.004 10 0 GGAEMN Cc1ccc(Cc2nc(CCNC(=O)COc3ccc(Cl)cc3)n[nH]2)cc1 ZINC000064969383 570619451 /nfs/dbraw/zinc/61/94/51/570619451.db2.gz NMRNGTGDICYEHX-UHFFFAOYSA-N 0 1 384.867 3.095 10 0 GGAEMN CC(C)(C)c1ccc(S(=O)(=O)NCCc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000064969459 570619526 /nfs/dbraw/zinc/61/95/26/570619526.db2.gz KDUBRRFHTDNMKQ-UHFFFAOYSA-N 0 1 384.505 3.290 10 0 GGAEMN Cc1cccc(Cc2nc(CCNS(=O)(=O)c3cc(C)c(C)cc3C)n[nH]2)c1 ZINC000064969888 570620171 /nfs/dbraw/zinc/62/01/71/570620171.db2.gz UZXOCJVQINJOMB-UHFFFAOYSA-N 0 1 398.532 3.150 10 0 GGAEMN Cc1cc(C)nc(NS(=O)(=O)c2ccc(N3Cc4ccccc4C3=O)cc2)n1 ZINC000005533898 570627927 /nfs/dbraw/zinc/62/79/27/570627927.db2.gz VYLOZBYCNZIPOQ-UHFFFAOYSA-N 0 1 394.456 3.055 10 0 GGAEMN Cc1cc(=NNS(=O)(=O)C[C@@]23CC[C@@H](CC2=O)C3(C)C)[nH]c2ccccc12 ZINC000006831245 570634310 /nfs/dbraw/zinc/63/43/10/570634310.db2.gz QTMGSMBOKDXVLM-XOBRGWDASA-N 0 1 387.505 3.185 10 0 GGAEMN CCOC(=O)C1CCN(C[C@H](O)COc2ccc(C)cc2C(C)(C)C)CC1 ZINC000005559787 570637431 /nfs/dbraw/zinc/63/74/31/570637431.db2.gz ZZPVHIRPKTUVOP-SFHVURJKSA-N 0 1 377.525 3.307 10 0 GGAEMN Cc1ccc(CN(CCC(=O)N2CCNCC2)C(=O)c2ccc(Cl)cc2)cc1 ZINC000045966614 570649862 /nfs/dbraw/zinc/64/98/62/570649862.db2.gz OLCGSFQEPJRVPQ-UHFFFAOYSA-N 0 1 399.922 3.113 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Nc2cccc(Cl)c2N2CCOCC2)C(C)C)n[nH]1 ZINC000072314097 570653813 /nfs/dbraw/zinc/65/38/13/570653813.db2.gz KFWLGAODFPJNOS-HNNXBMFYSA-N 0 1 392.891 3.122 10 0 GGAEMN CCCN(CCC)C(=O)c1sc2ncnc(N3CCN(C)CC3)c2c1C ZINC000033048275 570699295 /nfs/dbraw/zinc/69/92/95/570699295.db2.gz DHNPFIRAKSYCFT-UHFFFAOYSA-N 0 1 375.542 3.014 10 0 GGAEMN Cc1ccc(C(=O)CCC(=O)NCCN2CCN(C)C[C@H]2c2ccccc2)s1 ZINC000036434839 570706070 /nfs/dbraw/zinc/70/60/70/570706070.db2.gz BIFBDFGDYNYLLC-IBGZPJMESA-N 0 1 399.560 3.124 10 0 GGAEMN CCCN1CCN(C(=O)c2cccn2Cc2noc(-c3ccc(C)cc3)n2)CC1 ZINC000065137063 570708106 /nfs/dbraw/zinc/70/81/06/570708106.db2.gz GUNXQCFBQXTXDB-UHFFFAOYSA-N 0 1 393.491 3.063 10 0 GGAEMN CCOC(=O)[C@@H]1C[C@@H]2CCCN2[C@@]12c1ccccc1N(Cc1ccccc1)C2=O ZINC000058090316 570708878 /nfs/dbraw/zinc/70/88/78/570708878.db2.gz JSPQCGNBGKHZMJ-WXVUKLJWSA-N 0 1 390.483 3.476 10 0 GGAEMN Cc1ccc(SCCNC(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)cc1C ZINC000058145723 570710764 /nfs/dbraw/zinc/71/07/64/570710764.db2.gz CRXWUZNJWFVFSE-QZTJIDSGSA-N 0 1 379.570 3.194 10 0 GGAEMN CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC(=O)N[C@@H](C)c2ccc(F)cc2)C1 ZINC000058184603 570717382 /nfs/dbraw/zinc/71/73/82/570717382.db2.gz UPJGJCFDZFADIK-XYJFISCASA-N 0 1 377.504 3.020 10 0 GGAEMN COc1ccc(OC)c(CCC(=O)N2CCC(c3n[nH]c(C4CC4)n3)CC2)c1 ZINC000058228729 570722297 /nfs/dbraw/zinc/72/22/97/570722297.db2.gz QPJJADUISBMKPD-UHFFFAOYSA-N 0 1 384.480 3.038 10 0 GGAEMN COc1ccc([C@H](CN2CCN(C)CC2)NC(=O)Nc2ccc(C)cc2C)cc1 ZINC000058298228 570725555 /nfs/dbraw/zinc/72/55/55/570725555.db2.gz KJTOJVBRARBZBW-QFIPXVFZSA-N 0 1 396.535 3.422 10 0 GGAEMN CCc1noc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2ccc(OC)cc2)n1 ZINC000065194554 570725662 /nfs/dbraw/zinc/72/56/62/570725662.db2.gz MFKMDYRTLUMMAH-UHFFFAOYSA-N 0 1 390.465 3.064 10 0 GGAEMN Cc1nnc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2ccc(C)c(F)c2)o1 ZINC000065194103 570725726 /nfs/dbraw/zinc/72/57/26/570725726.db2.gz FUFZWLSEAYGYLB-UHFFFAOYSA-N 0 1 378.429 3.249 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CC2)C3)c(F)c1 ZINC000065196246 570728444 /nfs/dbraw/zinc/72/84/44/570728444.db2.gz YSHMMVBGTFOLNF-UHFFFAOYSA-N 0 1 394.493 3.291 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000249073621 570733066 /nfs/dbraw/zinc/73/30/66/570733066.db2.gz ALUGUOZMQRMSNM-ZACQAIPSSA-N 0 1 398.425 3.206 10 0 GGAEMN CC(C)N1CCN(Cc2nc(-c3ccc(N4CCCCCC4)nc3)no2)CC1 ZINC000065216238 570734443 /nfs/dbraw/zinc/73/44/43/570734443.db2.gz NFYMHNDTYWIUSD-UHFFFAOYSA-N 0 1 384.528 3.038 10 0 GGAEMN COc1ccc(OC)c(CNCc2cccn2-c2nnc(N3CCCC3)s2)c1 ZINC000007002036 570737465 /nfs/dbraw/zinc/73/74/65/570737465.db2.gz QCFSBDABRWATEO-UHFFFAOYSA-N 0 1 399.520 3.236 10 0 GGAEMN COc1ccc(-c2c(C(=O)N3CCN(CC(C)C)CC3)nc3ccccn32)cc1 ZINC000065232121 570741864 /nfs/dbraw/zinc/74/18/64/570741864.db2.gz HWDDLRFXSJIVDC-UHFFFAOYSA-N 0 1 392.503 3.424 10 0 GGAEMN O=C(Cc1n[nH]c(Cc2ccc(Cl)cc2)n1)Nc1ccc2c(c1)OCCO2 ZINC000065232801 570743129 /nfs/dbraw/zinc/74/31/29/570743129.db2.gz IIJRSFOEAQPKIH-UHFFFAOYSA-N 0 1 384.823 3.001 10 0 GGAEMN Cc1ccc(Cn2cc(-c3noc(C(=O)Nc4cc(F)ccc4F)n3)nn2)cc1 ZINC000065236814 570744097 /nfs/dbraw/zinc/74/40/97/570744097.db2.gz XTBHEWXFYBGFIS-UHFFFAOYSA-N 0 1 396.357 3.215 10 0 GGAEMN O=C(CCc1cc2ccccc2[nH]c1=O)NCCN1CCc2ccccc2C1 ZINC000065245433 570746629 /nfs/dbraw/zinc/74/66/29/570746629.db2.gz NAXQDHYNIMRJNB-UHFFFAOYSA-N 0 1 375.472 3.048 10 0 GGAEMN Cc1ccc2cc(CCC(=O)NCCN3CCc4ccccc4C3)c(=O)[nH]c2c1 ZINC000065245616 570747078 /nfs/dbraw/zinc/74/70/78/570747078.db2.gz ZKDTZRJCFBCQQW-UHFFFAOYSA-N 0 1 389.499 3.356 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cn(C(C)C)c3ncccc23)cc(OC)c1 ZINC000065242196 570748107 /nfs/dbraw/zinc/74/81/07/570748107.db2.gz ZLXPWWPKUWUMPL-UHFFFAOYSA-N 0 1 375.450 3.435 10 0 GGAEMN CCCn1cc(S(=O)(=O)Nc2ccc(OC)c(OC)c2)c2cccnc21 ZINC000065242228 570748121 /nfs/dbraw/zinc/74/81/21/570748121.db2.gz IQJFGUFWQHSNOK-UHFFFAOYSA-N 0 1 375.450 3.264 10 0 GGAEMN Cc1ccc(C)c(NS(=O)(=O)c2cc3n(c2)CCN(CC(C)C)C3=O)c1 ZINC000065254799 570752364 /nfs/dbraw/zinc/75/23/64/570752364.db2.gz RGXBQVKJFARALA-UHFFFAOYSA-N 0 1 375.494 3.018 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1 ZINC000249174747 570763837 /nfs/dbraw/zinc/76/38/37/570763837.db2.gz YMKPDAUNKPQYRD-KBMXLJTQSA-N 0 1 398.425 3.206 10 0 GGAEMN CCN(CC)c1cc(CCC(=O)NCCN2CCc3ccccc3C2)ccn1 ZINC000065270063 570772816 /nfs/dbraw/zinc/77/28/16/570772816.db2.gz CRVXWFVTUXLAKL-UHFFFAOYSA-N 0 1 380.536 3.035 10 0 GGAEMN Cc1cc(NC(=O)C2CC2)sc1C(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000189778972 570773192 /nfs/dbraw/zinc/77/31/92/570773192.db2.gz KXRJOLDGUFKJTI-UHFFFAOYSA-N 0 1 395.488 3.163 10 0 GGAEMN O=C(CSc1nc(-c2cccs2)n[nH]1)Nc1ccc(N2CCCC2=O)cc1 ZINC000007111293 570791610 /nfs/dbraw/zinc/79/16/10/570791610.db2.gz VQLFYTDCKZXRSD-UHFFFAOYSA-N 0 1 399.501 3.391 10 0 GGAEMN Cc1ccc([C@H](CN2CCOCC2)n2c(=O)c3ccccc3[nH]c2=S)cc1 ZINC000032751244 570791864 /nfs/dbraw/zinc/79/18/64/570791864.db2.gz UWHARHHWMURUCQ-IBGZPJMESA-N 0 1 381.501 3.289 10 0 GGAEMN COc1cccc(CNC(=O)[C@@H]2CCCN(c3nc4ccc(C)cc4[nH]3)C2)c1 ZINC000033072054 570803734 /nfs/dbraw/zinc/80/37/34/570803734.db2.gz JZKYFETUXVYANF-QGZVFWFLSA-N 0 1 378.476 3.413 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2)n[nH]1)Nc1ccc(N2CCCC2=O)cc1 ZINC000007149497 570807080 /nfs/dbraw/zinc/80/70/80/570807080.db2.gz HKFIRFDIROJPEZ-UHFFFAOYSA-N 0 1 393.472 3.329 10 0 GGAEMN Cc1c(O)ccc2c(CN[C@@H](C)c3ccc(S(C)(=O)=O)cc3)cc(=O)oc12 ZINC000032797383 570819942 /nfs/dbraw/zinc/81/99/42/570819942.db2.gz UWMWVSJNOAYXAD-ZDUSSCGKSA-N 0 1 387.457 3.061 10 0 GGAEMN CC1CCN(Cc2nnc(-c3cn(CC(=O)NC4CC4)c4ccccc34)o2)CC1 ZINC000033129374 570819955 /nfs/dbraw/zinc/81/99/55/570819955.db2.gz FYNNNFZPUFLFII-UHFFFAOYSA-N 0 1 393.491 3.202 10 0 GGAEMN CN(Cc1ccccc1)Cc1cc(=O)n2nc(-c3ccc(Cl)cc3)nc2[nH]1 ZINC000101747326 570832302 /nfs/dbraw/zinc/83/23/02/570832302.db2.gz ULPDWBJUDIOXPG-UHFFFAOYSA-N 0 1 379.851 3.370 10 0 GGAEMN Cn1c(=O)c2ccc(C(=O)N[C@@H]3CCCC[C@H]3C(F)(F)F)cc2[nH]c1=S ZINC000102832506 570866404 /nfs/dbraw/zinc/86/64/04/570866404.db2.gz CYXUEIIIUCEKFZ-VXGBXAGGSA-N 0 1 385.411 3.073 10 0 GGAEMN Cn1c(=O)c2ccc(C(=O)N[C@H]3CCCC[C@@H]3C(F)(F)F)cc2[nH]c1=S ZINC000102832503 570866409 /nfs/dbraw/zinc/86/64/09/570866409.db2.gz CYXUEIIIUCEKFZ-RYUDHWBXSA-N 0 1 385.411 3.073 10 0 GGAEMN Cc1ccc(C(C)C)cc1OCC(=O)Nc1ccc(N2CCN(C)CC2)nc1 ZINC000012612537 570890473 /nfs/dbraw/zinc/89/04/73/570890473.db2.gz JCZOCXDQCAKFPN-UHFFFAOYSA-N 0 1 382.508 3.283 10 0 GGAEMN COC[C@H](O)CN(Cc1ccccc1)C[C@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000104983057 570911782 /nfs/dbraw/zinc/91/17/82/570911782.db2.gz ZJVZTHUDMZHKBW-WOJBJXKFSA-N 0 1 388.895 3.343 10 0 GGAEMN COc1ccccc1[C@@H](CNC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O)[NH+](C)C ZINC000032912164 570915495 /nfs/dbraw/zinc/91/54/95/570915495.db2.gz GXJTXTIJRWUYPW-MRXNPFEDSA-N 0 1 398.488 3.039 10 0 GGAEMN CCc1nc(SCc2noc(CCC(=O)Nc3ccc(Cl)cc3)n2)n[nH]1 ZINC000033270851 570946920 /nfs/dbraw/zinc/94/69/20/570946920.db2.gz MSEATDUKDRRJJW-UHFFFAOYSA-N 0 1 392.872 3.267 10 0 GGAEMN CCc1n[nH]c(SCc2noc(CCC(=O)Nc3ccc(Cl)cc3)n2)n1 ZINC000033270851 570946925 /nfs/dbraw/zinc/94/69/25/570946925.db2.gz MSEATDUKDRRJJW-UHFFFAOYSA-N 0 1 392.872 3.267 10 0 GGAEMN Cc1nnc(SCc2noc(CCC(=O)Nc3ccc(Cl)cc3C)n2)[nH]1 ZINC000033270986 570946976 /nfs/dbraw/zinc/94/69/76/570946976.db2.gz JPIPEBRITBASMJ-UHFFFAOYSA-N 0 1 392.872 3.322 10 0 GGAEMN Cc1n[nH]c(SCc2noc(CCC(=O)Nc3ccc(Cl)cc3C)n2)n1 ZINC000033270986 570946979 /nfs/dbraw/zinc/94/69/79/570946979.db2.gz JPIPEBRITBASMJ-UHFFFAOYSA-N 0 1 392.872 3.322 10 0 GGAEMN CCc1nc(SCc2noc(CCC(=O)Nc3cc(C)cc(C)c3)n2)n[nH]1 ZINC000033270856 570947007 /nfs/dbraw/zinc/94/70/07/570947007.db2.gz KXCIFVAMJPKIOW-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN CCc1n[nH]c(SCc2noc(CCC(=O)Nc3cc(C)cc(C)c3)n2)n1 ZINC000033270856 570947012 /nfs/dbraw/zinc/94/70/12/570947012.db2.gz KXCIFVAMJPKIOW-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN CCOC(=O)c1nc2ccccc2nc1N1CCN(Cc2ccccc2)CC1 ZINC000045901011 570968185 /nfs/dbraw/zinc/96/81/85/570968185.db2.gz GDHZVLSFPKHIEK-UHFFFAOYSA-N 0 1 376.460 3.129 10 0 GGAEMN O=C(c1ccn2c(c1)nnc2-c1ccccc1)N1CCN(C2CCCCC2)CC1 ZINC000065296039 570969249 /nfs/dbraw/zinc/96/92/49/570969249.db2.gz DAVLBQAOMSGPLB-UHFFFAOYSA-N 0 1 389.503 3.487 10 0 GGAEMN C[C@H]1C[N@@H+](CCC(=O)[O-])CCN1C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000725240375 570973393 /nfs/dbraw/zinc/97/33/93/570973393.db2.gz ANQMMUCRPPQMFP-INIZCTEOSA-N 0 1 394.471 3.416 10 0 GGAEMN COC[C@H](c1cccc(C(F)(F)F)c1)N(C)Cc1cccc(OCC(N)=O)c1 ZINC000083864180 570974146 /nfs/dbraw/zinc/97/41/46/570974146.db2.gz UXQSJNIBYKXVQJ-GOSISDBHSA-N 0 1 396.409 3.389 10 0 GGAEMN CC(=O)N(CCC(C)C)Cc1c(C)nn(-c2ccccc2)c1N1CCN(C)CC1 ZINC000034834625 570988852 /nfs/dbraw/zinc/98/88/52/570988852.db2.gz XMFQZOLEJNCSBE-UHFFFAOYSA-N 0 1 397.567 3.327 10 0 GGAEMN Cc1cc(N)n(-c2cc(NC3CCN(Cc4ccc(Cl)cc4)CC3)ncn2)n1 ZINC000170655620 571000090 /nfs/dbraw/zinc/00/00/90/571000090.db2.gz SEMAXILJSIVBIX-UHFFFAOYSA-N 0 1 397.914 3.283 10 0 GGAEMN CCCN(Cc1ccc(OC)c(OC)c1)Cc1cc(=O)n2cc(C)ccc2n1 ZINC000045974116 571006985 /nfs/dbraw/zinc/00/69/85/571006985.db2.gz DGEJOYJRXQDAOZ-UHFFFAOYSA-N 0 1 381.476 3.432 10 0 GGAEMN CCN(Cc1ccc(OC)cc1)Cc1cc(=O)n2nc(C(C)(C)C)sc2n1 ZINC000046032419 571014279 /nfs/dbraw/zinc/01/42/79/571014279.db2.gz DUODYLYEAJIUOS-UHFFFAOYSA-N 0 1 386.521 3.479 10 0 GGAEMN O=C(NC[C@@H](c1ccco1)N1CCCC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000053534299 1406430710 /nfs/dbraw/zinc/43/07/10/1406430710.db2.gz ANBDOEFYSJOYLK-IBGZPJMESA-N 0 1 386.471 3.087 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)c3cc(-c4cccc(Cl)c4)[nH]n3)nc2)CC1 ZINC000053745758 1406501583 /nfs/dbraw/zinc/50/15/83/1406501583.db2.gz BKTBMTTZEXHEKQ-UHFFFAOYSA-N 0 1 396.882 3.129 10 0 GGAEMN COc1ccc(-c2n[nH]cc2CNCc2cc(OC)c(OC)cc2OC)cc1 ZINC000053945974 1406562944 /nfs/dbraw/zinc/56/29/44/1406562944.db2.gz GUFZRYLSTPMGGU-UHFFFAOYSA-N 0 1 383.448 3.401 10 0 GGAEMN Cc1[nH]nc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)c1Br ZINC000054675389 1406802795 /nfs/dbraw/zinc/80/27/95/1406802795.db2.gz FYOQYCMFDVXVHB-UHFFFAOYSA-N 0 1 383.677 3.096 10 0 GGAEMN CCC(=O)c1ccc(OC[C@H](O)CN2CCC(O)(c3ccccc3)CC2)cc1 ZINC000001729449 1398303062 /nfs/dbraw/zinc/30/30/62/1398303062.db2.gz VBQYVPWJXQKIMF-HXUWFJFHSA-N 0 1 383.488 3.003 10 0 GGAEMN Nc1c(C(=O)c2ccccc2O)cnn1C(=O)CSc1ccc(Cl)cc1 ZINC000002647890 1398315757 /nfs/dbraw/zinc/31/57/57/1398315757.db2.gz VLROYCYDDFORSD-UHFFFAOYSA-N 0 1 387.848 3.488 10 0 GGAEMN O=C(CCn1c(=O)c2ccccc2[nH]c1=S)NCCSCc1ccccc1 ZINC000003043691 1398325802 /nfs/dbraw/zinc/32/58/02/1398325802.db2.gz IDPKVYMYFPUUEZ-UHFFFAOYSA-N 0 1 399.541 3.499 10 0 GGAEMN COc1ccc2nc(SCC(=O)NCC(=O)Nc3cccc(C)c3C)[nH]c2c1 ZINC000004274436 1398387919 /nfs/dbraw/zinc/38/79/19/1398387919.db2.gz XWQQDGISHPYXTB-UHFFFAOYSA-N 0 1 398.488 3.035 10 0 GGAEMN COC(=O)c1cc(NS(=O)(=O)c2cccc3ccccc32)cc(C(=O)OC)c1 ZINC000006706867 1398566980 /nfs/dbraw/zinc/56/69/80/1398566980.db2.gz ISWFCLWXBARCTP-UHFFFAOYSA-N 0 1 399.424 3.214 10 0 GGAEMN CCOc1cc2c(cc1CNCc1ccc(-n3cncn3)c(F)c1)O[C@H](C)C2 ZINC000055472463 1406974978 /nfs/dbraw/zinc/97/49/78/1406974978.db2.gz IEHSHMMWXUDCSX-CQSZACIVSA-N 0 1 382.439 3.418 10 0 GGAEMN CCOc1cc2c(cc1CNCc1ccc(-n3cncn3)c(F)c1)O[C@@H](C)C2 ZINC000055472464 1406975065 /nfs/dbraw/zinc/97/50/65/1406975065.db2.gz IEHSHMMWXUDCSX-AWEZNQCLSA-N 0 1 382.439 3.418 10 0 GGAEMN CC(C)[C@@H](NCC(=O)Nc1ccccc1S(C)(=O)=O)c1ccc(F)cc1 ZINC000008004117 1398789469 /nfs/dbraw/zinc/78/94/69/1398789469.db2.gz OPGGLVCVAFKNSY-LJQANCHMSA-N 0 1 378.469 3.155 10 0 GGAEMN CCCOc1ccc(C(=O)Nc2ccccc2N2CCN(C)CC2)cc1OC ZINC000008343628 1398824545 /nfs/dbraw/zinc/82/45/45/1398824545.db2.gz LHQOYICTCVGHCD-UHFFFAOYSA-N 0 1 383.492 3.488 10 0 GGAEMN Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000008367092 1398826960 /nfs/dbraw/zinc/82/69/60/1398826960.db2.gz CUNVDETWXQFWGP-SFHVURJKSA-N 0 1 395.894 3.233 10 0 GGAEMN COc1cn(CC(=O)Nc2cc(C)ccc2C)c(CN2CCCCC2)cc1=O ZINC000008602111 1398841646 /nfs/dbraw/zinc/84/16/46/1398841646.db2.gz DMGZBFMHIVPZGJ-UHFFFAOYSA-N 0 1 383.492 3.098 10 0 GGAEMN O=C(CSc1nc(C2CCCC2)n[nH]1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000008708988 1398843968 /nfs/dbraw/zinc/84/39/68/1398843968.db2.gz OCXFABVHMDZCEP-UHFFFAOYSA-N 0 1 385.493 3.085 10 0 GGAEMN O=C(CSc1n[nH]c(C2CCCC2)n1)Nc1cccc(C(=O)NC2CC2)c1 ZINC000008708988 1398843969 /nfs/dbraw/zinc/84/39/69/1398843969.db2.gz OCXFABVHMDZCEP-UHFFFAOYSA-N 0 1 385.493 3.085 10 0 GGAEMN COc1cc(CCC2CCN(C(=O)c3ccc4[nH]nnc4c3)CC2)cc(OC)c1 ZINC000008719788 1398844682 /nfs/dbraw/zinc/84/46/82/1398844682.db2.gz XPMHKTIJGXGQKM-UHFFFAOYSA-N 0 1 394.475 3.460 10 0 GGAEMN CN(Cc1nc2ccccc2s1)C(=O)CSc1nc(-c2ccncc2)n[nH]1 ZINC000008848575 1398847612 /nfs/dbraw/zinc/84/76/12/1398847612.db2.gz BLNXRNUAIKJICQ-UHFFFAOYSA-N 0 1 396.501 3.227 10 0 GGAEMN CC(=O)Nc1cc(C(=O)CSc2nnc(C)n2Cc2ccccc2)ccc1O ZINC000008878729 1398848185 /nfs/dbraw/zinc/84/81/85/1398848185.db2.gz IQEAOPKUJYEBPI-UHFFFAOYSA-N 0 1 396.472 3.274 10 0 GGAEMN O=C(CSc1nc(-c2cccs2)n[nH]1)Nc1ccc2c(c1)OCCCO2 ZINC000009336610 1398856767 /nfs/dbraw/zinc/85/67/67/1398856767.db2.gz BAUBQMIKFLZVIS-UHFFFAOYSA-N 0 1 388.474 3.425 10 0 GGAEMN C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[C@@H]2CCCC[C@@H]2C1 ZINC000009638457 1398861807 /nfs/dbraw/zinc/86/18/07/1398861807.db2.gz UUXMTJVRWVBWBJ-HZSPNIEDSA-N 0 1 375.538 3.175 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2cccc(Cl)c2)c(C)n1C ZINC000009684658 1398863291 /nfs/dbraw/zinc/86/32/91/1398863291.db2.gz NDQUYUSCAYTYHN-UHFFFAOYSA-N 0 1 395.912 3.332 10 0 GGAEMN Cc1c(C(=O)N2CCCCC2)c(S(=O)(=O)Nc2cccc(F)c2)c(C)n1C ZINC000009684986 1398863307 /nfs/dbraw/zinc/86/33/07/1398863307.db2.gz DHWXPBOXBPJQST-UHFFFAOYSA-N 0 1 393.484 3.208 10 0 GGAEMN Cc1c(C(=O)N2CCCCC2)c(S(=O)(=O)Nc2ccc(C)cc2)c(C)n1C ZINC000009685143 1398863389 /nfs/dbraw/zinc/86/33/89/1398863389.db2.gz STVBJXJJXJZWIQ-UHFFFAOYSA-N 0 1 389.521 3.377 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccccc2C)c1C(=O)N1CCCCC1 ZINC000009684465 1398863485 /nfs/dbraw/zinc/86/34/85/1398863485.db2.gz IGLJRGXLILYVBN-UHFFFAOYSA-N 0 1 375.494 3.367 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(C)cc2C)c1C(=O)N1CCCC1 ZINC000009684177 1398863528 /nfs/dbraw/zinc/86/35/28/1398863528.db2.gz PVCLUMVLYAVTJG-UHFFFAOYSA-N 0 1 375.494 3.285 10 0 GGAEMN O=C(c1n[nH]c2c1COc1ccccc1-2)N1CCN(c2ccc(F)cc2)CC1 ZINC000009728717 1398864915 /nfs/dbraw/zinc/86/49/15/1398864915.db2.gz GZHBGUOYMIUUHE-UHFFFAOYSA-N 0 1 378.407 3.071 10 0 GGAEMN COc1cc(/C=C/C(=O)Nc2ccc(N3CCN(C)CC3)c(C)c2)cc(OC)c1 ZINC000012736248 1399056883 /nfs/dbraw/zinc/05/68/83/1399056883.db2.gz UBZZUGYTSVYAJK-VMPITWQZSA-N 0 1 395.503 3.416 10 0 GGAEMN C[C@H](NC(=O)COc1ccc(-c2ncccn2)cc1CN(C)C)c1ccco1 ZINC000015005211 1399130903 /nfs/dbraw/zinc/13/09/03/1399130903.db2.gz CPSBNYHOQSXEID-HNNXBMFYSA-N 0 1 380.448 3.054 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(Br)cc2Cl)c(N)c1 ZINC000020432370 1399346512 /nfs/dbraw/zinc/34/65/12/1399346512.db2.gz PDARVJUMZZQVEL-UHFFFAOYSA-N 0 1 391.674 3.494 10 0 GGAEMN CCCC[N@@H+](C)CCn1c(=O)c2cc(OCC)c(OCC)cc2[n-]c1=S ZINC000020644609 1399351290 /nfs/dbraw/zinc/35/12/90/1399351290.db2.gz ZYMCTKXLHVOIHE-UHFFFAOYSA-N 0 1 379.526 3.215 10 0 GGAEMN CCOc1ccc(OC[C@@H](O)CN2CCN(c3cccc(Cl)c3)CC2)cc1 ZINC000046345946 1404376684 /nfs/dbraw/zinc/37/66/84/1404376684.db2.gz GYMMHFNMVCMMRA-IBGZPJMESA-N 0 1 390.911 3.301 10 0 GGAEMN CCOC(=O)c1cnc2nc(C)ccc2c1N1CCN(Cc2ccccc2)CC1 ZINC000047157726 1404725640 /nfs/dbraw/zinc/72/56/40/1404725640.db2.gz HIGHCVKAHDGXGV-UHFFFAOYSA-N 0 1 390.487 3.437 10 0 GGAEMN COc1ccc([C@@H](CNC(=O)NCc2cccnc2OC)N2CCCCC2)cc1 ZINC000047793519 1404947473 /nfs/dbraw/zinc/94/74/73/1404947473.db2.gz ARJBNSHISGZFDJ-HXUWFJFHSA-N 0 1 398.507 3.125 10 0 GGAEMN CC[C@@H](C)NC(=O)c1cccc(CNCc2ccc(-n3cncn3)c(F)c2)c1 ZINC000047821918 1404963820 /nfs/dbraw/zinc/96/38/20/1404963820.db2.gz BFPPYPLTFWQAJH-OAHLLOKOSA-N 0 1 381.455 3.225 10 0 GGAEMN c1ccc(COc2cccc(CNCc3cnc(N4CCCC4)nc3)c2)nc1 ZINC000048713690 1405265628 /nfs/dbraw/zinc/26/56/28/1405265628.db2.gz DEBMBGHXONXNFQ-UHFFFAOYSA-N 0 1 375.476 3.341 10 0 GGAEMN CN(C)C(=O)COc1cccc(CNCc2csc(Br)c2)c1 ZINC000048745719 1405279512 /nfs/dbraw/zinc/27/95/12/1405279512.db2.gz CZVIAEYSIONVGI-UHFFFAOYSA-N 0 1 383.311 3.267 10 0 GGAEMN CC[C@@H](NCc1ccc(OC)c(OC)c1)c1ccccc1OCC(=O)N(C)C ZINC000048750609 1405280875 /nfs/dbraw/zinc/28/08/75/1405280875.db2.gz BPAAAUIFYMXMND-GOSISDBHSA-N 0 1 386.492 3.412 10 0 GGAEMN CCOc1cc(CNCC(=O)N(C)Cc2ccccc2)cc(Cl)c1OC ZINC000048777115 1405287710 /nfs/dbraw/zinc/28/77/10/1405287710.db2.gz BYJJZLIUQGJUED-UHFFFAOYSA-N 0 1 376.884 3.496 10 0 GGAEMN O=C(Nc1cccc(CNCc2cnc(N3CCCC3)nc2)c1)c1ccccn1 ZINC000048781025 1405291057 /nfs/dbraw/zinc/29/10/57/1405291057.db2.gz GCEZNYILSZWEKB-UHFFFAOYSA-N 0 1 388.475 3.014 10 0 GGAEMN COc1ccccc1C1(CNS(=O)(=O)c2c(F)cccc2F)CCOCC1 ZINC000049411725 1405379473 /nfs/dbraw/zinc/37/94/73/1405379473.db2.gz ZGOYJSLMXOLXKH-UHFFFAOYSA-N 0 1 397.443 3.000 10 0 GGAEMN CCN(C[C@H]1COc2ccccc2O1)C(=O)CCc1nc2cccc(C)c2[nH]1 ZINC000176315379 1428239348 /nfs/dbraw/zinc/23/93/48/1428239348.db2.gz XGMDYVBIIGHTDD-INIZCTEOSA-N 0 1 379.460 3.492 10 0 GGAEMN CCN(C[C@@H]1COc2ccccc2O1)C(=O)CCc1nc2cccc(C)c2[nH]1 ZINC000176315363 1428239618 /nfs/dbraw/zinc/23/96/18/1428239618.db2.gz XGMDYVBIIGHTDD-MRXNPFEDSA-N 0 1 379.460 3.492 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)C1)c1ccsc1 ZINC000056864565 1407459150 /nfs/dbraw/zinc/45/91/50/1407459150.db2.gz AKFYOGUJPVZFMH-HOTGVXAUSA-N 0 1 396.557 3.050 10 0 GGAEMN COc1ccc(CN2CCC(NC(=O)N[C@@H]3COc4ccccc43)CC2)cc1F ZINC000058575427 1407847007 /nfs/dbraw/zinc/84/70/07/1407847007.db2.gz BVWMNSQMUQSJLF-LJQANCHMSA-N 0 1 399.466 3.232 10 0 GGAEMN CCN(CC)[C@@H](CNC(=O)NCCC(=O)OC(C)C)c1ccccc1Cl ZINC000061194116 1408089137 /nfs/dbraw/zinc/08/91/37/1408089137.db2.gz AYNIIAVREXNBKS-KRWDZBQOSA-N 0 1 383.920 3.364 10 0 GGAEMN CC(C)Oc1ccccc1CNCc1cccc(OCCN2CCOCC2)c1 ZINC000065014138 1408635996 /nfs/dbraw/zinc/63/59/96/1408635996.db2.gz AUUWOANXXBQCEA-UHFFFAOYSA-N 0 1 384.520 3.475 10 0 GGAEMN COc1cc(CNCc2cc(Br)c3c(c2)OCCCO3)ccn1 ZINC000065890204 1408748869 /nfs/dbraw/zinc/74/88/69/1408748869.db2.gz ADORQVZGLKDRGU-UHFFFAOYSA-N 0 1 379.254 3.304 10 0 GGAEMN C[C@@H](NC(=O)NCc1cccnc1N1CCN(C)CC1)c1ccc(Cl)cc1 ZINC000066892092 1408943762 /nfs/dbraw/zinc/94/37/62/1408943762.db2.gz CEBQDVSCQOVPBJ-OAHLLOKOSA-N 0 1 387.915 3.047 10 0 GGAEMN CCOc1ccc(CN[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC ZINC000067010784 1408979693 /nfs/dbraw/zinc/97/96/93/1408979693.db2.gz HPERAOSFKIYPAZ-OAHLLOKOSA-N 0 1 392.521 3.195 10 0 GGAEMN Cn1cc(CNCc2cccnc2OCC(F)(F)F)c(-c2cccnc2)n1 ZINC000067187450 1409035652 /nfs/dbraw/zinc/03/56/52/1409035652.db2.gz FUHILHSCVBJFRM-UHFFFAOYSA-N 0 1 377.370 3.108 10 0 GGAEMN Cn1cc(CNCc2ccnc(OCC(F)(F)F)c2)c(-c2ccncc2)n1 ZINC000067188232 1409036055 /nfs/dbraw/zinc/03/60/55/1409036055.db2.gz HIBGFVPAPRUJIS-UHFFFAOYSA-N 0 1 377.370 3.108 10 0 GGAEMN CN(C)C(=O)COc1ccccc1CNCc1ccnc(OC2CCCC2)c1 ZINC000067187818 1409036066 /nfs/dbraw/zinc/03/60/66/1409036066.db2.gz AFVMWFVECADXNJ-UHFFFAOYSA-N 0 1 383.492 3.160 10 0 GGAEMN CN(C)C(=O)COc1ccccc1CNCc1ccc(N2CCCCCC2)nc1 ZINC000067189382 1409036668 /nfs/dbraw/zinc/03/66/68/1409036668.db2.gz APIAIASCLWEINJ-UHFFFAOYSA-N 0 1 396.535 3.219 10 0 GGAEMN O=C(CCn1c(=O)c2ccccc2[nH]c1=S)N[C@H]1C[C@H]1c1cccc(F)c1 ZINC000067333322 1409078164 /nfs/dbraw/zinc/07/81/64/1409078164.db2.gz HQBAYQAUXILLKF-RDJZCZTQSA-N 0 1 383.448 3.261 10 0 GGAEMN O=C(CCn1c(=O)c2ccccc2[nH]c1=S)N[C@@H]1C[C@@H]1c1cccc(F)c1 ZINC000067333317 1409078188 /nfs/dbraw/zinc/07/81/88/1409078188.db2.gz HQBAYQAUXILLKF-NVXWUHKLSA-N 0 1 383.448 3.261 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N(C)[C@H]3CCCN(c4ccccc4)C3=O)[nH]c21 ZINC000176597821 1428375289 /nfs/dbraw/zinc/37/52/89/1428375289.db2.gz BRNYCIPDCJLTOG-IBGZPJMESA-N 0 1 390.487 3.458 10 0 GGAEMN C[C@@H]1CN(c2ccc(CNCc3csc(Br)c3)cn2)CCO1 ZINC000067669213 1409202927 /nfs/dbraw/zinc/20/29/27/1409202927.db2.gz GKGOHGZIRMGQPI-GFCCVEGCSA-N 0 1 382.327 3.421 10 0 GGAEMN O=C(Nc1cccc(CNCc2cnn(-c3ccccc3)c2)c1)[C@@H]1CCCO1 ZINC000067976128 1409267349 /nfs/dbraw/zinc/26/73/49/1409267349.db2.gz AOVHINKCUQWHGS-NRFANRHFSA-N 0 1 376.460 3.280 10 0 GGAEMN O=C(Nc1cccc(CNCc2cnn(-c3ccccc3)c2)c1)[C@H]1CCCO1 ZINC000067976129 1409267725 /nfs/dbraw/zinc/26/77/25/1409267725.db2.gz AOVHINKCUQWHGS-OAQYLSRUSA-N 0 1 376.460 3.280 10 0 GGAEMN CC[C@H](C)NC(=O)[C@@H](C)NCc1cc(Br)c2c(c1)OCCCO2 ZINC000068366636 1409381446 /nfs/dbraw/zinc/38/14/46/1409381446.db2.gz FHVSUQJOVIAHAY-NWDGAFQWSA-N 0 1 385.302 3.003 10 0 GGAEMN CS(=O)(=O)c1ccc(CNCc2c[nH]nc2-c2ccc(Cl)cc2)cc1 ZINC000068411925 1409395152 /nfs/dbraw/zinc/39/51/52/1409395152.db2.gz DHFUTHSUHLOBHP-UHFFFAOYSA-N 0 1 375.881 3.423 10 0 GGAEMN COc1ccc(COC[C@@H](O)CN2CCN(c3cccc(Cl)c3)CC2)cc1 ZINC000068845936 1409507137 /nfs/dbraw/zinc/50/71/37/1409507137.db2.gz DPUMUZGHBIAAAW-FQEVSTJZSA-N 0 1 390.911 3.048 10 0 GGAEMN Cc1nc([C@H](NC(=O)Nc2cc3c(cc2Cl)OCCO3)c2ccccc2)n[nH]1 ZINC000069256637 1409596174 /nfs/dbraw/zinc/59/61/74/1409596174.db2.gz LNTKXOQIOIZRNN-QGZVFWFLSA-N 0 1 399.838 3.449 10 0 GGAEMN CN1CCN(C[C@H](NC(=O)N[C@@H]2CCCc3ccccc32)c2ccccc2)CC1 ZINC000069725723 1409684269 /nfs/dbraw/zinc/68/42/69/1409684269.db2.gz CWEHFBWAXOAYAR-PKTZIBPZSA-N 0 1 392.547 3.352 10 0 GGAEMN CCN(CC)c1ccc(NC(=O)NCC2(N3CCOCC3)CCCCC2)cn1 ZINC000069949180 1409730349 /nfs/dbraw/zinc/73/03/49/1409730349.db2.gz ZLHCBNGWUXZSJX-UHFFFAOYSA-N 0 1 389.544 3.084 10 0 GGAEMN CCOC(=O)c1cnn2ccc(NS(=O)(=O)c3ccc4ccccc4c3)cc12 ZINC000090653900 1410065897 /nfs/dbraw/zinc/06/58/97/1410065897.db2.gz OEJGCYQJTSBDJU-UHFFFAOYSA-N 0 1 395.440 3.465 10 0 GGAEMN O=S(=O)(Nc1ncccc1Br)c1ccc(Br)s1 ZINC000091272330 1410071671 /nfs/dbraw/zinc/07/16/71/1410071671.db2.gz BMFJXUFOBMVLAA-UHFFFAOYSA-N 0 1 398.101 3.469 10 0 GGAEMN CCCOc1c(Cl)cc(CN2CCC[C@@H]2CN2CCOCC2)cc1OC ZINC000092217994 1410121125 /nfs/dbraw/zinc/12/11/25/1410121125.db2.gz HHYKLWPXCSDIFC-QGZVFWFLSA-N 0 1 382.932 3.434 10 0 GGAEMN O=C(NCc1nc2ccc(F)cc2[nH]1)[C@@H]1CCn2c(cnc2-c2ccccc2)C1 ZINC000095993240 1410319604 /nfs/dbraw/zinc/31/96/04/1410319604.db2.gz NWCMWMXFWPLAQH-OAHLLOKOSA-N 0 1 389.434 3.444 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)/C=C\c2cc(OC)cc(OC)c2)CC1 ZINC000097998655 1410393440 /nfs/dbraw/zinc/39/34/40/1410393440.db2.gz RZRKVRAFTJLTEK-KTKRTIGZSA-N 0 1 395.503 3.498 10 0 GGAEMN COc1ccccc1CN(CCO)CCC(=O)Nc1ccc(Cl)cc1F ZINC000103228473 1410838648 /nfs/dbraw/zinc/83/86/48/1410838648.db2.gz DHDWUYNTRMVJNO-UHFFFAOYSA-N 0 1 380.847 3.311 10 0 GGAEMN Cc1nn(C)c(C)c1-c1cc(C(=O)N2CCC(c3ccc(O)cc3)CC2)n[nH]1 ZINC000103547024 1410866600 /nfs/dbraw/zinc/86/66/00/1410866600.db2.gz GNAWEIHCAPVWMR-UHFFFAOYSA-N 0 1 379.464 3.152 10 0 GGAEMN Brc1cc(CNCc2ccc3c(c2)OCCO3)cc2c1OCO2 ZINC000104864417 1410983983 /nfs/dbraw/zinc/98/39/83/1410983983.db2.gz ANGAVIWEDDECGW-UHFFFAOYSA-N 0 1 378.222 3.239 10 0 GGAEMN CCc1oc2ccccc2c1CNCc1cccnc1N1CCC(C(N)=O)CC1 ZINC000105430297 1411066127 /nfs/dbraw/zinc/06/61/27/1411066127.db2.gz ADBNOSRQYMSMAB-UHFFFAOYSA-N 0 1 392.503 3.382 10 0 GGAEMN O[C@@H](CNCc1c(F)cccc1N1CCCC1)COc1ccc(F)c(F)c1 ZINC000105499879 1411073136 /nfs/dbraw/zinc/07/31/36/1411073136.db2.gz GNUIWRRMASAYLA-AWEZNQCLSA-N 0 1 380.410 3.234 10 0 GGAEMN O=S(=O)([N-]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)c(F)cc1F ZINC000105616411 1411091872 /nfs/dbraw/zinc/09/18/72/1411091872.db2.gz SBDQJTIOBJSRIS-UHFFFAOYSA-N 0 1 384.423 3.178 10 0 GGAEMN Cc1ccc(-c2cc(C(=O)N3CCN(Cc4cccc(F)c4)CC3)n[nH]2)cc1 ZINC000105936116 1411130774 /nfs/dbraw/zinc/13/07/74/1411130774.db2.gz GMNQVBLNCDCXJQ-UHFFFAOYSA-N 0 1 378.451 3.482 10 0 GGAEMN COc1ccc2nc(CN3CCN(C(=O)c4ccc(Cl)cc4)CC3)[nH]c2c1 ZINC000106482760 1411223696 /nfs/dbraw/zinc/22/36/96/1411223696.db2.gz VAVRSBKQTMOVHO-UHFFFAOYSA-N 0 1 384.867 3.183 10 0 GGAEMN COc1ccc2nc(CN3CCN(C(=O)c4cccc(Cl)c4)CC3)[nH]c2c1 ZINC000106482899 1411224381 /nfs/dbraw/zinc/22/43/81/1411224381.db2.gz WXXJOHKSKNGJAX-UHFFFAOYSA-N 0 1 384.867 3.183 10 0 GGAEMN Cc1nn(C)c(C)c1-c1cc(C(=O)N(C)Cc2ccc(F)cc2Cl)n[nH]1 ZINC000107263885 1411355819 /nfs/dbraw/zinc/35/58/19/1411355819.db2.gz DDNGMVLPNSCAPT-UHFFFAOYSA-N 0 1 375.835 3.492 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)Nc3ccc(C(F)(F)F)cc3)cn2)CC1 ZINC000109810937 1411811796 /nfs/dbraw/zinc/81/17/96/1411811796.db2.gz ATQXSVVFMMFRDP-UHFFFAOYSA-N 0 1 379.386 3.496 10 0 GGAEMN O=C1[C@@H](NCc2ccc(OC[C@H]3CCCO3)cc2)CCN1c1ccccc1F ZINC000112366739 1412136046 /nfs/dbraw/zinc/13/60/46/1412136046.db2.gz HJMJFTOLGIXIMF-QUCCMNQESA-N 0 1 384.451 3.279 10 0 GGAEMN C[C@@H](N[C@@H](C)C(=O)Nc1ncccn1)c1cccc(NC(=O)c2ccccc2)c1 ZINC000112527332 1412162465 /nfs/dbraw/zinc/16/24/65/1412162465.db2.gz FRHUWFYMFQZZMH-CVEARBPZSA-N 0 1 389.459 3.407 10 0 GGAEMN C[C@@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)C(=O)Nc1ncccn1 ZINC000112527337 1412163049 /nfs/dbraw/zinc/16/30/49/1412163049.db2.gz FRHUWFYMFQZZMH-HZPDHXFCSA-N 0 1 389.459 3.407 10 0 GGAEMN CC(C)[C@H](CO)N(CC(=O)Nc1ccnn1C1CCCC1)Cc1ccccc1 ZINC000112658013 1412187777 /nfs/dbraw/zinc/18/77/77/1412187777.db2.gz HZUFVJSIOKPXSY-FQEVSTJZSA-N 0 1 384.524 3.456 10 0 GGAEMN CCN(C(=O)CS(=O)(=O)c1nc(Cc2ccccc2)c(C)[nH]1)c1ccccc1 ZINC000113636705 1412325435 /nfs/dbraw/zinc/32/54/35/1412325435.db2.gz GMKXGKKYVLVNHR-UHFFFAOYSA-N 0 1 397.500 3.136 10 0 GGAEMN CCN(C(C)=O)c1nc(CNCC(C)(C)c2ccc3c(c2)OCCO3)cs1 ZINC000115614779 1412735790 /nfs/dbraw/zinc/73/57/90/1412735790.db2.gz GUKMCASEENNLMX-UHFFFAOYSA-N 0 1 389.521 3.355 10 0 GGAEMN O=C(/C=C/C1CCCCC1)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 ZINC000117559944 1413052323 /nfs/dbraw/zinc/05/23/23/1413052323.db2.gz IAXVXEZHNNOGQB-KPKJPENVSA-N 0 1 386.477 3.352 10 0 GGAEMN COc1ncccc1CNC(=O)CSc1nc(Cc2ccccc2)c(C)[nH]1 ZINC000119446275 1413449378 /nfs/dbraw/zinc/44/93/78/1413449378.db2.gz GEUFJKUDCNMUCT-UHFFFAOYSA-N 0 1 382.489 3.121 10 0 GGAEMN CC(C)(C)OC(=O)N[C@H]1CCN(C[C@@H](O)c2ccc(Br)cc2)C1 ZINC000120102266 1413688438 /nfs/dbraw/zinc/68/84/38/1413688438.db2.gz GXVURWXRVCMCLW-LSDHHAIUSA-N 0 1 385.302 3.082 10 0 GGAEMN COc1cc2c(c(CNc3cccc(CN4CCC[C@@H]4C(N)=O)c3)c1)O[C@@H](C)C2 ZINC000120124278 1413696900 /nfs/dbraw/zinc/69/69/00/1413696900.db2.gz FRZKRWZONILQHM-YCRPNKLZSA-N 0 1 395.503 3.080 10 0 GGAEMN NC(=O)[C@H]1CCCN1Cc1cccc(NCc2cc3ccccc3[nH]c2=O)c1 ZINC000120136631 1413702617 /nfs/dbraw/zinc/70/26/17/1413702617.db2.gz FLFXEIROOVVFMD-HXUWFJFHSA-N 0 1 376.460 3.002 10 0 GGAEMN NC(=O)[C@@H]1CCCN1Cc1cccc(NCc2ccc(F)c3cccnc23)c1 ZINC000120144786 1413705086 /nfs/dbraw/zinc/70/50/86/1413705086.db2.gz CNJNLFGJYFGRBW-FQEVSTJZSA-N 0 1 378.451 3.436 10 0 GGAEMN COCCOc1ccc([C@@H](C)N[C@@H](C)C(=O)NC2CCCCC2)cc1OC ZINC000120350649 1413799940 /nfs/dbraw/zinc/79/99/40/1413799940.db2.gz HSCZYTJQZBGZDM-CVEARBPZSA-N 0 1 378.513 3.208 10 0 GGAEMN C[C@H](NCC(=O)Nc1sc2c(c1C(N)=O)CCCC2)c1ccc(F)c(F)c1 ZINC000120610372 1413854448 /nfs/dbraw/zinc/85/44/48/1413854448.db2.gz HDIRLAZDNABVLW-JTQLQIEISA-N 0 1 393.459 3.293 10 0 GGAEMN C[C@H](c1ccncc1)N1CCC(NC(=O)Nc2ccc3c(c2)N(C)CCO3)CC1 ZINC000121244088 1414056476 /nfs/dbraw/zinc/05/64/76/1414056476.db2.gz BBIFHYLGIDAFOW-MRXNPFEDSA-N 0 1 395.507 3.257 10 0 GGAEMN C[C@H]1CN(Cc2cccc(CNCc3c(Cl)nc4ccccn43)c2)CCO1 ZINC000121687607 1414223891 /nfs/dbraw/zinc/22/38/91/1414223891.db2.gz GICCPFSAZFVREG-INIZCTEOSA-N 0 1 384.911 3.498 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)NCc1ccc(OCc2ccccn2)cc1 ZINC000121836563 1414274253 /nfs/dbraw/zinc/27/42/53/1414274253.db2.gz AAYMPQMUUAYTOC-UHFFFAOYSA-N 0 1 379.464 3.124 10 0 GGAEMN CCOc1c(CNc2ccc(N3CCN(C)CC3)cn2)c(C)nn1CC(C)C ZINC000123248939 1414678543 /nfs/dbraw/zinc/67/85/43/1414678543.db2.gz CRYUBCYTQUWQAH-UHFFFAOYSA-N 0 1 386.544 3.005 10 0 GGAEMN CC(C)CN1CCN(C(=O)NCc2ccc(OCc3ccccn3)cc2)CC1 ZINC000123465813 1414741795 /nfs/dbraw/zinc/74/17/95/1414741795.db2.gz GSJGFIGAALNURI-UHFFFAOYSA-N 0 1 382.508 3.144 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCN(c2cccc(Cl)c2)CC1 ZINC000177791561 1428859128 /nfs/dbraw/zinc/85/91/28/1428859128.db2.gz BRMGDENZTGZYGN-UHFFFAOYSA-N 0 1 386.955 3.295 10 0 GGAEMN CN1CCN(c2cc(CNCc3csc(-c4ccc(F)cc4)n3)ccn2)CC1 ZINC000126068578 1415349907 /nfs/dbraw/zinc/34/99/07/1415349907.db2.gz HMTFUGLEPPQPSO-UHFFFAOYSA-N 0 1 397.523 3.386 10 0 GGAEMN C[C@H](NCC(=O)N[C@H](c1ccccc1)C1CC1)c1ccc(S(C)(=O)=O)cc1 ZINC000127279857 1415717058 /nfs/dbraw/zinc/71/70/58/1415717058.db2.gz HMWPUQCNGWMAIO-YCRPNKLZSA-N 0 1 386.517 3.008 10 0 GGAEMN COc1cc(CN2CCC(N3CCNC3=O)CC2)ccc1OCc1ccccc1 ZINC000127587360 1415814950 /nfs/dbraw/zinc/81/49/50/1415814950.db2.gz GZLVGWGJQMZHKV-UHFFFAOYSA-N 0 1 395.503 3.264 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N[C@H]3CCN(c4cccc(Cl)c4)C3=O)[nH]c21 ZINC000178207904 1429018689 /nfs/dbraw/zinc/01/86/89/1429018689.db2.gz DWMVEDDWQGXBPH-KRWDZBQOSA-N 0 1 396.878 3.379 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N[C@@H]3CCN(c4cccc(Cl)c4)C3=O)[nH]c21 ZINC000178207892 1429018885 /nfs/dbraw/zinc/01/88/85/1429018885.db2.gz DWMVEDDWQGXBPH-QGZVFWFLSA-N 0 1 396.878 3.379 10 0 GGAEMN O=C(Nc1cccc(CNCc2ccc3c(c2)OCCO3)c1)c1ccncc1 ZINC000129078698 1416139521 /nfs/dbraw/zinc/13/95/21/1416139521.db2.gz FRYOJMGZLGTQRV-UHFFFAOYSA-N 0 1 375.428 3.395 10 0 GGAEMN COc1ccc(CNc2ccc(CCN3CCOCC3)cc2)c(OC)c1OC ZINC000129228040 1416175128 /nfs/dbraw/zinc/17/51/28/1416175128.db2.gz BPGHHQRBKLNZJG-UHFFFAOYSA-N 0 1 386.492 3.199 10 0 GGAEMN O=C([C@H](Sc1ccccc1)c1ccccc1)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000129270134 1416183074 /nfs/dbraw/zinc/18/30/74/1416183074.db2.gz HSJBWTHFFDPAFU-FUHWJXTLSA-N 0 1 379.489 3.439 10 0 GGAEMN Cc1cc2cc(CNC[C@@H](O)CS(=O)(=O)c3cccs3)oc2cc1C ZINC000129337063 1416193546 /nfs/dbraw/zinc/19/35/46/1416193546.db2.gz AWLQTTJUSOKCRX-OAHLLOKOSA-N 0 1 379.503 3.036 10 0 GGAEMN C[C@H]1CCN(CC(=O)Nc2ccc(N3CCCCC3)cc2)C[C@@H]1n1ccnc1 ZINC000129559353 1416228464 /nfs/dbraw/zinc/22/84/64/1416228464.db2.gz HNTKVMPZFJGQKY-RXVVDRJESA-N 0 1 381.524 3.395 10 0 GGAEMN CC(C)OCc1cccc(CNC(=O)CN2CC[C@@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000129753062 1416258088 /nfs/dbraw/zinc/25/80/88/1416258088.db2.gz DMFSSDZEIXCDQJ-NQIIRXRSSA-N 0 1 384.524 3.007 10 0 GGAEMN CC(C)OCc1cccc(CNC(=O)CN2CC[C@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000129753267 1416258607 /nfs/dbraw/zinc/25/86/07/1416258607.db2.gz DMFSSDZEIXCDQJ-RXVVDRJESA-N 0 1 384.524 3.007 10 0 GGAEMN CCOc1ccc(CN[C@@H](CC)CS(=O)(=O)c2ccccc2)cc1OC ZINC000130959909 1416487755 /nfs/dbraw/zinc/48/77/55/1416487755.db2.gz ICOYVYUDMRTARF-KRWDZBQOSA-N 0 1 377.506 3.436 10 0 GGAEMN CCOc1cc(CN[C@H](CC)CS(=O)(=O)c2ccccc2)ccc1OC ZINC000131005850 1416494716 /nfs/dbraw/zinc/49/47/16/1416494716.db2.gz BOQSYOAJTFLBCY-QGZVFWFLSA-N 0 1 377.506 3.436 10 0 GGAEMN CCOc1cc(CN[C@@H](CC)CS(=O)(=O)c2ccccc2)ccc1OC ZINC000131005611 1416494796 /nfs/dbraw/zinc/49/47/96/1416494796.db2.gz BOQSYOAJTFLBCY-KRWDZBQOSA-N 0 1 377.506 3.436 10 0 GGAEMN CC[C@H](CS(=O)(=O)c1ccccc1)NCc1cnn(Cc2ccccc2)c1 ZINC000131045997 1416501011 /nfs/dbraw/zinc/50/10/11/1416501011.db2.gz GOIRVYPETDDOJA-HXUWFJFHSA-N 0 1 383.517 3.274 10 0 GGAEMN Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC[C@@H](CN2CCOCC2)C1 ZINC000131633234 1416587110 /nfs/dbraw/zinc/58/71/10/1416587110.db2.gz DXLSRXSXCNXZEL-HNNXBMFYSA-N 0 1 375.900 3.314 10 0 GGAEMN Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC[C@H](CN2CCOCC2)C1 ZINC000131633040 1416587130 /nfs/dbraw/zinc/58/71/30/1416587130.db2.gz DXLSRXSXCNXZEL-OAHLLOKOSA-N 0 1 375.900 3.314 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCCCC[C@@H]2C[C@@H](O)c2ccccc2)[nH]1 ZINC000131705587 1416600701 /nfs/dbraw/zinc/60/07/01/1416600701.db2.gz DGBFOINVIXOHIK-QZTJIDSGSA-N 0 1 388.537 3.490 10 0 GGAEMN Brc1cnc(-c2noc([C@H]3CCCCN3)n2)c(Br)c1 ZINC000132548645 1416783278 /nfs/dbraw/zinc/78/32/78/1416783278.db2.gz YEBFOHSQSBKRJA-SECBINFHSA-N 0 1 388.063 3.471 10 0 GGAEMN O=C(NC1CC1)c1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1 ZINC000132903690 1416829328 /nfs/dbraw/zinc/82/93/28/1416829328.db2.gz BZLIRLYCDQXYNU-UHFFFAOYSA-N 0 1 386.260 3.081 10 0 GGAEMN COc1cc(OC)cc(N2CC[C@H](NCc3cnc(C(C)C)s3)C2=O)c1 ZINC000133255392 1416871078 /nfs/dbraw/zinc/87/10/78/1416871078.db2.gz HCVDUBSTZBSLAJ-KRWDZBQOSA-N 0 1 375.494 3.179 10 0 GGAEMN CCn1c(=S)n(CN2CCN(Cc3ccccc3)CC2)nc1-c1ccccn1 ZINC000133747705 1416955922 /nfs/dbraw/zinc/95/59/22/1416955922.db2.gz GSZIVGMZIKTJNM-UHFFFAOYSA-N 0 1 394.548 3.271 10 0 GGAEMN Fc1ccc(CNCc2cccc(OCCN3CCOCC3)c2)c(Cl)c1 ZINC000135965047 1417282321 /nfs/dbraw/zinc/28/23/21/1417282321.db2.gz HBEGUDCDQSVXLB-UHFFFAOYSA-N 0 1 378.875 3.480 10 0 GGAEMN CCN(Cc1ccc(OC)c(OC)c1)C(=O)CN(C)C1Cc2ccccc2C1 ZINC000138432796 1417414628 /nfs/dbraw/zinc/41/46/28/1417414628.db2.gz BOTUGFDOALUVRN-UHFFFAOYSA-N 0 1 382.504 3.152 10 0 GGAEMN CN1C(=O)Cc2cc(S(=O)(=O)Nc3ccc(F)cc3C(F)(F)F)ccc21 ZINC000150829662 1417815396 /nfs/dbraw/zinc/81/53/96/1417815396.db2.gz SZUFXXGUOGOPPA-UHFFFAOYSA-N 0 1 388.342 3.164 10 0 GGAEMN Fc1ccc(CNCc2ccccc2OCCN2CCOCC2)c2ncccc12 ZINC000151471633 1417988810 /nfs/dbraw/zinc/98/88/10/1417988810.db2.gz ATIXMVYFDCNWLH-UHFFFAOYSA-N 0 1 395.478 3.375 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2ccc(OC(F)F)c(OC)c2)C1=O ZINC000151511120 1418009421 /nfs/dbraw/zinc/00/94/21/1418009421.db2.gz HZGCYLTYYUHYKT-AWEZNQCLSA-N 0 1 392.402 3.200 10 0 GGAEMN CCOCc1cc(CN2CCCN(Cc3cscn3)CC2)ccc1OC ZINC000179413862 1429364907 /nfs/dbraw/zinc/36/49/07/1429364907.db2.gz BGRCNUAHHVGPGS-UHFFFAOYSA-N 0 1 375.538 3.396 10 0 GGAEMN CCc1nc(NC(=O)CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)sc1C ZINC000179752497 1429539139 /nfs/dbraw/zinc/53/91/39/1429539139.db2.gz BEFGKNHMZXHZSV-LJQANCHMSA-N 0 1 387.505 3.465 10 0 GGAEMN COc1ccc(CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)c(OC)c1OC ZINC000153996418 1422822998 /nfs/dbraw/zinc/82/29/98/1422822998.db2.gz ICFUDRUZFAUVHR-IBGZPJMESA-N 0 1 398.503 3.036 10 0 GGAEMN CNC(=O)c1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1Cl ZINC000154356091 1422877546 /nfs/dbraw/zinc/87/75/46/1422877546.db2.gz ABUOOXLAWSVVPO-UHFFFAOYSA-N 0 1 394.667 3.202 10 0 GGAEMN COCCOc1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1F ZINC000154367876 1422879336 /nfs/dbraw/zinc/87/93/36/1422879336.db2.gz CTDPMNCEQOLFAC-UHFFFAOYSA-N 0 1 395.239 3.354 10 0 GGAEMN COc1cccc(-c2nc(C)c(C(=O)Nc3ccc4c(c3)N(C)CCO4)[nH]2)c1 ZINC000154721532 1423011663 /nfs/dbraw/zinc/01/16/63/1423011663.db2.gz GSMJTZHQCFVENC-UHFFFAOYSA-N 0 1 378.432 3.475 10 0 GGAEMN COc1ccc(CN(C)C(=O)CN2CCC[C@@H](Nc3ccccc3)C2)cc1OC ZINC000154931068 1423083969 /nfs/dbraw/zinc/08/39/69/1423083969.db2.gz GVWOVUYEDMUMIH-HXUWFJFHSA-N 0 1 397.519 3.239 10 0 GGAEMN CN1CCC[C@@H]1C(=O)NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000154957892 1423091478 /nfs/dbraw/zinc/09/14/78/1423091478.db2.gz AZEOXGKZACTUES-JOCHJYFZSA-N 0 1 394.515 3.482 10 0 GGAEMN CC(C)(C)OC(=O)N1CCc2cccc(CN3CCC(NC(=O)C4CC4)CC3)c21 ZINC000179913215 1429637764 /nfs/dbraw/zinc/63/77/64/1429637764.db2.gz VQIPETBRICWPLK-UHFFFAOYSA-N 0 1 399.535 3.475 10 0 GGAEMN c1oc(-c2ccccc2)nc1CN[C@H](Cc1ccccc1)CN1CCOCC1 ZINC000156068946 1423659337 /nfs/dbraw/zinc/65/93/37/1423659337.db2.gz ARPJKQZTUDKSOY-OAQYLSRUSA-N 0 1 377.488 3.375 10 0 GGAEMN COc1cc(Cl)c(CNCc2cccnc2N2CCN(C)CC2)cc1Cl ZINC000156975095 1423895740 /nfs/dbraw/zinc/89/57/40/1423895740.db2.gz CKVHINPWYDKWJT-UHFFFAOYSA-N 0 1 395.334 3.439 10 0 GGAEMN C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1Br)c1nnn[n-]1 ZINC000044925889 1423903297 /nfs/dbraw/zinc/90/32/97/1423903297.db2.gz NTXNFWYACVKYJC-NKWVEPMBSA-N 0 1 375.068 3.137 10 0 GGAEMN COc1ccc(CN[C@@H]2CCCN(CC(F)(F)F)C2=O)cc1Br ZINC000158333733 1424229111 /nfs/dbraw/zinc/22/91/11/1424229111.db2.gz BNNUESKFQDYPAW-GFCCVEGCSA-N 0 1 395.219 3.101 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C)c1cccs1 ZINC000158635735 1424306775 /nfs/dbraw/zinc/30/67/75/1424306775.db2.gz BCQIWIXGZBJPAD-ZNMIVQPWSA-N 0 1 381.542 3.160 10 0 GGAEMN C[C@@H]1CCN(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)C[C@@H]1n1ccnc1 ZINC000159018592 1424397088 /nfs/dbraw/zinc/39/70/88/1424397088.db2.gz GDDIUKQFKOCAKR-QAPCUYQASA-N 0 1 392.450 3.026 10 0 GGAEMN O=C([C@@H](Cc1ccccc1)NCc1cnn(Cc2ccccc2)c1)N1CCCC1 ZINC000159928736 1424553789 /nfs/dbraw/zinc/55/37/89/1424553789.db2.gz FLAIRIQGHXNICE-HSZRJFAPSA-N 0 1 388.515 3.255 10 0 GGAEMN CC(C)(C)OC(=O)N[C@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000160323519 1424595280 /nfs/dbraw/zinc/59/52/80/1424595280.db2.gz KONOZPCWIWMGBV-LBPRGKRZSA-N 0 1 395.301 3.424 10 0 GGAEMN O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)N1CCN2CCCC[C@H]2C1 ZINC000160669058 1424624108 /nfs/dbraw/zinc/62/41/08/1424624108.db2.gz UBOIZTWRSWUILI-HNNXBMFYSA-N 0 1 391.878 3.426 10 0 GGAEMN CC(=O)NCCCN1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000164626815 1425130587 /nfs/dbraw/zinc/13/05/87/1425130587.db2.gz GQCINCPLVOMGIP-UHFFFAOYSA-N 0 1 375.513 3.198 10 0 GGAEMN O=C1[C@H]2CN(Cc3ccc(Cl)c(F)c3)C[C@H]2C(=O)N1CCc1ccccc1 ZINC000169756899 1425247494 /nfs/dbraw/zinc/24/74/94/1425247494.db2.gz OFEROKYFDRGYOI-CALCHBBNSA-N 0 1 386.854 3.139 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC(OCCOCc2ccccc2)CC1 ZINC000169771958 1425252970 /nfs/dbraw/zinc/25/29/70/1425252970.db2.gz XWBHDTOCDKZEQK-UHFFFAOYSA-N 0 1 379.460 3.401 10 0 GGAEMN COC[C@H]1CN(C(C)=O)CC12CCN(Cc1cccc(Br)c1)CC2 ZINC000169782736 1425255813 /nfs/dbraw/zinc/25/58/13/1425255813.db2.gz FDFYUBBVASSFMJ-QGZVFWFLSA-N 0 1 395.341 3.156 10 0 GGAEMN O=C(NCc1ccc(F)cc1)N1CC(c2noc([C@H]3CCCN3CC3CC3)n2)C1 ZINC000169782970 1425256071 /nfs/dbraw/zinc/25/60/71/1425256071.db2.gz AAAVPVNYMJAZGE-GOSISDBHSA-N 0 1 399.470 3.065 10 0 GGAEMN O=C(c1ccccc1)N1CCC(OC2CCN(Cc3cccnc3)CC2)CC1 ZINC000169792125 1425258749 /nfs/dbraw/zinc/25/87/49/1425258749.db2.gz ZBLFZPNJXPQLOK-UHFFFAOYSA-N 0 1 379.504 3.367 10 0 GGAEMN CC(=O)Nc1ccc(NS(=O)(=O)CCC(F)(F)F)c(C(F)(F)F)c1 ZINC000171332298 1425622617 /nfs/dbraw/zinc/62/26/17/1425622617.db2.gz VOHALMALMDMWSK-UHFFFAOYSA-N 0 1 378.294 3.358 10 0 GGAEMN CCN(C)[C@H](C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000171622165 1425761419 /nfs/dbraw/zinc/76/14/19/1425761419.db2.gz CJQPAWGPOHRIOG-MJGOQNOKSA-N 0 1 389.540 3.443 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCN([C@@H](C)c3ccc(Cl)cc3)CC2)[nH]1 ZINC000173340682 1426519717 /nfs/dbraw/zinc/51/97/17/1426519717.db2.gz FOQBIEYGSFDRSW-ZDUSSCGKSA-N 0 1 393.944 3.154 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccccc2NC(=O)c2ccccc2)[nH]1 ZINC000173921504 1426892680 /nfs/dbraw/zinc/89/26/80/1426892680.db2.gz CJLCHKLTEXLNHH-UHFFFAOYSA-N 0 1 381.461 3.486 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(-c3ncc4n3CCCC4)cc2)[nH]1 ZINC000173974892 1426920228 /nfs/dbraw/zinc/92/02/28/1426920228.db2.gz HUQQSYDRSIXQJJ-UHFFFAOYSA-N 0 1 382.493 3.434 10 0 GGAEMN COc1ccc(CN2CCC(NC(=O)c3cc4ccccn4c3)CC2)cc1F ZINC000174078526 1426990725 /nfs/dbraw/zinc/99/07/25/1426990725.db2.gz UFMMHELKZUCKJS-UHFFFAOYSA-N 0 1 381.451 3.481 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)Cc2c(C)nn(-c3ccccc3C)c2C)[nH]1 ZINC000174239645 1427065138 /nfs/dbraw/zinc/06/51/38/1427065138.db2.gz CFWDTMPUHJMDIM-UHFFFAOYSA-N 0 1 398.536 3.365 10 0 GGAEMN Cc1nnc(SCCC(=O)N(CCc2ccccn2)Cc2ccc(F)cc2)[nH]1 ZINC000174510342 1427192449 /nfs/dbraw/zinc/19/24/49/1427192449.db2.gz FLKFJOAYCZUJBA-UHFFFAOYSA-N 0 1 399.495 3.401 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2ccc(-n3cnc4ccccc43)cc2)[nH]1 ZINC000174834714 1427394789 /nfs/dbraw/zinc/39/47/89/1427394789.db2.gz HCQLJFPRLQHIDU-UHFFFAOYSA-N 0 1 392.488 3.251 10 0 GGAEMN CC(=O)N1CC[C@H](C(=O)Nc2ccc3nc(Cc4ccccc4F)[nH]c3c2)C1 ZINC000176179533 1428143802 /nfs/dbraw/zinc/14/38/02/1428143802.db2.gz HVCCNMAPHWBDHA-HNNXBMFYSA-N 0 1 380.423 3.100 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)[C@@H]3CCCCN3S(=O)(=O)c3ccccc3)ccc12 ZINC000180319333 1429835466 /nfs/dbraw/zinc/83/54/66/1429835466.db2.gz KYKPCHFJOPLYQH-IBGZPJMESA-N 0 1 398.488 3.053 10 0 GGAEMN COc1cccc(S(=O)(=O)CCN[C@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000180826398 1430059774 /nfs/dbraw/zinc/05/97/74/1430059774.db2.gz CVPUTIRSBXFILK-MRXNPFEDSA-N 0 1 385.489 3.005 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)[nH]1 ZINC000180903550 1430099240 /nfs/dbraw/zinc/09/92/40/1430099240.db2.gz DVTCFHHQZUJAKM-UHFFFAOYSA-N 0 1 396.398 3.439 10 0 GGAEMN COc1ccc2c(c1)[nH]cc(C(=O)N1CCO[C@H](Cc3ccccc3)C1)c2=O ZINC000181191082 1430243363 /nfs/dbraw/zinc/24/33/63/1430243363.db2.gz LCKLEAQULKQTHA-QGZVFWFLSA-N 0 1 378.428 3.033 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccc(F)c(F)c1 ZINC000181640168 1430333127 /nfs/dbraw/zinc/33/31/27/1430333127.db2.gz CNDOUSZCSWAZRM-ORAYPTAESA-N 0 1 378.394 3.355 10 0 GGAEMN O=C(NCc1cccc(CO)c1)N1CCC[C@@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000181715327 1430345844 /nfs/dbraw/zinc/34/58/44/1430345844.db2.gz UCPOVFUNPZKIDN-LJQANCHMSA-N 0 1 391.475 3.053 10 0 GGAEMN CCOC(=O)c1cnc(=NNC(=O)[C@H]2C[C@H]2c2cccc3ccccc32)[nH]c1C ZINC000182717602 1430525660 /nfs/dbraw/zinc/52/56/60/1430525660.db2.gz DUMFQURABXTVTQ-ROUUACIJSA-N 0 1 390.443 3.362 10 0 GGAEMN C[C@@H](CCc1cccc(F)c1)N1CCN(CC(=O)N2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000182998891 1430588898 /nfs/dbraw/zinc/58/88/98/1430588898.db2.gz AFSBXCNDHVIQOY-AQNXPRMDSA-N 0 1 389.559 3.269 10 0 GGAEMN CCO[C@H](C)c1noc(CN2CCN([C@H](C)CCc3cccc(F)c3)CC2)n1 ZINC000183365181 1430691043 /nfs/dbraw/zinc/69/10/43/1430691043.db2.gz FJPHAHGNGDSWKO-IAGOWNOFSA-N 0 1 390.503 3.445 10 0 GGAEMN CN(C)c1ccncc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 ZINC000183772095 1430790356 /nfs/dbraw/zinc/79/03/56/1430790356.db2.gz PTFUMPXDBIFCAK-QGZVFWFLSA-N 0 1 384.480 3.143 10 0 GGAEMN COc1cc(N[C@@H]2CCCN(Cc3cc(-c4cnn(C)c4)no3)C2)cc(OC)c1 ZINC000185039041 1431047256 /nfs/dbraw/zinc/04/72/56/1431047256.db2.gz FAGBGKKHTYRAHV-MRXNPFEDSA-N 0 1 397.479 3.169 10 0 GGAEMN Cc1ccc(OC(F)F)c(CNCc2cccc(N3CCCS3(=O)=O)c2)c1 ZINC000185095195 1431059597 /nfs/dbraw/zinc/05/95/97/1431059597.db2.gz CCFLSLZNBKWVFQ-UHFFFAOYSA-N 0 1 396.459 3.426 10 0 GGAEMN COC(=O)c1cc(F)ccc1CN1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000186026356 1431313685 /nfs/dbraw/zinc/31/36/85/1431313685.db2.gz AQXIMSMUKALYNC-WBAXXEDZSA-N 0 1 392.471 3.347 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC(Cn2cncn2)CC1 ZINC000186224155 1431356626 /nfs/dbraw/zinc/35/66/26/1431356626.db2.gz ACIKDXALSNOFMO-ZWKOTPCHSA-N 0 1 391.519 3.409 10 0 GGAEMN C[C@@H](NC(=O)[C@@H](C)N1CCC(Cn2cncn2)CC1)c1cccc2ccccc21 ZINC000186224175 1431356894 /nfs/dbraw/zinc/35/68/94/1431356894.db2.gz ACIKDXALSNOFMO-QZTJIDSGSA-N 0 1 391.519 3.409 10 0 GGAEMN COc1ccc(-c2ccncc2)cc1CN[C@@H]1CC(=O)N(CC(F)(F)F)C1 ZINC000187255413 1431668118 /nfs/dbraw/zinc/66/81/18/1431668118.db2.gz TWWDQKQQSQLQNM-MRXNPFEDSA-N 0 1 379.382 3.010 10 0 GGAEMN CN(C)[C@H](CNC(=O)N(C)CC1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000187473220 1431741974 /nfs/dbraw/zinc/74/19/74/1431741974.db2.gz HHPZNIHVMJCVKG-QGZVFWFLSA-N 0 1 387.446 3.376 10 0 GGAEMN CN(CCc1cccs1)C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2 ZINC000188202813 1431860053 /nfs/dbraw/zinc/86/00/53/1431860053.db2.gz SZKRIHDVIIUGLL-UHFFFAOYSA-N 0 1 390.509 3.079 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)c3n[nH]c4c3CN(C(=O)OC(C)(C)C)CC4)ccc12 ZINC000188686185 1431933358 /nfs/dbraw/zinc/93/33/58/1431933358.db2.gz TVDXVBWKWKTDFH-UHFFFAOYSA-N 0 1 396.451 3.140 10 0 GGAEMN CN(CC1CCCCC1)C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2 ZINC000189773472 1432231615 /nfs/dbraw/zinc/23/16/15/1432231615.db2.gz HCCATTNLGCZMAE-UHFFFAOYSA-N 0 1 376.501 3.355 10 0 GGAEMN CC(C)(C)OC(=O)c1ccc(C(=O)NCCc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000189784111 1432234487 /nfs/dbraw/zinc/23/44/87/1432234487.db2.gz WYVOMKJAJAFSQT-UHFFFAOYSA-N 0 1 392.459 3.400 10 0 GGAEMN C[C@H](NC(=O)[C@H](C)N1CCN(CC(C)(C)O)[C@H](C)C1)c1cccc2ccccc21 ZINC000189879459 1432260687 /nfs/dbraw/zinc/26/06/87/1432260687.db2.gz HOYKAFANLVXRFT-QYZOEREBSA-N 0 1 397.563 3.183 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N(C)[C@H]3CCN(Cc4ccccc4)C3=O)[nH]c21 ZINC000191833604 1432735665 /nfs/dbraw/zinc/73/56/65/1432735665.db2.gz SDLATZDNXGBZKZ-IBGZPJMESA-N 0 1 390.487 3.063 10 0 GGAEMN CN(C)c1noc(C2CCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)n1 ZINC000191907863 1432753066 /nfs/dbraw/zinc/75/30/66/1432753066.db2.gz BGKJRIOYYPVYSD-LJQANCHMSA-N 0 1 386.496 3.073 10 0 GGAEMN CCOC(=O)c1cc(C)sc1NC(=O)CN[C@@H]1CCO[C@H]1c1ccccc1 ZINC000191942724 1432761807 /nfs/dbraw/zinc/76/18/07/1432761807.db2.gz HTHDNKPVGNPAGR-AEFFLSMTSA-N 0 1 388.489 3.292 10 0 GGAEMN CCCCNC(=O)C1CCN([C@@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)CC1 ZINC000192869279 1432901225 /nfs/dbraw/zinc/90/12/25/1432901225.db2.gz CWGJAYSSEBIKIW-ROUUACIJSA-N 0 1 385.552 3.371 10 0 GGAEMN O=C(Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1)[C@@H]1CCCCC(=O)N1 ZINC000194384290 1433170021 /nfs/dbraw/zinc/17/00/21/1433170021.db2.gz DATAABZNOXWUPX-KRWDZBQOSA-N 0 1 375.432 3.136 10 0 GGAEMN O=C(Nc1ccc(-c2nc(-c3ccccc3)n[nH]2)cc1)[C@@H]1CCCCC(=O)N1 ZINC000194384290 1433170025 /nfs/dbraw/zinc/17/00/25/1433170025.db2.gz DATAABZNOXWUPX-KRWDZBQOSA-N 0 1 375.432 3.136 10 0 GGAEMN CN1CCN(c2ccc(NCc3cccc(OCc4ccccn4)c3)nc2)CC1 ZINC000237113726 1433389538 /nfs/dbraw/zinc/38/95/38/1433389538.db2.gz AGKZPIDIPCXIQQ-UHFFFAOYSA-N 0 1 389.503 3.420 10 0 GGAEMN COc1cc(OC)cc(N2CC[C@@H](NCc3ccc(OC(C)C)cc3)C2=O)c1 ZINC000237350211 1433398512 /nfs/dbraw/zinc/39/85/12/1433398512.db2.gz FANRQZQYEVLBHK-OAQYLSRUSA-N 0 1 384.476 3.386 10 0 GGAEMN COc1cc(OC)cc(N2CC[C@H](NCc3ccc(OC(C)C)cc3)C2=O)c1 ZINC000237354185 1433398753 /nfs/dbraw/zinc/39/87/53/1433398753.db2.gz FANRQZQYEVLBHK-NRFANRHFSA-N 0 1 384.476 3.386 10 0 GGAEMN CS(=O)(=O)c1ccc(CNCc2cccc(OCc3ccccn3)c2)cc1 ZINC000237453471 1433403867 /nfs/dbraw/zinc/40/38/67/1433403867.db2.gz AECPYNNAVXFYSL-UHFFFAOYSA-N 0 1 382.485 3.354 10 0 GGAEMN COc1ccc2cc(CNCc3c(C)nn(C)c3N3CCOCC3)ccc2c1 ZINC000237467787 1433404555 /nfs/dbraw/zinc/40/45/55/1433404555.db2.gz HXCOSYKMVVPOJK-UHFFFAOYSA-N 0 1 380.492 3.017 10 0 GGAEMN Cc1nn(Cc2ccccc2)c(C)c1CNCc1cnc(N2CCOCC2)s1 ZINC000237641325 1433414432 /nfs/dbraw/zinc/41/44/32/1433414432.db2.gz CEWTWAAJPWDIBV-UHFFFAOYSA-N 0 1 397.548 3.131 10 0 GGAEMN O=C(CNCc1cccc(OC(F)(F)F)c1)N1CCN(c2ccccc2)CC1 ZINC000237744444 1433420752 /nfs/dbraw/zinc/42/07/52/1433420752.db2.gz ASAARIPBCILSQI-UHFFFAOYSA-N 0 1 393.409 3.024 10 0 GGAEMN O=C(Nc1cccc(CNCc2cnc(N3CCOCC3)s2)c1)c1ccco1 ZINC000238142538 1433444349 /nfs/dbraw/zinc/44/43/49/1433444349.db2.gz DQARYJNTAVXWPI-UHFFFAOYSA-N 0 1 398.488 3.115 10 0 GGAEMN Cc1ccc(S(=O)(=O)N2CCC(N3CCc4sccc4C3)CC2)cc1 ZINC000238863088 1433445532 /nfs/dbraw/zinc/44/55/32/1433445532.db2.gz LDDPHOFFPUHVNK-UHFFFAOYSA-N 0 1 376.547 3.268 10 0 GGAEMN COc1ccc(NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)c(OC)c1 ZINC000244415250 1433452750 /nfs/dbraw/zinc/45/27/50/1433452750.db2.gz YQIPVFHTQDOVAE-UHFFFAOYSA-N 0 1 386.521 3.265 10 0 GGAEMN c1nc(CN2CCCN(Cc3ccc(OC[C@H]4CCCO4)cc3)CC2)cs1 ZINC000245536413 1433482326 /nfs/dbraw/zinc/48/23/26/1433482326.db2.gz HXWQQSMOPZTPKD-OAQYLSRUSA-N 0 1 387.549 3.409 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245808888 1433520592 /nfs/dbraw/zinc/52/05/92/1433520592.db2.gz BXASEDOWLBMWTF-OTWHNJEPSA-N 0 1 380.536 3.431 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@@H](CC)c2ccc(F)cc2F)C1 ZINC000245835917 1433524030 /nfs/dbraw/zinc/52/40/30/1433524030.db2.gz BEEKTGKILLAGTJ-LBTNJELSSA-N 0 1 382.451 3.196 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H](CC)c2ccc(F)cc2F)C1 ZINC000245835922 1433524165 /nfs/dbraw/zinc/52/41/65/1433524165.db2.gz BEEKTGKILLAGTJ-PMUMKWKESA-N 0 1 382.451 3.196 10 0 GGAEMN CN(C(=O)CN1CC[C@@H](CNc2ccccn2)C1)[C@@H]1CCCc2ccccc21 ZINC000246126486 1433572006 /nfs/dbraw/zinc/57/20/06/1433572006.db2.gz LVLBREYSOIIBJK-GHTZIAJQSA-N 0 1 378.520 3.351 10 0 GGAEMN C[C@@H]1CCN([C@H]2CC(=O)N(c3cccc4ccccc43)C2=O)C[C@H]1n1ccnc1 ZINC000246409166 1433608855 /nfs/dbraw/zinc/60/88/55/1433608855.db2.gz BYCSFFDNQWZEDF-TYCQWZJGSA-N 0 1 388.471 3.251 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@H](C)[C@H](n3ccnc3)C2)C(C)C)cc1 ZINC000246924239 1433687799 /nfs/dbraw/zinc/68/77/99/1433687799.db2.gz BSDURJYCWWXUGE-UCNVEGJOSA-N 0 1 384.524 3.288 10 0 GGAEMN COC(=O)c1cc(F)ccc1CN1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC000248553810 1433808067 /nfs/dbraw/zinc/80/80/67/1433808067.db2.gz AQXIMSMUKALYNC-QGTPRVQTSA-N 0 1 392.471 3.347 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(Cc3cc(F)cc4c3OCOC4)C[C@H]21 ZINC000248634359 1433812742 /nfs/dbraw/zinc/81/27/42/1433812742.db2.gz XIUCCFXQUGJIDR-MORSLUCNSA-N 0 1 392.471 3.427 10 0 GGAEMN C[C@H]1C[N@@H+](Cc2cc(Br)cc(Br)c2[O-])CC[C@H]1O ZINC000249528152 1433846399 /nfs/dbraw/zinc/84/63/99/1433846399.db2.gz AFBOSVYGJYLEJA-QPUJVOFHSA-N 0 1 379.092 3.120 10 0 GGAEMN CC(C)c1ccc(C[N@@H+]2CCc3nc(-c4cnccn4)[n-]c(=O)c3CC2)cc1 ZINC000257174089 1433893194 /nfs/dbraw/zinc/89/31/94/1433893194.db2.gz CFBWMEAHFMLEKU-UHFFFAOYSA-N 0 1 375.476 3.363 10 0 GGAEMN CC(C)c1ccc(C[N@H+]2CCc3nc(-c4cnccn4)[n-]c(=O)c3CC2)cc1 ZINC000257174089 1433893196 /nfs/dbraw/zinc/89/31/96/1433893196.db2.gz CFBWMEAHFMLEKU-UHFFFAOYSA-N 0 1 375.476 3.363 10 0 GGAEMN COc1ccc(CN2CCCCCNC(=O)[C@@H]3CCC[C@@H]32)cc1Cn1ccnc1 ZINC000257175503 1433893375 /nfs/dbraw/zinc/89/33/75/1433893375.db2.gz AZQPANJRGOWKLI-RTWAWAEBSA-N 0 1 396.535 3.211 10 0 GGAEMN CC(C)S(=O)(=O)N1CCC(N2C[C@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257175364 1433893432 /nfs/dbraw/zinc/89/34/32/1433893432.db2.gz AUKAXYQZQGECMU-IBGZPJMESA-N 0 1 384.586 3.003 10 0 GGAEMN COc1ccc(S(=O)(=O)N2CCC[C@@H](n3c(C)cnc3C)C2)cc1Cl ZINC000257177309 1433893539 /nfs/dbraw/zinc/89/35/39/1433893539.db2.gz WKIMJRHLZAFHQE-CQSZACIVSA-N 0 1 383.901 3.188 10 0 GGAEMN O=C(c1ccn[nH]1)N1CCC(N2C(=O)C3(CCCC3)[C@H]2c2ccccc2)CC1 ZINC000257180478 1433893780 /nfs/dbraw/zinc/89/37/80/1433893780.db2.gz DOTLLZQWDBOZIV-LJQANCHMSA-N 0 1 378.476 3.158 10 0 GGAEMN O=C(c1cccs1)N1CCC(N2C[C@H](OCC3CC3)C23CCOCC3)CC1 ZINC000257179302 1433893804 /nfs/dbraw/zinc/89/38/04/1433893804.db2.gz IJIJLHPPUQDHNR-IBGZPJMESA-N 0 1 390.549 3.013 10 0 GGAEMN O=C1[C@H](OCC2CC2)C2(CCCCC2)N1C1CCN(Cc2cccnc2)CC1 ZINC000257188074 1433894338 /nfs/dbraw/zinc/89/43/38/1433894338.db2.gz DIRBKWSETKZEIK-NRFANRHFSA-N 0 1 383.536 3.386 10 0 GGAEMN Cn1cccc1CN1CCC(N2C(=O)[C@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257190371 1433894484 /nfs/dbraw/zinc/89/44/84/1433894484.db2.gz MGOZPRGMJTWNBQ-NRFANRHFSA-N 0 1 385.552 3.330 10 0 GGAEMN CN(Cc1cc(C(F)(F)F)ccc1Cl)[C@@H]1CCc2nn(C)c(=O)n2CC1 ZINC000257190973 1433894572 /nfs/dbraw/zinc/89/45/72/1433894572.db2.gz OMIPJDKIRDOONT-CYBMUJFWSA-N 0 1 388.821 3.091 10 0 GGAEMN COc1ccc(NC(=O)CCSc2nnc(C)[nH]2)cc1OCc1ccncc1 ZINC000266686329 1434363850 /nfs/dbraw/zinc/36/38/50/1434363850.db2.gz APDDNNCAXFLRGG-UHFFFAOYSA-N 0 1 399.476 3.217 10 0 GGAEMN COc1ccc(CNC(=O)CCSc2nnc(C)[nH]2)cc1OC1CCCC1 ZINC000266723954 1434367993 /nfs/dbraw/zinc/36/79/93/1434367993.db2.gz GAQZFLWLDUYOSR-UHFFFAOYSA-N 0 1 390.509 3.242 10 0 GGAEMN O=C(Nc1ccc2c(c1)OC1(CCCC1)O2)N1CCN(C2CCOCC2)CC1 ZINC000267005297 1434397981 /nfs/dbraw/zinc/39/79/81/1434397981.db2.gz FNZZDDIKDSHWTJ-UHFFFAOYSA-N 0 1 387.480 3.057 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N1CCC[C@@H](c2nc(C)n[nH]2)C1 ZINC000268433446 1434522274 /nfs/dbraw/zinc/52/22/74/1434522274.db2.gz FSMORDYXTDQGLJ-IUODEOHRSA-N 0 1 395.463 3.269 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N1CCC[C@@H](c2nnc(C)[nH]2)C1 ZINC000268433446 1434522275 /nfs/dbraw/zinc/52/22/75/1434522275.db2.gz FSMORDYXTDQGLJ-IUODEOHRSA-N 0 1 395.463 3.269 10 0 GGAEMN CCCCCC(=O)NC1CCN(C(=O)c2cc(-c3cccc(OC)c3)[nH]n2)CC1 ZINC000268787763 1434557368 /nfs/dbraw/zinc/55/73/68/1434557368.db2.gz DJJCPJJYJHEQRJ-UHFFFAOYSA-N 0 1 398.507 3.386 10 0 GGAEMN CC(=O)Nc1ccc(O)c(C(=O)Nc2ccc3nc([C@@H]4CCCO4)[nH]c3c2)c1 ZINC000270034503 1434695374 /nfs/dbraw/zinc/69/53/74/1434695374.db2.gz IEQRPRBOYLWWJM-SFHVURJKSA-N 0 1 380.404 3.331 10 0 GGAEMN CC(=O)Nc1ccc([O-])c(-c2nc(-c3cccc(OCC[NH+](C)C)c3)no2)c1 ZINC000273763511 1435012031 /nfs/dbraw/zinc/01/20/31/1435012031.db2.gz DBCCRKKCCXELFA-UHFFFAOYSA-N 0 1 382.420 3.008 10 0 GGAEMN O=C1[C@@H]2CC[C@@H](c3ccccc3)N2C(=O)N1C1CCN(Cc2ccncc2)CC1 ZINC000280914172 1435741123 /nfs/dbraw/zinc/74/11/23/1435741123.db2.gz CWBKTNYCJVXKCW-SFTDATJTSA-N 0 1 390.487 3.214 10 0 GGAEMN COc1cccc(-c2nc(CN[C@@H]3CCC(=O)NC34CCC4)cs2)c1OC ZINC000282725263 1435857901 /nfs/dbraw/zinc/85/79/01/1435857901.db2.gz HYGBYZWAHJLHIC-MRXNPFEDSA-N 0 1 387.505 3.118 10 0 GGAEMN CC(C)Oc1ccc(CNC(=O)[C@H]2CCc3[nH]nnc3C2)c(C(F)(F)F)c1 ZINC000283230962 1435880393 /nfs/dbraw/zinc/88/03/93/1435880393.db2.gz YWPDYMXXTUFJHC-NSHDSACASA-N 0 1 382.386 3.032 10 0 GGAEMN CC(C)Oc1ccc(CNC(=O)[C@H]2CCc3nn[nH]c3C2)c(C(F)(F)F)c1 ZINC000283230962 1435880394 /nfs/dbraw/zinc/88/03/94/1435880394.db2.gz YWPDYMXXTUFJHC-NSHDSACASA-N 0 1 382.386 3.032 10 0 GGAEMN O=C(C=Cc1ccc(Cl)c(C(F)(F)F)c1)N1CCOC[C@@H]1c1nnc[nH]1 ZINC000284221085 1436005009 /nfs/dbraw/zinc/00/50/09/1436005009.db2.gz HGHBEKVIDXJUGU-CXLRFSCWSA-N 0 1 386.761 3.090 10 0 GGAEMN c1cc2c(nc(-c3ccccn3)nc2N2CCN(C[C@@H]3CCCO3)CC2)s1 ZINC000858317123 721922953 /nfs/dbraw/zinc/92/29/53/721922953.db2.gz RDVBDKBMDVBXSF-HNNXBMFYSA-N 0 1 381.505 3.054 10 0 GGAEMN c1cc2c(nc(-c3ccccn3)nc2N2CCN(C[C@H]3CCCO3)CC2)s1 ZINC000858317124 721923033 /nfs/dbraw/zinc/92/30/33/721923033.db2.gz RDVBDKBMDVBXSF-OAHLLOKOSA-N 0 1 381.505 3.054 10 0 GGAEMN C[C@@]1(CNC(=O)N[C@@H](C(=O)[O-])c2cccs2)CCC[N@H+]1Cc1ccccc1 ZINC000397908498 939138196 /nfs/dbraw/zinc/13/81/96/939138196.db2.gz XSASRCZFBKWJMG-XLIONFOSSA-N 0 1 387.505 3.228 10 0 GGAEMN CC(C)C[N@@H+](C)CCCNC(=O)N[C@@H](C(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000871645397 939260606 /nfs/dbraw/zinc/26/06/06/939260606.db2.gz BQRNQODFVKQKNC-OAHLLOKOSA-N 0 1 389.418 3.108 10 0 GGAEMN C[N@@H+](CCCNC(=O)N[C@@H](C(=O)[O-])C1CCCCCC1)Cc1ccccc1 ZINC000908759874 939314854 /nfs/dbraw/zinc/31/48/54/939314854.db2.gz FAUXTOFXUUJDTO-LJQANCHMSA-N 0 1 375.513 3.231 10 0 GGAEMN C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N[C@]2(C(=O)[O-])CCCC(C)(C)C2)C1 ZINC000908829809 939332155 /nfs/dbraw/zinc/33/21/55/939332155.db2.gz NSJSITKHTJFNIK-LLGFUMIMSA-N 0 1 381.561 3.467 10 0 GGAEMN CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@H](C(=O)[O-])C2CCCCCC2)c1 ZINC000908882845 939344290 /nfs/dbraw/zinc/34/42/90/939344290.db2.gz MFZQFFOVPCTXOP-IBGZPJMESA-N 0 1 375.513 3.361 10 0 GGAEMN CC(C)[N@H+]1CCC[C@@H](CNC(=O)N[C@H](C(=O)[O-])c2ccc3ccccc3c2)C1 ZINC000908903499 939347668 /nfs/dbraw/zinc/34/76/68/939347668.db2.gz FSIBEBKKFHIOOF-JXFKEZNVSA-N 0 1 383.492 3.385 10 0 GGAEMN O=C([O-])[C@H](NC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC000908924876 939354386 /nfs/dbraw/zinc/35/43/86/939354386.db2.gz NCCSJKOPJANZPQ-UYAOXDASSA-N 0 1 387.524 3.231 10 0 GGAEMN C[C@]1(CNC(=O)N[C@H](C(=O)[O-])c2ccccc2F)CCC[N@H+]1Cc1ccccc1 ZINC000908958649 939361260 /nfs/dbraw/zinc/36/12/60/939361260.db2.gz AILMOCKXNLTPGC-SIKLNZKXSA-N 0 1 399.466 3.305 10 0 GGAEMN C[C@H]1CC[C@@](NC(=O)NC[C@]2(C)CCC[N@H+]2Cc2ccccc2)(C(=O)[O-])CC1 ZINC000908959712 939361490 /nfs/dbraw/zinc/36/14/90/939361490.db2.gz LALYTTFVUQHELZ-HSQYWUDLSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@@]1(CNC(=O)N[C@H](C(=O)[O-])C2CCCCC2)CCC[N@H+]1Cc1ccccc1 ZINC000908960360 939361723 /nfs/dbraw/zinc/36/17/23/939361723.db2.gz RKVIQQUGCKWTRH-UGKGYDQZSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@H](CNC(=O)N[C@H](C(=O)[O-])C1CCCCCC1)[N@@H+](C)Cc1ccccc1 ZINC000908990420 939367017 /nfs/dbraw/zinc/36/70/17/939367017.db2.gz RPKGSNARRZVKSG-APWZRJJASA-N 0 1 375.513 3.230 10 0 GGAEMN CC1(C)CCC[C@@](NC(=O)NC[C@@H]2CCC[N@H+]2Cc2ccccc2)(C(=O)[O-])C1 ZINC000908999052 939369293 /nfs/dbraw/zinc/36/92/93/939369293.db2.gz WPFJXVRBENQXQV-AVRDEDQJSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@@H]1[C@@H](NC(=O)N[C@@]2(C(=O)[O-])CCCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000908999853 939369353 /nfs/dbraw/zinc/36/93/53/939369353.db2.gz CWKIXXRUSXYPAH-NRJQMVOHSA-N 0 1 387.524 3.372 10 0 GGAEMN CC1(C)CCC[C@](NC(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)(C(=O)[O-])C1 ZINC000908999055 939369750 /nfs/dbraw/zinc/36/97/50/939369750.db2.gz WPFJXVRBENQXQV-XMSQKQJNSA-N 0 1 387.524 3.374 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@@H](C(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000910379495 939755052 /nfs/dbraw/zinc/75/50/52/939755052.db2.gz IPQUSSNPEJSJOG-BDJLRTHQSA-N 0 1 383.370 3.358 10 0 GGAEMN C[C@H](NC(=O)N[C@H](C(=O)[O-])C1CCCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041378 939798809 /nfs/dbraw/zinc/79/88/09/939798809.db2.gz NNLDBZKNRLKRJI-WDYCEAGBSA-N 0 1 379.545 3.362 10 0 GGAEMN CC(C)CCSCC(=O)N[C@@]1(C(=O)[O-])CCC[N@@H+](Cc2ccccc2)C1 ZINC001123268902 939817837 /nfs/dbraw/zinc/81/78/37/939817837.db2.gz VQXUEFCDIQXFOJ-FQEVSTJZSA-N 0 1 378.538 3.001 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CCCC2)[C@H]1c1ccc(F)c(F)c1 ZINC000663046933 939851300 /nfs/dbraw/zinc/85/13/00/939851300.db2.gz YESIRZBJBRROGS-IPMKNSEASA-N 0 1 394.462 3.496 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CCCC2)[C@H]1c1ccc(F)c(F)c1 ZINC000663046933 939851301 /nfs/dbraw/zinc/85/13/01/939851301.db2.gz YESIRZBJBRROGS-IPMKNSEASA-N 0 1 394.462 3.496 10 0 GGAEMN O=C([O-])[C@H](Cc1ccc2c(c1)OCCCO2)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000277373192 1126078928 /nfs/dbraw/zinc/07/89/28/1126078928.db2.gz QKGDXBCFPRESSW-SFHVURJKSA-N 0 1 393.443 3.024 10 0 GGAEMN CCOC(=O)c1c(C)c2ccccc2nc1CNC1(CO)Cc2ccccc2C1 ZINC000510248564 1126095593 /nfs/dbraw/zinc/09/55/93/1126095593.db2.gz IPWIXTVVLLPMKM-UHFFFAOYSA-N 0 1 390.483 3.339 10 0 GGAEMN OCC1(NCc2csc(-c3ccc4c(c3)OCO4)n2)Cc2ccccc2C1 ZINC000553789743 1126096997 /nfs/dbraw/zinc/09/69/97/1126096997.db2.gz CHEGFZNWMYYWIW-UHFFFAOYSA-N 0 1 380.469 3.158 10 0 GGAEMN O[C@@H]([C@H](Cc1ccccc1)NCc1cc(-c2cccnc2)n[nH]1)C(F)(F)F ZINC000675100097 1126105058 /nfs/dbraw/zinc/10/50/58/1126105058.db2.gz WBGDKODMJSQAKT-ROUUACIJSA-N 0 1 376.382 3.096 10 0 GGAEMN Cc1cc(C)cc(-n2ncc(CN[C@H](CO)Cc3c[nH]c4ccccc34)n2)c1 ZINC000781416827 1126109503 /nfs/dbraw/zinc/10/95/03/1126109503.db2.gz WWOIGEFJBFBROR-SFHVURJKSA-N 0 1 375.476 3.059 10 0 GGAEMN COCc1nc(CN[C@@](C)(CO)Cc2ccc(Br)cc2)cs1 ZINC000865715699 1126115272 /nfs/dbraw/zinc/11/52/72/1126115272.db2.gz YDRXOWYGLSDIDV-MRXNPFEDSA-N 0 1 385.327 3.135 10 0 GGAEMN Cn1cc(-c2nc(CN[C@](C)(CO)Cc3ccc(Cl)cc3)cs2)cn1 ZINC000865772608 1126116648 /nfs/dbraw/zinc/11/66/48/1126116648.db2.gz PAWFVAFQPIAHIG-SFHVURJKSA-N 0 1 376.913 3.280 10 0 GGAEMN COc1ccc(C[C@](C)(CO)NCc2nc(C)c(Br)s2)cc1 ZINC000922328508 1126134471 /nfs/dbraw/zinc/13/44/71/1126134471.db2.gz OYSCYZUHHIEMEF-MRXNPFEDSA-N 0 1 385.327 3.306 10 0 GGAEMN Cn1nc(C(F)(F)F)c(CN[C@@](C)(CO)Cc2ccc(F)cc2)c1Cl ZINC001460858175 1126192178 /nfs/dbraw/zinc/19/21/78/1126192178.db2.gz AIEACTOSLGYJPH-OAHLLOKOSA-N 0 1 379.785 3.315 10 0 GGAEMN COc1ncc(Br)cc1CN[C@@](C)(CO)Cc1ccccc1F ZINC001473839166 1126199536 /nfs/dbraw/zinc/19/95/36/1126199536.db2.gz UIHTWOJVKKVYHL-QGZVFWFLSA-N 0 1 383.261 3.075 10 0 GGAEMN O[C@@H]([C@@H](Cc1ccccc1)NCc1cccc(Br)n1)C(F)(F)F ZINC001648158309 1126250216 /nfs/dbraw/zinc/25/02/16/1126250216.db2.gz KPSMWYNDZFCRHX-HIFRSBDPSA-N 0 1 389.215 3.468 10 0 GGAEMN COC(=O)c1ccc(-c2nc(CN[C@@](C)(CO)Cc3ccccc3F)co2)cc1 ZINC001648466462 1126250576 /nfs/dbraw/zinc/25/05/76/1126250576.db2.gz IJCYKBYYOZQPKM-JOCHJYFZSA-N 0 1 398.434 3.351 10 0 GGAEMN COc1ccc(C[C@](C)(CO)NCc2nccc(Cl)c2Cl)cc1OC ZINC001655740469 1126256367 /nfs/dbraw/zinc/25/63/67/1126256367.db2.gz URHCARRQTYSVDD-GOSISDBHSA-N 0 1 385.291 3.489 10 0 GGAEMN C[C@](CO)(Cc1ccc(Br)cc1)NCc1cc2n(n1)CCCC2 ZINC001660390195 1126264760 /nfs/dbraw/zinc/26/47/60/1126264760.db2.gz ZOPNSRGLVHPBER-GOSISDBHSA-N 0 1 378.314 3.065 10 0 GGAEMN CC(C)N1CCN(C(=O)c2cc(-c3cn[nH]c3)nc3ccc(Cl)cc32)CC1 ZINC000019148088 210229837 /nfs/dbraw/zinc/22/98/37/210229837.db2.gz UAXDHLKKKABYAD-UHFFFAOYSA-N 0 1 383.883 3.445 10 0 GGAEMN Fc1ccccc1-c1noc(NCCCN2CCN(c3ccccc3)CC2)n1 ZINC000015770770 210167258 /nfs/dbraw/zinc/16/72/58/210167258.db2.gz JEDXZSSPFVMKQL-UHFFFAOYSA-N 0 1 381.455 3.500 10 0 GGAEMN COc1cccc(-c2n[nH]c(SCc3cc(=O)n4c(C)csc4n3)n2)c1 ZINC000015731910 210165033 /nfs/dbraw/zinc/16/50/33/210165033.db2.gz RGGDYXHGQKUGJA-UHFFFAOYSA-N 0 1 385.474 3.150 10 0 GGAEMN CCC(CC)C(=O)N1CCN(C(=O)c2cc(-c3ccc(C)cc3C)[nH]n2)CC1 ZINC000015680706 210163072 /nfs/dbraw/zinc/16/30/72/210163072.db2.gz HLUWDAILHHGCKW-UHFFFAOYSA-N 0 1 382.508 3.414 10 0 GGAEMN Cc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4ccccc4)CC3)n[nH]2)c(C)c1 ZINC000015680785 210163138 /nfs/dbraw/zinc/16/31/38/210163138.db2.gz VFYNGHNAFJOKJG-UHFFFAOYSA-N 0 1 388.471 3.292 10 0 GGAEMN CN(C[C@H]1COc2ccccc2O1)C(=O)CN(C)[C@@H]1CCCc2ccccc21 ZINC000015291772 210155868 /nfs/dbraw/zinc/15/58/68/210155868.db2.gz PCXQMOCMSIGFOQ-AZUAARDMSA-N 0 1 380.488 3.294 10 0 GGAEMN C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)c2ccc3oc(=S)[n-]c3c2)C1 ZINC000408518198 530006290 /nfs/dbraw/zinc/00/62/90/530006290.db2.gz WQWPISNNYJPJNX-OAHLLOKOSA-N 0 1 382.489 3.106 10 0 GGAEMN CCOC(=O)c1cc(C)nc(N2CCc3n[nH]c(-c4cccc(F)c4)c3C2)n1 ZINC000015075925 210149530 /nfs/dbraw/zinc/14/95/30/210149530.db2.gz RNHBGPGOSIEQTE-UHFFFAOYSA-N 0 1 381.411 3.054 10 0 GGAEMN CC(C)n1cc2c3c1cccc3[C@@H]1C[C@@H](C(=O)O[C@@H](C)[C@H](C)O)CN(C)[C@@H]1C2 ZINC000014952188 210130420 /nfs/dbraw/zinc/13/04/20/210130420.db2.gz JQYLIGHHVGCTPR-BQRMZNRMSA-N 0 1 384.520 3.495 10 0 in-vitro GGAEMN CC(C)c1n[nH]c(SCC(=O)N2CCN(Cc3ccc(Cl)s3)CC2)n1 ZINC000014241186 210112633 /nfs/dbraw/zinc/11/26/33/210112633.db2.gz ODCXIPZNAYMDEY-UHFFFAOYSA-N 0 1 399.973 3.080 10 0 GGAEMN CC(C)c1nc(SCC(=O)N2CCN(Cc3ccc(Cl)s3)CC2)n[nH]1 ZINC000014241186 210112638 /nfs/dbraw/zinc/11/26/38/210112638.db2.gz ODCXIPZNAYMDEY-UHFFFAOYSA-N 0 1 399.973 3.080 10 0 GGAEMN CC(C)n1cc2c3c1cccc3[C@H]1C[C@@H](C(=O)O[C@@H](C)[C@H](C)O)CN(C)[C@@H]1C2 ZINC000013783296 210089770 /nfs/dbraw/zinc/08/97/70/210089770.db2.gz JQYLIGHHVGCTPR-BVRWACBHSA-N 0 1 384.520 3.495 10 0 in-vitro GGAEMN CCc1cc2c(ncn(NC(=O)c3nc(-c4ccco4)sc3C)c2=O)s1 ZINC000012972627 210036147 /nfs/dbraw/zinc/03/61/47/210036147.db2.gz CMAXNNKKFAZUGV-UHFFFAOYSA-N 0 1 386.458 3.429 10 0 GGAEMN O=C(CSc1ncnc2sccc21)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000012881945 210022662 /nfs/dbraw/zinc/02/26/62/210022662.db2.gz PSXNVTCIBKFBJK-HNNXBMFYSA-N 0 1 384.530 3.174 10 0 GGAEMN CCCN1CCN(C(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)CC1 ZINC000012820211 210014635 /nfs/dbraw/zinc/01/46/35/210014635.db2.gz PZUDYDICXDUDHM-GOSISDBHSA-N 0 1 379.932 3.039 10 0 GGAEMN COc1cn(CC(=O)Nc2cccc(F)c2)c(CN2CCCCCC2)cc1=O ZINC000009622057 209836560 /nfs/dbraw/zinc/83/65/60/209836560.db2.gz NJDPNNJEOPWHPZ-UHFFFAOYSA-N 0 1 387.455 3.011 10 0 GGAEMN Cc1cc(OCCCC(=O)N2CCC[C@H]([N@@H+](C)CC(=O)[O-])CC2)ccc1Cl ZINC000186653389 209263973 /nfs/dbraw/zinc/26/39/73/209263973.db2.gz HGBJUZJQSUEVBZ-INIZCTEOSA-N 0 1 396.915 3.205 10 0 GGAEMN CN1CCN(c2cccc3c(S(=O)(=O)n4ccc5ccccc54)c[nH]c32)CC1 ZINC000034035337 209246270 /nfs/dbraw/zinc/24/62/70/209246270.db2.gz OJZHBRJWLTXUBQ-UHFFFAOYSA-N 0 1 394.500 3.111 10 0 GGAEMN COc1ccccc1N1CCN(CCC(=O)Nc2ccc(F)cc2F)CC1 ZINC000028647117 209244164 /nfs/dbraw/zinc/24/41/64/209244164.db2.gz FCYYYWXVEGABAA-UHFFFAOYSA-N 0 1 375.419 3.124 10 0 GGAEMN CCn1cc([C@@H]2NC(=O)CC[C@H]2NCc2nc3ccc(Cl)cc3n2C)cn1 ZINC000328622037 209148757 /nfs/dbraw/zinc/14/87/57/209148757.db2.gz AXGNKTUDEMPECG-BEFAXECRSA-N 0 1 386.887 3.393 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@H](C)Oc2cccc(C(C)(C)C)c2)CC1 ZINC000186639726 209137571 /nfs/dbraw/zinc/13/75/71/209137571.db2.gz UHDQWBCJXRWTLI-INIZCTEOSA-N 0 1 390.524 3.149 10 0 GGAEMN CCCCOC(=O)c1ccc(NC(=O)C([O-])=CC(=O)c2ccc(OC)cc2)cc1 ZINC000101354911 211398739 /nfs/dbraw/zinc/39/87/39/211398739.db2.gz KKSGGRVZYHWEAK-UHFFFAOYSA-N 0 1 397.427 3.433 10 0 GGAEMN CCCCOC(=O)c1ccc(NC(=O)C(O)=CC(=O)c2ccc(OC)cc2)cc1 ZINC000101354911 211398743 /nfs/dbraw/zinc/39/87/43/211398743.db2.gz KKSGGRVZYHWEAK-UHFFFAOYSA-N 0 1 397.427 3.433 10 0 GGAEMN C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCc1c[nH]nn1 ZINC000097011706 211354564 /nfs/dbraw/zinc/35/45/64/211354564.db2.gz JLUXEIKNZAFQJT-JTQLQIEISA-N 0 1 377.857 3.051 10 0 GGAEMN O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2cc(-c3ccncc3)[nH]n2)CC1 ZINC000096324568 211335152 /nfs/dbraw/zinc/33/51/52/211335152.db2.gz OTMDZKCYCSNCKN-UHFFFAOYSA-N 0 1 393.422 3.102 10 0 GGAEMN CCc1nnc(-c2cc(S(=O)(=O)Nc3ccc(OC)c(Cl)c3)c[nH]2)o1 ZINC000096321615 211335160 /nfs/dbraw/zinc/33/51/60/211335160.db2.gz OIRIACOADWPYKH-UHFFFAOYSA-N 0 1 382.829 3.090 10 0 GGAEMN O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2cc(-c3cccnc3)[nH]n2)CC1 ZINC000096324664 211334653 /nfs/dbraw/zinc/33/46/53/211334653.db2.gz VCCSAZWGLZCQAW-UHFFFAOYSA-N 0 1 393.422 3.102 10 0 GGAEMN CC1CCC(NC(=O)C2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)CC2)CC1 ZINC000096324600 211334257 /nfs/dbraw/zinc/33/42/57/211334257.db2.gz DZMOQSWNKDAECP-UHFFFAOYSA-N 0 1 395.507 3.019 10 0 GGAEMN COCC(=O)N(c1ccc(C)cc1)C1CCN(Cc2ccc(O)c(OC)c2)CC1 ZINC000096281070 211329738 /nfs/dbraw/zinc/32/97/38/211329738.db2.gz KPLMTVAXHRUGNW-UHFFFAOYSA-N 0 1 398.503 3.353 10 0 GGAEMN CCCN1CCN(C(=O)Cc2c3[nH]cccc-3c(=O)n2-c2ccc(C)cc2)CC1 ZINC000096386962 211339681 /nfs/dbraw/zinc/33/96/81/211339681.db2.gz FXCOMGWYEXOYLP-HXUWFJFHSA-N 0 1 392.503 3.036 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nnc(C)o2)c(C)c1 ZINC000096379603 211338619 /nfs/dbraw/zinc/33/86/19/211338619.db2.gz OXEQLNBVGNIPQE-UHFFFAOYSA-N 0 1 376.438 3.108 10 0 GGAEMN CCc1nnc(-c2[nH]c(C)c(S(=O)(=O)Nc3ccc(F)c(F)c3)c2C)o1 ZINC000096379444 211338282 /nfs/dbraw/zinc/33/82/82/211338282.db2.gz ANNCYLJHJTTXQF-UHFFFAOYSA-N 0 1 382.392 3.323 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(F)cc2)c1-c1nnc(C2CC2)o1 ZINC000096379637 211338131 /nfs/dbraw/zinc/33/81/31/211338131.db2.gz MTIADZJACKEIKG-UHFFFAOYSA-N 0 1 376.413 3.499 10 0 GGAEMN Cc1nc2ncc(C(=O)Nc3ccc(Cl)cc3C(=O)N3CCCC3)cc2[nH]1 ZINC000096011802 211295291 /nfs/dbraw/zinc/29/52/91/211295291.db2.gz IUXSFOLHDMGFGK-UHFFFAOYSA-N 0 1 383.839 3.408 10 0 GGAEMN CCO[C@H]1C[C@@H](N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)C12CCC2 ZINC000096009200 211294149 /nfs/dbraw/zinc/29/41/49/211294149.db2.gz YMCHAQPYLNQVNX-MOPGFXCFSA-N 0 1 376.928 3.374 10 0 GGAEMN C[C@@H](CS(=O)(=O)c1ccccc1)N[C@H](Cc1nccn1C)c1ccccc1 ZINC000095986460 211292940 /nfs/dbraw/zinc/29/29/40/211292940.db2.gz SJRQXUMPXCMFDE-FXAWDEMLSA-N 0 1 383.517 3.156 10 0 GGAEMN O=C(Nc1ccc(CN2CCOCC2)cn1)c1cc(-c2ccccc2Cl)n[nH]1 ZINC000095976302 211291191 /nfs/dbraw/zinc/29/11/91/211291191.db2.gz PLHPXYQKADJKJS-UHFFFAOYSA-N 0 1 397.866 3.210 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)c1 ZINC000095963625 211289351 /nfs/dbraw/zinc/28/93/51/211289351.db2.gz YLIWXHKLZOFWIU-UHFFFAOYSA-N 0 1 390.443 3.287 10 0 GGAEMN CC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2c1cnn2CC)c1n[nH]c(C)n1 ZINC000095961571 211289066 /nfs/dbraw/zinc/28/90/66/211289066.db2.gz AHSOVGUQVQIURC-QGZVFWFLSA-N 0 1 389.463 3.426 10 0 GGAEMN O=C(c1cc(=O)[nH]c2ccc(Cl)cc21)N1CCC(c2n[nH]c(C3CC3)n2)CC1 ZINC000095957671 211288135 /nfs/dbraw/zinc/28/81/35/211288135.db2.gz CWEHKSYOTHMZEO-UHFFFAOYSA-N 0 1 397.866 3.197 10 0 GGAEMN Cn1cc(CNCc2cccc(NC(=O)NC3CC3)c2)c(-c2ccncc2)n1 ZINC000095959252 211286840 /nfs/dbraw/zinc/28/68/40/211286840.db2.gz SNAAMEVSXWGNSG-UHFFFAOYSA-N 0 1 376.464 3.056 10 0 GGAEMN CSc1nn2c(nc(CN3CCC[C@@](C)(c4ccccc4)C3)cc2=O)s1 ZINC000095497749 211251644 /nfs/dbraw/zinc/25/16/44/211251644.db2.gz KAPCVZSJFVNWIL-LJQANCHMSA-N 0 1 386.546 3.427 10 0 GGAEMN COc1ccccc1-n1cc(C(=O)N(C)Cc2ccc3c(c2)CN(C)C3)cn1 ZINC000091382183 211190693 /nfs/dbraw/zinc/19/06/93/211190693.db2.gz RVPWBSFVEAGYQP-UHFFFAOYSA-N 0 1 376.460 3.099 10 0 GGAEMN O=C(c1cccc(CN2CC[C@H](OCc3ccccn3)C2)c1)N1CCCCC1 ZINC000089883764 211185329 /nfs/dbraw/zinc/18/53/29/211185329.db2.gz DNVQRXHLMFLYAZ-QFIPXVFZSA-N 0 1 379.504 3.499 10 0 GGAEMN O=C(NC[C@H](c1ccco1)N1CCCC1)[C@@H]1CCCN1C(=O)C1CCCCC1 ZINC000084429537 211169569 /nfs/dbraw/zinc/16/95/69/211169569.db2.gz QQYXVBUNTMCGOP-RBUKOAKNSA-N 0 1 387.524 3.104 10 0 GGAEMN Cc1ccccc1NCCC(=O)Nc1ccc2nc(CN3CCOCC3)[nH]c2c1 ZINC000069925753 211041282 /nfs/dbraw/zinc/04/12/82/211041282.db2.gz FXBXKNDQHDCSPX-UHFFFAOYSA-N 0 1 393.491 3.144 10 0 GGAEMN CC1=NO[C@@H](C(=O)NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)C1 ZINC000067855468 211024097 /nfs/dbraw/zinc/02/40/97/211024097.db2.gz XRDFYNZTDIXKLH-MRXNPFEDSA-N 0 1 379.395 3.059 10 0 GGAEMN CC[C@@]1(C(=O)[O-])C[C@H](C(=O)N(C)CCC(C)C)[C@H](c2ccc(OC)cc2)[N@H+]1C ZINC000067785451 211021543 /nfs/dbraw/zinc/02/15/43/211021543.db2.gz NAYJRVNATSBWQV-IPJJNNNSSA-N 0 1 390.524 3.426 10 0 GGAEMN CCCCc1nc2ccc(NC(=O)Cn3cnc4ccccc4c3=O)cc2[nH]1 ZINC000067656075 211014828 /nfs/dbraw/zinc/01/48/28/211014828.db2.gz HSEDWZXEJULRHL-UHFFFAOYSA-N 0 1 375.432 3.254 10 0 GGAEMN C[C@@H](C(=O)Nc1ccccn1)N1CCc2n[nH]c(-c3ccc(F)c(F)c3)c2C1 ZINC000067650743 211014660 /nfs/dbraw/zinc/01/46/60/211014660.db2.gz VCYRXFNDOQKICX-LBPRGKRZSA-N 0 1 383.402 3.135 10 0 GGAEMN Cc1cccc(Cc2nc(CCNS(=O)(=O)c3ccc(C(C)C)cc3)n[nH]2)c1 ZINC000064969857 210956592 /nfs/dbraw/zinc/95/65/92/210956592.db2.gz PDCKZUAKHATAPW-UHFFFAOYSA-N 0 1 398.532 3.348 10 0 GGAEMN CCCN1CCN(c2nc3c(cnn3C)c(NCc3ccccc3Cl)n2)CC1 ZINC000021929207 210399932 /nfs/dbraw/zinc/39/99/32/210399932.db2.gz QRHMRCRWQCRHHC-UHFFFAOYSA-N 0 1 399.930 3.161 10 0 GGAEMN COc1ccc(-c2noc(NCCCN3CCN(c4ccccc4)CC3)n2)cc1 ZINC000021630447 210385833 /nfs/dbraw/zinc/38/58/33/210385833.db2.gz KAAZIKGUPKAAKB-UHFFFAOYSA-N 0 1 393.491 3.369 10 0 GGAEMN Fc1ccccc1-c1noc(NCCCN2CCN(Cc3ccccc3)CC2)n1 ZINC000020996777 210372710 /nfs/dbraw/zinc/37/27/10/210372710.db2.gz KYVQAMBPYZEYNV-UHFFFAOYSA-N 0 1 395.482 3.496 10 0 GGAEMN CCCN1CCN(C(=O)c2c(C)nn(-c3cccc(C)c3)c2-n2cccc2)CC1 ZINC000020979244 210370391 /nfs/dbraw/zinc/37/03/91/210370391.db2.gz VQLCNMDTUBMTKT-UHFFFAOYSA-N 0 1 391.519 3.448 10 0 GGAEMN Cn1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3ccc(Cl)cc3)ccc21 ZINC000020893060 210367132 /nfs/dbraw/zinc/36/71/32/210367132.db2.gz LFGHFROKLWXZRC-UHFFFAOYSA-N 0 1 397.910 3.226 10 0 GGAEMN O=C(c1cc(COc2ccccc2)n[nH]1)N1CCCN(Cc2cccs2)CC1 ZINC000020999866 210375064 /nfs/dbraw/zinc/37/50/64/210375064.db2.gz UOGKWUDMAREUJX-UHFFFAOYSA-N 0 1 396.516 3.398 10 0 GGAEMN CCCn1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3ccccc3)ccc21 ZINC000020677516 210356005 /nfs/dbraw/zinc/35/60/05/210356005.db2.gz GKVVZCMENRYUSE-UHFFFAOYSA-N 0 1 391.519 3.446 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cncc(C(=O)N[C@@H]3CCCC[C@@H]3C)c2)cc1 ZINC000020532765 210346594 /nfs/dbraw/zinc/34/65/94/210346594.db2.gz YIHNAUBYFRMWGS-HNAYVOBHSA-N 0 1 387.505 3.499 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cncc(C(=O)N[C@H]3CCCC[C@@H]3C)c2)cc1 ZINC000020532763 210346604 /nfs/dbraw/zinc/34/66/04/210346604.db2.gz YIHNAUBYFRMWGS-KXBFYZLASA-N 0 1 387.505 3.499 10 0 GGAEMN CC(C)n1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3ccco3)ccc21 ZINC000020677919 210355209 /nfs/dbraw/zinc/35/52/09/210355209.db2.gz FKXJVWPEGOKJLG-UHFFFAOYSA-N 0 1 381.480 3.210 10 0 GGAEMN CC(=O)N1CCc2cc([C@H](O)CN3CCN(c4ccc(Cl)cc4)CC3)ccc21 ZINC000020287287 210325666 /nfs/dbraw/zinc/32/56/66/210325666.db2.gz OAXXLMBPRMHKCP-JOCHJYFZSA-N 0 1 399.922 3.105 10 0 GGAEMN O=C(Cn1cccc1C(=O)c1ccccc1)N1CCN(C2CCCCC2)CC1 ZINC000020414860 210334026 /nfs/dbraw/zinc/33/40/26/210334026.db2.gz NLAFILOPMUIHHZ-UHFFFAOYSA-N 0 1 379.504 3.196 10 0 GGAEMN Cc1c[nH]c(C(=O)N2CC[C@H](C3CCN(Cc4cccc(F)c4F)CC3)C2)n1 ZINC000011819806 221129862 /nfs/dbraw/zinc/12/98/62/221129862.db2.gz CAWAZAOPWBZBFT-INIZCTEOSA-N 0 1 388.462 3.371 10 0 GGAEMN Cc1cc(N2CCC(n3cc(C4CC4)nn3)CC2)nc(-c2ccccc2O)n1 ZINC000063872072 136156560 /nfs/dbraw/zinc/15/65/60/136156560.db2.gz YFKRZSMARDXYHM-UHFFFAOYSA-N 0 1 376.464 3.468 10 0 GGAEMN CC(C)C(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3F)CC2)cc1C(=O)[O-] ZINC000064589726 136157087 /nfs/dbraw/zinc/15/70/87/136157087.db2.gz YGMGZDSDHMPQRN-UHFFFAOYSA-N 0 1 399.466 3.441 10 0 GGAEMN O=C(C1=CCN(Cc2cccc(F)c2)CC1)N1CCN(c2ccccc2)CC1 ZINC000064818105 136157873 /nfs/dbraw/zinc/15/78/73/136157873.db2.gz MUTBLRDEDCQSRO-UHFFFAOYSA-N 0 1 379.479 3.307 10 0 GGAEMN CN1CCN(c2nc3c(-c4cccc(Cl)c4)nnn3c3ccccc32)CC1 ZINC000067262697 136164500 /nfs/dbraw/zinc/16/45/00/136164500.db2.gz GSFFLKFOZNJNJY-UHFFFAOYSA-N 0 1 378.867 3.350 10 0 GGAEMN O=C(NCc1ccco1)c1cc(N2CCc3n[nH]c(C4CCC4)c3C2)ccn1 ZINC000071747274 136166048 /nfs/dbraw/zinc/16/60/48/136166048.db2.gz QRUSIFJMNXQKCR-UHFFFAOYSA-N 0 1 377.448 3.158 10 0 GGAEMN CC(=O)Nc1ccc(/C=C\C(=O)Nc2ccc(N3CCN(C)CC3)c(C)c2)cc1 ZINC000096947461 136187969 /nfs/dbraw/zinc/18/79/69/136187969.db2.gz GLOZRCMIRSPSIJ-WDZFZDKYSA-N 0 1 392.503 3.357 10 0 GGAEMN CCn1cc(/C=C2/C(=O)NC(=S)N(c3ccccc3)C2=O)c2ccccc21 ZINC000000677831 136192968 /nfs/dbraw/zinc/19/29/68/136192968.db2.gz RJCPIHUJDHHRDV-ATVHPVEESA-N 0 1 375.453 3.493 10 0 GGAEMN CC(C)CN1CCN(Cc2nc(-c3ccc(N4CCC[C@@H](C)C4)nc3)no2)CC1 ZINC000065216118 535103681 /nfs/dbraw/zinc/10/36/81/535103681.db2.gz SBOBBYIFSJQSND-GOSISDBHSA-N 0 1 398.555 3.142 10 0 GGAEMN CC(C)CN1CCN(Cc2nc(-c3ccc(N4CCC[C@H](C)C4)nc3)no2)CC1 ZINC000065216121 535104454 /nfs/dbraw/zinc/10/44/54/535104454.db2.gz SBOBBYIFSJQSND-SFHVURJKSA-N 0 1 398.555 3.142 10 0 GGAEMN CCC(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3F)CC2)cc1C(=O)[O-] ZINC000064589940 535333300 /nfs/dbraw/zinc/33/33/00/535333300.db2.gz JJGMIRGVWRYQMT-UHFFFAOYSA-N 0 1 385.439 3.195 10 0 GGAEMN COc1ccccc1N1CCN([C@H](C)c2cccc(OCC(=O)N(C)C)c2)CC1 ZINC000097165315 537069999 /nfs/dbraw/zinc/06/99/99/537069999.db2.gz XSEPCUVJKKUXAT-GOSISDBHSA-N 0 1 397.519 3.045 10 0 GGAEMN O=C1NCC[C@@H]1NCc1ccc(OCc2ccccc2)c(Br)c1 ZINC000115924425 564200962 /nfs/dbraw/zinc/20/09/62/564200962.db2.gz OKSFMHLMLVCLEA-INIZCTEOSA-N 0 1 375.266 3.006 10 0 GGAEMN C[C@H]1CN(C2CCN(C(=O)/C=C/c3csc(Br)c3)CC2)CCO1 ZINC000116196160 564205705 /nfs/dbraw/zinc/20/57/05/564205705.db2.gz OYCKIDAKDFTYPL-IBUXWKBASA-N 0 1 399.354 3.236 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1nc(Cl)ccc1Cl ZINC000116248960 564206474 /nfs/dbraw/zinc/20/64/74/564206474.db2.gz HOHKIEURMVTEJJ-DOMZBBRYSA-N 0 1 379.291 3.424 10 0 GGAEMN Cc1[nH]c(=S)sc1CC(=O)N[C@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000116252490 564206652 /nfs/dbraw/zinc/20/66/52/564206652.db2.gz GCXFKUUOWODKHV-WFASDCNBSA-N 0 1 376.551 3.078 10 0 GGAEMN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN1CC[C@H](c2cnn(C)c2)C1 ZINC000116319373 564207173 /nfs/dbraw/zinc/20/71/73/564207173.db2.gz LAJUAZFIAPMNKG-AWEZNQCLSA-N 0 1 381.307 3.175 10 0 GGAEMN Cn1cc([C@@H]2CCN(Cc3nc(-c4cccc(Br)c4)no3)C2)cn1 ZINC000116319815 564207361 /nfs/dbraw/zinc/20/73/61/564207361.db2.gz AEDHAOXJBHDVHA-CYBMUJFWSA-N 0 1 388.269 3.222 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)CCN1CCOC ZINC000117301669 564225728 /nfs/dbraw/zinc/22/57/28/564225728.db2.gz QRQFXXQBTADGGS-KZNAEPCWSA-N 0 1 395.341 3.122 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 ZINC000006779313 564226856 /nfs/dbraw/zinc/22/68/56/564226856.db2.gz CFYXDOGIFLBAFR-NSHDSACASA-N 0 1 378.475 3.237 10 0 GGAEMN CCOc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 ZINC000006779304 564227160 /nfs/dbraw/zinc/22/71/60/564227160.db2.gz VNMHYGMPOJTQQF-NSHDSACASA-N 0 1 378.475 3.319 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2ccc(Br)cc2C)CCN1CCOC ZINC000117437419 564227178 /nfs/dbraw/zinc/22/71/78/564227178.db2.gz NGZFPJKMBXZVMD-HNNXBMFYSA-N 0 1 384.318 3.332 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2cc(Br)ccc2C)CCN1CCOC ZINC000117445349 564227722 /nfs/dbraw/zinc/22/77/22/564227722.db2.gz JXILCIHBJQBNDF-OAHLLOKOSA-N 0 1 384.318 3.332 10 0 GGAEMN CCOc1cc(Br)c(CSc2nc(N)cc(N)n2)cc1OCC ZINC000006831860 564228158 /nfs/dbraw/zinc/22/81/58/564228158.db2.gz YAPRFHGJZCRQAU-UHFFFAOYSA-N 0 1 399.314 3.493 10 0 GGAEMN O=C(CSC1=Nc2ccccc2S(=O)(=O)N1)Nc1cccc(Cl)c1 ZINC000006918581 564229806 /nfs/dbraw/zinc/22/98/06/564229806.db2.gz DBPZFPXMQPGJDZ-UHFFFAOYSA-N 0 1 381.866 3.182 10 0 GGAEMN CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)Nc1ccc(F)c(Cl)c1 ZINC000007002823 564231131 /nfs/dbraw/zinc/23/11/31/564231131.db2.gz CPHYFWWAHZZUKI-UHFFFAOYSA-N 0 1 388.848 3.412 10 0 GGAEMN Cn1cnnc1Sc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1 ZINC000008940623 564251621 /nfs/dbraw/zinc/25/16/21/564251621.db2.gz LZSBCHYPZFOBIM-UHFFFAOYSA-N 0 1 380.882 3.421 10 0 GGAEMN CCCn1c(=O)[nH]nc1SCC(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000010438729 564257932 /nfs/dbraw/zinc/25/79/32/564257932.db2.gz ZRPXPNCPTAJGCZ-UHFFFAOYSA-N 0 1 392.815 3.379 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)[nH]n1 ZINC000119304680 564264809 /nfs/dbraw/zinc/26/48/09/564264809.db2.gz DEDVNBLRDXWNAN-OLZOCXBDSA-N 0 1 386.253 3.315 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@H]2C[C@H]2c2cccc(Br)c2)[nH]n1 ZINC000119390272 564268942 /nfs/dbraw/zinc/26/89/42/564268942.db2.gz YWXDGIVHQUYPHE-STQMWFEESA-N 0 1 386.253 3.315 10 0 GGAEMN CC(C)n1cc(Br)cc1C(=O)Nc1cc(-c2nccn2C)n[nH]1 ZINC000119445771 564271200 /nfs/dbraw/zinc/27/12/00/564271200.db2.gz RAWXNSKIRTWZQG-UHFFFAOYSA-N 0 1 377.246 3.207 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)Cc2cc(Cl)ccc2Br)[nH]n1 ZINC000119434036 564271329 /nfs/dbraw/zinc/27/13/29/564271329.db2.gz CXTKCLSYPPFKJD-UHFFFAOYSA-N 0 1 394.660 3.407 10 0 GGAEMN Cc1cccc(C(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c1Br ZINC000119636258 564280144 /nfs/dbraw/zinc/28/01/44/564280144.db2.gz PHSGVZQGJWFROR-AWEZNQCLSA-N 0 1 381.314 3.083 10 0 GGAEMN Cc1cc(C(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)ccc1Br ZINC000119636644 564280289 /nfs/dbraw/zinc/28/02/89/564280289.db2.gz AUEWBSXICCAYBF-AWEZNQCLSA-N 0 1 381.314 3.083 10 0 GGAEMN COc1cc(CNCc2cccc(C)n2)cc(I)c1OC ZINC000119783170 564288209 /nfs/dbraw/zinc/28/82/09/564288209.db2.gz BGRLFPBRBXUZDM-UHFFFAOYSA-N 0 1 398.244 3.302 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCC2(c3cccc(Br)c3)CC2)n[nH]1 ZINC000120219255 564309749 /nfs/dbraw/zinc/30/97/49/564309749.db2.gz HPASKMQUECKPQV-GFCCVEGCSA-N 0 1 391.313 3.443 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCC2(c3cccc(Br)c3)CC2)n[nH]1 ZINC000120219379 564310127 /nfs/dbraw/zinc/31/01/27/564310127.db2.gz HPASKMQUECKPQV-LBPRGKRZSA-N 0 1 391.313 3.443 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cc(C)sc2C)ccc1N1CCCC1=O ZINC000021867882 564312269 /nfs/dbraw/zinc/31/22/69/564312269.db2.gz IBYPXCYFJDJXAZ-UHFFFAOYSA-N 0 1 380.491 3.301 10 0 GGAEMN Cc1nnc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)[nH]1 ZINC000120351005 564316781 /nfs/dbraw/zinc/31/67/81/564316781.db2.gz JOTZMWARIMRGSI-CYBMUJFWSA-N 0 1 384.267 3.203 10 0 GGAEMN Cc1n[nH]c(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)n1 ZINC000120351005 564316782 /nfs/dbraw/zinc/31/67/82/564316782.db2.gz JOTZMWARIMRGSI-CYBMUJFWSA-N 0 1 384.267 3.203 10 0 GGAEMN C[C@H](C1CC1)N(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120518943 564323546 /nfs/dbraw/zinc/32/35/46/564323546.db2.gz STYRWLABSYZIIX-SNVBAGLBSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@H](C1CC1)N(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120518943 564323550 /nfs/dbraw/zinc/32/35/50/564323550.db2.gz STYRWLABSYZIIX-SNVBAGLBSA-N 0 1 378.274 3.174 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1Cc2ccccc2C1 ZINC000120509982 564323754 /nfs/dbraw/zinc/32/37/54/564323754.db2.gz DXXRMOVVCGJVAH-UHFFFAOYSA-N 0 1 398.264 3.460 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1Cc2ccccc2C1 ZINC000120509982 564323758 /nfs/dbraw/zinc/32/37/58/564323758.db2.gz DXXRMOVVCGJVAH-UHFFFAOYSA-N 0 1 398.264 3.460 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCCCCC1 ZINC000120520129 564323852 /nfs/dbraw/zinc/32/38/52/564323852.db2.gz HLZXIPVLXJPVJW-UHFFFAOYSA-N 0 1 378.274 3.320 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCCCCC1 ZINC000120520129 564323856 /nfs/dbraw/zinc/32/38/56/564323856.db2.gz HLZXIPVLXJPVJW-UHFFFAOYSA-N 0 1 378.274 3.320 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H](C)C(=O)Nc1ccccc1Br ZINC000023762066 564326565 /nfs/dbraw/zinc/32/65/65/564326565.db2.gz MQXPLPPOJBIMAO-VIFPVBQESA-N 0 1 385.287 3.276 10 0 GGAEMN CCc1[nH]nc(NC(=O)[C@@H]2CCc3[nH]c(C(C)C)nc3C2)c1Br ZINC000476187192 564329303 /nfs/dbraw/zinc/32/93/03/564329303.db2.gz GZNPWLSJQALBHI-SECBINFHSA-N 0 1 380.290 3.325 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c(Cl)cc1F ZINC000120663448 564331936 /nfs/dbraw/zinc/33/19/36/564331936.db2.gz ODZWAYCTKDRFII-UHFFFAOYSA-N 0 1 382.844 3.481 10 0 GGAEMN COC(=O)[C@H](c1cccc(Br)c1)N1CCC(c2ccn[nH]2)CC1 ZINC000120772434 564337157 /nfs/dbraw/zinc/33/71/57/564337157.db2.gz WEYDHZBKGBIDBW-INIZCTEOSA-N 0 1 378.270 3.266 10 0 GGAEMN COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1ccc(Cl)cc1 ZINC000120845515 564339768 /nfs/dbraw/zinc/33/97/68/564339768.db2.gz MAPTVZQJRATDFB-UHFFFAOYSA-N 0 1 380.853 3.498 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c(C)s1 ZINC000120889773 564342010 /nfs/dbraw/zinc/34/20/10/564342010.db2.gz OSFYSIPRNUTPOL-UHFFFAOYSA-N 0 1 375.475 3.130 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(CC(=O)N(C)C)cc2)c(Cl)cc1F ZINC000120901531 564342347 /nfs/dbraw/zinc/34/23/47/564342347.db2.gz XOQSUVNXPRWZQD-UHFFFAOYSA-N 0 1 384.860 3.219 10 0 GGAEMN CC[C@@H]1CN(Cc2cc(Br)c(OC)s2)CCN1CCOC ZINC000120925382 564343201 /nfs/dbraw/zinc/34/32/01/564343201.db2.gz BVVZOOJNZQLILW-GFCCVEGCSA-N 0 1 377.348 3.062 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccccc2Cn2cncn2)c(Cl)cc1F ZINC000120971781 564345999 /nfs/dbraw/zinc/34/59/99/564345999.db2.gz LAUHZIGIWGQOPH-UHFFFAOYSA-N 0 1 380.832 3.228 10 0 GGAEMN Cc1nc(-c2ccc(S(=O)(=O)N[C@@H]3CN(C(C)C)C[C@@H]3C)s2)cs1 ZINC000121069365 564351409 /nfs/dbraw/zinc/35/14/09/564351409.db2.gz YYICOWIDRPWKOG-WCQYABFASA-N 0 1 385.580 3.187 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nc2)cc1Cl ZINC000121183663 564358135 /nfs/dbraw/zinc/35/81/35/564358135.db2.gz FAAQITXCWUUHEE-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN O=C(c1cncc(Br)c1)N1CCCN(Cc2cccs2)CC1 ZINC000028037932 564358966 /nfs/dbraw/zinc/35/89/66/564358966.db2.gz KGFOJAZSYQSQAS-UHFFFAOYSA-N 0 1 380.311 3.254 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2)c1 ZINC000028813452 564364828 /nfs/dbraw/zinc/36/48/28/564364828.db2.gz UJKUIGONZMYDKP-LLVKDONJSA-N 0 1 383.853 3.245 10 0 GGAEMN COc1ccc([C@@H](C)NCC(=O)Nc2ccc(Br)cn2)cc1F ZINC000121524574 564373015 /nfs/dbraw/zinc/37/30/15/564373015.db2.gz ZCZLIZHBCBUTPX-SNVBAGLBSA-N 0 1 382.233 3.281 10 0 GGAEMN Cc1cc(CN2CCCN(Cc3cnn(C)c3)CC2)ccc1Br ZINC000121552843 564373987 /nfs/dbraw/zinc/37/39/87/564373987.db2.gz MJWKKZNUMALMSV-UHFFFAOYSA-N 0 1 377.330 3.199 10 0 GGAEMN CCN1CCC[C@H](NC(=O)C(=O)Nc2ccc(Br)cc2C(C)C)C1 ZINC000121580337 564375198 /nfs/dbraw/zinc/37/51/98/564375198.db2.gz HMEGRFANIWGXLE-AWEZNQCLSA-N 0 1 396.329 3.112 10 0 GGAEMN COc1c(Cl)cc(Cl)cc1CN1CCCN(Cc2cnn(C)c2)CC1 ZINC000121578075 564375451 /nfs/dbraw/zinc/37/54/51/564375451.db2.gz FXCJJODQWHISAG-UHFFFAOYSA-N 0 1 383.323 3.443 10 0 GGAEMN Cc1cc(Br)ccc1CN1CCCN(Cc2cnn(C)c2)CC1 ZINC000121596705 564376586 /nfs/dbraw/zinc/37/65/86/564376586.db2.gz FUZFRKHSTTULCK-UHFFFAOYSA-N 0 1 377.330 3.199 10 0 GGAEMN Brc1ccccc1-c1nnc(CN2CCCC[C@H]2c2nnc[nH]2)o1 ZINC000121636587 564378376 /nfs/dbraw/zinc/37/83/76/564378376.db2.gz UCNKUULAOUCLHR-ZDUSSCGKSA-N 0 1 389.257 3.344 10 0 GGAEMN COc1ccsc1S(=O)(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000121625991 564378797 /nfs/dbraw/zinc/37/87/97/564378797.db2.gz AAOUQLAZRFHZTF-IUODEOHRSA-N 0 1 386.564 3.180 10 0 GGAEMN O=C(CN1CCCC[C@@H]1c1nnc[nH]1)Nc1ccc(Br)cc1Cl ZINC000121671609 564380787 /nfs/dbraw/zinc/38/07/87/564380787.db2.gz VUXCNDJGVPQSNP-CYBMUJFWSA-N 0 1 398.692 3.386 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1coc(Br)c1 ZINC000030565360 564382055 /nfs/dbraw/zinc/38/20/55/564382055.db2.gz HXEIGNRATWJVNV-UHFFFAOYSA-N 0 1 378.270 3.355 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@@H]1c1nnc[nH]1 ZINC000121713370 564382584 /nfs/dbraw/zinc/38/25/84/564382584.db2.gz SZRHMZOGAPOOAH-CQSZACIVSA-N 0 1 378.274 3.041 10 0 GGAEMN COc1ccc(CN2CCCC[C@H]2c2nnc[nH]2)c(Br)c1OC ZINC000121741106 564384438 /nfs/dbraw/zinc/38/44/38/564384438.db2.gz HRACTYURZBWMHZ-LBPRGKRZSA-N 0 1 381.274 3.312 10 0 GGAEMN NC(=O)c1ccc(NS(=O)(=O)c2cccc(OC(F)(F)F)c2)cc1Cl ZINC000031720903 564391848 /nfs/dbraw/zinc/39/18/48/564391848.db2.gz ZHMDCMCFEDJFIG-UHFFFAOYSA-N 0 1 394.758 3.138 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)c(Cl)cc1F ZINC000121922317 564393477 /nfs/dbraw/zinc/39/34/77/564393477.db2.gz ZJUPNRPFUOBMQQ-UHFFFAOYSA-N 0 1 388.823 3.429 10 0 GGAEMN C[C@H](CC(=O)N1CC[C@H](CN2CCOCC2)C1)c1ccc(Br)cc1 ZINC000122295057 564407961 /nfs/dbraw/zinc/40/79/61/564407961.db2.gz WEALHKUQYJNIMU-HZPDHXFCSA-N 0 1 395.341 3.123 10 0 GGAEMN C[C@H](CC(=O)N1CC[C@@H](CN2CCOCC2)C1)c1ccc(Br)cc1 ZINC000122295494 564408088 /nfs/dbraw/zinc/40/80/88/564408088.db2.gz WEALHKUQYJNIMU-CVEARBPZSA-N 0 1 395.341 3.123 10 0 GGAEMN CCCCNC(=O)[C@@H]1CCCN(c2nc3ccc(Br)cc3[nH]2)C1 ZINC000033071324 564409524 /nfs/dbraw/zinc/40/95/24/564409524.db2.gz OVXGGJVWQQKRRV-GFCCVEGCSA-N 0 1 379.302 3.458 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@]3(C)CC3(Cl)Cl)cc2)C[C@H](C)O1 ZINC000040087464 564425356 /nfs/dbraw/zinc/42/53/56/564425356.db2.gz XWCNEOOMLOPCRM-IYOUNJFTSA-N 0 1 385.335 3.496 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)Nc1ccc(F)cn1 ZINC000123391737 564446833 /nfs/dbraw/zinc/44/68/33/564446833.db2.gz BFNDDWKRDZWSPU-UHFFFAOYSA-N 0 1 391.204 3.090 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)Nc1ccc(F)cn1 ZINC000123391737 564446837 /nfs/dbraw/zinc/44/68/37/564446837.db2.gz BFNDDWKRDZWSPU-UHFFFAOYSA-N 0 1 391.204 3.090 10 0 GGAEMN CNC(=O)c1ccc(CN[C@@H]2CCOc3ccc(Br)cc32)cc1 ZINC000123857713 564464413 /nfs/dbraw/zinc/46/44/13/564464413.db2.gz CBDNEETUNOOJNU-MRXNPFEDSA-N 0 1 375.266 3.422 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000124505313 564484802 /nfs/dbraw/zinc/48/48/02/564484802.db2.gz RPZGTIPTZASGBN-PWSUYJOCSA-N 0 1 380.261 3.479 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000124569654 564486017 /nfs/dbraw/zinc/48/60/17/564486017.db2.gz GELKHIHCKZNXQZ-ZUZCIYMTSA-N 0 1 393.285 3.235 10 0 GGAEMN Cn1c(=O)sc2cc(NS(=O)(=O)c3ccccc3Br)ccc21 ZINC000046017664 564493349 /nfs/dbraw/zinc/49/33/49/564493349.db2.gz NYLFZWOZDJKQKI-UHFFFAOYSA-N 0 1 399.291 3.163 10 0 GGAEMN C[C@@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CCC1 ZINC000125205129 564506807 /nfs/dbraw/zinc/50/68/07/564506807.db2.gz HWPUTWKMRSEFQP-SNVBAGLBSA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCC1 ZINC000125205129 564506809 /nfs/dbraw/zinc/50/68/09/564506809.db2.gz HWPUTWKMRSEFQP-SNVBAGLBSA-N 0 1 378.274 3.222 10 0 GGAEMN CC(C)(NC(=O)NCCCCN1CCOCC1)c1ccc(Br)cc1 ZINC000046750174 564507142 /nfs/dbraw/zinc/50/71/42/564507142.db2.gz FEVPZLJKMPWQKZ-UHFFFAOYSA-N 0 1 398.345 3.096 10 0 GGAEMN Cc1cccc(N2CCN(CCCNc3ncncc3Br)CC2)c1 ZINC000481680560 564520114 /nfs/dbraw/zinc/52/01/14/564520114.db2.gz ZUNNCCGGCLXCFH-UHFFFAOYSA-N 0 1 390.329 3.172 10 0 GGAEMN CNC(=O)c1ccc(CN(C)C(=O)c2cc(C)cc(Br)c2O)cc1 ZINC000047831150 564526742 /nfs/dbraw/zinc/52/67/42/564526742.db2.gz VJROZSUJAUZMPP-UHFFFAOYSA-N 0 1 391.265 3.095 10 0 GGAEMN Cc1cc(Br)c(O)c(C(=O)N(C)C[C@@H]2COc3ccccc3O2)c1 ZINC000047827670 564527340 /nfs/dbraw/zinc/52/73/40/564527340.db2.gz LQRBRVGFIIZOAN-GFCCVEGCSA-N 0 1 392.249 3.375 10 0 GGAEMN CN1CC[C@H](NC(=O)c2ccc(Oc3cccc(Br)c3)nc2)C1 ZINC000048275173 564535257 /nfs/dbraw/zinc/53/52/57/564535257.db2.gz IVTYPMBWAAEHTK-AWEZNQCLSA-N 0 1 376.254 3.070 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc(C3SCCCS3)cc2)CC1 ZINC000048427925 564539001 /nfs/dbraw/zinc/53/90/01/564539001.db2.gz MBEVVPZWPIZIPH-UHFFFAOYSA-N 0 1 380.579 3.350 10 0 GGAEMN COCCN1CCCN(C(=O)CSc2cc(Cl)ccc2Cl)CC1 ZINC000048426965 564539404 /nfs/dbraw/zinc/53/94/04/564539404.db2.gz PLJWTOAUDULGSI-UHFFFAOYSA-N 0 1 377.337 3.266 10 0 GGAEMN CN(C)[C@H](CNC(=O)NCc1cn2cc(Cl)ccc2n1)c1ccsc1 ZINC000048486219 564541419 /nfs/dbraw/zinc/54/14/19/564541419.db2.gz CYRQRNJHPPBQRD-OAHLLOKOSA-N 0 1 377.901 3.151 10 0 GGAEMN O=c1c(NS(=O)(=O)c2c(F)cccc2Cl)cccn1CC(F)(F)F ZINC000126262539 564542736 /nfs/dbraw/zinc/54/27/36/564542736.db2.gz CLSGUVUSMUXTKD-UHFFFAOYSA-N 0 1 384.738 3.004 10 0 GGAEMN O=C(Nc1ccc(Br)cc1)C1CCN(Cc2cncnc2)CC1 ZINC000126477418 564550729 /nfs/dbraw/zinc/55/07/29/564550729.db2.gz YNUFWWWMYQMTEK-UHFFFAOYSA-N 0 1 375.270 3.090 10 0 GGAEMN CN(C)C[C@@H](NC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000049379164 564551207 /nfs/dbraw/zinc/55/12/07/564551207.db2.gz NINKUNSKWXJCJN-MRXNPFEDSA-N 0 1 380.275 3.351 10 0 GGAEMN CN(C)C[C@@H](NC(=O)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000049379592 564551243 /nfs/dbraw/zinc/55/12/43/564551243.db2.gz PXNRPQPWRPCSGQ-OAHLLOKOSA-N 0 1 380.275 3.351 10 0 GGAEMN CN(C)C[C@@H](NC(=O)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000049379346 564551550 /nfs/dbraw/zinc/55/15/50/564551550.db2.gz NMPHIPHBTRNKDP-MRXNPFEDSA-N 0 1 380.275 3.351 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cnc(-c2ccccc2Cl)s1 ZINC000050581685 564558779 /nfs/dbraw/zinc/55/87/79/564558779.db2.gz INDSFRMNHIHLNZ-UHFFFAOYSA-N 0 1 379.913 3.306 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@H](C)c1ccc2ccccc2c1 ZINC000127049384 564571271 /nfs/dbraw/zinc/57/12/71/564571271.db2.gz RULLNHWHNPRFBF-LLVKDONJSA-N 0 1 376.459 3.122 10 0 GGAEMN Cc1cc(C(=O)N2[C@H](C)CN(C)C[C@@H]2C)c2ccc(Br)cc2n1 ZINC000127297712 564579869 /nfs/dbraw/zinc/57/98/69/564579869.db2.gz OXYJXTKKSSQMBW-BETUJISGSA-N 0 1 376.298 3.470 10 0 GGAEMN COc1cc(CN(C)Cc2ccc(Cl)cc2)cc(Cl)c1OCC(N)=O ZINC000127381248 564582522 /nfs/dbraw/zinc/58/25/22/564582522.db2.gz YXAYBQVDCMHPCW-UHFFFAOYSA-N 0 1 383.275 3.498 10 0 GGAEMN Cc1noc(C2CCN(C[C@H](O)COc3c(Cl)cccc3Cl)CC2)n1 ZINC000053640404 564591964 /nfs/dbraw/zinc/59/19/64/564591964.db2.gz YTFJAZCZMWAFCG-ZDUSSCGKSA-N 0 1 386.279 3.304 10 0 GGAEMN CC(C)COC1CCN(Cc2cc(=O)n3cc(Br)ccc3n2)CC1 ZINC000054322315 564603571 /nfs/dbraw/zinc/60/35/71/564603571.db2.gz LIGPECYDEUDSJZ-UHFFFAOYSA-N 0 1 394.313 3.094 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@H](C)c1ccc(CC(C)C)cc1 ZINC000128540121 564622108 /nfs/dbraw/zinc/62/21/08/564622108.db2.gz JFBHKWPCKDNCGF-GFCCVEGCSA-N 0 1 382.507 3.168 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc3nc(C)sc3c2)cc1 ZINC000055561065 564624232 /nfs/dbraw/zinc/62/42/32/564624232.db2.gz QLZUVGZGXKIGDL-UHFFFAOYSA-N 0 1 396.515 3.199 10 0 GGAEMN O=C(NCCCCN1CCOCC1)Nc1ccc(Br)cc1Cl ZINC000128707409 564626433 /nfs/dbraw/zinc/62/64/33/564626433.db2.gz NUSOFJDXDHEJJF-UHFFFAOYSA-N 0 1 390.709 3.336 10 0 GGAEMN Cc1ccc(Br)c(NC(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c1 ZINC000128996409 564635921 /nfs/dbraw/zinc/63/59/21/564635921.db2.gz ZQSSCBMXGXIRRR-AWEZNQCLSA-N 0 1 396.329 3.475 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(-c3nc(C)cc(=O)[nH]3)cc2)c(C)s1 ZINC000129115160 564638635 /nfs/dbraw/zinc/63/86/35/564638635.db2.gz AQSMLFWWTPNOJW-UHFFFAOYSA-N 0 1 375.475 3.224 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCc3[nH]c4c(cccc4Br)c3C2)C1 ZINC000056752743 564652436 /nfs/dbraw/zinc/65/24/36/564652436.db2.gz NJOORRPSJSPQQS-GFCCVEGCSA-N 0 1 391.313 3.092 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2cc(C)ccc2Br)CCN1CCOC ZINC000129656753 564656458 /nfs/dbraw/zinc/65/64/58/564656458.db2.gz ZJXHCIMPTYQYQR-AWEZNQCLSA-N 0 1 384.318 3.332 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc(Br)cc2OC(C)C)CC1 ZINC000057045130 564658819 /nfs/dbraw/zinc/65/88/19/564658819.db2.gz FVZRZWXABJZRGS-UHFFFAOYSA-N 0 1 399.329 3.031 10 0 GGAEMN O=C(Cc1csc(-c2ccc(Cl)s2)n1)NCCCCN1CCOCC1 ZINC000057431814 564667705 /nfs/dbraw/zinc/66/77/05/564667705.db2.gz GHDPTGUZKGKRIZ-UHFFFAOYSA-N 0 1 399.969 3.296 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(Br)s3)[nH]c21 ZINC000130055210 564668788 /nfs/dbraw/zinc/66/87/88/564668788.db2.gz BDIZXCCYWIAKCA-UHFFFAOYSA-N 0 1 386.296 3.174 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ccc(Br)o2)CC1 ZINC000057511935 564669793 /nfs/dbraw/zinc/66/97/93/564669793.db2.gz DCCSVAHNMSREFO-UHFFFAOYSA-N 0 1 378.270 3.436 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3cc(C)ccc3Br)CCO2)n[nH]1 ZINC000130134179 564670858 /nfs/dbraw/zinc/67/08/58/564670858.db2.gz VMAXILSRCLPEER-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN O=C(Nc1ccccc1Br)C1CCN(Cc2cncnc2)CC1 ZINC000130204525 564673581 /nfs/dbraw/zinc/67/35/81/564673581.db2.gz PKTPTTSPJRTPME-UHFFFAOYSA-N 0 1 375.270 3.090 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)C3(c4ccc(Br)cc4)CC3)cc21 ZINC000130356335 564678633 /nfs/dbraw/zinc/67/86/33/564678633.db2.gz YEFUXJMMUJXUEI-UHFFFAOYSA-N 0 1 399.248 3.095 10 0 GGAEMN Brc1ccc(N2CCN(Cc3cccc(-n4cccn4)c3)CC2)nc1 ZINC000130375904 564679552 /nfs/dbraw/zinc/67/95/52/564679552.db2.gz ULPVJDWLKMIEGA-UHFFFAOYSA-N 0 1 398.308 3.352 10 0 GGAEMN O=S(=O)(Nc1cc(F)c(F)c(F)c1)c1cc2c(cc1Cl)OCCO2 ZINC000130455881 564681690 /nfs/dbraw/zinc/68/16/90/564681690.db2.gz CVDOYEPSPOMTJP-UHFFFAOYSA-N 0 1 379.743 3.329 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2cc(Br)c[nH]2)CC1 ZINC000061438642 564706168 /nfs/dbraw/zinc/70/61/68/564706168.db2.gz YZNMCXKWPHVKEZ-UHFFFAOYSA-N 0 1 377.286 3.171 10 0 GGAEMN Cc1nncn1-c1cccc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)c1 ZINC000131500705 564713872 /nfs/dbraw/zinc/71/38/72/564713872.db2.gz JWEUFGJUXYQYIF-UHFFFAOYSA-N 0 1 380.832 3.477 10 0 GGAEMN Cn1c2ccc(Cl)cc2[nH]c1=NC(=O)c1n[nH]c(C2CC2)c1Br ZINC000064091410 564726507 /nfs/dbraw/zinc/72/65/07/564726507.db2.gz XZUDMDORRKBFFQ-UHFFFAOYSA-N 0 1 394.660 3.264 10 0 GGAEMN CC(=O)c1ccc(NS(=O)(=O)c2cc(-c3noc(C)n3)sc2C)cc1 ZINC000064844559 564735504 /nfs/dbraw/zinc/73/55/04/564735504.db2.gz NHBPXOVKZGVMJO-UHFFFAOYSA-N 0 1 377.447 3.418 10 0 GGAEMN O=c1ccc(-c2csc(S(=O)(=O)Nc3ccc(Cl)cc3F)c2)n[nH]1 ZINC000065119389 564740453 /nfs/dbraw/zinc/74/04/53/564740453.db2.gz SZOHRGJHXDVUDY-UHFFFAOYSA-N 0 1 385.829 3.092 10 0 GGAEMN Cc1noc(C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)n1 ZINC000132626832 564748799 /nfs/dbraw/zinc/74/87/99/564748799.db2.gz UEAOCFZXELLAMH-UHFFFAOYSA-N 0 1 376.258 3.396 10 0 GGAEMN Cc1noc([C@@H]2CCCN(Cc3nc4ccc(Br)cc4[nH]3)C2)n1 ZINC000132625805 564748950 /nfs/dbraw/zinc/74/89/50/564748950.db2.gz DTJAIILGZPIJGR-LLVKDONJSA-N 0 1 376.258 3.396 10 0 GGAEMN CCc1ccc(S(=O)(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)s1 ZINC000065972452 564753167 /nfs/dbraw/zinc/75/31/67/564753167.db2.gz KOEFVEDHZYUFOR-UHFFFAOYSA-N 0 1 388.505 3.341 10 0 GGAEMN C[NH+](C)C[C@@H](Cc1ccccc1)NC(=O)c1ccc(Br)c([O-])c1 ZINC000133227593 564766672 /nfs/dbraw/zinc/76/66/72/564766672.db2.gz GKQVEIVXTXPPTF-OAHLLOKOSA-N 0 1 377.282 3.057 10 0 GGAEMN CS(=O)(=O)c1cccc(OCCSc2nc(-c3ccccc3)n[nH]2)c1 ZINC000133245985 564767493 /nfs/dbraw/zinc/76/74/93/564767493.db2.gz HLXXMEKCUKCQFB-UHFFFAOYSA-N 0 1 375.475 3.046 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1 ZINC000066588376 564770122 /nfs/dbraw/zinc/77/01/22/564770122.db2.gz IFDOTKAAUXPQAU-UHFFFAOYSA-N 0 1 395.836 3.131 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@@H](C)NCc2cccc(Br)c2)c1 ZINC000067010476 564781242 /nfs/dbraw/zinc/78/12/42/564781242.db2.gz OZZBURXRILDIND-GFCCVEGCSA-N 0 1 383.311 3.208 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCO[C@@H](c2ccccc2Br)C1 ZINC000134220839 564796539 /nfs/dbraw/zinc/79/65/39/564796539.db2.gz JVPGRNJMHGOUFD-YVEFUNNKSA-N 0 1 390.281 3.192 10 0 GGAEMN Cn1ccnc1[C@H](O)[C@H]1CCCN(C(=O)c2c(O)cc(Cl)cc2Cl)C1 ZINC000134331803 564800298 /nfs/dbraw/zinc/80/02/98/564800298.db2.gz IMENGQZHRFESPZ-ZUZCIYMTSA-N 0 1 384.263 3.018 10 0 GGAEMN O=C(NCCCc1ccc(Br)cc1F)[C@H]1CCCc2[nH]ncc21 ZINC000134364324 564801064 /nfs/dbraw/zinc/80/10/64/564801064.db2.gz WLOVHOGNBVXTGJ-ZDUSSCGKSA-N 0 1 380.261 3.480 10 0 GGAEMN OCC[C@]1(CNCc2csc(COc3ccc(Cl)cc3)n2)CCOC1 ZINC000134426383 564802898 /nfs/dbraw/zinc/80/28/98/564802898.db2.gz IKRYUECCWUETIL-GOSISDBHSA-N 0 1 382.913 3.254 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc(Cl)cn1 ZINC000134766638 564814535 /nfs/dbraw/zinc/81/45/35/564814535.db2.gz CAFPFIDZFTZFRO-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc(Cl)cn1 ZINC000134766638 564814537 /nfs/dbraw/zinc/81/45/37/564814537.db2.gz CAFPFIDZFTZFRO-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN Cc1nn(CCS(C)(=O)=O)c(C)c1[C@H](C)N[C@@H]1CCCc2sccc21 ZINC000134965616 564820535 /nfs/dbraw/zinc/82/05/35/564820535.db2.gz NWXONNBYYKNETP-BLLLJJGKSA-N 0 1 381.567 3.334 10 0 GGAEMN CN1CC[C@H](CNC(=O)NCc2cscn2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135285028 564827045 /nfs/dbraw/zinc/82/70/45/564827045.db2.gz HGTOPAAJZIARNK-WBMJQRKESA-N 0 1 382.892 3.428 10 0 GGAEMN COc1cc(CN[C@@]2(CO)CCc3ccccc32)cc(Br)c1O ZINC000135899198 564841707 /nfs/dbraw/zinc/84/17/07/564841707.db2.gz YGTWSLPGBYXCRO-GOSISDBHSA-N 0 1 378.266 3.087 10 0 GGAEMN C[C@@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1nnc2ccccn21 ZINC000070869437 564852210 /nfs/dbraw/zinc/85/22/10/564852210.db2.gz APGGXUAUCBOGQD-VXGBXAGGSA-N 0 1 381.263 3.127 10 0 GGAEMN CCCCN(CCCc1nc(-c2cccs2)no1)[C@@H]1CCS(=O)(=O)C1 ZINC000071089656 564855209 /nfs/dbraw/zinc/85/52/09/564855209.db2.gz NFPNXIXELFBQDA-CQSZACIVSA-N 0 1 383.539 3.020 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1Br ZINC000136889604 564856587 /nfs/dbraw/zinc/85/65/87/564856587.db2.gz KLCJHIXLHWOUIM-CMPLNLGQSA-N 0 1 395.301 3.481 10 0 GGAEMN COC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1 ZINC000072031544 564860217 /nfs/dbraw/zinc/86/02/17/564860217.db2.gz AUIAKKDABPQYNW-UHFFFAOYSA-N 0 1 377.315 3.432 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cc(F)c(F)c(F)c2)cc1Cl ZINC000137543082 564863156 /nfs/dbraw/zinc/86/31/56/564863156.db2.gz XSAURSQPLYLYLV-UHFFFAOYSA-N 0 1 379.743 3.345 10 0 GGAEMN C[C@@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(Br)cc1Br ZINC000084063654 564869316 /nfs/dbraw/zinc/86/93/16/564869316.db2.gz BQGABDJVAXDGMB-KOLCDFICSA-N 0 1 390.119 3.483 10 0 GGAEMN COCCNC(=O)[C@@H]1CC[C@@H](C)N(CCOc2c(Cl)cccc2Cl)C1 ZINC000144338566 564877700 /nfs/dbraw/zinc/87/77/00/564877700.db2.gz XXPRJCNMOLEDIU-ZIAGYGMSSA-N 0 1 389.323 3.235 10 0 GGAEMN CC(C)Cc1ncc(CN2CCN(CCCOCC(F)(F)F)CC2)s1 ZINC000092505512 564878885 /nfs/dbraw/zinc/87/88/85/564878885.db2.gz JVURRVSEDPGZSC-UHFFFAOYSA-N 0 1 379.492 3.428 10 0 GGAEMN O=C(CNCc1ccc(OC(F)F)c(Br)c1)NCc1ccco1 ZINC000092560511 564878906 /nfs/dbraw/zinc/87/89/06/564878906.db2.gz QTIPUOFWRPIFMI-UHFFFAOYSA-N 0 1 389.196 3.050 10 0 GGAEMN Cc1nc(C[C@H]2CCCN(CCOc3ccccc3Br)C2)no1 ZINC000093789536 564888784 /nfs/dbraw/zinc/88/87/84/564888784.db2.gz OSBUWIKCDKNFOJ-CQSZACIVSA-N 0 1 380.286 3.474 10 0 GGAEMN CCn1cnnc1C1CCN(CCOc2ccccc2Br)CC1 ZINC000093790738 564890130 /nfs/dbraw/zinc/89/01/30/564890130.db2.gz OKGHGJZPRDQITR-UHFFFAOYSA-N 0 1 379.302 3.319 10 0 GGAEMN CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(C)[nH]nc3c2)cc1Cl ZINC000093909430 564893147 /nfs/dbraw/zinc/89/31/47/564893147.db2.gz CZXLYIVDWCCSML-UHFFFAOYSA-N 0 1 378.841 3.284 10 0 GGAEMN C[C@H]1CN2CCCC[C@@H]2CN1C(=O)c1csc(I)c1 ZINC000096658525 564903273 /nfs/dbraw/zinc/90/32/73/564903273.db2.gz IFUKBNLXCJNFEE-CMPLNLGQSA-N 0 1 390.290 3.052 10 0 GGAEMN C[C@@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)cc1Br ZINC000097996895 564911173 /nfs/dbraw/zinc/91/11/73/564911173.db2.gz MCLNXQFCCWIQIU-ZYHUDNBSSA-N 0 1 392.135 3.193 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000101563212 564917637 /nfs/dbraw/zinc/91/76/37/564917637.db2.gz NMGDLKKGEDSELS-GJZGRUSLSA-N 0 1 389.323 3.114 10 0 GGAEMN CC(C)(O)CN1CCN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000151746516 564934926 /nfs/dbraw/zinc/93/49/26/564934926.db2.gz BRNQZHMKQMKOAT-HNNXBMFYSA-N 0 1 386.323 3.079 10 0 GGAEMN COc1cccc(CS(=O)(=O)c2nc3cc(Br)c(C)[nH]c-3n2)c1 ZINC000152029856 564944761 /nfs/dbraw/zinc/94/47/61/564944761.db2.gz YKEOLKVICYACSD-UHFFFAOYSA-N 0 1 396.266 3.011 10 0 GGAEMN Cc1[nH]c2nc(S(=O)(=O)CCc3ccccc3)nc-2cc1Br ZINC000152034407 564945241 /nfs/dbraw/zinc/94/52/41/564945241.db2.gz UCBCPUOJLGZMTL-UHFFFAOYSA-N 0 1 380.267 3.045 10 0 GGAEMN Cc1nc([C@H](NC(=O)Cc2cccc(Br)c2)c2ccccc2)n[nH]1 ZINC000103280449 564945303 /nfs/dbraw/zinc/94/53/03/564945303.db2.gz JIQQVHTXZKNKQE-QGZVFWFLSA-N 0 1 385.265 3.324 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3ccc(SC)c(Cl)c3)CCO2)n[nH]1 ZINC000152058050 564945852 /nfs/dbraw/zinc/94/58/52/564945852.db2.gz QQXGITBKENEXSS-LBPRGKRZSA-N 0 1 381.889 3.348 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000103286443 564945889 /nfs/dbraw/zinc/94/58/89/564945889.db2.gz TWOSBBIRZDDXBZ-OAHLLOKOSA-N 0 1 378.270 3.334 10 0 GGAEMN Cc1nc([C@H](NC(=O)Cc2ccccc2Br)c2ccccc2)n[nH]1 ZINC000104404631 564954764 /nfs/dbraw/zinc/95/47/64/564954764.db2.gz UNYUGPYPIAZTAH-QGZVFWFLSA-N 0 1 385.265 3.324 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Cc2ccccc2Br)c2ccccc2)n[nH]1 ZINC000104404636 564954805 /nfs/dbraw/zinc/95/48/05/564954805.db2.gz UNYUGPYPIAZTAH-KRWDZBQOSA-N 0 1 385.265 3.324 10 0 GGAEMN COc1ccccc1CCN(C)[C@@H](C(N)=O)c1ccc(Br)cc1 ZINC000104711353 564958269 /nfs/dbraw/zinc/95/82/69/564958269.db2.gz BTMVPZSRXDTKEY-QGZVFWFLSA-N 0 1 377.282 3.159 10 0 GGAEMN COc1cc(Br)c(NC(=O)N2CCN3CCCC[C@H]3C2)cc1OC ZINC000105015537 564962812 /nfs/dbraw/zinc/96/28/12/564962812.db2.gz LPGRCBOVXPXHCE-LBPRGKRZSA-N 0 1 398.301 3.168 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)Nc2ccc(Br)cc2C(C)C)CC1 ZINC000152787436 564971554 /nfs/dbraw/zinc/97/15/54/564971554.db2.gz UQWUPYLCLOVMQF-HNNXBMFYSA-N 0 1 398.345 3.493 10 0 GGAEMN CC[C@H]1CN([C@@H](C)C(=O)Nc2cc(Cl)ccc2Cl)CCN1CCOC ZINC000106116231 564977866 /nfs/dbraw/zinc/97/78/66/564977866.db2.gz WAUZWBDTVRSMPT-ZFWWWQNUSA-N 0 1 388.339 3.363 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2ccc(Cl)c(Cl)c2)C[C@@H]1CC ZINC000106119330 564978516 /nfs/dbraw/zinc/97/85/16/564978516.db2.gz UEQMLTFELBLJCW-HNNXBMFYSA-N 0 1 388.339 3.365 10 0 GGAEMN CCn1cc(CN2CCCN(Cc3ccc(Br)cc3)CC2)cn1 ZINC000106158452 564979491 /nfs/dbraw/zinc/97/94/91/564979491.db2.gz YKACHRQDXXUUNO-UHFFFAOYSA-N 0 1 377.330 3.373 10 0 GGAEMN C[C@@H](C(=O)Nc1cccc(Br)c1)N1CCC(Cn2cccn2)CC1 ZINC000106184394 564980740 /nfs/dbraw/zinc/98/07/40/564980740.db2.gz KSBSYLQUQYLBFP-AWEZNQCLSA-N 0 1 391.313 3.385 10 0 GGAEMN C[C@@H](NC(=O)N[C@@H](C)CN1CCN(C)CC1)c1c(Cl)ccc(F)c1Cl ZINC000106539698 564984676 /nfs/dbraw/zinc/98/46/76/564984676.db2.gz MVCQQFSOSLFRIY-NWDGAFQWSA-N 0 1 391.318 3.129 10 0 GGAEMN CCN(CC(=O)N1CCC[C@H]1c1ccc(I)cc1)C1CC1 ZINC000153165292 564986855 /nfs/dbraw/zinc/98/68/55/564986855.db2.gz MTTQBHZIBRLWFN-INIZCTEOSA-N 0 1 398.288 3.439 10 0 GGAEMN COc1cc([C@@H](C)NCCNS(=O)(=O)c2cccc(Cl)c2)ccc1F ZINC000153312698 564991075 /nfs/dbraw/zinc/99/10/75/564991075.db2.gz DUIRRYOICYSWSG-GFCCVEGCSA-N 0 1 386.876 3.117 10 0 GGAEMN CC(C)(C)OC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000153292010 564991328 /nfs/dbraw/zinc/99/13/28/564991328.db2.gz LRVKIKRXAYGMOH-MRXNPFEDSA-N 0 1 389.367 3.330 10 0 GGAEMN COc1ccc(CNC(=O)[C@@H](Cc2ccccc2)N(C)C)cc1Br ZINC000106914922 564991888 /nfs/dbraw/zinc/99/18/88/564991888.db2.gz LXVMUYDAEMBWCC-QGZVFWFLSA-N 0 1 391.309 3.247 10 0 GGAEMN C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000153836826 565013274 /nfs/dbraw/zinc/01/32/74/565013274.db2.gz VNZIUCZQZKPEGN-CMPLNLGQSA-N 0 1 382.835 3.216 10 0 GGAEMN Brc1ccc(-c2nccc(CN3CCC(n4cncn4)CC3)n2)cc1 ZINC000153836925 565013398 /nfs/dbraw/zinc/01/33/98/565013398.db2.gz FQEPWEXBLUFATN-UHFFFAOYSA-N 0 1 399.296 3.335 10 0 GGAEMN COC(=O)[C@@H]1CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000153930591 565017828 /nfs/dbraw/zinc/01/78/28/565017828.db2.gz ARJXPKHTKWRRKI-CQSZACIVSA-N 0 1 390.281 3.291 10 0 GGAEMN C[C@@H](CC(=O)N1CCN(C2CCOCC2)CC1)c1ccc(Br)cc1 ZINC000154146480 565028166 /nfs/dbraw/zinc/02/81/66/565028166.db2.gz JNSRMMFJJKAXIW-HNNXBMFYSA-N 0 1 395.341 3.266 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H](C(=O)OC)c1cccc(Br)c1 ZINC000154677902 565048913 /nfs/dbraw/zinc/04/89/13/565048913.db2.gz LPDQWTQQQPJSJW-LLVKDONJSA-N 0 1 386.271 3.163 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C ZINC000154697970 565049553 /nfs/dbraw/zinc/04/95/53/565049553.db2.gz ODDTWDNRIZBJDX-ZYHUDNBSSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Br)c(Cl)c2)CCN1C ZINC000154696896 565049793 /nfs/dbraw/zinc/04/97/93/565049793.db2.gz MUABOXVIZRWDLW-MNOVXSKESA-N 0 1 395.750 3.206 10 0 GGAEMN CCc1c(NC(=O)[C@@H]2C[C@@H]2C(=O)OC)[nH]nc1-c1ccc(Br)cc1 ZINC000111148502 565050899 /nfs/dbraw/zinc/05/08/99/565050899.db2.gz SQCCFNYKGNECQB-OLZOCXBDSA-N 0 1 392.253 3.149 10 0 GGAEMN Brc1ccc(-c2nc(CNc3ccc4nccnc4n3)n[nH]2)cc1 ZINC000112079585 565059417 /nfs/dbraw/zinc/05/94/17/565059417.db2.gz WJQJXXKGAXJBAT-UHFFFAOYSA-N 0 1 382.225 3.185 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNc3ccc4nccnc4n3)n2)cc1 ZINC000112079585 565059419 /nfs/dbraw/zinc/05/94/19/565059419.db2.gz WJQJXXKGAXJBAT-UHFFFAOYSA-N 0 1 382.225 3.185 10 0 GGAEMN C[C@@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(C)(C)C ZINC000112462187 565063845 /nfs/dbraw/zinc/06/38/45/565063845.db2.gz UQCFVUIIBVIOOA-SNVBAGLBSA-N 0 1 380.290 3.468 10 0 GGAEMN C[C@@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(C)(C)C ZINC000112462187 565063846 /nfs/dbraw/zinc/06/38/46/565063846.db2.gz UQCFVUIIBVIOOA-SNVBAGLBSA-N 0 1 380.290 3.468 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3csc(I)c3)[nH]c21 ZINC000155253373 565065163 /nfs/dbraw/zinc/06/51/63/565065163.db2.gz ZGZGYKHQVSAOBS-UHFFFAOYSA-N 0 1 397.241 3.467 10 0 GGAEMN CCCn1nccc1NC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 ZINC000112633729 565065229 /nfs/dbraw/zinc/06/52/29/565065229.db2.gz ZOKZEZTUVNIPFX-UHFFFAOYSA-N 0 1 375.226 3.149 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)CNC(=O)c3ccc(Br)cc3)ccc12 ZINC000155573515 565069304 /nfs/dbraw/zinc/06/93/04/565069304.db2.gz RSIVBCKCXXRYLA-UHFFFAOYSA-N 0 1 387.237 3.002 10 0 GGAEMN C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000113305300 565069326 /nfs/dbraw/zinc/06/93/26/565069326.db2.gz UJYVVFCJSWPYIP-ZYHUDNBSSA-N 0 1 382.835 3.216 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)CN1CCCC[C@@H]1c1cn[nH]c1 ZINC000114483191 565074716 /nfs/dbraw/zinc/07/47/16/565074716.db2.gz WJIYOWPRNHXPGG-DOTOQJQBSA-N 0 1 380.286 3.139 10 0 GGAEMN Cc1cc(NC(=O)[C@H](C)N[C@@H](CO)c2ccccc2)ccc1Br ZINC000183626252 565083142 /nfs/dbraw/zinc/08/31/42/565083142.db2.gz MKCQHRXJHUEUNF-GUYCJALGSA-N 0 1 377.282 3.408 10 0 GGAEMN C[C@H](CN[C@H](c1ccco1)c1ccc(Br)cc1)N1CCOCC1 ZINC000183692460 565088856 /nfs/dbraw/zinc/08/88/56/565088856.db2.gz UIIILEDAMJWQAZ-KDOFPFPSSA-N 0 1 379.298 3.442 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCc2c(Br)ccc(F)c2C1 ZINC000183771014 565094895 /nfs/dbraw/zinc/09/48/95/565094895.db2.gz VXAGCYYWTFBJLI-LLVKDONJSA-N 0 1 378.245 3.316 10 0 GGAEMN OC[C@H](CNCc1cn(-c2ccc(Cl)c(Cl)c2)nn1)c1ccccc1 ZINC000183867132 565100233 /nfs/dbraw/zinc/10/02/33/565100233.db2.gz KKNICWBDIJWSDY-AWEZNQCLSA-N 0 1 377.275 3.440 10 0 GGAEMN CCc1nc([C@@H]2CN(C[C@@H](C)c3cccc(Br)c3)CCO2)n[nH]1 ZINC000156714184 565102158 /nfs/dbraw/zinc/10/21/58/565102158.db2.gz HFQPATXGOPCGCA-DOMZBBRYSA-N 0 1 379.302 3.307 10 0 GGAEMN CCc1nc([C@H]2CN(C[C@@H](C)c3cccc(Br)c3)CCO2)n[nH]1 ZINC000156714317 565102734 /nfs/dbraw/zinc/10/27/34/565102734.db2.gz HFQPATXGOPCGCA-IUODEOHRSA-N 0 1 379.302 3.307 10 0 GGAEMN Cc1nc(C(F)(F)F)c(CS(=O)(=O)Cc2n[nH]c(C(C)(C)C)n2)s1 ZINC000292412560 565114042 /nfs/dbraw/zinc/11/40/42/565114042.db2.gz JZSUFTSEPDEJOF-UHFFFAOYSA-N 0 1 382.433 3.001 10 0 GGAEMN COc1ccc(OC)c([C@H]2CCCN2C(=O)CSc2n[nH]c(=S)s2)c1 ZINC000369968008 565120735 /nfs/dbraw/zinc/12/07/35/565120735.db2.gz VPEXHMNHSOWCCG-GFCCVEGCSA-N 0 1 397.547 3.300 10 0 GGAEMN Cc1nccn1-c1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cn1 ZINC000370013306 565121860 /nfs/dbraw/zinc/12/18/60/565121860.db2.gz YPRZNWRURMMLAS-UHFFFAOYSA-N 0 1 397.236 3.467 10 0 GGAEMN CO[C@H](C)c1nc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cs1 ZINC000267725874 565128492 /nfs/dbraw/zinc/12/84/92/565128492.db2.gz LTJCANQLJBLNDI-MRVPVSSYSA-N 0 1 395.282 3.419 10 0 GGAEMN O=C(N[C@H]1CCc2c1cccc2Br)N1CCC[C@@H](c2nc[nH]n2)C1 ZINC000370112637 565129288 /nfs/dbraw/zinc/12/92/88/565129288.db2.gz PIIYUPYYNYXVSR-ABAIWWIYSA-N 0 1 390.285 3.144 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Br)c(Cl)c2)CCN1C[C@@H](C)O ZINC000157613452 565138783 /nfs/dbraw/zinc/13/87/83/565138783.db2.gz UBNMJJJWNJMNTF-DGCLKSJQSA-N 0 1 389.721 3.020 10 0 GGAEMN COc1ccc(Cl)c(S(=O)(=O)N[C@H](c2nccs2)C(F)(F)F)c1 ZINC000292892240 565141225 /nfs/dbraw/zinc/14/12/25/565141225.db2.gz VGGCZAZOKQOCGN-SNVBAGLBSA-N 0 1 386.804 3.387 10 0 GGAEMN O=C(Nc1ccc(F)cc1I)[C@H]1CCCc2[nH]ncc21 ZINC000268142823 565142268 /nfs/dbraw/zinc/14/22/68/565142268.db2.gz JKDJGZDVMRNJJV-VIFPVBQESA-N 0 1 385.180 3.212 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1ccc(F)cc1I ZINC000184557654 565144241 /nfs/dbraw/zinc/14/42/41/565144241.db2.gz OXKJHEGKGMNTMG-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1ccc(F)cc1I ZINC000184557654 565144246 /nfs/dbraw/zinc/14/42/46/565144246.db2.gz OXKJHEGKGMNTMG-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN CN(C)C(=O)C1CCN(Cc2cc(Br)cc3cccnc32)CC1 ZINC000268277500 565145592 /nfs/dbraw/zinc/14/55/92/565145592.db2.gz AAUWMFZNUHYWSD-UHFFFAOYSA-N 0 1 376.298 3.298 10 0 GGAEMN O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184589721 565146553 /nfs/dbraw/zinc/14/65/53/565146553.db2.gz NEXNGAKIUXKADS-GFCCVEGCSA-N 0 1 377.857 3.167 10 0 GGAEMN O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184589721 565146557 /nfs/dbraw/zinc/14/65/57/565146557.db2.gz NEXNGAKIUXKADS-GFCCVEGCSA-N 0 1 377.857 3.167 10 0 GGAEMN CO[C@@H]1CC[C@H]2OCCN(CCC(=O)Nc3cccc(Br)c3)[C@@H]2C1 ZINC000157904414 565148515 /nfs/dbraw/zinc/14/85/15/565148515.db2.gz XDGHEFYRFBJDRY-BRWVUGGUSA-N 0 1 397.313 3.046 10 0 GGAEMN Cc1cc(CN2CCC(C(=O)Nc3ccccc3Br)CC2)ncn1 ZINC000293156589 565153792 /nfs/dbraw/zinc/15/37/92/565153792.db2.gz MRJMZEBVPVXQBX-UHFFFAOYSA-N 0 1 389.297 3.398 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)N[C@@H]2CCc3nc[nH]c3C2)cc1Br ZINC000370672132 565155412 /nfs/dbraw/zinc/15/54/12/565155412.db2.gz BOAHKJFUOOTNBT-ZYHUDNBSSA-N 0 1 393.285 3.099 10 0 GGAEMN Cc1cc(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)ncn1 ZINC000293321461 565162102 /nfs/dbraw/zinc/16/21/02/565162102.db2.gz WEIUNVQPSXZIKT-UHFFFAOYSA-N 0 1 389.297 3.398 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC2(c3cccc(Br)c3)CC2)n[nH]1 ZINC000158303365 565164732 /nfs/dbraw/zinc/16/47/32/565164732.db2.gz DCFBNFBLMPKVQN-NSHDSACASA-N 0 1 377.286 3.400 10 0 GGAEMN O=C(c1ccccc1)N1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000184933208 565166202 /nfs/dbraw/zinc/16/62/02/565166202.db2.gz QFHSVYZISMCZQX-UHFFFAOYSA-N 0 1 399.292 3.283 10 0 GGAEMN Brc1ccc2nc(CN3CCN(c4nccs4)CC3)[nH]c2c1 ZINC000184937322 565166716 /nfs/dbraw/zinc/16/67/16/565166716.db2.gz HMLGSNRVVPIVCH-UHFFFAOYSA-N 0 1 378.299 3.104 10 0 GGAEMN O=C(C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1)N1CCCC1 ZINC000158358905 565167417 /nfs/dbraw/zinc/16/74/17/565167417.db2.gz RWUYFHFTGWSCKO-UHFFFAOYSA-N 0 1 391.313 3.160 10 0 GGAEMN Cc1csc(N2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)n1 ZINC000184947436 565168042 /nfs/dbraw/zinc/16/80/42/565168042.db2.gz AXLJUMYQCMPLEG-UHFFFAOYSA-N 0 1 392.326 3.413 10 0 GGAEMN Cc1noc(C2CCN(C[C@](C)(O)c3ccc(Br)cc3F)CC2)n1 ZINC000293617714 565177919 /nfs/dbraw/zinc/17/79/19/565177919.db2.gz VYKZJLTZPOPLLG-KRWDZBQOSA-N 0 1 398.276 3.367 10 0 GGAEMN CCc1nc(CN2CCC[C@@H]2c2ccc(I)cc2)n[nH]1 ZINC000158752949 565180265 /nfs/dbraw/zinc/18/02/65/565180265.db2.gz WKBVRZQVQBAUEW-CYBMUJFWSA-N 0 1 382.249 3.309 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)[C@H](O)c2c(Cl)cccc2Cl)n[nH]1 ZINC000269324475 565185885 /nfs/dbraw/zinc/18/58/85/565185885.db2.gz MPUPUILKWLOFEW-ZXLZKYRFSA-N 0 1 385.295 3.377 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)[C@@H](O)c2c(Cl)cccc2Cl)n[nH]1 ZINC000269324469 565186011 /nfs/dbraw/zinc/18/60/11/565186011.db2.gz MPUPUILKWLOFEW-KJRLAJNESA-N 0 1 385.295 3.377 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000371362440 565188264 /nfs/dbraw/zinc/18/82/64/565188264.db2.gz WDTDAFFWGGPQSQ-JQWIXIFHSA-N 0 1 380.261 3.164 10 0 GGAEMN C[C@H](Sc1ccc(Br)cc1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000371358678 565188342 /nfs/dbraw/zinc/18/83/42/565188342.db2.gz CKBJYJHGFBROHN-JQWIXIFHSA-N 0 1 380.311 3.327 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1cccs1 ZINC000269381882 565188426 /nfs/dbraw/zinc/18/84/26/565188426.db2.gz VKTJHIZILWPVOE-HUUCEWRRSA-N 0 1 383.583 3.095 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000371361581 565189039 /nfs/dbraw/zinc/18/90/39/565189039.db2.gz RYABXFTWFXYQIP-JTQLQIEISA-N 0 1 376.247 3.190 10 0 GGAEMN CCCNC(=O)[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159047551 565192782 /nfs/dbraw/zinc/19/27/82/565192782.db2.gz JTJKLSDHETUWQP-GFCCVEGCSA-N 0 1 379.302 3.064 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000371454328 565193486 /nfs/dbraw/zinc/19/34/86/565193486.db2.gz GOGRQJJSEQBEGW-NSHDSACASA-N 0 1 376.247 3.190 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1ccsc1 ZINC000269555897 565194250 /nfs/dbraw/zinc/19/42/50/565194250.db2.gz ZEPWOGPJBHVFOM-CVEARBPZSA-N 0 1 383.583 3.095 10 0 GGAEMN CCn1cnnc1[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159129484 565195686 /nfs/dbraw/zinc/19/56/86/565195686.db2.gz PTFFTVYYYKFGTQ-LBPRGKRZSA-N 0 1 389.301 3.316 10 0 GGAEMN CC(C)C[C@@H](CO)N(C)CC(=O)Nc1ccc(Br)cc1Cl ZINC000185335188 565196247 /nfs/dbraw/zinc/19/62/47/565196247.db2.gz QDDHYBDRRIWQNA-LBPRGKRZSA-N 0 1 377.710 3.380 10 0 GGAEMN CCCC(=O)NC[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159161825 565196995 /nfs/dbraw/zinc/19/69/95/565196995.db2.gz MJMJJVFWOUNZPS-ZDUSSCGKSA-N 0 1 393.329 3.454 10 0 GGAEMN O=C(NC[C@H](O)CN1CCc2ccccc2C1)c1cc(Cl)sc1Cl ZINC000159151156 565197077 /nfs/dbraw/zinc/19/70/77/565197077.db2.gz MTRJQZUOQXOSDH-ZDUSSCGKSA-N 0 1 385.316 3.204 10 0 GGAEMN O=C(NC[C@H](O)CN1CCc2ccccc2C1)c1cccc(Cl)c1Cl ZINC000159191441 565198210 /nfs/dbraw/zinc/19/82/10/565198210.db2.gz GPTNTKLEULQIMK-HNNXBMFYSA-N 0 1 379.287 3.142 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1ccc(Br)cc1F ZINC000371562054 565199832 /nfs/dbraw/zinc/19/98/32/565199832.db2.gz KTNCFPJRFYECQK-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN COc1ccc(Br)c(C(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)c1 ZINC000371564272 565199982 /nfs/dbraw/zinc/19/99/82/565199982.db2.gz ZRGQEEHGMUCLQF-OAHLLOKOSA-N 0 1 387.237 3.095 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(F)cc(Br)c1 ZINC000371554355 565200161 /nfs/dbraw/zinc/20/01/61/565200161.db2.gz RDIHPGMAIXFFJX-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN Brc1ccc2nc(CSc3nnnn3Cc3ccco3)[nH]c2c1 ZINC000185508105 565205376 /nfs/dbraw/zinc/20/53/76/565205376.db2.gz NCCOETKGQSVXAX-UHFFFAOYSA-N 0 1 391.254 3.246 10 0 GGAEMN O[C@@H](COC1CCOCC1)CN1CCC[C@@H]1c1ccc(Br)s1 ZINC000371715971 565207358 /nfs/dbraw/zinc/20/73/58/565207358.db2.gz MFJZYUHRZNVZDZ-TZMCWYRMSA-N 0 1 390.343 3.204 10 0 GGAEMN CN(Cc1cnc(-c2ccccc2)[nH]1)[C@@H](C(N)=O)c1cccc(Br)c1 ZINC000185577970 565209923 /nfs/dbraw/zinc/20/99/23/565209923.db2.gz GHDQIRNTEJXVED-QGZVFWFLSA-N 0 1 399.292 3.498 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000371840258 565211763 /nfs/dbraw/zinc/21/17/63/565211763.db2.gz GAWSEOSBMLRNPJ-HUUCEWRRSA-N 0 1 377.231 3.051 10 0 GGAEMN O=C(Cc1ccc(Br)c(F)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000371840829 565212189 /nfs/dbraw/zinc/21/21/89/565212189.db2.gz MDDPBPXXJBJKKP-MRXNPFEDSA-N 0 1 389.228 3.155 10 0 GGAEMN Cc1cc(Br)ccc1CC(=O)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000371875293 565212612 /nfs/dbraw/zinc/21/26/12/565212612.db2.gz AHMRRPCJFUCVQT-KRWDZBQOSA-N 0 1 385.265 3.324 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCc2ccccc2[C@H]1CO ZINC000185686370 565215799 /nfs/dbraw/zinc/21/57/99/565215799.db2.gz VEJJZQKVCHNPMW-MRXNPFEDSA-N 0 1 386.249 3.057 10 0 GGAEMN COc1ccc(OC[C@H](O)CN2CCc3ccccc3C2)c(Br)c1 ZINC000185690783 565216722 /nfs/dbraw/zinc/21/67/22/565216722.db2.gz LKSUTTASMMHUML-MRXNPFEDSA-N 0 1 392.293 3.256 10 0 GGAEMN CC(C)[C@@]1(CO)CCCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000294625213 565219850 /nfs/dbraw/zinc/21/98/50/565219850.db2.gz HFYKTSGNUBXBGF-KRWDZBQOSA-N 0 1 380.286 3.196 10 0 GGAEMN Oc1ccc(Br)c(CNCc2n[nH]c(COc3ccccc3)n2)c1 ZINC000185754778 565219945 /nfs/dbraw/zinc/21/99/45/565219945.db2.gz AGZIQAPFNZXCLS-UHFFFAOYSA-N 0 1 389.253 3.142 10 0 GGAEMN CC(C)[C@]1(CO)CCCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000294625216 565220281 /nfs/dbraw/zinc/22/02/81/565220281.db2.gz HFYKTSGNUBXBGF-QGZVFWFLSA-N 0 1 380.286 3.196 10 0 GGAEMN Brc1csc(CNCc2n[nH]c(COc3ccccc3)n2)c1 ZINC000185756035 565220304 /nfs/dbraw/zinc/22/03/04/565220304.db2.gz NTMOALKRQDPCNT-UHFFFAOYSA-N 0 1 379.283 3.498 10 0 GGAEMN COC(=O)c1c(C)oc(C)c1S(=O)(=O)N[C@H](C1CCCC1)C(F)(F)F ZINC000185807857 565222218 /nfs/dbraw/zinc/22/22/18/565222218.db2.gz YLIGENKZKQFYIA-CYBMUJFWSA-N 0 1 383.388 3.082 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCc2cc3cc(Br)ccc3[nH]2)n[nH]1 ZINC000185880372 565225929 /nfs/dbraw/zinc/22/59/29/565225929.db2.gz GEXLWORQVCMJBR-JTQLQIEISA-N 0 1 390.285 3.392 10 0 GGAEMN CC[C@H](C)NC(=O)CCN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186133685 565242021 /nfs/dbraw/zinc/24/20/21/565242021.db2.gz XAAFJNBULMCKIH-SCLBCKFNSA-N 0 1 391.313 3.223 10 0 GGAEMN CC[C@@H](C)NC(=O)CCN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186133668 565242130 /nfs/dbraw/zinc/24/21/30/565242130.db2.gz XAAFJNBULMCKIH-FZKQIMNGSA-N 0 1 391.313 3.223 10 0 GGAEMN C[C@@H](NCc1coc(-c2ccc(I)cc2)n1)[C@H](C)CO ZINC000295071400 565243463 /nfs/dbraw/zinc/24/34/63/565243463.db2.gz AHXXSEGIKLTKSS-GHMZBOCLSA-N 0 1 386.233 3.053 10 0 GGAEMN OCCCSCCN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186179044 565244941 /nfs/dbraw/zinc/24/49/41/565244941.db2.gz JZDFVZIAMNGLNL-INIZCTEOSA-N 0 1 382.327 3.034 10 0 GGAEMN CC(C)(C)c1ccc(S(=O)(=O)N[C@H](c2nnc[nH]2)c2ccccc2)s1 ZINC000372602554 565246186 /nfs/dbraw/zinc/24/61/86/565246186.db2.gz XBEYSIDGWVHDGP-HNNXBMFYSA-N 0 1 376.507 3.232 10 0 GGAEMN O=C(NCc1cc(Br)cs1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000372614686 565247578 /nfs/dbraw/zinc/24/75/78/565247578.db2.gz YBLPGQQQHBSZOJ-CYBMUJFWSA-N 0 1 392.282 3.218 10 0 GGAEMN CC1(C)C[C@H]1NC(=O)c1c[nH]c2ccc(I)cc2c1=O ZINC000271334231 565248268 /nfs/dbraw/zinc/24/82/68/565248268.db2.gz SDGGKPZVHCBNHG-GFCCVEGCSA-N 0 1 382.201 3.073 10 0 GGAEMN Cc1nn(C)c(C)c1S(=O)(=O)Nc1ncc(C2CCC2)cc1Br ZINC000295193529 565250242 /nfs/dbraw/zinc/25/02/42/565250242.db2.gz LMTDCDBDJOIHDM-UHFFFAOYSA-N 0 1 399.314 3.263 10 0 GGAEMN COC1(CN[C@H](c2ccc(Br)cc2)c2cncnc2)CCOCC1 ZINC000186293462 565253288 /nfs/dbraw/zinc/25/32/88/565253288.db2.gz TXESFDLCKGVNHK-QGZVFWFLSA-N 0 1 392.297 3.114 10 0 GGAEMN CCNC(=O)C(C)(C)CN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186348379 565257404 /nfs/dbraw/zinc/25/74/04/565257404.db2.gz JDVUZDHEAAPALT-INIZCTEOSA-N 0 1 391.313 3.080 10 0 GGAEMN O=S(=O)(N[C@H](c1nnc[nH]1)c1ccccc1)c1cccc(Cl)c1Cl ZINC000372876393 565258962 /nfs/dbraw/zinc/25/89/62/565258962.db2.gz ICSBRVDPOVVAPA-AWEZNQCLSA-N 0 1 383.260 3.179 10 0 GGAEMN O=S(=O)(N[C@@H](c1nnc[nH]1)c1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000372877864 565259314 /nfs/dbraw/zinc/25/93/14/565259314.db2.gz LVWSGXMIIKJWOO-CQSZACIVSA-N 0 1 383.260 3.179 10 0 GGAEMN COc1cc(Br)c(CN[C@@H](c2nnc[nH]2)c2ccccc2)cc1O ZINC000372919538 565260311 /nfs/dbraw/zinc/26/03/11/565260311.db2.gz CPPIRPKCQDZKNL-MRXNPFEDSA-N 0 1 389.253 3.161 10 0 GGAEMN COC(=O)c1cc(NC(=O)N[C@@H]2CCCc3cn[nH]c32)ccc1Br ZINC000271755670 565267287 /nfs/dbraw/zinc/26/72/87/565267287.db2.gz YOSUTCLNQULQJJ-CYBMUJFWSA-N 0 1 393.241 3.158 10 0 GGAEMN COc1cc(I)ccc1NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000295511979 565270149 /nfs/dbraw/zinc/27/01/49/565270149.db2.gz QAIONTLCXQBNJF-JTQLQIEISA-N 0 1 397.216 3.082 10 0 GGAEMN C[C@@H]1CN(c2ccc(CNCc3cncc(Br)c3)cn2)C[C@@H](C)O1 ZINC000186590432 565271367 /nfs/dbraw/zinc/27/13/67/565271367.db2.gz GRHSRFQIPIGOBX-ZIAGYGMSSA-N 0 1 391.313 3.143 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000186621224 565272200 /nfs/dbraw/zinc/27/22/00/565272200.db2.gz RKIIYYXOYVHSPB-UHFFFAOYSA-N 0 1 387.307 3.324 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)CSc2cc(Cl)ccc2Cl)CC1 ZINC000186626800 565273625 /nfs/dbraw/zinc/27/36/25/565273625.db2.gz KQXGQWDWJJEJOT-UHFFFAOYSA-N 0 1 391.320 3.093 10 0 GGAEMN Cc1cc(NC(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)cnc1Br ZINC000373339968 565280546 /nfs/dbraw/zinc/28/05/46/565280546.db2.gz NSOWGAHOINQQID-CYBMUJFWSA-N 0 1 387.241 3.182 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@H]1CCCC1=O ZINC000272218632 565281654 /nfs/dbraw/zinc/28/16/54/565281654.db2.gz SUBODPDLTUTCFW-BXUZGUMPSA-N 0 1 376.254 3.299 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H]1[C@H]1CCCC1=O ZINC000272218637 565281958 /nfs/dbraw/zinc/28/19/58/565281958.db2.gz SUBODPDLTUTCFW-RISCZKNCSA-N 0 1 376.254 3.299 10 0 GGAEMN CCC1(CC)CN(C(=O)c2cc(-c3ccc(Cl)cc3)[nH]n2)CC[S@@]1=O ZINC000186764382 565283918 /nfs/dbraw/zinc/28/39/18/565283918.db2.gz BDTBJMHSDLSWKP-VWLOTQADSA-N 0 1 379.913 3.493 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOc2c(Br)cccc2C1 ZINC000373414910 565284285 /nfs/dbraw/zinc/28/42/85/565284285.db2.gz BHYZCTZCPMLUNG-LBPRGKRZSA-N 0 1 376.254 3.013 10 0 GGAEMN Cc1n[nH]c(C)c1[C@@H]1COCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000373458476 565286932 /nfs/dbraw/zinc/28/69/32/565286932.db2.gz GVPVJLBWDRLARZ-HNNXBMFYSA-N 0 1 390.285 3.239 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)[C@H](C)CC(=O)c2cccc(Br)c2)n[nH]1 ZINC000161698421 565291201 /nfs/dbraw/zinc/29/12/01/565291201.db2.gz RARQMBYENZKXAX-VXGBXAGGSA-N 0 1 392.297 3.437 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2cnn(-c3ccc(Br)cc3)c2)n[nH]1 ZINC000161778422 565292727 /nfs/dbraw/zinc/29/27/27/565292727.db2.gz VHJRQWAQCRJWEL-LLVKDONJSA-N 0 1 388.269 3.027 10 0 GGAEMN C[C@H](CC(=O)N1CCN(CC(C)(C)O)C[C@@H]1C)c1ccc(Br)cc1 ZINC000186898676 565294058 /nfs/dbraw/zinc/29/40/58/565294058.db2.gz KJRCAAIEVLYURT-CABCVRRESA-N 0 1 397.357 3.246 10 0 GGAEMN C[C@H](CC(=O)N1CCN(CC(C)(C)O)C[C@H]1C)c1ccc(Br)cc1 ZINC000186898656 565294280 /nfs/dbraw/zinc/29/42/80/565294280.db2.gz KJRCAAIEVLYURT-HUUCEWRRSA-N 0 1 397.357 3.246 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)CSc2ncnc3sc(C)c(C)c32)n[nH]1 ZINC000161869812 565296661 /nfs/dbraw/zinc/29/66/61/565296661.db2.gz QMXDPTGIPVBCAO-SECBINFHSA-N 0 1 375.523 3.179 10 0 GGAEMN C[C@H](N[C@H]1CCCN(c2ncccn2)C1)c1ncc(Br)cc1F ZINC000187023956 565302409 /nfs/dbraw/zinc/30/24/09/565302409.db2.gz RGTXICGEHJZEEJ-AAEUAGOBSA-N 0 1 380.265 3.093 10 0 GGAEMN C[C@@H](N[C@@H]1CCCN(c2ncccn2)C1)c1ncc(Br)cc1F ZINC000187023940 565302931 /nfs/dbraw/zinc/30/29/31/565302931.db2.gz RGTXICGEHJZEEJ-DGCLKSJQSA-N 0 1 380.265 3.093 10 0 GGAEMN CC[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@]2(CCOC2)O1 ZINC000373802989 565304548 /nfs/dbraw/zinc/30/45/48/565304548.db2.gz BYGGAEMWVCIAOZ-GUYCJALGSA-N 0 1 380.286 3.095 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCOc3c(Br)cccc3C2)n[nH]1 ZINC000373836968 565305125 /nfs/dbraw/zinc/30/51/25/565305125.db2.gz OZNCEEHHBVPYAZ-LLVKDONJSA-N 0 1 393.285 3.016 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCOc3c(Br)cccc3C2)n[nH]1 ZINC000373836971 565305317 /nfs/dbraw/zinc/30/53/17/565305317.db2.gz OZNCEEHHBVPYAZ-NSHDSACASA-N 0 1 393.285 3.016 10 0 GGAEMN CCOc1cccc(CCN[C@H](C(N)=O)c2cccc(Br)c2)c1 ZINC000162289326 565311714 /nfs/dbraw/zinc/31/17/14/565311714.db2.gz MRFLMMZBVBMCLB-KRWDZBQOSA-N 0 1 377.282 3.207 10 0 GGAEMN CC(C)(C)OC(=O)[C@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000187132819 565312383 /nfs/dbraw/zinc/31/23/83/565312383.db2.gz RAGOPDQPIYOCIL-NSHDSACASA-N 0 1 380.286 3.489 10 0 GGAEMN CC(C)(C)OC(=O)[C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000187132805 565312446 /nfs/dbraw/zinc/31/24/46/565312446.db2.gz RAGOPDQPIYOCIL-LLVKDONJSA-N 0 1 380.286 3.489 10 0 GGAEMN Cc1cccnc1CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000296339347 565314094 /nfs/dbraw/zinc/31/40/94/565314094.db2.gz HTVVIRUWVABYHR-LLVKDONJSA-N 0 1 388.320 3.238 10 0 GGAEMN COc1c(Br)cccc1CN[C@H](Cc1ccccc1)C(=O)N(C)C ZINC000187227401 565317395 /nfs/dbraw/zinc/31/73/95/565317395.db2.gz LDHOZRJBQKNQDQ-QGZVFWFLSA-N 0 1 391.309 3.247 10 0 GGAEMN C[C@@H](N[C@H]1CCCN(c2cnn(C)c2)C1)c1ncc(Br)cc1F ZINC000187248804 565319024 /nfs/dbraw/zinc/31/90/24/565319024.db2.gz PMCSKMMOPUBWQC-YPMHNXCESA-N 0 1 382.281 3.036 10 0 GGAEMN C[C@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1ncc(Br)cc1F ZINC000187248751 565319062 /nfs/dbraw/zinc/31/90/62/565319062.db2.gz PMCSKMMOPUBWQC-WCQYABFASA-N 0 1 382.281 3.036 10 0 GGAEMN CN1C(=O)CCc2cc(CN[C@@H](CO)c3cccc(Br)c3)ccc21 ZINC000187306181 565321714 /nfs/dbraw/zinc/32/17/14/565321714.db2.gz QTQJDSVOBBZFEH-KRWDZBQOSA-N 0 1 389.293 3.181 10 0 GGAEMN OC[C@@]1(NCc2nc3ccc(Br)cc3[nH]2)CCOc2ccccc21 ZINC000374134248 565321883 /nfs/dbraw/zinc/32/18/83/565321883.db2.gz AHOOPKSBKGMSAR-SFHVURJKSA-N 0 1 388.265 3.085 10 0 GGAEMN CC(C)c1nc2n(n1)C[C@H](N[C@H](C)c1ncc(Br)cc1F)CC2 ZINC000187329004 565323814 /nfs/dbraw/zinc/32/38/14/565323814.db2.gz DDTYCTJBYZDUAQ-ZYHUDNBSSA-N 0 1 382.281 3.364 10 0 GGAEMN C[C@H](N[C@@H]1CCCN(c2cccnn2)C1)c1ncc(Br)cc1F ZINC000187344551 565325212 /nfs/dbraw/zinc/32/52/12/565325212.db2.gz JOYVKTBAXQXIJP-WCQYABFASA-N 0 1 380.265 3.093 10 0 GGAEMN CCS(=O)(=O)c1c(Cl)cccc1CNCCCc1c(C)nn(C)c1C ZINC000187352391 565326262 /nfs/dbraw/zinc/32/62/62/565326262.db2.gz NBJOCTHFMDSPFG-UHFFFAOYSA-N 0 1 383.945 3.206 10 0 GGAEMN O=C(Nc1cccnc1-n1cccn1)c1cc(Br)cc2nc[nH]c21 ZINC000374300324 565331021 /nfs/dbraw/zinc/33/10/21/565331021.db2.gz CWKAYWPKCOGSKB-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@@H](c1nccs1)C(F)(F)F)c1cccs1 ZINC000296723872 565331906 /nfs/dbraw/zinc/33/19/06/565331906.db2.gz BUILROWWTFSXNI-ONGXEEELSA-N 0 1 378.445 3.410 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(Br)c(F)c1 ZINC000162954183 565332783 /nfs/dbraw/zinc/33/27/83/565332783.db2.gz UQEOWQXMLLNRNC-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN CC(C)c1nnc2n1C[C@H](N[C@@H](C)c1ncc(Br)cc1F)CC2 ZINC000187446242 565333574 /nfs/dbraw/zinc/33/35/74/565333574.db2.gz QAPNNZPSUJWOCX-CMPLNLGQSA-N 0 1 382.281 3.364 10 0 GGAEMN CSc1cccc(NC(=O)CN[C@H](C)c2ccc(S(C)(=O)=O)cc2)c1 ZINC000163129676 565337893 /nfs/dbraw/zinc/33/78/93/565337893.db2.gz XJXKYWNVAWEJRU-CYBMUJFWSA-N 0 1 378.519 3.101 10 0 GGAEMN CC(C)n1cc(Br)cc1-c1nc([C@@H]2CN3CCC[C@@H]3CO2)no1 ZINC000273853027 565339863 /nfs/dbraw/zinc/33/98/63/565339863.db2.gz CISFHVHUJOHYJF-OCCSQVGLSA-N 0 1 381.274 3.417 10 0 GGAEMN Cc1ccc(I)c(C(=O)N[C@H]2CCCc3cn[nH]c32)c1 ZINC000374459165 565340383 /nfs/dbraw/zinc/34/03/83/565340383.db2.gz BRVHUUAEVSPJSX-ZDUSSCGKSA-N 0 1 381.217 3.130 10 0 GGAEMN O=S(=O)(c1cc(Cl)cc(C(F)(F)F)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000187594899 565344105 /nfs/dbraw/zinc/34/41/05/565344105.db2.gz QLFBIMGOSMESRY-GFCCVEGCSA-N 0 1 394.806 3.393 10 0 GGAEMN CC[C@H]1CN(C(=O)CCCc2ccccc2Br)CC[N@H+]1C[C@@H](C)O ZINC000163404204 565345521 /nfs/dbraw/zinc/34/55/21/565345521.db2.gz IQCYOADFJLSANE-WBVHZDCISA-N 0 1 397.357 3.075 10 0 GGAEMN CC[C@H]1CN(C(=O)CCCc2ccccc2Br)CCN1C[C@@H](C)O ZINC000163404204 565345524 /nfs/dbraw/zinc/34/55/24/565345524.db2.gz IQCYOADFJLSANE-WBVHZDCISA-N 0 1 397.357 3.075 10 0 GGAEMN O=C(NCc1ccsc1Br)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000374668801 565349311 /nfs/dbraw/zinc/34/93/11/565349311.db2.gz JOTUPRNRJLVMKU-LBPRGKRZSA-N 0 1 392.282 3.218 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1c(F)cccc1Br ZINC000163719233 565350859 /nfs/dbraw/zinc/35/08/59/565350859.db2.gz COMYCCLYNJPFRE-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN CS(=O)(=O)N1CC[C@H](CN2CCc3sccc3[C@@H]2c2cccs2)C1 ZINC000374774543 565354694 /nfs/dbraw/zinc/35/46/94/565354694.db2.gz BFRFWKQDHDWBNU-CXAGYDPISA-N 0 1 382.576 3.039 10 0 GGAEMN C[C@H]1CC[C@](CO)(N(C)Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000187938418 565363974 /nfs/dbraw/zinc/36/39/74/565363974.db2.gz KUUJYQHROCLIHL-SJCJKPOMSA-N 0 1 380.286 3.482 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)N[C@H](C)c3cc(Cl)ccc3Cl)CCO2)n[nH]1 ZINC000187946640 565365563 /nfs/dbraw/zinc/36/55/63/565365563.db2.gz IWTLTGKJWQRSKJ-OTYXRUKQSA-N 0 1 384.267 3.264 10 0 GGAEMN C[C@H]1CC[C@@](CO)(N(C)CC(=O)Nc2c(F)cc(F)cc2Br)C1 ZINC000187994843 565369920 /nfs/dbraw/zinc/36/99/20/565369920.db2.gz VYYCGUWSZPKZPU-MGPLVRAMSA-N 0 1 391.256 3.149 10 0 GGAEMN C[C@H]1CC[C@](CO)(N(C)CC(=O)Nc2c(F)cc(F)cc2Br)C1 ZINC000187994885 565369958 /nfs/dbraw/zinc/36/99/58/565369958.db2.gz VYYCGUWSZPKZPU-QFYYESIMSA-N 0 1 391.256 3.149 10 0 GGAEMN C[C@@H]1CC[C@](CO)(N(C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1 ZINC000188021720 565372054 /nfs/dbraw/zinc/37/20/54/565372054.db2.gz KRICNTFGPKTEAM-DIFFPNOSSA-N 0 1 376.831 3.363 10 0 GGAEMN Cc1cc(C[C@H](C)NCc2ncc(Br)cc2Br)n[nH]1 ZINC000274826033 565383476 /nfs/dbraw/zinc/38/34/76/565383476.db2.gz IEARZJVCVVLATM-QMMMGPOBSA-N 0 1 388.107 3.359 10 0 GGAEMN Cc1cc(C[C@H](C)NCc2ncc(Br)cc2Br)[nH]n1 ZINC000274826033 565383481 /nfs/dbraw/zinc/38/34/81/565383481.db2.gz IEARZJVCVVLATM-QMMMGPOBSA-N 0 1 388.107 3.359 10 0 GGAEMN O=C([C@H]1CCc2[nH]nnc2C1)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000375489331 565392219 /nfs/dbraw/zinc/39/22/19/565392219.db2.gz YDTVTLOALYSEKG-MGPLVRAMSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@H]1CCc2nn[nH]c2C1)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000375489331 565392224 /nfs/dbraw/zinc/39/22/24/565392224.db2.gz YDTVTLOALYSEKG-MGPLVRAMSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C(COc1ccc(C2SCCCS2)cc1)N1CCN2CCC1CC2 ZINC000375496242 565392467 /nfs/dbraw/zinc/39/24/67/565392467.db2.gz MBXGKZDEFUTTQM-UHFFFAOYSA-N 0 1 378.563 3.241 10 0 GGAEMN CCOc1cc(CN2CCC[C@@H](c3nc(C)n[nH]3)C2)cc(Br)c1O ZINC000297931579 565392885 /nfs/dbraw/zinc/39/28/85/565392885.db2.gz UPEPSFJSTGXNBR-CYBMUJFWSA-N 0 1 395.301 3.360 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CC1)N1CCO[C@H]2CCCC[C@@H]21 ZINC000170871915 565397283 /nfs/dbraw/zinc/39/72/83/565397283.db2.gz ZECSVOKQSWZAQH-IRXDYDNUSA-N 0 1 393.325 3.198 10 0 GGAEMN Brc1ccc(CN[C@@H]2CCCc3n[nH]cc32)c(N2CCOCC2)c1 ZINC000375791499 565406225 /nfs/dbraw/zinc/40/62/25/565406225.db2.gz OHXQHUMJVGJJMK-MRXNPFEDSA-N 0 1 391.313 3.176 10 0 GGAEMN Brc1ccc(CN[C@H]2CCCc3n[nH]cc32)c(N2CCOCC2)c1 ZINC000375791496 565406904 /nfs/dbraw/zinc/40/69/04/565406904.db2.gz OHXQHUMJVGJJMK-INIZCTEOSA-N 0 1 391.313 3.176 10 0 GGAEMN CC1(C)CC(=O)c2cc(NC(=O)CSc3n[nH]c(=S)s3)ccc2O1 ZINC000375924362 565413570 /nfs/dbraw/zinc/41/35/70/565413570.db2.gz HZLYHYDSJDZXAX-UHFFFAOYSA-N 0 1 381.504 3.301 10 0 GGAEMN C[C@H](CC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1)c1ccc(Br)cc1 ZINC000188638538 565413776 /nfs/dbraw/zinc/41/37/76/565413776.db2.gz ZIXHWRMUQVDUOS-HUUCEWRRSA-N 0 1 397.357 3.246 10 0 GGAEMN C[C@H](CC(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1)c1ccc(Br)cc1 ZINC000188638563 565414424 /nfs/dbraw/zinc/41/44/24/565414424.db2.gz ZIXHWRMUQVDUOS-CABCVRRESA-N 0 1 397.357 3.246 10 0 GGAEMN O=C(c1ccc(Br)cc1C(F)(F)F)N1CCN2CCC1CC2 ZINC000188644156 565415123 /nfs/dbraw/zinc/41/51/23/565415123.db2.gz INXCOCTVLWLAHH-UHFFFAOYSA-N 0 1 377.204 3.388 10 0 GGAEMN O=C(c1cc(Br)cc(C(F)(F)F)c1)N1CCN2CCC1CC2 ZINC000188651074 565415243 /nfs/dbraw/zinc/41/52/43/565415243.db2.gz OVCRRZDXWWOZGL-UHFFFAOYSA-N 0 1 377.204 3.388 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)N1CCC(c2cn[nH]c2C)CC1 ZINC000375980148 565416322 /nfs/dbraw/zinc/41/63/22/565416322.db2.gz NCYFUCRGPIJIFI-UHFFFAOYSA-N 0 1 392.297 3.438 10 0 GGAEMN CCCCO[C@H](C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171222141 565418900 /nfs/dbraw/zinc/41/89/00/565418900.db2.gz XEIJSSVXMQWSLV-LLVKDONJSA-N 0 1 381.274 3.056 10 0 GGAEMN CCCCO[C@H](C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171222141 565418907 /nfs/dbraw/zinc/41/89/07/565418907.db2.gz XEIJSSVXMQWSLV-LLVKDONJSA-N 0 1 381.274 3.056 10 0 GGAEMN Cc1ccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C)n1 ZINC000171223905 565419077 /nfs/dbraw/zinc/41/90/77/565419077.db2.gz COSRRGIBUIDDER-UHFFFAOYSA-N 0 1 386.253 3.176 10 0 GGAEMN Cc1ccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)n1 ZINC000171223905 565419082 /nfs/dbraw/zinc/41/90/82/565419082.db2.gz COSRRGIBUIDDER-UHFFFAOYSA-N 0 1 386.253 3.176 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc(F)ccc1F ZINC000171223293 565419243 /nfs/dbraw/zinc/41/92/43/565419243.db2.gz VUFJUDUIUACIPH-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc(F)ccc1F ZINC000171223293 565419249 /nfs/dbraw/zinc/41/92/49/565419249.db2.gz VUFJUDUIUACIPH-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(CCc1ccccc1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223809 565419554 /nfs/dbraw/zinc/41/95/54/565419554.db2.gz GLIIKGUZEVTWBY-UHFFFAOYSA-N 0 1 385.265 3.483 10 0 GGAEMN O=C(CCc1ccccc1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223809 565419560 /nfs/dbraw/zinc/41/95/60/565419560.db2.gz GLIIKGUZEVTWBY-UHFFFAOYSA-N 0 1 385.265 3.483 10 0 GGAEMN Cc1ccc(CC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1 ZINC000171223252 565419615 /nfs/dbraw/zinc/41/96/15/565419615.db2.gz CBYUGBUQMXAQHX-UHFFFAOYSA-N 0 1 385.265 3.402 10 0 GGAEMN Cc1ccc(CC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1 ZINC000171223252 565419621 /nfs/dbraw/zinc/41/96/21/565419621.db2.gz CBYUGBUQMXAQHX-UHFFFAOYSA-N 0 1 385.265 3.402 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1[nH]nc2ccccc21 ZINC000171223485 565419775 /nfs/dbraw/zinc/41/97/75/565419775.db2.gz JUVRDZDDWPMYDA-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN COCCN1CCCN(C(=O)CCCc2ccc(Br)s2)CC1 ZINC000298597847 565423059 /nfs/dbraw/zinc/42/30/59/565423059.db2.gz RNJFKSWZFWGGIS-UHFFFAOYSA-N 0 1 389.359 3.014 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1S(=O)(=O)Nc1ccnn1[C@@H](C)C1CC1 ZINC000171341609 565427419 /nfs/dbraw/zinc/42/74/19/565427419.db2.gz OSTVLCQKZGZUSH-JTQLQIEISA-N 0 1 383.857 3.095 10 0 GGAEMN CN(CC(=O)Nc1ccc(Br)cc1Cl)[C@H]1CC[C@H](O)CC1 ZINC000275814289 565427966 /nfs/dbraw/zinc/42/79/66/565427966.db2.gz GONDZCRYCCVTDW-HAQNSBGRSA-N 0 1 375.694 3.276 10 0 GGAEMN O=C1[C@H](NCc2cc(Br)c(Cl)s2)CCN1C1CCOCC1 ZINC000376455312 565437143 /nfs/dbraw/zinc/43/71/43/565437143.db2.gz PXJGMDJSUJGSSW-GFCCVEGCSA-N 0 1 393.734 3.034 10 0 GGAEMN CN(C)[C@@H](Cc1ccccc1)C(=O)NCc1ccc(F)cc1Br ZINC000171612621 565439365 /nfs/dbraw/zinc/43/93/65/565439365.db2.gz QUILYQBXAUEXTR-KRWDZBQOSA-N 0 1 379.273 3.377 10 0 GGAEMN COc1ccc(Br)cc1CNC(=O)[C@@H](Cc1ccccc1)N(C)C ZINC000171615323 565439506 /nfs/dbraw/zinc/43/95/06/565439506.db2.gz LJGVBQUXEOZCBE-QGZVFWFLSA-N 0 1 391.309 3.247 10 0 GGAEMN CN(C)[C@H](Cc1ccccc1)C(=O)NCc1cc(F)ccc1Br ZINC000171674550 565444167 /nfs/dbraw/zinc/44/41/67/565444167.db2.gz NNWLBIMZQDLOGZ-QGZVFWFLSA-N 0 1 379.273 3.377 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)CCCCc1cn[nH]n1 ZINC000189138754 565445881 /nfs/dbraw/zinc/44/58/81/565445881.db2.gz DKYQNHQHQNPREU-LLVKDONJSA-N 0 1 381.274 3.166 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)CCSc1nnc(C)[nH]1 ZINC000189144673 565447273 /nfs/dbraw/zinc/44/72/73/565447273.db2.gz LVVSDHOVJDHTOK-VIFPVBQESA-N 0 1 399.314 3.244 10 0 GGAEMN CC(C)c1noc(CCCNC(=O)c2n[nH]c3ccc(Br)cc32)n1 ZINC000171773314 565450428 /nfs/dbraw/zinc/45/04/28/565450428.db2.gz WESPJMHZLZSGDH-UHFFFAOYSA-N 0 1 392.257 3.194 10 0 GGAEMN O=C(c1n[nH]c2ccc(Br)cc21)N1CCN(C2CCCC2)CC1 ZINC000171795703 565450913 /nfs/dbraw/zinc/45/09/13/565450913.db2.gz ZCZNGFXLULAVOS-UHFFFAOYSA-N 0 1 377.286 3.026 10 0 GGAEMN CCOC(=O)[C@@H](CC)N(C(=O)c1[nH]nc2ccc(Br)cc21)C1CC1 ZINC000189199954 565451798 /nfs/dbraw/zinc/45/17/98/565451798.db2.gz NUJQANJKVFGUEP-CQSZACIVSA-N 0 1 394.269 3.272 10 0 GGAEMN Cc1nc(C2(NC(=O)c3n[nH]c4ccc(Br)cc43)CCCC2)no1 ZINC000171796848 565451911 /nfs/dbraw/zinc/45/19/11/565451911.db2.gz FGMZUJRZQVPUNT-UHFFFAOYSA-N 0 1 390.241 3.216 10 0 GGAEMN CCN(Cc1ccccc1Br)C(=O)NCCCCN1CCOCC1 ZINC000299473144 565452316 /nfs/dbraw/zinc/45/23/16/565452316.db2.gz WCFFAMNVBUIOEW-UHFFFAOYSA-N 0 1 398.345 3.093 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)Nc1ccccc1 ZINC000171822824 565452955 /nfs/dbraw/zinc/45/29/55/565452955.db2.gz ZVYFVPCWLWCPHK-JTQLQIEISA-N 0 1 387.237 3.082 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc(Br)cc(Br)c1 ZINC000376802528 565455672 /nfs/dbraw/zinc/45/56/72/565455672.db2.gz BGQGYOQKAYQTSZ-NSHDSACASA-N 0 1 399.086 3.222 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)[C@@H](Cc1ccccc1)N(C)C ZINC000189290894 565456658 /nfs/dbraw/zinc/45/66/58/565456658.db2.gz XNBVTNVJWJGNHS-QGZVFWFLSA-N 0 1 391.309 3.247 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)c2cc(Cl)cc(F)c2Br)[nH][nH]1 ZINC000376839795 565456735 /nfs/dbraw/zinc/45/67/35/565456735.db2.gz UDRUORXOJYKYOS-UHFFFAOYSA-N 0 1 398.623 3.039 10 0 GGAEMN CCc1c(NS(=O)(=O)c2ccnn2CC)cnn1-c1ccc(Cl)cc1 ZINC000276779766 565459993 /nfs/dbraw/zinc/45/99/93/565459993.db2.gz BTVUILDDBZZQKK-UHFFFAOYSA-N 0 1 379.873 3.105 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(Br)c(F)cc1F ZINC000376984163 565461922 /nfs/dbraw/zinc/46/19/22/565461922.db2.gz ZXMWUBSVKDTLOZ-CQSZACIVSA-N 0 1 393.191 3.365 10 0 GGAEMN CCc1nc([C@@H]2CN(Cc3ccc(Br)c(Cl)c3)CCO2)n[nH]1 ZINC000189449936 565466621 /nfs/dbraw/zinc/46/66/21/565466621.db2.gz BSQILCDXHNHIOS-ZDUSSCGKSA-N 0 1 385.693 3.357 10 0 GGAEMN Cn1ncc(NC[C@@H]2CCCCN2Cc2ccccc2)c(Br)c1=O ZINC000301222775 565473235 /nfs/dbraw/zinc/47/32/35/565473235.db2.gz CSHFXPPOZWMENN-HNNXBMFYSA-N 0 1 391.313 3.009 10 0 GGAEMN CC(C)CN1CCO[C@H](CNc2ncnc3ccc(Br)cc32)C1 ZINC000301238285 565474520 /nfs/dbraw/zinc/47/45/20/565474520.db2.gz FCLMQONGGCHPNX-CQSZACIVSA-N 0 1 379.302 3.161 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cccc(Cl)c2Br)CCN1C ZINC000277135216 565477657 /nfs/dbraw/zinc/47/76/57/565477657.db2.gz ZCJWJRXNJHFRLV-WDEREUQCSA-N 0 1 395.750 3.206 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCC[C@@H]1c1ncon1 ZINC000172376600 565482398 /nfs/dbraw/zinc/48/23/98/565482398.db2.gz AIAQQHGAHJEPCQ-GFCCVEGCSA-N 0 1 376.214 3.076 10 0 GGAEMN Cc1cc(Br)ccc1CC(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000189795345 565488298 /nfs/dbraw/zinc/48/82/98/565488298.db2.gz XCZKFUGKOMIYJJ-UHFFFAOYSA-N 0 1 399.292 3.444 10 0 GGAEMN O[C@H](COC[C@H]1CCCO1)CN1CCC(c2ccccc2Br)CC1 ZINC000189807331 565489365 /nfs/dbraw/zinc/48/93/65/565489365.db2.gz NLKJVWQSFZYTEO-DLBZAZTESA-N 0 1 398.341 3.185 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000377762921 565497209 /nfs/dbraw/zinc/49/72/09/565497209.db2.gz OFFXWAMEDLALTP-LLVKDONJSA-N 0 1 396.232 3.002 10 0 GGAEMN CCOc1ccc(NC(=O)N[C@H]2CCc3nc[nH]c3C2)cc1Br ZINC000377808175 565499388 /nfs/dbraw/zinc/49/93/88/565499388.db2.gz XDJZRXWDDZSCGF-NSHDSACASA-N 0 1 379.258 3.250 10 0 GGAEMN CCOCCCNC(=O)[C@@H](C)N[C@H](C)c1ccc(Br)cc1OC ZINC000189976080 565499360 /nfs/dbraw/zinc/49/93/60/565499360.db2.gz ORNAINJSWRFEBP-CHWSQXEVSA-N 0 1 387.318 3.040 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@H](C)C(=O)NCC(F)(F)F ZINC000189971403 565499505 /nfs/dbraw/zinc/49/95/05/565499505.db2.gz VWXDGHHHNIZWNG-DTWKUNHWSA-N 0 1 383.208 3.175 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@@H](C)Cc1cc(C)[nH]n1 ZINC000189965774 565499842 /nfs/dbraw/zinc/49/98/42/565499842.db2.gz DWNHZNNIMWJYNR-CMPLNLGQSA-N 0 1 395.301 3.481 10 0 GGAEMN CCN1CCN(c2cc(CNc3ncc(Br)cc3C)ccn2)CC1 ZINC000301638790 565500530 /nfs/dbraw/zinc/50/05/30/565500530.db2.gz XWPNJPOEGRTDPF-UHFFFAOYSA-N 0 1 390.329 3.302 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000189976218 565500656 /nfs/dbraw/zinc/50/06/56/565500656.db2.gz DMNQYOWXADCVLD-BXKDBHETSA-N 0 1 395.219 3.272 10 0 GGAEMN CCOCCCNC(=O)[C@H](C)N[C@H](C)c1ccc(Br)cc1OC ZINC000189976096 565500793 /nfs/dbraw/zinc/50/07/93/565500793.db2.gz ORNAINJSWRFEBP-OLZOCXBDSA-N 0 1 387.318 3.040 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)C2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000377845166 565502827 /nfs/dbraw/zinc/50/28/27/565502827.db2.gz OXJCRKFKAAOYQA-BBRMVZONSA-N 0 1 376.444 3.170 10 0 GGAEMN Cc1cc(C[C@H](C)N2C(=O)N[C@H](Cc3cc(Cl)cc(Cl)c3)C2=O)n[nH]1 ZINC000277563349 565506687 /nfs/dbraw/zinc/50/66/87/565506687.db2.gz ZXYILDRSQKXAOT-ZUZCIYMTSA-N 0 1 381.263 3.119 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N[C@H]1COc2c1ccc(Cl)c2Cl ZINC000377971595 565506844 /nfs/dbraw/zinc/50/68/44/565506844.db2.gz WUUWOJBEZYAMLU-ZETCQYMHSA-N 0 1 394.330 3.476 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)[C@H]1CCCc2[nH]ncc21 ZINC000190140711 565510704 /nfs/dbraw/zinc/51/07/04/565510704.db2.gz FLYPKPOTMLYTAZ-NSHDSACASA-N 0 1 398.326 3.329 10 0 GGAEMN Cn1ccc2ccc(NS(=O)(=O)c3cc4c(cc3Cl)OCCO4)cc21 ZINC000172888462 565511121 /nfs/dbraw/zinc/51/11/21/565511121.db2.gz VXEGGQYCZHTGAJ-UHFFFAOYSA-N 0 1 378.837 3.404 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)N[C@H]1CCc2nc[nH]c2C1 ZINC000378101983 565513181 /nfs/dbraw/zinc/51/31/81/565513181.db2.gz RHAJYUYIMZLBGM-ZIBATOQPSA-N 0 1 393.260 3.024 10 0 GGAEMN CCN(Cc1cccc(Br)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378102708 565513361 /nfs/dbraw/zinc/51/33/61/565513361.db2.gz SCSOVZAZXDRUNK-CQSZACIVSA-N 0 1 377.286 3.261 10 0 GGAEMN CC[C@H](Cc1cccc(Br)c1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378200157 565515751 /nfs/dbraw/zinc/51/57/51/565515751.db2.gz JZDCQNSYEHSUGD-HIFRSBDPSA-N 0 1 376.298 3.415 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@H]2CCCc3[nH]ncc32)cc(Br)c1F ZINC000277728419 565516544 /nfs/dbraw/zinc/51/65/44/565516544.db2.gz JMZWKCDXQSQXFO-VIFPVBQESA-N 0 1 396.216 3.157 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378310067 565521240 /nfs/dbraw/zinc/52/12/40/565521240.db2.gz NZDHCKOLPYZBGF-GXTWGEPZSA-N 0 1 376.298 3.415 10 0 GGAEMN CC(C)Oc1cc(Br)cc(C(=O)N[C@H]2CCc3nc[nH]c3C2)c1 ZINC000378315895 565521603 /nfs/dbraw/zinc/52/16/03/565521603.db2.gz WYVJGHWXHGIDRH-ZDUSSCGKSA-N 0 1 378.270 3.247 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)CCCSc3ccc(Cl)cc3)CCO2)n[nH]1 ZINC000173090859 565525402 /nfs/dbraw/zinc/52/54/02/565525402.db2.gz ZLOZLLDLTGVHAU-HNNXBMFYSA-N 0 1 380.901 3.239 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)CCCc3ccc(Cl)c(Cl)c3)CCO2)n[nH]1 ZINC000173087740 565525843 /nfs/dbraw/zinc/52/58/43/565525843.db2.gz NTPFJFFFRHTLGT-OAHLLOKOSA-N 0 1 383.279 3.343 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)CSc3cc(Cl)ccc3Cl)CCO2)n[nH]1 ZINC000173085391 565525963 /nfs/dbraw/zinc/52/59/63/565525963.db2.gz SEEKCWNTCMKVND-LBPRGKRZSA-N 0 1 387.292 3.112 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1ccccc1-c1nnc[nH]1 ZINC000378421235 565526143 /nfs/dbraw/zinc/52/61/43/565526143.db2.gz HYJBNCNXBSJAMA-UHFFFAOYSA-N 0 1 387.237 3.424 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)CCc3ccc(Cl)cc3Cl)CCO2)n[nH]1 ZINC000173094032 565526820 /nfs/dbraw/zinc/52/68/20/565526820.db2.gz ZZMHGUZGEPLNRY-AWEZNQCLSA-N 0 1 383.279 3.207 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)CCSc3ccccc3Cl)CCO2)n[nH]1 ZINC000173095552 565527001 /nfs/dbraw/zinc/52/70/01/565527001.db2.gz DSVZLDGSYJFROP-CYBMUJFWSA-N 0 1 380.901 3.103 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)[C@H](C)Sc3ccccc3Cl)CCO2)n[nH]1 ZINC000173096105 565527044 /nfs/dbraw/zinc/52/70/44/565527044.db2.gz OTLKEICTYFVVMP-WCQYABFASA-N 0 1 380.901 3.101 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NCC(=O)N(C)CC(F)(F)F ZINC000190429340 565532259 /nfs/dbraw/zinc/53/22/59/565532259.db2.gz MBEJKQRXGWSQMW-VIFPVBQESA-N 0 1 383.208 3.129 10 0 GGAEMN O=C(CCc1ccc(Br)cc1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000378527148 565532646 /nfs/dbraw/zinc/53/26/46/565532646.db2.gz CGEKCAXVYSXGGD-KRWDZBQOSA-N 0 1 385.265 3.406 10 0 GGAEMN Cc1ncsc1C[N@H+](C)C[C@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000190529368 565540074 /nfs/dbraw/zinc/54/00/74/565540074.db2.gz KCTGINHWMIZFPO-CYBMUJFWSA-N 0 1 379.913 3.405 10 0 GGAEMN Cc1ncsc1C[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000190529368 565540078 /nfs/dbraw/zinc/54/00/78/565540078.db2.gz KCTGINHWMIZFPO-CYBMUJFWSA-N 0 1 379.913 3.405 10 0 GGAEMN Cc1ncsc1C[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([O-])c(Cl)c2)C1 ZINC000190529420 565540208 /nfs/dbraw/zinc/54/02/08/565540208.db2.gz WAPLYXBVCNGWFV-CYBMUJFWSA-N 0 1 379.913 3.405 10 0 GGAEMN Cc1c(Br)cccc1C(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000173252946 565540635 /nfs/dbraw/zinc/54/06/35/565540635.db2.gz PVIHNLCPHSSSAH-CYBMUJFWSA-N 0 1 381.314 3.083 10 0 GGAEMN Cc1ncsc1C[N@H+](C)C[C@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000190545345 565541017 /nfs/dbraw/zinc/54/10/17/565541017.db2.gz OIMVOEOBWWRYDE-CYBMUJFWSA-N 0 1 379.913 3.405 10 0 GGAEMN Cc1ncsc1C[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000190545345 565541024 /nfs/dbraw/zinc/54/10/24/565541024.db2.gz OIMVOEOBWWRYDE-CYBMUJFWSA-N 0 1 379.913 3.405 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Br)cc2Cl)CCN1C ZINC000173269846 565542259 /nfs/dbraw/zinc/54/22/59/565542259.db2.gz PUBOOBQSTJJYGJ-JQWIXIFHSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)CCN1C ZINC000173273644 565543290 /nfs/dbraw/zinc/54/32/90/565543290.db2.gz PSFAQNGMALQESI-QWRGUYRKSA-N 0 1 382.860 3.045 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)CCN1C ZINC000173276670 565543313 /nfs/dbraw/zinc/54/33/13/565543313.db2.gz MFAFDTTVRNEBDF-QWRGUYRKSA-N 0 1 384.851 3.462 10 0 GGAEMN CN1CCN([C@@H]2CCCCN(C(=O)CSc3ccccc3Cl)C2)CC1 ZINC000173283695 565544319 /nfs/dbraw/zinc/54/43/19/565544319.db2.gz FVBSNDXYLLKLOJ-MRXNPFEDSA-N 0 1 381.973 3.061 10 0 GGAEMN CN1CCN([C@H]2CCCCN(C(=O)c3cc(F)c(Cl)cc3Cl)C2)CC1 ZINC000173295884 565545730 /nfs/dbraw/zinc/54/57/30/565545730.db2.gz GMFHPKUAOSECFC-ZDUSSCGKSA-N 0 1 388.314 3.375 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2ccc(F)c(F)c2)[C@@H]1c1cccs1 ZINC000173322758 565547635 /nfs/dbraw/zinc/54/76/35/565547635.db2.gz OBHCTKGQCCQKCJ-SJKOYZFVSA-N 0 1 386.489 3.388 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2cccc(F)c2)[C@@H]1c1cccs1 ZINC000173322881 565547997 /nfs/dbraw/zinc/54/79/97/565547997.db2.gz OZUJXFWOVSOZJW-CRAIPNDOSA-N 0 1 382.526 3.390 10 0 GGAEMN CCc1n[nH]c(C2CCN(CC(=O)Nc3c(Cl)cccc3Cl)CC2)n1 ZINC000190666000 565550613 /nfs/dbraw/zinc/55/06/13/565550613.db2.gz GCCJZCXYYCIXSP-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN CCc1nnc(C2CCN(CC(=O)Nc3c(Cl)cccc3Cl)CC2)[nH]1 ZINC000190666000 565550618 /nfs/dbraw/zinc/55/06/18/565550618.db2.gz GCCJZCXYYCIXSP-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN CCc1n[nH]c(C2CCN(CC(=O)Nc3cc(Cl)ccc3Cl)CC2)n1 ZINC000190687889 565551400 /nfs/dbraw/zinc/55/14/00/565551400.db2.gz MRBGVMCFNQABOR-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN CCc1nnc(C2CCN(CC(=O)Nc3cc(Cl)ccc3Cl)CC2)[nH]1 ZINC000190687889 565551404 /nfs/dbraw/zinc/55/14/04/565551404.db2.gz MRBGVMCFNQABOR-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@@H](C)c3ncc(Br)s3)C2)n(C)n1 ZINC000278478815 565560766 /nfs/dbraw/zinc/56/07/66/565560766.db2.gz OMGUJGYGUIBMOT-RYUDHWBXSA-N 0 1 384.347 3.267 10 0 GGAEMN CCn1cc([C@@H]2CN(Cc3nc4ccc(Br)cc4[nH]3)CCO2)cn1 ZINC000190832196 565561643 /nfs/dbraw/zinc/56/16/43/565561643.db2.gz RSORXASEBQBMDO-INIZCTEOSA-N 0 1 390.285 3.115 10 0 GGAEMN Cn1ncc(Br)c1CNc1ccccc1CN1CCSCC1 ZINC000278523067 565563419 /nfs/dbraw/zinc/56/34/19/565563419.db2.gz QOCHGSSRKATTKZ-UHFFFAOYSA-N 0 1 381.343 3.344 10 0 GGAEMN CCOC(=O)C1CCC(O)(CN2CCc3c(Br)cccc3C2)CC1 ZINC000190849182 565564468 /nfs/dbraw/zinc/56/44/68/565564468.db2.gz KZNHEDDONQGIKG-UHFFFAOYSA-N 0 1 396.325 3.292 10 0 GGAEMN CN(Cc1ccc(Cl)s1)C(=O)C[N@H+]1Cc2ccccc2[C@H](C(=O)[O-])C1 ZINC000392621346 565565268 /nfs/dbraw/zinc/56/52/68/565565268.db2.gz NHQCYTUZJSTFGF-OAHLLOKOSA-N 0 1 378.881 3.044 10 0 GGAEMN CN(Cc1ccc(Cl)s1)C(=O)C[N@@H+]1Cc2ccccc2[C@H](C(=O)[O-])C1 ZINC000392621346 565565275 /nfs/dbraw/zinc/56/52/75/565565275.db2.gz NHQCYTUZJSTFGF-OAHLLOKOSA-N 0 1 378.881 3.044 10 0 GGAEMN OC[C@H]1CCC[C@H](NCc2c(Br)cncc2Br)C1 ZINC000394532220 565571017 /nfs/dbraw/zinc/57/10/17/565571017.db2.gz PGYONUIERAFDAS-UWVGGRQHSA-N 0 1 378.108 3.247 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1cc(Br)ccc1Cl ZINC000303142806 565567660 /nfs/dbraw/zinc/56/76/60/565567660.db2.gz DUEZGZWEYQSKFM-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000173660454 565574420 /nfs/dbraw/zinc/57/44/20/565574420.db2.gz JPAUVNKFKXMLGQ-DGCLKSJQSA-N 0 1 378.270 3.190 10 0 GGAEMN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173660654 565574870 /nfs/dbraw/zinc/57/48/70/565574870.db2.gz WACHWZHZXKQZSM-YPMHNXCESA-N 0 1 378.270 3.190 10 0 GGAEMN COCC[C@@H](CO)N[C@H](C)c1ccc(Br)cc1Br ZINC000305946048 565576933 /nfs/dbraw/zinc/57/69/33/565576933.db2.gz SPOUWJIWTMOLQA-KOLCDFICSA-N 0 1 381.108 3.260 10 0 GGAEMN COCCN(Cc1nc2ccc(Br)cc2[nH]1)Cc1cccnc1 ZINC000191108786 565582806 /nfs/dbraw/zinc/58/28/06/565582806.db2.gz LRDBDOROMUIFAR-UHFFFAOYSA-N 0 1 375.270 3.369 10 0 GGAEMN C[C@@H]1C[C@H](NC(=O)c2nscc2Br)CN1Cc1ccccc1 ZINC000404817792 565584605 /nfs/dbraw/zinc/58/46/05/565584605.db2.gz QSQGLRDVJSCFBY-YPMHNXCESA-N 0 1 380.311 3.298 10 0 GGAEMN CCc1nc([C@H]2CN(Cc3cc(Br)c(Cl)s3)CCO2)n[nH]1 ZINC000191155414 565584970 /nfs/dbraw/zinc/58/49/70/565584970.db2.gz DCIUJJDZNUQSQN-SNVBAGLBSA-N 0 1 391.722 3.418 10 0 GGAEMN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)c1nscc1Br ZINC000404970633 565585652 /nfs/dbraw/zinc/58/56/52/565585652.db2.gz ZMVJYIQEDURIEJ-CYBMUJFWSA-N 0 1 380.311 3.300 10 0 GGAEMN CCN1CCC(N(C)S(=O)(=O)c2c(Cl)cccc2Br)CC1 ZINC000314148224 565585885 /nfs/dbraw/zinc/58/58/85/565585885.db2.gz FKBYNTHUMKNAGM-UHFFFAOYSA-N 0 1 395.750 3.207 10 0 GGAEMN O=C([O-])[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2I)C1 ZINC000405270305 565585869 /nfs/dbraw/zinc/58/58/69/565585869.db2.gz UPKYWQYSABGBJS-SECBINFHSA-N 0 1 379.625 3.241 10 0 GGAEMN O=C([O-])[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2I)C1 ZINC000405270305 565585874 /nfs/dbraw/zinc/58/58/74/565585874.db2.gz UPKYWQYSABGBJS-SECBINFHSA-N 0 1 379.625 3.241 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)c1cn2ccnc2s1 ZINC000191160671 565586732 /nfs/dbraw/zinc/58/67/32/565586732.db2.gz XEHICVDLCULWCV-UHFFFAOYSA-N 0 1 389.238 3.196 10 0 GGAEMN COCC[C@@H](COC)NCc1cc(Cl)ccc1I ZINC000405345113 565587105 /nfs/dbraw/zinc/58/71/05/565587105.db2.gz PODVLGXKJQJLAE-LBPRGKRZSA-N 0 1 383.657 3.086 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000191195406 565587756 /nfs/dbraw/zinc/58/77/56/565587756.db2.gz XATDPXCPYDUXFK-XAGWURHQSA-N 0 1 378.270 3.099 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3ccc(Br)s3)C2)n[nH]1 ZINC000407975277 565588044 /nfs/dbraw/zinc/58/80/44/565588044.db2.gz FWSQOMANPKBUCI-SNVBAGLBSA-N 0 1 390.328 3.110 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2cc(Br)ccc2C)n[nH]1 ZINC000407976918 565588205 /nfs/dbraw/zinc/58/82/05/565588205.db2.gz OBDZBHYMYCOCNF-CYBMUJFWSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3)C2)n[nH]1 ZINC000407974398 565588602 /nfs/dbraw/zinc/58/86/02/565588602.db2.gz AJKWBWVUDIHVQB-GFCCVEGCSA-N 0 1 384.299 3.049 10 0 GGAEMN Cn1cc([C@H]2CSCCN2Cc2nc3ccc(Br)cc3[nH]2)cn1 ZINC000191221278 565588871 /nfs/dbraw/zinc/58/88/71/565588871.db2.gz RRRBJLLAHLUQCJ-OAHLLOKOSA-N 0 1 392.326 3.349 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2c(Cl)cc(F)cc2Cl)n[nH]1 ZINC000407977337 565589265 /nfs/dbraw/zinc/58/92/65/565589265.db2.gz QTLJDHMODNAKSH-LBPRGKRZSA-N 0 1 393.271 3.475 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)c2ccc(I)cc2)n[nH]1 ZINC000407980761 565589798 /nfs/dbraw/zinc/58/97/98/565589798.db2.gz NWXMYXLUKQAJCG-CYBMUJFWSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1c(Br)ccc(C(=O)N2CCC(CN3CCOCC3)CC2)c1F ZINC000278998611 565589858 /nfs/dbraw/zinc/58/98/58/565589858.db2.gz LJDXWUIWBCSOMV-UHFFFAOYSA-N 0 1 399.304 3.081 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2cc(Cl)ccc2Cl)n[nH]1 ZINC000407977657 565589946 /nfs/dbraw/zinc/58/99/46/565589946.db2.gz YQWJKHRQQGTWON-GFCCVEGCSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3cccc(Br)c3C)C2)n[nH]1 ZINC000407978017 565589999 /nfs/dbraw/zinc/58/99/99/565589999.db2.gz VDOXGKKSZCSPCE-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)n[nH]1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000408023572 565591074 /nfs/dbraw/zinc/59/10/74/565591074.db2.gz UCPFCKFWWNBUGF-HNNXBMFYSA-N 0 1 389.297 3.150 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCC[C@@H]1[C@@H]1CCCO1 ZINC000408091788 565594702 /nfs/dbraw/zinc/59/47/02/565594702.db2.gz XLTXUFRGNBXATC-CVEARBPZSA-N 0 1 391.265 3.074 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N[C@H]2CN(C(C)C)C[C@@H]2C)cc1Cl ZINC000173885134 565597348 /nfs/dbraw/zinc/59/73/48/565597348.db2.gz WYYCTQNKOPAEAC-GWCFXTLKSA-N 0 1 381.325 3.009 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCO[C@@H]2CCCC[C@H]21 ZINC000408195149 565598380 /nfs/dbraw/zinc/59/83/80/565598380.db2.gz LLBWBDYYDHMLGI-HZPDHXFCSA-N 0 1 391.265 3.074 10 0 GGAEMN O=S(=O)(N[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(Br)o1 ZINC000408216062 565599582 /nfs/dbraw/zinc/59/95/82/565599582.db2.gz SSORVSRBCOVDGG-YUMQZZPRSA-N 0 1 376.194 3.442 10 0 GGAEMN O=C(CCCN1CC[C@@](O)(C(F)(F)F)C1)c1ccc(Br)cc1 ZINC000319389751 565599843 /nfs/dbraw/zinc/59/98/43/565599843.db2.gz KTKPDZZOVTZNRY-AWEZNQCLSA-N 0 1 380.204 3.411 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Cl)c(C)cc2Br)CC1 ZINC000320639886 565603005 /nfs/dbraw/zinc/60/30/05/565603005.db2.gz DNCDUIOOLHVMMB-UHFFFAOYSA-N 0 1 389.721 3.205 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000191444676 565604891 /nfs/dbraw/zinc/60/48/91/565604891.db2.gz LYWFAOVMUXHARM-TZMCWYRMSA-N 0 1 382.302 3.008 10 0 GGAEMN CN1Cc2ccc(N[C@H](C(N)=O)c3ccc(Br)cc3F)cc2C1 ZINC000173989949 565605249 /nfs/dbraw/zinc/60/52/49/565605249.db2.gz MCOXEISAXGYROZ-INIZCTEOSA-N 0 1 378.245 3.172 10 0 GGAEMN CN1Cc2ccc(N[C@@H](C(N)=O)c3ccc(Br)cc3F)cc2C1 ZINC000173989963 565605684 /nfs/dbraw/zinc/60/56/84/565605684.db2.gz MCOXEISAXGYROZ-MRXNPFEDSA-N 0 1 378.245 3.172 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN2CCCC[C@@H]2C1 ZINC000191456853 565605827 /nfs/dbraw/zinc/60/58/27/565605827.db2.gz OKYOLVPNMFWWKX-UKRRQHHQSA-N 0 1 396.329 3.398 10 0 GGAEMN C[C@@H]1CSCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000408440732 565609580 /nfs/dbraw/zinc/60/95/80/565609580.db2.gz FSUWZRKKKRRGKJ-JTQLQIEISA-N 0 1 381.295 3.116 10 0 GGAEMN CCOC(=O)c1csc(CCN[C@@H](C)c2ncc(Br)s2)n1 ZINC000191554181 565612493 /nfs/dbraw/zinc/61/24/93/565612493.db2.gz CZOYYVUYVPTADJ-QMMMGPOBSA-N 0 1 390.328 3.432 10 0 GGAEMN CCOC(=O)c1csc(CCN[C@H](C)c2ncc(Br)s2)n1 ZINC000191554192 565612684 /nfs/dbraw/zinc/61/26/84/565612684.db2.gz CZOYYVUYVPTADJ-MRVPVSSYSA-N 0 1 390.328 3.432 10 0 GGAEMN COC(=O)c1nc(N[C@@H]2CCOc3c(Br)cccc32)sc1C ZINC000409636928 565628932 /nfs/dbraw/zinc/62/89/32/565628932.db2.gz VVQMBCVBZDUEBY-LLVKDONJSA-N 0 1 383.267 3.358 10 0 GGAEMN O=C1[C@@H](NCc2ccc(Br)cc2)CCN1Cc1ccc(F)cc1 ZINC000191767165 565630269 /nfs/dbraw/zinc/63/02/69/565630269.db2.gz OXEUUEIGJQNSDG-KRWDZBQOSA-N 0 1 377.257 3.479 10 0 GGAEMN CC(=O)c1ccccc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000174505991 565640556 /nfs/dbraw/zinc/64/05/56/565640556.db2.gz UGUCOLUMQDTQBC-UHFFFAOYSA-N 0 1 399.248 3.367 10 0 GGAEMN CC(=O)c1ccccc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000174505991 565640564 /nfs/dbraw/zinc/64/05/64/565640564.db2.gz UGUCOLUMQDTQBC-UHFFFAOYSA-N 0 1 399.248 3.367 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1nc(C(C)(C)C)no1 ZINC000174694688 565651780 /nfs/dbraw/zinc/65/17/80/565651780.db2.gz YKDUVEJKCGJGML-MRVPVSSYSA-N 0 1 392.257 3.497 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1nc(C(C)(C)C)no1 ZINC000174694675 565652441 /nfs/dbraw/zinc/65/24/41/565652441.db2.gz YKDUVEJKCGJGML-QMMMGPOBSA-N 0 1 392.257 3.497 10 0 GGAEMN C[C@@H](CO)N(Cc1nnc(-c2ccccc2Br)o1)CC1CCC1 ZINC000280311435 565665155 /nfs/dbraw/zinc/66/51/55/565665155.db2.gz GKAAQTZUUIPABQ-LBPRGKRZSA-N 0 1 380.286 3.482 10 0 GGAEMN CCC(=O)N1CSC[C@@H]1C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000174915268 565666361 /nfs/dbraw/zinc/66/63/61/565666361.db2.gz NPOMPSKHRWWULW-SNVBAGLBSA-N 0 1 393.690 3.058 10 0 GGAEMN COc1cc(CNCC2(C)OCCCO2)cc(Br)c1OC(F)F ZINC000192248812 565674462 /nfs/dbraw/zinc/67/44/62/565674462.db2.gz QDAQUTHGRYNGHS-UHFFFAOYSA-N 0 1 396.228 3.302 10 0 GGAEMN O=C(CSc1n[n-]c(=S)s1)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000175071606 565677555 /nfs/dbraw/zinc/67/75/55/565677555.db2.gz KOVPLLVMAJMGAI-CQSZACIVSA-N 0 1 394.591 3.464 10 0 GGAEMN Cc1ccc(CN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)cc1 ZINC000280556807 565680312 /nfs/dbraw/zinc/68/03/12/565680312.db2.gz JGJFIKWOLPSKSR-LBPRGKRZSA-N 0 1 383.311 3.256 10 0 GGAEMN CC(=O)c1ccc(NS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)cc1Cl ZINC000410394565 565682358 /nfs/dbraw/zinc/68/23/58/565682358.db2.gz BREZGVKWFCRZGI-UHFFFAOYSA-N 0 1 387.244 3.096 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)Nc2ccc(N3CCC3=O)cc2)c1 ZINC000410414836 565684228 /nfs/dbraw/zinc/68/42/28/565684228.db2.gz CHSZKSYRVYXFPE-UHFFFAOYSA-N 0 1 395.278 3.295 10 0 GGAEMN CC1(C)[C@@H]2CN(C(=O)NCc3n[nH]c(-c4ccc(Br)cc4)n3)C[C@@H]21 ZINC000175260259 565687933 /nfs/dbraw/zinc/68/79/33/565687933.db2.gz QGEVELMYPRIVMT-BETUJISGSA-N 0 1 390.285 3.032 10 0 GGAEMN CC1(C)[C@@H]2CN(C(=O)NCc3nc(-c4ccc(Br)cc4)n[nH]3)C[C@@H]21 ZINC000175260259 565687939 /nfs/dbraw/zinc/68/79/39/565687939.db2.gz QGEVELMYPRIVMT-BETUJISGSA-N 0 1 390.285 3.032 10 0 GGAEMN O=C1[C@H](N2CCC[C@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000330023673 565689515 /nfs/dbraw/zinc/68/95/15/565689515.db2.gz JBDFIASMUHDYAK-XHDPSFHLSA-N 0 1 380.279 3.096 10 0 GGAEMN COC(=O)c1cccc(NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)c1Br ZINC000192424717 565689691 /nfs/dbraw/zinc/68/96/91/565689691.db2.gz YVZVVVLFSJIIRK-VIFPVBQESA-N 0 1 395.257 3.020 10 0 GGAEMN Cc1ccncc1CNCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 ZINC000280762604 565693229 /nfs/dbraw/zinc/69/32/29/565693229.db2.gz DOWLZVRORZJKGC-UHFFFAOYSA-N 0 1 397.338 3.495 10 0 GGAEMN CCN1CCC[C@H]1CN(C)S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000175400658 565697509 /nfs/dbraw/zinc/69/75/09/565697509.db2.gz DPJFPIJZCVXELL-NSHDSACASA-N 0 1 384.851 3.464 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@@H](CO)c3cccc(Br)c3)ccc21 ZINC000192618380 565701706 /nfs/dbraw/zinc/70/17/06/565701706.db2.gz ZTJBHNDHDUYEHF-AWEZNQCLSA-N 0 1 393.306 3.186 10 0 GGAEMN O=C1COc2ccccc2N1CCCNCc1c(F)cccc1Br ZINC000192602707 565702041 /nfs/dbraw/zinc/70/20/41/565702041.db2.gz AZVSPBWKFIGFCQ-UHFFFAOYSA-N 0 1 393.256 3.494 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)[nH]1 ZINC000280948749 565704059 /nfs/dbraw/zinc/70/40/59/565704059.db2.gz GSAUEVYUYFDDHE-QWHCGFSZSA-N 0 1 381.299 3.030 10 0 GGAEMN C[C@@H](NC(=O)N1CCN(C[C@@H]2CCOC2)CC1)c1ccc(Cl)cc1Cl ZINC000175543600 565707233 /nfs/dbraw/zinc/70/72/33/565707233.db2.gz GQJADJYXOKZKLS-KGLIPLIRSA-N 0 1 386.323 3.418 10 0 GGAEMN C[C@@H](NC(=O)N1CCN(C[C@H]2CCOC2)CC1)c1ccc(Cl)cc1Cl ZINC000175543634 565707441 /nfs/dbraw/zinc/70/74/41/565707441.db2.gz GQJADJYXOKZKLS-ZIAGYGMSSA-N 0 1 386.323 3.418 10 0 GGAEMN C[C@H](NCc1ccc(F)c(Br)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000192728811 565708044 /nfs/dbraw/zinc/70/80/44/565708044.db2.gz WAQMEMTYMNTNEM-JTQLQIEISA-N 0 1 387.274 3.086 10 0 GGAEMN C[C@@H](NC1(c2ccccc2)CC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000281165339 565715070 /nfs/dbraw/zinc/71/50/70/565715070.db2.gz QEAJJGSXPPVTQD-GFCCVEGCSA-N 0 1 395.322 3.436 10 0 GGAEMN C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CC[N@H+]1C ZINC000281181741 565716658 /nfs/dbraw/zinc/71/66/58/565716658.db2.gz FFHQSJJEFWANSG-VDNDLQMASA-N 0 1 380.330 3.429 10 0 GGAEMN Cc1nn(C)c(C)c1[C@H](NS(=O)(=O)c1cc(C)ccc1F)C(F)(F)F ZINC000330693649 565718979 /nfs/dbraw/zinc/71/89/79/565718979.db2.gz CGSOZADOCTWIMY-AWEZNQCLSA-N 0 1 379.379 3.066 10 0 GGAEMN CC(=O)Nc1ccc(CN2CCN(c3ccc(Br)cn3)CC2)cc1 ZINC000192949479 565721204 /nfs/dbraw/zinc/72/12/04/565721204.db2.gz PNSWFRAVYVGRCE-UHFFFAOYSA-N 0 1 389.297 3.125 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)c2cc(F)c(Br)cc2Cl)n[nH]1 ZINC000281262760 565721213 /nfs/dbraw/zinc/72/12/13/565721213.db2.gz QTSSFZSSFHHKNE-LURJTMIESA-N 0 1 375.629 3.413 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)c2cc(F)c(Br)cc2Cl)n[nH]1 ZINC000281262763 565721283 /nfs/dbraw/zinc/72/12/83/565721283.db2.gz QTSSFZSSFHHKNE-ZCFIWIBFSA-N 0 1 375.629 3.413 10 0 GGAEMN Cc1nc(C(F)(F)F)c(C[NH+]2CCC(C[N-]C(=O)C(F)(F)F)CC2)s1 ZINC000281390740 565728699 /nfs/dbraw/zinc/72/86/99/565728699.db2.gz PSUPZJYUYDMCLJ-UHFFFAOYSA-N 0 1 389.365 3.361 10 0 GGAEMN CN(C)c1ncc(CN(C)CCC(=O)Nc2cc(Cl)ccc2Cl)cn1 ZINC000411491631 565732082 /nfs/dbraw/zinc/73/20/82/565732082.db2.gz BAFOWLDMSMZTDL-UHFFFAOYSA-N 0 1 382.295 3.310 10 0 GGAEMN C[C@@H]1CC[C@H](CCC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)O1 ZINC000175911331 565733156 /nfs/dbraw/zinc/73/31/56/565733156.db2.gz WKBXOJOHOGFICA-BXUZGUMPSA-N 0 1 393.285 3.198 10 0 GGAEMN C[C@@H]1CC[C@H](CCC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)O1 ZINC000175911331 565733162 /nfs/dbraw/zinc/73/31/62/565733162.db2.gz WKBXOJOHOGFICA-BXUZGUMPSA-N 0 1 393.285 3.198 10 0 GGAEMN CCN(CC(=O)NCc1cccs1)C(=O)CN[C@@H](C)c1ccc(Cl)s1 ZINC000193115438 565733551 /nfs/dbraw/zinc/73/35/51/565733551.db2.gz PGWMQQDGZNGSEN-LBPRGKRZSA-N 0 1 399.969 3.279 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NCC(=O)N(C)Cc1ccco1 ZINC000411612795 565740055 /nfs/dbraw/zinc/74/00/55/565740055.db2.gz AZGSVDJCANUCBJ-GFCCVEGCSA-N 0 1 381.270 3.360 10 0 GGAEMN Cc1nc([C@@H](C)N(C)Cc2cccc(Br)c2OCC(C)(C)O)n[nH]1 ZINC000411614623 565740183 /nfs/dbraw/zinc/74/01/83/565740183.db2.gz FMUOUZODXVRMQH-LLVKDONJSA-N 0 1 397.317 3.218 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@H](C)c3ccnn3C)C2=O)ccc1Br ZINC000193293240 565743585 /nfs/dbraw/zinc/74/35/85/565743585.db2.gz PTEGWACMXXLTRD-CZUORRHYSA-N 0 1 391.313 3.337 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NCc1nc2ccc(F)cc2[nH]1 ZINC000176121337 565751459 /nfs/dbraw/zinc/75/14/59/565751459.db2.gz UWYFMJKWEOAMTE-UHFFFAOYSA-N 0 1 392.228 3.332 10 0 GGAEMN O=C(CCN1CCO[C@H](C2CCC2)C1)Nc1ccc(Br)cc1F ZINC000411870327 565759522 /nfs/dbraw/zinc/75/95/22/565759522.db2.gz GEZCSLNREBWBAN-INIZCTEOSA-N 0 1 385.277 3.418 10 0 GGAEMN CN1CCc2nc(NC(=O)c3cc(Br)cc4nc[nH]c43)sc2C1 ZINC000282000551 565759684 /nfs/dbraw/zinc/75/96/84/565759684.db2.gz IUMSFONAPLBAKF-UHFFFAOYSA-N 0 1 392.282 3.022 10 0 GGAEMN CC(C)N(CC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)C[C@H]1CCC(=O)N1 ZINC000412064402 565768703 /nfs/dbraw/zinc/76/87/03/565768703.db2.gz JXNPTWQPEPXIPI-GXTWGEPZSA-N 0 1 386.323 3.160 10 0 GGAEMN COC(=O)[C@H]1CSCCN(Cc2ccc(Br)c3cccnc23)C1 ZINC000412084421 565769028 /nfs/dbraw/zinc/76/90/28/565769028.db2.gz STHCTQIQBHXSSY-CYBMUJFWSA-N 0 1 395.322 3.335 10 0 GGAEMN Cc1nc(C(=O)NCc2ccc(F)c(CN(C)C)c2)c(Br)s1 ZINC000412111893 565771388 /nfs/dbraw/zinc/77/13/88/565771388.db2.gz OQRDAGPUZNLRIF-UHFFFAOYSA-N 0 1 386.290 3.345 10 0 GGAEMN COc1cc(C)c(S(=O)(=O)Nc2nc3c(s2)COCC3)cc1C(C)C ZINC000193716129 565771530 /nfs/dbraw/zinc/77/15/30/565771530.db2.gz VGZYNGUKSYDTAM-UHFFFAOYSA-N 0 1 382.507 3.457 10 0 GGAEMN C[C@@H]1CN(C(=O)CSc2n[nH]c(=S)s2)C[C@H](c2ccc(F)cc2)O1 ZINC000176441689 565772610 /nfs/dbraw/zinc/77/26/10/565772610.db2.gz QYWGVDWBCGSJTJ-BXKDBHETSA-N 0 1 385.511 3.420 10 0 GGAEMN COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc(Cl)cc(Br)c2O)C1 ZINC000412153948 565773382 /nfs/dbraw/zinc/77/33/82/565773382.db2.gz CCSLAASLUBTPQF-JGVFFNPUSA-N 0 1 376.634 3.336 10 0 GGAEMN CC(C)(C)c1nnc(CNC(=O)c2cc(Br)cc3nc[nH]c32)s1 ZINC000282310928 565773653 /nfs/dbraw/zinc/77/36/53/565773653.db2.gz GYVIOFWUYWBBIM-UHFFFAOYSA-N 0 1 394.298 3.404 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000176487193 565777279 /nfs/dbraw/zinc/77/72/79/565777279.db2.gz DMFBMMFCQIILMJ-CHWSQXEVSA-N 0 1 381.548 3.407 10 0 GGAEMN COCCn1nc(C)c(NC(=O)c2cc(Br)cc3nc[nH]c32)c1C ZINC000282498041 565783215 /nfs/dbraw/zinc/78/32/15/565783215.db2.gz NOAZMXUALOIYBU-UHFFFAOYSA-N 0 1 392.257 3.037 10 0 GGAEMN Brc1cncc(Br)c1CN[C@H]1CCCc2cn[nH]c21 ZINC000331848406 565787165 /nfs/dbraw/zinc/78/71/65/565787165.db2.gz VPQIMMZHSHTVLO-LBPRGKRZSA-N 0 1 386.091 3.497 10 0 GGAEMN O=C(N[C@H]1CCO[C@]2(CCSC2)C1)c1cc(Br)cc2nc[nH]c21 ZINC000282611790 565788689 /nfs/dbraw/zinc/78/86/89/565788689.db2.gz XFCGUYQZZXICKI-MEDUHNTESA-N 0 1 396.310 3.110 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)ccc1NC(=O)N1CCC=C(Br)C1 ZINC000282653793 565790256 /nfs/dbraw/zinc/79/02/56/565790256.db2.gz JHBGVJWXDRUNQI-UHFFFAOYSA-N 0 1 393.329 3.263 10 0 GGAEMN Cc1cc(S(C)(=O)=O)ccc1NS(=O)(=O)c1cccc2ccccc21 ZINC000176676118 565793855 /nfs/dbraw/zinc/79/38/55/565793855.db2.gz FIAYKEZTCBNMAL-UHFFFAOYSA-N 0 1 375.471 3.353 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3cc(Br)cs3)C2=O)n(C)n1 ZINC000194148565 565796821 /nfs/dbraw/zinc/79/68/21/565796821.db2.gz HODQZUHCIQSTIG-WCQYABFASA-N 0 1 397.342 3.399 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@@H](C)c3cc(Br)cs3)C2=O)n(C)n1 ZINC000194148550 565797105 /nfs/dbraw/zinc/79/71/05/565797105.db2.gz HODQZUHCIQSTIG-AAEUAGOBSA-N 0 1 397.342 3.399 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CCOCC1)Nc1nccs1 ZINC000194312882 565807956 /nfs/dbraw/zinc/80/79/56/565807956.db2.gz IVKABEBAIOQNHG-UHFFFAOYSA-N 0 1 396.310 3.140 10 0 GGAEMN O=C(CN1CCCN(CCc2cc(Cl)cc(Cl)c2)CC1)N1CCCC1 ZINC000194415687 565814224 /nfs/dbraw/zinc/81/42/24/565814224.db2.gz FAXUBQHLVIRLNA-UHFFFAOYSA-N 0 1 384.351 3.166 10 0 GGAEMN CN(C)C(=O)c1ccnc(NS(=O)(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000194624027 565826371 /nfs/dbraw/zinc/82/63/71/565826371.db2.gz XBBMQVPRNHOJHC-UHFFFAOYSA-N 0 1 388.276 3.032 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000177272968 565840410 /nfs/dbraw/zinc/84/04/10/565840410.db2.gz KILBMJVWQOACGK-UHFFFAOYSA-N 0 1 386.323 3.174 10 0 GGAEMN C[C@H](NC(=O)N1CCN(C2CCOCC2)CC1)c1ccccc1Br ZINC000177303226 565841658 /nfs/dbraw/zinc/84/16/58/565841658.db2.gz WBSBPTKBKNTKFN-AWEZNQCLSA-N 0 1 396.329 3.016 10 0 GGAEMN C[C@]1(c2nc(-c3nc(-c4cccc(Br)c4)n[nH]3)no2)CCCO1 ZINC000284114186 565841914 /nfs/dbraw/zinc/84/19/14/565841914.db2.gz WYAHGRDXMDVDCG-OAHLLOKOSA-N 0 1 376.214 3.310 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000284160901 565844144 /nfs/dbraw/zinc/84/41/44/565844144.db2.gz WHXVKAPUIGBKEN-GOEBONIOSA-N 0 1 396.329 3.087 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@H](CO)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000284160898 565844602 /nfs/dbraw/zinc/84/46/02/565844602.db2.gz WHXVKAPUIGBKEN-GDBMZVCRSA-N 0 1 396.329 3.087 10 0 GGAEMN O=C(N[C@@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCCc2[nH]ncc21 ZINC000284522496 565857559 /nfs/dbraw/zinc/85/75/59/565857559.db2.gz BYNIRFDQBGSWEB-CZUORRHYSA-N 0 1 375.270 3.255 10 0 GGAEMN CCC1(CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000177553957 565858616 /nfs/dbraw/zinc/85/86/16/565858616.db2.gz DQVXQZKIDFBAOX-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN CCC1(CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000177553957 565858618 /nfs/dbraw/zinc/85/86/18/565858618.db2.gz DQVXQZKIDFBAOX-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN CC(C)(C)c1nc(CS(=O)(=O)c2n[nH]c(Cc3cccs3)n2)cs1 ZINC000195162439 565863882 /nfs/dbraw/zinc/86/38/82/565863882.db2.gz LJSUPWQPZBKIKQ-UHFFFAOYSA-N 0 1 382.536 3.185 10 0 GGAEMN O=S(=O)([C@H]1C[C@@H]2CC[C@H]1C2)N1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000333181211 565870429 /nfs/dbraw/zinc/87/04/29/565870429.db2.gz PVZDVGMOSJXXIU-XQHKEYJVSA-N 0 1 377.432 3.126 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)CCc2cccs2)[C@@H]1c1cccs1 ZINC000195384373 565879159 /nfs/dbraw/zinc/87/91/59/565879159.db2.gz WKKQUTNFGSPHNK-RHSMWYFYSA-N 0 1 384.592 3.355 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3cccc(Br)c3C2)n[nH]1 ZINC000177891720 565880273 /nfs/dbraw/zinc/88/02/73/565880273.db2.gz IRXPSKNZZQOHNV-LLVKDONJSA-N 0 1 377.286 3.180 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000177945913 565882570 /nfs/dbraw/zinc/88/25/70/565882570.db2.gz HHJLKWMICYYAFK-APPDUMDISA-N 0 1 378.270 3.093 10 0 GGAEMN O=S(=O)(CCN1CCC(c2ccn[nH]2)CC1)c1cc(Cl)ccc1Cl ZINC000195506225 565888714 /nfs/dbraw/zinc/88/87/14/565888714.db2.gz KJAMERFAJHOZJI-UHFFFAOYSA-N 0 1 388.320 3.370 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cccc(OC(C)(C)C)n1 ZINC000414105183 565895401 /nfs/dbraw/zinc/89/54/01/565895401.db2.gz PAIFXEHOUNMNAO-ZDUSSCGKSA-N 0 1 394.313 3.361 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cccc(C(F)(F)F)n1 ZINC000414154480 565898682 /nfs/dbraw/zinc/89/86/82/565898682.db2.gz ZHBBGYJYEMUDMZ-JTQLQIEISA-N 0 1 390.203 3.203 10 0 GGAEMN CC[N@H+]1CCC[C@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000219671202 565901841 /nfs/dbraw/zinc/90/18/41/565901841.db2.gz FFOZQUZLAJTORN-ZDUSSCGKSA-N 0 1 390.119 3.426 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](c2cncc(Br)c2)C2CC2)n[nH]1 ZINC000285438717 565907156 /nfs/dbraw/zinc/90/71/56/565907156.db2.gz OGNWCXLLFOORIB-MGPLVRAMSA-N 0 1 392.301 3.257 10 0 GGAEMN C[C@@H](N[C@@H]1CCCC[C@H]1F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000414319316 565910732 /nfs/dbraw/zinc/91/07/32/565910732.db2.gz YWKARNFHFHYOEI-OASPWFOLSA-N 0 1 379.295 3.028 10 0 GGAEMN Cc1cc(C[C@H](C)Nc2ncnc3ccc(I)cc32)[nH]n1 ZINC000178372396 565915045 /nfs/dbraw/zinc/91/50/45/565915045.db2.gz RJVFFXHTPMXWCP-VIFPVBQESA-N 0 1 393.232 3.309 10 0 GGAEMN NS(=O)(=O)c1ccc(CNCc2ccccc2OC2CCC2)cc1Cl ZINC000414389647 565922424 /nfs/dbraw/zinc/92/24/24/565922424.db2.gz GODVLJLSWSJGLD-UHFFFAOYSA-N 0 1 380.897 3.209 10 0 GGAEMN Cc1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2N2CCOCC2)c1 ZINC000414395483 565923246 /nfs/dbraw/zinc/92/32/46/565923246.db2.gz MMYXUJTVQDGUAZ-UHFFFAOYSA-N 0 1 384.860 3.425 10 0 GGAEMN C[NH+](C)Cc1ccc([N-]S(=O)(=O)c2cnccc2C(F)(F)F)c(F)c1 ZINC000414401709 565924707 /nfs/dbraw/zinc/92/47/07/565924707.db2.gz WLCKIWIIMNUCMN-UHFFFAOYSA-N 0 1 377.363 3.102 10 0 GGAEMN O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)c1n[nH]c2ccc(Br)cc21 ZINC000178541525 565925574 /nfs/dbraw/zinc/92/55/74/565925574.db2.gz JBQUBBQTOUJUBW-ZBEGNZNMSA-N 0 1 396.310 3.110 10 0 GGAEMN OC[C@H]1CCCC[C@H]1NCc1ncc(Br)cc1Br ZINC000229603591 565927073 /nfs/dbraw/zinc/92/70/73/565927073.db2.gz NVNRJYQILJJYMV-BXKDBHETSA-N 0 1 378.108 3.247 10 0 GGAEMN C[C@@H](CC(=O)N1CCN(C[C@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000178601796 565928324 /nfs/dbraw/zinc/92/83/24/565928324.db2.gz NFUICMGSJXVXSP-JKSUJKDBSA-N 0 1 395.341 3.123 10 0 GGAEMN CCCCCS(=O)(=O)CC(=O)Nc1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000178633697 565930282 /nfs/dbraw/zinc/93/02/82/565930282.db2.gz MAOGMSXMBDECPA-UHFFFAOYSA-N 0 1 377.388 3.125 10 0 GGAEMN Cc1cc(CN2CCC[C@@H](N3CCCS3(=O)=O)C2)ccc1C(F)(F)F ZINC000414428481 565931014 /nfs/dbraw/zinc/93/10/14/565931014.db2.gz BGXCIBNGXFJMPD-OAHLLOKOSA-N 0 1 376.444 3.014 10 0 GGAEMN CCOC(=O)c1cnc(C)c(NS(=O)(=O)c2ccc(Cl)c(OC)c2)c1 ZINC000414439104 565931890 /nfs/dbraw/zinc/93/18/90/565931890.db2.gz FLUSEFRGPCNWLK-UHFFFAOYSA-N 0 1 384.841 3.030 10 0 GGAEMN COc1ncc(Br)cc1Cc1noc(-c2ccc3cncn3c2)n1 ZINC000350124102 565932077 /nfs/dbraw/zinc/93/20/77/565932077.db2.gz SYEQQQZXGQFAKH-UHFFFAOYSA-N 0 1 386.209 3.141 10 0 GGAEMN O[C@@H](CNCc1ccc(OC(F)(F)F)c(Br)c1)C(F)(F)F ZINC000236515763 565938622 /nfs/dbraw/zinc/93/86/22/565938622.db2.gz CESCECBNDFZFEH-VIFPVBQESA-N 0 1 382.098 3.361 10 0 GGAEMN COCc1cc(Cl)cc(S(=O)(=O)Nc2n[nH]c(C)c2Br)c1 ZINC000414470534 565938706 /nfs/dbraw/zinc/93/87/06/565938706.db2.gz MONSSAQPBZKNAG-UHFFFAOYSA-N 0 1 394.678 3.081 10 0 GGAEMN C[C@@H]1CN(C)C[C@@H](C)N1C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000178936835 565947601 /nfs/dbraw/zinc/94/76/01/565947601.db2.gz NXLDRTVRMZFAKI-ZIAGYGMSSA-N 0 1 377.941 3.481 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(Cc2cnc(-c3c(F)cccc3F)s2)C1 ZINC000414578023 565949317 /nfs/dbraw/zinc/94/93/17/565949317.db2.gz HYKUUSMZLFLEEC-NSHDSACASA-N 0 1 384.473 3.426 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)[C@@H](O)Cc1ccccc1 ZINC000178984281 565950045 /nfs/dbraw/zinc/95/00/45/565950045.db2.gz MQHWIPSXDROHQX-ZBEGNZNMSA-N 0 1 388.265 3.047 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)[C@H](O)Cc1ccccc1 ZINC000178984260 565950180 /nfs/dbraw/zinc/95/01/80/565950180.db2.gz MQHWIPSXDROHQX-MEDUHNTESA-N 0 1 388.265 3.047 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(Cc2cnc(CCc3ccccc3)s2)C1 ZINC000414598731 565950628 /nfs/dbraw/zinc/95/06/28/565950628.db2.gz YJTNVGJKPCAORX-INIZCTEOSA-N 0 1 376.547 3.266 10 0 GGAEMN FC(F)(F)c1nc(NCc2nnc([C@@H]3CCOC3)[nH]2)sc1Br ZINC000631374486 565955936 /nfs/dbraw/zinc/95/59/36/565955936.db2.gz MQVPEBCKTQJIHD-RXMQYKEDSA-N 0 1 398.208 3.159 10 0 GGAEMN FC(F)(F)c1nc(NCc2n[nH]c([C@@H]3CCOC3)n2)sc1Br ZINC000631374486 565955939 /nfs/dbraw/zinc/95/59/39/565955939.db2.gz MQVPEBCKTQJIHD-RXMQYKEDSA-N 0 1 398.208 3.159 10 0 GGAEMN CCN(CC(=O)NC1(c2ccc(Br)cc2)CCOCC1)C1CC1 ZINC000179160530 565962619 /nfs/dbraw/zinc/96/26/19/565962619.db2.gz VVOCIYAOLVTAJG-UHFFFAOYSA-N 0 1 381.314 3.055 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)C[N@H+]1[C@H](C(=O)[O-])C[C@@H]2CCCC[C@@H]21 ZINC000237566837 565964153 /nfs/dbraw/zinc/96/41/53/565964153.db2.gz AUPHMBQDDDKJIB-RCBQFDQVSA-N 0 1 395.297 3.414 10 0 GGAEMN C[N@@H+]1CC[C@H](NC(=O)c2ccc(Br)c([O-])c2)[C@@H]1c1ccccc1 ZINC000179338741 565973603 /nfs/dbraw/zinc/97/36/03/565973603.db2.gz KDYYLYQZTSXTMI-RDJZCZTQSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2ccc(Br)c([O-])c2)[C@@H]1c1ccccc1 ZINC000179338741 565973605 /nfs/dbraw/zinc/97/36/05/565973605.db2.gz KDYYLYQZTSXTMI-RDJZCZTQSA-N 0 1 375.266 3.330 10 0 GGAEMN Cc1ccc(C(=O)N2CCCC[C@H]2c2nnc[nH]2)cc1I ZINC000179342272 565973779 /nfs/dbraw/zinc/97/37/79/565973779.db2.gz BSSMJHLAYALPSF-ZDUSSCGKSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1ccc(C(=O)N2CCCC[C@@H]2c2nnc[nH]2)cc1I ZINC000179342260 565974050 /nfs/dbraw/zinc/97/40/50/565974050.db2.gz BSSMJHLAYALPSF-CYBMUJFWSA-N 0 1 396.232 3.085 10 0 GGAEMN O=C(CCOc1cccc(Br)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000179355047 565975400 /nfs/dbraw/zinc/97/54/00/565975400.db2.gz JDZJBFCMHLIGTA-CQSZACIVSA-N 0 1 379.258 3.090 10 0 GGAEMN Cc1ccccc1NC(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000286707829 565976057 /nfs/dbraw/zinc/97/60/57/565976057.db2.gz WQJIBOOUWMQROP-SFHVURJKSA-N 0 1 377.282 3.193 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)CCCc2cc(Cl)sc2Cl)CC1 ZINC000179395201 565977750 /nfs/dbraw/zinc/97/77/50/565977750.db2.gz ZXIGJPRZOVNNJI-CYBMUJFWSA-N 0 1 379.353 3.293 10 0 GGAEMN COc1ccc(-c2nc3c(s2)[C@@H](N[C@@H](C)CS(C)(=O)=O)CCC3)cc1 ZINC000362295353 565978156 /nfs/dbraw/zinc/97/81/56/565978156.db2.gz YNGSMPHMMATOHB-WFASDCNBSA-N 0 1 380.535 3.219 10 0 GGAEMN CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2C)[C@@H](C)C1 ZINC000245413775 565989361 /nfs/dbraw/zinc/98/93/61/565989361.db2.gz CCKGUALUAAGPSW-DZGCQCFKSA-N 0 1 378.460 3.365 10 0 GGAEMN CC[C@H](NC(=O)N1CCN2CCCC[C@H]2C1)c1nc(C(F)(F)F)cs1 ZINC000245495175 565992835 /nfs/dbraw/zinc/99/28/35/565992835.db2.gz OXPPDNJXSKTXJG-RYUDHWBXSA-N 0 1 376.448 3.493 10 0 GGAEMN CC[C@@H](NC(=O)N1CCN2CCCC[C@H]2C1)c1nc(C(F)(F)F)cs1 ZINC000245495174 565993341 /nfs/dbraw/zinc/99/33/41/565993341.db2.gz OXPPDNJXSKTXJG-NWDGAFQWSA-N 0 1 376.448 3.493 10 0 GGAEMN COCCOc1c(Cl)cc(NC(=O)N2CCNC(C)(C)C2)cc1Cl ZINC000415401506 565993984 /nfs/dbraw/zinc/99/39/84/565993984.db2.gz HKPROVBECCEQOX-UHFFFAOYSA-N 0 1 376.284 3.234 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCCOCc2ccc(Cl)cc2Cl)n[nH]1 ZINC000179665180 565997244 /nfs/dbraw/zinc/99/72/44/565997244.db2.gz SBQMNKWTAREJTH-LLVKDONJSA-N 0 1 385.295 3.472 10 0 GGAEMN Brc1ccc(-n2cc(CN3CCC(n4cncn4)CC3)cn2)cc1 ZINC000179702628 566001414 /nfs/dbraw/zinc/00/14/14/566001414.db2.gz RZUQTAUEKXYMEI-UHFFFAOYSA-N 0 1 387.285 3.063 10 0 GGAEMN O[C@@H](CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1)c1cccc(Br)c1 ZINC000245717490 566003663 /nfs/dbraw/zinc/00/36/63/566003663.db2.gz GWSAQKOWNZXYIJ-ZBFHGGJFSA-N 0 1 391.313 3.358 10 0 GGAEMN CCOC(=O)c1c[nH]c(NC(=O)C(C)(C)c2cccc(Br)c2)n1 ZINC000415638573 566011184 /nfs/dbraw/zinc/01/11/84/566011184.db2.gz OHVCTTIAPCZIID-UHFFFAOYSA-N 0 1 380.242 3.265 10 0 GGAEMN CC(C)C(=O)N1CCC[C@H]1C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000179819288 566011227 /nfs/dbraw/zinc/01/12/27/566011227.db2.gz PGVSMKCJJLYRRL-LBPRGKRZSA-N 0 1 389.677 3.394 10 0 GGAEMN Cc1ccc(I)cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000245965988 566011814 /nfs/dbraw/zinc/01/18/14/566011814.db2.gz DRDSIWUDAYPYTL-GXTWGEPZSA-N 0 1 386.277 3.154 10 0 GGAEMN O[C@@H](C[N@H+]1CCC[C@@H](c2nncn2C2CC2)C1)c1cccc(Br)c1 ZINC000245958910 566012586 /nfs/dbraw/zinc/01/25/86/566012586.db2.gz CZXMIFPLOZTULT-PBHICJAKSA-N 0 1 391.313 3.289 10 0 GGAEMN O[C@@H](CN1CCC[C@@H](c2nncn2C2CC2)C1)c1cccc(Br)c1 ZINC000245958910 566012590 /nfs/dbraw/zinc/01/25/90/566012590.db2.gz CZXMIFPLOZTULT-PBHICJAKSA-N 0 1 391.313 3.289 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2ccc(Cl)nc2)[C@H]1c1cccs1 ZINC000246072117 566014582 /nfs/dbraw/zinc/01/45/82/566014582.db2.gz FBVGAWAHKHZRQB-YOEHRIQHSA-N 0 1 399.969 3.299 10 0 GGAEMN O=C(CCOc1cccc(Br)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000363657890 566015961 /nfs/dbraw/zinc/01/59/61/566015961.db2.gz IEKLXLQVCBTAMV-UHFFFAOYSA-N 0 1 378.270 3.347 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C[C@H](C)O ZINC000246129431 566017726 /nfs/dbraw/zinc/01/77/26/566017726.db2.gz QMCKFNLPWJURME-AAEUAGOBSA-N 0 1 378.822 3.276 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2ccc(F)cc2F)[C@H]1c1cccs1 ZINC000246105269 566017812 /nfs/dbraw/zinc/01/78/12/566017812.db2.gz HTNOZOYCNAGHBA-PXAZEXFGSA-N 0 1 386.489 3.388 10 0 GGAEMN Cc1cc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(C)cc1Br ZINC000246130547 566018617 /nfs/dbraw/zinc/01/86/17/566018617.db2.gz JQQGGNMIDLDMAU-KBPBESRZSA-N 0 1 389.359 3.169 10 0 GGAEMN Cc1cc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(C)cc1Br ZINC000246132221 566018737 /nfs/dbraw/zinc/01/87/37/566018737.db2.gz JQQGGNMIDLDMAU-UONOGXRCSA-N 0 1 389.359 3.169 10 0 GGAEMN CC(C)[C@@H](C)CNC(=O)c1c[nH]c2ccc(I)cc2c1=O ZINC000179961324 566021617 /nfs/dbraw/zinc/02/16/17/566021617.db2.gz AJLMYJLRNYGCEZ-JTQLQIEISA-N 0 1 398.244 3.155 10 0 GGAEMN O=C(Nc1cccc2c1CN(C1CC1)C2)c1cc(I)c[nH]1 ZINC000363862505 566024359 /nfs/dbraw/zinc/02/43/59/566024359.db2.gz JMKRCSWRUNRZIV-UHFFFAOYSA-N 0 1 393.228 3.350 10 0 GGAEMN CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2F)[C@@H](C)C1 ZINC000246274711 566024478 /nfs/dbraw/zinc/02/44/78/566024478.db2.gz VEJKOOVXBPVYLT-SMDDNHRTSA-N 0 1 382.423 3.195 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)CN1CCCC[C@H]1c1cn[nH]c1 ZINC000246299183 566026117 /nfs/dbraw/zinc/02/61/17/566026117.db2.gz BTWUTYRHWTZJTR-WBVHZDCISA-N 0 1 380.286 3.139 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)cc1Cl ZINC000246483446 566031009 /nfs/dbraw/zinc/03/10/09/566031009.db2.gz WYYCTQNKOPAEAC-GXFFZTMASA-N 0 1 381.325 3.009 10 0 GGAEMN C[C@@H](NC(=O)Nc1cc(Br)ccc1Br)c1nnc[nH]1 ZINC000180130656 566035293 /nfs/dbraw/zinc/03/52/93/566035293.db2.gz BLKMLRRJFXZWKF-ZCFIWIBFSA-N 0 1 389.051 3.212 10 0 GGAEMN CC(C)c1n[nH]c(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c1Br ZINC000180153571 566037842 /nfs/dbraw/zinc/03/78/42/566037842.db2.gz YHNHBAMUUQKCSO-SUMWQHHRSA-N 0 1 391.313 3.471 10 0 GGAEMN CN1CCCN(C(=O)Nc2cc(C(F)(F)F)cc(Br)n2)CC1 ZINC000287764056 566038201 /nfs/dbraw/zinc/03/82/01/566038201.db2.gz XNPYQSSLIFMKMB-UHFFFAOYSA-N 0 1 381.196 3.032 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@@H]1C ZINC000246753302 566039674 /nfs/dbraw/zinc/03/96/74/566039674.db2.gz ZOFCRKUNBCOGQP-JJRVBVJISA-N 0 1 382.346 3.362 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Cl)ccc2Br)CCN1C[C@H](C)O ZINC000246753836 566039904 /nfs/dbraw/zinc/03/99/04/566039904.db2.gz HFOCZYMKYVWMFM-WCQYABFASA-N 0 1 389.721 3.020 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@@H]1CC[N@@H+](C)C[C@H]1C ZINC000246753281 566039761 /nfs/dbraw/zinc/03/97/61/566039761.db2.gz ZOFCRKUNBCOGQP-CKEIUWERSA-N 0 1 382.346 3.362 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Cl)ccc2Br)CC[N@H+]1C[C@H](C)O ZINC000246753836 566039900 /nfs/dbraw/zinc/03/99/00/566039900.db2.gz HFOCZYMKYVWMFM-WCQYABFASA-N 0 1 389.721 3.020 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cccc(Br)c2Cl)CCN1C[C@@H](C)O ZINC000180175383 566040390 /nfs/dbraw/zinc/04/03/90/566040390.db2.gz NBONBDPONREMBL-NEPJUHHUSA-N 0 1 389.721 3.020 10 0 GGAEMN COc1ccc(Br)cc1C1(C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)CC1 ZINC000416177317 566041718 /nfs/dbraw/zinc/04/17/18/566041718.db2.gz LOWMLPVIUSFZRN-NSHDSACASA-N 0 1 392.297 3.268 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Br)cc1)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000246817622 566042835 /nfs/dbraw/zinc/04/28/35/566042835.db2.gz JRJAOBQKJAFUMI-LBTNJELSSA-N 0 1 381.314 3.403 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)CCN1C[C@H](C)O ZINC000246843067 566044477 /nfs/dbraw/zinc/04/44/77/566044477.db2.gz MMQLCUWDJVDUPZ-DRPJVOAASA-N 0 1 385.335 3.401 10 0 GGAEMN COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1nc(C)c(Cl)cc1Cl ZINC000180213845 566044973 /nfs/dbraw/zinc/04/49/73/566044973.db2.gz HOGZKLIOJZFWFP-UHFFFAOYSA-N 0 1 393.248 3.494 10 0 GGAEMN Cc1cc(NC(=O)[C@H](C)N2CC[C@@H](c3cnn(C)c3)C2)ccc1Br ZINC000246914904 566045919 /nfs/dbraw/zinc/04/59/19/566045919.db2.gz HPHNWMOYNKRFCQ-UONOGXRCSA-N 0 1 391.313 3.308 10 0 GGAEMN C[C@H]1C[N@H+]2CCC[C@H]2CN1Cc1nc(-c2cc(Br)cs2)no1 ZINC000246982395 566048736 /nfs/dbraw/zinc/04/87/36/566048736.db2.gz DYHFLPLHINMCNH-JQWIXIFHSA-N 0 1 383.315 3.229 10 0 GGAEMN COC(=O)c1cc(Br)cc(NC(=O)[C@@H]2CCCc3[nH]ncc32)c1C ZINC000416280738 566050605 /nfs/dbraw/zinc/05/06/05/566050605.db2.gz ZHHIZPLTPYAILO-LLVKDONJSA-N 0 1 392.253 3.326 10 0 GGAEMN C[C@@H]1CN(CCO)[C@@H](C)CN1C(=O)CCCc1cc(Cl)sc1Cl ZINC000416285056 566050716 /nfs/dbraw/zinc/05/07/16/566050716.db2.gz BLVJEDHDLUQGOY-NWDGAFQWSA-N 0 1 379.353 3.291 10 0 GGAEMN C[C@@H]1CN(CCO)[C@@H](C)CN1C(=O)CCCCc1ccc(Br)cc1 ZINC000416294323 566052326 /nfs/dbraw/zinc/05/23/26/566052326.db2.gz KUOPJJHOAUDHJF-JKSUJKDBSA-N 0 1 397.357 3.075 10 0 GGAEMN CS(=O)(=O)N1CCC[C@@H](CN2CCC[C@H]2c2nc3ccccc3s2)C1 ZINC000247107352 566053128 /nfs/dbraw/zinc/05/31/28/566053128.db2.gz DRRRQPXORHBYNR-HOCLYGCPSA-N 0 1 379.551 3.105 10 0 GGAEMN Cc1[nH]c(=S)sc1CC(=O)N[C@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000247116543 566053561 /nfs/dbraw/zinc/05/35/61/566053561.db2.gz GCXFKUUOWODKHV-DOMZBBRYSA-N 0 1 376.551 3.078 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2ccc(Br)c(O)c2)[C@H]1c1ccccc1 ZINC000247268227 566056745 /nfs/dbraw/zinc/05/67/45/566056745.db2.gz KDYYLYQZTSXTMI-DOTOQJQBSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2ccc(Br)c([O-])c2)[C@H]1c1ccccc1 ZINC000247268227 566056749 /nfs/dbraw/zinc/05/67/49/566056749.db2.gz KDYYLYQZTSXTMI-DOTOQJQBSA-N 0 1 375.266 3.330 10 0 GGAEMN CS(=O)(=O)N1CCC[C@@H](CN2CCc3sccc3[C@H]2c2cccs2)C1 ZINC000247415579 566060521 /nfs/dbraw/zinc/06/05/21/566060521.db2.gz ZYVOSVSCMGSBOX-KSSFIOAISA-N 0 1 396.603 3.429 10 0 GGAEMN C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000247493137 566062001 /nfs/dbraw/zinc/06/20/01/566062001.db2.gz UJYVVFCJSWPYIP-JQWIXIFHSA-N 0 1 382.835 3.216 10 0 GGAEMN CC[C@H]1CN([C@H](C)C(=O)Nc2cccc(Cl)c2Cl)CCN1CCOC ZINC000247601744 566064280 /nfs/dbraw/zinc/06/42/80/566064280.db2.gz LCHOIPPPMNODNS-KGLIPLIRSA-N 0 1 388.339 3.363 10 0 GGAEMN C[C@@H](NC[C@@H](O)COC(C)(C)C)c1cc2c(cc1Br)OCCO2 ZINC000180482682 566066412 /nfs/dbraw/zinc/06/64/12/566066412.db2.gz ZIHHPEAYIWYZEZ-VXGBXAGGSA-N 0 1 388.302 3.047 10 0 GGAEMN O=C(NCc1cccc(Br)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000364735053 566066656 /nfs/dbraw/zinc/06/66/56/566066656.db2.gz SKSGRGFYOVDWTB-OAHLLOKOSA-N 0 1 386.253 3.156 10 0 GGAEMN COc1cc([N-]S(=O)(=O)c2cc(C)sc2C)ccc1OCC[NH+](C)C ZINC000416423418 566067109 /nfs/dbraw/zinc/06/71/09/566067109.db2.gz VDCHGIAMZHRULW-UHFFFAOYSA-N 0 1 384.523 3.115 10 0 GGAEMN O=C1[C@H](N=c2ccc3ccc(Cl)c(Cl)c3[nH]2)CCN1C1CCOCC1 ZINC000364903337 566073973 /nfs/dbraw/zinc/07/39/73/566073973.db2.gz FJGCDGXROOSCMD-CQSZACIVSA-N 0 1 380.275 3.155 10 0 GGAEMN CNc1cc(N2CCC[C@H]2CN[C@H](C)c2ncc(Br)s2)ncn1 ZINC000180573568 566073965 /nfs/dbraw/zinc/07/39/65/566073965.db2.gz CIXJEMWBFYPHMG-MNOVXSKESA-N 0 1 397.346 3.057 10 0 GGAEMN CC(C)C[N@H+]1CCO[C@@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000248260453 566074817 /nfs/dbraw/zinc/07/48/17/566074817.db2.gz VYSGYBKWBMMFSF-ZFWWWQNUSA-N 0 1 389.323 3.234 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000248260453 566074820 /nfs/dbraw/zinc/07/48/20/566074820.db2.gz VYSGYBKWBMMFSF-ZFWWWQNUSA-N 0 1 389.323 3.234 10 0 GGAEMN CC(C)C[N@H+]1CCO[C@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000248260444 566074838 /nfs/dbraw/zinc/07/48/38/566074838.db2.gz VYSGYBKWBMMFSF-DZGCQCFKSA-N 0 1 389.323 3.234 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000248260444 566074839 /nfs/dbraw/zinc/07/48/39/566074839.db2.gz VYSGYBKWBMMFSF-DZGCQCFKSA-N 0 1 389.323 3.234 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)CN1CCCN(CC(F)F)CC1 ZINC000180584957 566074882 /nfs/dbraw/zinc/07/48/82/566074882.db2.gz AWVFVGXTOJMBMX-LBPRGKRZSA-N 0 1 383.266 3.006 10 0 GGAEMN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCCN(CC(F)F)CC1 ZINC000180584941 566075054 /nfs/dbraw/zinc/07/50/54/566075054.db2.gz AWVFVGXTOJMBMX-GFCCVEGCSA-N 0 1 383.266 3.006 10 0 GGAEMN COC(C)(C)CS(=O)(=O)N1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000416536908 566083431 /nfs/dbraw/zinc/08/34/31/566083431.db2.gz RDLJLBCDEBVJSR-OAHLLOKOSA-N 0 1 385.917 3.498 10 0 GGAEMN CC(C)n1ncc2c1C[C@H](NCc1c(Cl)cccc1S(C)(=O)=O)CC2 ZINC000365143620 566085184 /nfs/dbraw/zinc/08/51/84/566085184.db2.gz VXGOHALHHAJLMO-CQSZACIVSA-N 0 1 381.929 3.168 10 0 GGAEMN C[C@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(F)c(Cl)c1 ZINC000180736075 566085962 /nfs/dbraw/zinc/08/59/62/566085962.db2.gz ZXCPRLJPNIPHQQ-NSHDSACASA-N 0 1 384.860 3.172 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccoc1Br ZINC000248845072 566090174 /nfs/dbraw/zinc/09/01/74/566090174.db2.gz SVJJTROOGNRVKB-SWLSCSKDSA-N 0 1 378.270 3.078 10 0 GGAEMN Cc1nn(C)c(C)c1CCCNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000180814371 566091355 /nfs/dbraw/zinc/09/13/55/566091355.db2.gz FJIRRHDEKHDQBI-UHFFFAOYSA-N 0 1 390.285 3.038 10 0 GGAEMN CCS(=O)(=O)C[C@@H](C)N[C@@H]1CCCOc2ccc(Br)cc21 ZINC000180821647 566091959 /nfs/dbraw/zinc/09/19/59/566091959.db2.gz VMJABMSBSTWEDD-BXUZGUMPSA-N 0 1 376.316 3.076 10 0 GGAEMN O[C@H](C[N@H+]1CCCN(c2nnc(C(F)(F)F)s2)CC1)C1CCCCC1 ZINC000365274711 566092677 /nfs/dbraw/zinc/09/26/77/566092677.db2.gz BXMFXCLPBSAOJM-CYBMUJFWSA-N 0 1 378.464 3.010 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)CCc2cccs2)[C@H]1c1cccs1 ZINC000248891774 566093390 /nfs/dbraw/zinc/09/33/90/566093390.db2.gz WKKQUTNFGSPHNK-PBHICJAKSA-N 0 1 384.592 3.355 10 0 GGAEMN CCS(=O)(=O)CCCCCN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000248975827 566094524 /nfs/dbraw/zinc/09/45/24/566094524.db2.gz DNPHZMMIBBUKJJ-SJORKVTESA-N 0 1 394.364 3.488 10 0 GGAEMN O=C1[C@H](N2CC[C@@]3(O)CCCC[C@H]3C2)CCN1c1cccc(Br)c1 ZINC000249317331 566100133 /nfs/dbraw/zinc/10/01/33/566100133.db2.gz PSBOXSRWWJMZMH-YJLNNSPDSA-N 0 1 393.325 3.181 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N2CCCC[C@@H]2c2nnc[nH]2)cc1Cl ZINC000180939387 566101451 /nfs/dbraw/zinc/10/14/51/566101451.db2.gz POFCKXJXNQRQNX-LLVKDONJSA-N 0 1 391.280 3.036 10 0 GGAEMN O=S(=O)(C=Cc1ccc(Br)cc1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000180934736 566101630 /nfs/dbraw/zinc/10/16/30/566101630.db2.gz AEHPAKPFBYJEIW-PLWJUESGSA-N 0 1 397.298 3.095 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](CCO)c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000289028686 566102133 /nfs/dbraw/zinc/10/21/33/566102133.db2.gz ASTKWLLJTDTCAC-QFYYESIMSA-N 0 1 385.295 3.379 10 0 GGAEMN Cc1ccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1O ZINC000181017037 566105862 /nfs/dbraw/zinc/10/58/62/566105862.db2.gz HAXKDPUOXOFFJO-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN Cc1ccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1O ZINC000181017037 566105868 /nfs/dbraw/zinc/10/58/68/566105868.db2.gz HAXKDPUOXOFFJO-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN COc1cc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc(OC)c1O ZINC000289207715 566111304 /nfs/dbraw/zinc/11/13/04/566111304.db2.gz BVOMZEGDIJWVBC-SFHVURJKSA-N 0 1 396.281 3.169 10 0 GGAEMN C[C@@H]1CN(C(=O)Nc2ccc(Cl)c(Br)c2)[C@H](C)CN1CCO ZINC000416929189 566113388 /nfs/dbraw/zinc/11/33/88/566113388.db2.gz ZXHVPFNHUYRREX-GHMZBOCLSA-N 0 1 390.709 3.021 10 0 GGAEMN C[C@H]1CN(C(=O)Nc2ccc(Br)c(Cl)c2)[C@@H](C)CN1CCO ZINC000416941689 566114210 /nfs/dbraw/zinc/11/42/10/566114210.db2.gz IJPOMYJRKPPLHL-QWRGUYRKSA-N 0 1 390.709 3.021 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)Nc3cc(Br)ccc3F)cn21 ZINC000416945182 566114362 /nfs/dbraw/zinc/11/43/62/566114362.db2.gz DUVVIGDFFGGOAL-SECBINFHSA-N 0 1 388.262 3.483 10 0 GGAEMN COC(=O)c1cccc(NS(=O)(=O)c2cn3c(n2)CCC[C@H]3C)c1Cl ZINC000416951699 566114892 /nfs/dbraw/zinc/11/48/92/566114892.db2.gz FZSJKJZXRXIHHX-SNVBAGLBSA-N 0 1 383.857 3.021 10 0 GGAEMN CC(C)c1cc(Br)ccc1NC(=O)N1C[C@@H](C)N(CCO)C[C@H]1C ZINC000416969016 566116649 /nfs/dbraw/zinc/11/66/49/566116649.db2.gz ZRXOXGYIBPUSSI-ZIAGYGMSSA-N 0 1 398.345 3.491 10 0 GGAEMN CCOc1c(Cl)cc(NC(=O)N2C[C@H](C)N(CCO)C[C@@H]2C)cc1Cl ZINC000416995659 566118082 /nfs/dbraw/zinc/11/80/82/566118082.db2.gz LQGCBMYWCCXXJZ-RYUDHWBXSA-N 0 1 390.311 3.311 10 0 GGAEMN CCOCc1nc([C@@H](C)NS(=O)(=O)c2cc(Cl)sc2Cl)no1 ZINC000289417755 566120800 /nfs/dbraw/zinc/12/08/00/566120800.db2.gz BNYJJJLNEUOFMN-ZCFIWIBFSA-N 0 1 386.282 3.014 10 0 GGAEMN C[C@@H](NC(=O)[C@](C)(N)c1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000261629457 566126772 /nfs/dbraw/zinc/12/67/72/566126772.db2.gz BRBQAILQOMYQFP-ADLMAVQZSA-N 0 1 391.265 3.229 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CC(=O)Nc1ccc(Br)cc1 ZINC000261718315 566130374 /nfs/dbraw/zinc/13/03/74/566130374.db2.gz LTRWAYPJCACANA-UGFHNGPFSA-N 0 1 381.270 3.105 10 0 GGAEMN Cc1ccc2c(c1C)OC[C@H]2NC(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261729192 566130424 /nfs/dbraw/zinc/13/04/24/566130424.db2.gz KUEQRUMHACHJIY-APWZRJJASA-N 0 1 389.293 3.490 10 0 GGAEMN Cc1ccc2c(c1C)OC[C@H]2NC(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000261729199 566130760 /nfs/dbraw/zinc/13/07/60/566130760.db2.gz KUEQRUMHACHJIY-VQIMIIECSA-N 0 1 389.293 3.490 10 0 GGAEMN Cc1cccc(C(=O)N2CCCC[C@@H]2c2nnc[nH]2)c1I ZINC000181364121 566135898 /nfs/dbraw/zinc/13/58/98/566135898.db2.gz RAGAQOUTJQSRTE-GFCCVEGCSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1cccc(C(=O)N2CCCC[C@H]2c2nnc[nH]2)c1I ZINC000181364140 566136272 /nfs/dbraw/zinc/13/62/72/566136272.db2.gz RAGAQOUTJQSRTE-LBPRGKRZSA-N 0 1 396.232 3.085 10 0 GGAEMN C[C@](N)(C(=O)N1CCC[C@]2(CCCOC2)C1)c1ccc(Br)cc1 ZINC000261823904 566136548 /nfs/dbraw/zinc/13/65/48/566136548.db2.gz SWYNYPHQOSQXLO-MSOLQXFVSA-N 0 1 381.314 3.042 10 0 GGAEMN COc1cc2c(cc1F)nccc2N1CCn2c(Br)cnc2C1 ZINC000289706190 566136892 /nfs/dbraw/zinc/13/68/92/566136892.db2.gz REPQTEDQJAXNMM-UHFFFAOYSA-N 0 1 377.217 3.362 10 0 GGAEMN COc1cc(Br)c(CN[C@H]2CCCc3[nH]c(=O)ccc32)cc1O ZINC000289699393 566136930 /nfs/dbraw/zinc/13/69/30/566136930.db2.gz FYAZWZUSHQGDBO-ZDUSSCGKSA-N 0 1 379.254 3.431 10 0 GGAEMN O=C(CSc1cccc(Br)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181373083 566137426 /nfs/dbraw/zinc/13/74/26/566137426.db2.gz FZHSVSLOTRLNTG-CYBMUJFWSA-N 0 1 381.299 3.413 10 0 GGAEMN O=C(c1c(F)cccc1I)N1CCC(c2cnc[nH]2)CC1 ZINC000366188898 566139123 /nfs/dbraw/zinc/13/91/23/566139123.db2.gz CRJULLLPNLGRHL-UHFFFAOYSA-N 0 1 399.207 3.173 10 0 GGAEMN C[C@](N)(C(=O)N1CCO[C@H](c2ccsc2)C1)c1ccc(Br)cc1 ZINC000261869027 566139534 /nfs/dbraw/zinc/13/95/34/566139534.db2.gz XSJVGOASXGNYLD-DOTOQJQBSA-N 0 1 395.322 3.285 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C[C@@H](C)O ZINC000181470088 566142940 /nfs/dbraw/zinc/14/29/40/566142940.db2.gz BTJQZWQUZIWYEN-DGCLKSJQSA-N 0 1 378.822 3.276 10 0 GGAEMN Cc1nc(SC(F)(F)F)sc1CC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000366288715 566144976 /nfs/dbraw/zinc/14/49/76/566144976.db2.gz QTWGTDUCZVQDDJ-QMMMGPOBSA-N 0 1 376.429 3.003 10 0 GGAEMN COC(=O)CCCCCNCc1ncc(Br)cc1Br ZINC000289877195 566145469 /nfs/dbraw/zinc/14/54/69/566145469.db2.gz RSKJTOFAEQJOCI-UHFFFAOYSA-N 0 1 394.107 3.430 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCCN[C@H]2CCCOc3ccc(C)cc32)s1 ZINC000181511988 566146681 /nfs/dbraw/zinc/14/66/81/566146681.db2.gz DMQRKCJMJYPXGE-INIZCTEOSA-N 0 1 380.535 3.147 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)Nc3cccc4c3OCC[C@@H]4O)cc2s1 ZINC000366356851 566147651 /nfs/dbraw/zinc/14/76/51/566147651.db2.gz HCEZZNRKCKTFOZ-HNNXBMFYSA-N 0 1 376.459 3.221 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C[C@@]2(CCOC2)O1 ZINC000366520722 566156055 /nfs/dbraw/zinc/15/60/55/566156055.db2.gz KIOSJKHKUMYLQP-PIGZYNQJSA-N 0 1 381.885 3.202 10 0 GGAEMN Fc1ccc(CN2CCC[C@H]3COCC[C@H]32)c(I)c1 ZINC000417778737 566175119 /nfs/dbraw/zinc/17/51/19/566175119.db2.gz GENWLBXLYRBCHG-SWLSCSKDSA-N 0 1 375.225 3.431 10 0 GGAEMN O=C(N1CCC(c2cnc[nH]2)CC1)C1(c2cncc(Br)c2)CC1 ZINC000366976747 566179274 /nfs/dbraw/zinc/17/92/74/566179274.db2.gz ZLOPQXXEVIFMKF-UHFFFAOYSA-N 0 1 375.270 3.005 10 0 GGAEMN Cc1cn[nH]c1C[NH+]1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000290581714 566179557 /nfs/dbraw/zinc/17/95/57/566179557.db2.gz ZMZPDMKEBFPHQY-UHFFFAOYSA-N 0 1 377.286 3.331 10 0 GGAEMN COc1ccc(Br)cc1CNCc1ccccc1C(=O)N(C)C ZINC000417905774 566180336 /nfs/dbraw/zinc/18/03/36/566180336.db2.gz APYGYNNHQARJPT-UHFFFAOYSA-N 0 1 377.282 3.449 10 0 GGAEMN O=C(Nc1nc2c(s1)COCC2)c1cc(Br)cc2nc[nH]c21 ZINC000367091417 566184664 /nfs/dbraw/zinc/18/46/64/566184664.db2.gz JXBSZISPMULNOE-UHFFFAOYSA-N 0 1 379.239 3.107 10 0 GGAEMN O=C([O-])[C@@H]1C[N@H+](Cc2cc(Br)cc3c2OCC3)C[C@H]1C(F)(F)F ZINC000263458616 566185996 /nfs/dbraw/zinc/18/59/96/566185996.db2.gz BGUBOOBTQCIUFH-VXGBXAGGSA-N 0 1 394.187 3.079 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](Cc2cc(Br)cc3c2OCC3)C[C@H]1C(F)(F)F ZINC000263458616 566185999 /nfs/dbraw/zinc/18/59/99/566185999.db2.gz BGUBOOBTQCIUFH-VXGBXAGGSA-N 0 1 394.187 3.079 10 0 GGAEMN C[C@H](CS(C)(=O)=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000367163564 566188145 /nfs/dbraw/zinc/18/81/45/566188145.db2.gz KOZGWQZBXDWCIQ-QNBCLJFBSA-N 0 1 384.973 3.277 10 0 GGAEMN COc1cc(Br)c(C[N@@H+]2[C@H](C(=O)[O-])C[C@@H]3CCCC[C@@H]32)cc1O ZINC000263521391 566188352 /nfs/dbraw/zinc/18/83/52/566188352.db2.gz RDTHQTSWWNUHHN-BPNCWPANSA-N 0 1 384.270 3.381 10 0 GGAEMN C[C@@H](CS(C)(=O)=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000367163563 566188536 /nfs/dbraw/zinc/18/85/36/566188536.db2.gz KOZGWQZBXDWCIQ-QKHUXGNCSA-N 0 1 384.973 3.277 10 0 GGAEMN Cc1cccc(Cl)c1NC(=O)CN[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000182194293 566188909 /nfs/dbraw/zinc/18/89/09/566188909.db2.gz LQRTUMIFFSIADY-CYBMUJFWSA-N 0 1 380.897 3.341 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(c2nnc(-c3ccccc3Cl)s2)CC1 ZINC000263550938 566189966 /nfs/dbraw/zinc/18/99/66/566189966.db2.gz KVQPXUJPGHVVST-GFCCVEGCSA-N 0 1 380.901 3.234 10 0 GGAEMN O=C1CC[C@@H](NCc2coc(-c3ccc(Br)cc3)n2)C2(CCC2)N1 ZINC000367251277 566193407 /nfs/dbraw/zinc/19/34/07/566193407.db2.gz FENQAYUQMBWHTI-OAHLLOKOSA-N 0 1 390.281 3.395 10 0 GGAEMN FC(F)(F)c1nc(N2CCC[C@@H](c3nc[nH]n3)C2)ccc1Br ZINC000367279363 566194703 /nfs/dbraw/zinc/19/47/03/566194703.db2.gz UYUFGTNAQPQJGO-MRVPVSSYSA-N 0 1 376.180 3.365 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3ccc(Br)s3)C2=O)n(C)n1 ZINC000182345999 566198103 /nfs/dbraw/zinc/19/81/03/566198103.db2.gz JPPHHHJZWLVMMF-NWDGAFQWSA-N 0 1 397.342 3.399 10 0 GGAEMN C[C@H](Cn1cncn1)NCc1csc(-c2cccc(Br)c2)n1 ZINC000263886735 566199981 /nfs/dbraw/zinc/19/99/81/566199981.db2.gz IYXIVAGMFVSFLR-LLVKDONJSA-N 0 1 378.299 3.342 10 0 GGAEMN O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000418199803 566203402 /nfs/dbraw/zinc/20/34/02/566203402.db2.gz JSKWYDIPPSZOOW-AMPCRFMZSA-N 0 1 378.314 3.231 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N(C)CCc2cccc(Br)c2)n[nH]1 ZINC000291156379 566206738 /nfs/dbraw/zinc/20/67/38/566206738.db2.gz FHIBQNAMAGAFTB-LBPRGKRZSA-N 0 1 379.302 3.296 10 0 GGAEMN CN1CC[C@@H](NCc2ncc(I)s2)[C@H]1c1ccccc1 ZINC000367603364 566209197 /nfs/dbraw/zinc/20/91/97/566209197.db2.gz ZIFHXJSGCBFJFQ-IUODEOHRSA-N 0 1 399.301 3.283 10 0 GGAEMN CCc1cnccc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000182532239 566210861 /nfs/dbraw/zinc/21/08/61/566210861.db2.gz PHYNHDUHHMPVMO-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN CCc1cnccc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000182532239 566210866 /nfs/dbraw/zinc/21/08/66/566210866.db2.gz PHYNHDUHHMPVMO-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN O=C(Cc1cccs1)N1CCC[C@H]1C(=O)Nc1cc(Cl)c(O)cc1F ZINC000367789451 566217170 /nfs/dbraw/zinc/21/71/70/566217170.db2.gz ZBXPHDCQEZQFFY-AWEZNQCLSA-N 0 1 382.844 3.418 10 0 GGAEMN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CCCC[C@@H]1c1nnc[nH]1 ZINC000182733666 566221164 /nfs/dbraw/zinc/22/11/64/566221164.db2.gz KIDDIWUIXXQQEX-OAHLLOKOSA-N 0 1 382.295 3.297 10 0 GGAEMN CS(=O)(=O)c1ccc([C@H](O)CN2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000264750134 566223381 /nfs/dbraw/zinc/22/33/81/566223381.db2.gz VFTLUMGSTSRRBY-VQIMIIECSA-N 0 1 379.909 3.266 10 0 GGAEMN Cc1cn[nH]c1CN(C)Cc1cccc(Br)c1OCC(C)(C)O ZINC000291530362 566223892 /nfs/dbraw/zinc/22/38/92/566223892.db2.gz KEPISQFCYPIOPX-UHFFFAOYSA-N 0 1 382.302 3.262 10 0 GGAEMN CC(C)c1scnc1C(=O)N1CC[C@H](C)[C@H](NC(=O)C(F)(F)F)[C@@H]1C ZINC000291635822 566228507 /nfs/dbraw/zinc/22/85/07/566228507.db2.gz BJGIBOIJYWINOX-DCAQKATOSA-N 0 1 377.432 3.184 10 0 GGAEMN Cc1ccc(NC(=O)[C@H](C)N[C@H](CO)c2ccccc2)c(Br)c1 ZINC000182922897 566230231 /nfs/dbraw/zinc/23/02/31/566230231.db2.gz LQGIHTAERWBBGP-SUMWQHHRSA-N 0 1 377.282 3.408 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H](C)N[C@H](CO)c2ccccc2)c(Br)c1 ZINC000182922873 566230437 /nfs/dbraw/zinc/23/04/37/566230437.db2.gz LQGIHTAERWBBGP-CXAGYDPISA-N 0 1 377.282 3.408 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H](C)N[C@@H](CO)c2ccccc2)c(Br)c1 ZINC000182922835 566230507 /nfs/dbraw/zinc/23/05/07/566230507.db2.gz LQGIHTAERWBBGP-DYVFJYSZSA-N 0 1 377.282 3.408 10 0 GGAEMN C[C@@H](NCC(=O)N1CCN(Cc2cccs2)CC1)c1ccc(Cl)s1 ZINC000182958027 566232029 /nfs/dbraw/zinc/23/20/29/566232029.db2.gz ZEIGIPXFBCDLNK-CYBMUJFWSA-N 0 1 383.970 3.458 10 0 GGAEMN C[C@@H]1CN(Cc2csc(Cc3ccc(Cl)cc3)n2)[C@@H](C)CN1CCO ZINC000419324660 566232519 /nfs/dbraw/zinc/23/25/19/566232519.db2.gz KEHNXUQLYFXQOA-CABCVRRESA-N 0 1 379.957 3.274 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000368193052 566232997 /nfs/dbraw/zinc/23/29/97/566232997.db2.gz BBCQCYVXMKAIBP-PWSUYJOCSA-N 0 1 395.276 3.099 10 0 GGAEMN C[C@H](NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1F ZINC000368207386 566233064 /nfs/dbraw/zinc/23/30/64/566233064.db2.gz FARUXVDCBNBBEN-ONGXEEELSA-N 0 1 381.249 3.229 10 0 GGAEMN C[C@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1F ZINC000368207385 566233381 /nfs/dbraw/zinc/23/33/81/566233381.db2.gz FARUXVDCBNBBEN-GXSJLCMTSA-N 0 1 381.249 3.229 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCC2CCC(F)(F)CC2)C1 ZINC000419599130 566239132 /nfs/dbraw/zinc/23/91/32/566239132.db2.gz DPKYGGFGEWIXJL-MRXNPFEDSA-N 0 1 378.529 3.018 10 0 GGAEMN O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505076 566240613 /nfs/dbraw/zinc/24/06/13/566240613.db2.gz UHHRCSIOCVUENL-SMDDNHRTSA-N 0 1 378.270 3.081 10 0 GGAEMN O=C(Nc1cccc2c1OCC[C@@H]2O)c1cc(Br)cc2nc[nH]c21 ZINC000368527720 566241153 /nfs/dbraw/zinc/24/11/53/566241153.db2.gz MAPUGZGMROEPAP-AWEZNQCLSA-N 0 1 388.221 3.394 10 0 GGAEMN Cc1nn(C(C)(C)C)cc1[C@H](C)NCc1ccc(S(N)(=O)=O)c(Cl)c1 ZINC000419678447 566241296 /nfs/dbraw/zinc/24/12/96/566241296.db2.gz DUNSAPWJQPGWDR-NSHDSACASA-N 0 1 384.933 3.098 10 0 GGAEMN O=S(=O)(Nc1cccc2c1OCC[C@@H]2O)c1ccc(Br)cc1 ZINC000368651714 566243589 /nfs/dbraw/zinc/24/35/89/566243589.db2.gz HNMFLUSCPNETQU-AWEZNQCLSA-N 0 1 384.251 3.066 10 0 GGAEMN CC[C@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1nccn1C ZINC000183325595 566244145 /nfs/dbraw/zinc/24/41/45/566244145.db2.gz YLIZBEREGRJOEU-ZDUSSCGKSA-N 0 1 375.274 3.209 10 0 GGAEMN CC[C@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1nccn1C ZINC000183325595 566244147 /nfs/dbraw/zinc/24/41/47/566244147.db2.gz YLIZBEREGRJOEU-ZDUSSCGKSA-N 0 1 375.274 3.209 10 0 GGAEMN O=C(Cc1cc(Br)ccc1F)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000368820289 566245791 /nfs/dbraw/zinc/24/57/91/566245791.db2.gz DBIPTWFRAWPYEA-INIZCTEOSA-N 0 1 389.228 3.155 10 0 GGAEMN Cc1nn(C)c(C)c1CCNCc1cn(-c2ccc(Cl)c(Cl)c2)nn1 ZINC000183426623 566246745 /nfs/dbraw/zinc/24/67/45/566246745.db2.gz FCEBDLKZFRDMSD-UHFFFAOYSA-N 0 1 379.295 3.257 10 0 GGAEMN COc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(Cl)c1Cl ZINC000266195595 566247254 /nfs/dbraw/zinc/24/72/54/566247254.db2.gz NNIAQMSAQXFYKQ-WDEREUQCSA-N 0 1 381.325 3.105 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC12CCOCC2 ZINC000368897223 566247116 /nfs/dbraw/zinc/24/71/16/566247116.db2.gz YIDWJXWSBDIRDY-UHFFFAOYSA-N 0 1 376.254 3.234 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000183483468 566247865 /nfs/dbraw/zinc/24/78/65/566247865.db2.gz WDSHTPJWUGZCFN-QGZVFWFLSA-N 0 1 390.281 3.124 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000183538321 566248598 /nfs/dbraw/zinc/24/85/98/566248598.db2.gz JLTANEYNEXFCLB-QGZVFWFLSA-N 0 1 390.281 3.124 10 0 GGAEMN O=C(CCc1cnc[nH]1)N1CCC[C@@H]1c1ccccc1I ZINC000369128219 566249913 /nfs/dbraw/zinc/24/99/13/566249913.db2.gz RMMBUSBRDRRPQO-OAHLLOKOSA-N 0 1 395.244 3.311 10 0 GGAEMN O=C(CCc1cnc[nH]1)N1CCC[C@H]1c1ccccc1I ZINC000369128218 566249956 /nfs/dbraw/zinc/24/99/56/566249956.db2.gz RMMBUSBRDRRPQO-HNNXBMFYSA-N 0 1 395.244 3.311 10 0 GGAEMN CN(C)C(=O)c1ccc(NS(=O)(=O)Cc2c(Cl)cccc2Cl)nc1 ZINC000481842885 566255584 /nfs/dbraw/zinc/25/55/84/566255584.db2.gz HUNFCHSJZFMSHY-UHFFFAOYSA-N 0 1 388.276 3.032 10 0 GGAEMN CNC(=O)C[C@@H](NCc1cc(Br)c(OC)s1)c1ccccc1 ZINC000481840072 566256122 /nfs/dbraw/zinc/25/61/22/566256122.db2.gz USVWFZQVJAVBKF-CQSZACIVSA-N 0 1 383.311 3.486 10 0 GGAEMN CN(C)C(=O)N(C)[C@H]1CCN(Cc2cc3cc(Br)ccc3o2)C1 ZINC000668689253 566256651 /nfs/dbraw/zinc/25/66/51/566256651.db2.gz VFRNFXGIQRCHOR-AWEZNQCLSA-N 0 1 380.286 3.383 10 0 GGAEMN CN(C(=O)c1cc2c(cncc2Br)s1)[C@@H]1CCN(C2CC2)C1 ZINC000648285023 566256752 /nfs/dbraw/zinc/25/67/52/566256752.db2.gz YHMCPNISFLIUPS-LLVKDONJSA-N 0 1 380.311 3.368 10 0 GGAEMN C[C@H](CN1CCC(C)(c2cccc(Br)c2)CC1)CS(C)(=O)=O ZINC000509052201 566256882 /nfs/dbraw/zinc/25/68/82/566256882.db2.gz CUNMHBSSRAIUEN-CQSZACIVSA-N 0 1 388.371 3.483 10 0 GGAEMN [O-]c1c(Br)cc(C[N@@H+]2CC[C@H]3COC[C@@H]3C2)cc1Br ZINC000668705218 566258122 /nfs/dbraw/zinc/25/81/22/566258122.db2.gz HBPDGPLAZGODIY-QWRGUYRKSA-N 0 1 391.103 3.386 10 0 GGAEMN [O-]c1c(Br)cc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)cc1Br ZINC000668705218 566258130 /nfs/dbraw/zinc/25/81/30/566258130.db2.gz HBPDGPLAZGODIY-QWRGUYRKSA-N 0 1 391.103 3.386 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@@H]2CC(=O)N(c3ccccc3Br)C2)n1 ZINC000575180059 566258538 /nfs/dbraw/zinc/25/85/38/566258538.db2.gz APBZZCMMWAFQSA-DGCLKSJQSA-N 0 1 393.285 3.399 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@@H]2CC(=O)N(c3ccccc3Br)C2)n1 ZINC000575180061 566258622 /nfs/dbraw/zinc/25/86/22/566258622.db2.gz APBZZCMMWAFQSA-YPMHNXCESA-N 0 1 393.285 3.399 10 0 GGAEMN CN(C)Cc1ccc(NS(=O)(=O)c2ccc3c(c2)N(C)CC3)cc1Cl ZINC000481869353 566259920 /nfs/dbraw/zinc/25/99/20/566259920.db2.gz OHQIEGZCPWCCGJ-UHFFFAOYSA-N 0 1 379.913 3.195 10 0 GGAEMN Cc1cc(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c(Br)s1 ZINC000534849929 566260311 /nfs/dbraw/zinc/26/03/11/566260311.db2.gz KMWJUGVPWGTRGY-UHFFFAOYSA-N 0 1 379.239 3.047 10 0 GGAEMN CC(C)OC1CCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000575201440 566260348 /nfs/dbraw/zinc/26/03/48/566260348.db2.gz ZUHGKIWMHSVLHA-UHFFFAOYSA-N 0 1 393.281 3.320 10 0 GGAEMN O=c1cc(CN2CC[C@H](CC(F)(F)F)C2)nc2ccc(Br)cn12 ZINC000555975961 566264630 /nfs/dbraw/zinc/26/46/30/566264630.db2.gz HYHNPTSXEZDPKV-SNVBAGLBSA-N 0 1 390.203 3.231 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C[C@H](C)n3cc(Br)cn3)[nH]c21 ZINC000648340666 566266336 /nfs/dbraw/zinc/26/63/36/566266336.db2.gz TVXGXWUJZSADHS-NSHDSACASA-N 0 1 376.258 3.098 10 0 GGAEMN OCCCOC1CCN(Cc2ccnc3c(Br)cccc23)CC1 ZINC000648378045 566274818 /nfs/dbraw/zinc/27/48/18/566274818.db2.gz OIYKMUNUUZHFCY-UHFFFAOYSA-N 0 1 379.298 3.361 10 0 GGAEMN CC(C)N(CCN(C)C)S(=O)(=O)c1c(Cl)cccc1Br ZINC000509206091 566276356 /nfs/dbraw/zinc/27/63/56/566276356.db2.gz SOUXEJQPAKBURM-UHFFFAOYSA-N 0 1 383.739 3.063 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)N[C@H](C)CN(C)Cc1ccccc1 ZINC000625110790 566277381 /nfs/dbraw/zinc/27/73/81/566277381.db2.gz FCZKZQJAJMNAQX-OAHLLOKOSA-N 0 1 376.513 3.498 10 0 GGAEMN CCc1ncc(NS(=O)(=O)c2c(Cl)cccc2Br)cn1 ZINC000509217460 566277835 /nfs/dbraw/zinc/27/78/35/566277835.db2.gz ABYRIVHUZFOFOI-UHFFFAOYSA-N 0 1 376.663 3.256 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1 ZINC000462302368 566278562 /nfs/dbraw/zinc/27/85/62/566278562.db2.gz XVFWJBGINCEQFL-DZGCQCFKSA-N 0 1 389.359 3.169 10 0 GGAEMN CCO[C@H](CN1CCN(C(=O)c2ccc(Br)cc2)CC1)C1CC1 ZINC000625130634 566279424 /nfs/dbraw/zinc/27/94/24/566279424.db2.gz VEYZVEXRENFHLD-QGZVFWFLSA-N 0 1 381.314 3.022 10 0 GGAEMN COc1cc(Br)c(CNCCc2cnc(C3CC3)nc2)c(OC)c1 ZINC000535187307 566285728 /nfs/dbraw/zinc/28/57/28/566285728.db2.gz WYBRKHKVERSXAP-UHFFFAOYSA-N 0 1 392.297 3.466 10 0 GGAEMN CC(C)COCCc1nc(-c2nc(-c3cccc(Br)c3)n[nH]2)no1 ZINC000556328088 566285872 /nfs/dbraw/zinc/28/58/72/566285872.db2.gz MGRMQGSEJXXICV-UHFFFAOYSA-N 0 1 392.257 3.499 10 0 GGAEMN CC(C)N1CCC[C@@H](NS(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509284737 566286122 /nfs/dbraw/zinc/28/61/22/566286122.db2.gz WXNWHQFDLZZWSU-LLVKDONJSA-N 0 1 395.750 3.254 10 0 GGAEMN Cc1cc(F)ccc1S(=O)(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000482144091 566286709 /nfs/dbraw/zinc/28/67/09/566286709.db2.gz UNOVCUYTTYGQLF-UHFFFAOYSA-N 0 1 386.558 3.164 10 0 GGAEMN COc1cc(-c2noc(-c3cc(C(C)=O)cn3C)n2)cc(Br)c1O ZINC000445394994 566287685 /nfs/dbraw/zinc/28/76/85/566287685.db2.gz SEUUXMCKDCZSOH-UHFFFAOYSA-N 0 1 392.209 3.421 10 0 GGAEMN C[C@H](c1ccc(Br)cc1)N1CCN(CCOC2CCOCC2)CC1 ZINC000625192368 566289544 /nfs/dbraw/zinc/28/95/44/566289544.db2.gz TVNWEJYHSOMHSQ-MRXNPFEDSA-N 0 1 397.357 3.323 10 0 GGAEMN COC[C@@H](NS(=O)(=O)c1cccc(Br)c1Cl)c1ccco1 ZINC000556376290 566292731 /nfs/dbraw/zinc/29/27/31/566292731.db2.gz XSDCUKJHIPDJBK-SNVBAGLBSA-N 0 1 394.674 3.362 10 0 GGAEMN COCC[N@H+]1CCC[C@@H]1CN[C@@H](C)c1ccccc1I ZINC000482241775 566296469 /nfs/dbraw/zinc/29/64/69/566296469.db2.gz JFVGFAURTGPOAA-UONOGXRCSA-N 0 1 388.293 3.053 10 0 GGAEMN CNC(=O)C[C@H](NCc1cccc(I)c1)c1ccccc1 ZINC000556412805 566298917 /nfs/dbraw/zinc/29/89/17/566298917.db2.gz VMDSDBCHPFCBFJ-INIZCTEOSA-N 0 1 394.256 3.258 10 0 GGAEMN COC(=O)c1cc(F)ccc1NS(=O)(=O)c1ccc2nc(C)sc2c1 ZINC000575932953 566300545 /nfs/dbraw/zinc/30/05/45/566300545.db2.gz CAIFUPUPDBPEDG-UHFFFAOYSA-N 0 1 380.422 3.331 10 0 GGAEMN C[C@@H](NCCOC1CCOCC1)c1cc2c(cc1Br)OCCO2 ZINC000625289390 566303103 /nfs/dbraw/zinc/30/31/03/566303103.db2.gz REYVDABBKJMXHX-GFCCVEGCSA-N 0 1 386.286 3.067 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@@H]2CCCc3[nH]ncc32)c(C)cc1Br ZINC000599938472 566304240 /nfs/dbraw/zinc/30/42/40/566304240.db2.gz BIMGLNBNGKTWEG-SNVBAGLBSA-N 0 1 392.253 3.326 10 0 GGAEMN C[C@H]1C[C@H](CN(C)Cc2cn(-c3cccc(Br)c3)nn2)CCO1 ZINC000482435353 566307311 /nfs/dbraw/zinc/30/73/11/566307311.db2.gz HPWBWJBINJLMRV-UONOGXRCSA-N 0 1 379.302 3.277 10 0 GGAEMN CN(Cc1nc2ccccc2[nH]1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000599994726 566309584 /nfs/dbraw/zinc/30/95/84/566309584.db2.gz LXVYOAFTBXYHGS-UHFFFAOYSA-N 0 1 384.237 3.474 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)c2c(F)ccc(C(F)(F)F)c2Br)n1 ZINC000625334847 566309738 /nfs/dbraw/zinc/30/97/38/566309738.db2.gz KKSPRAUKNHFQNQ-UHFFFAOYSA-N 0 1 395.154 3.006 10 0 GGAEMN Cc1csc(NC(=O)CN[C@H](c2cncc(Br)c2)C2CC2)n1 ZINC000556520827 566310709 /nfs/dbraw/zinc/31/07/09/566310709.db2.gz XIVIUGSPTXCAER-AWEZNQCLSA-N 0 1 381.299 3.288 10 0 GGAEMN CCOC(=O)c1cccc(CNCCOc2ccc(Br)cc2)n1 ZINC000600133573 566317169 /nfs/dbraw/zinc/31/71/69/566317169.db2.gz VWWKNMLYBMWPLH-UHFFFAOYSA-N 0 1 379.254 3.189 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)CCCO3)c(Cl)c1 ZINC000509586627 566317573 /nfs/dbraw/zinc/31/75/73/566317573.db2.gz HZHTYHFXUKRFSH-UHFFFAOYSA-N 0 1 381.837 3.252 10 0 GGAEMN CC(C)(C)OC(=O)[C@@]1(C)CCCN1C(=O)c1cccc(Br)c1O ZINC000600144461 566318069 /nfs/dbraw/zinc/31/80/69/566318069.db2.gz WYDFSSCGTGSKLQ-QGZVFWFLSA-N 0 1 384.270 3.491 10 0 GGAEMN Cc1ccncc1N1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000535683508 566318476 /nfs/dbraw/zinc/31/84/76/566318476.db2.gz ILBCTRYBMQEGGJ-UHFFFAOYSA-N 0 1 386.297 3.351 10 0 GGAEMN CCc1nc([C@H](C)Nc2ncnc3ccc(I)cc32)n[nH]1 ZINC000535684765 566318720 /nfs/dbraw/zinc/31/87/20/566318720.db2.gz AVESIHGWSKEYLH-QMMMGPOBSA-N 0 1 394.220 3.088 10 0 GGAEMN Cc1c[nH]c(CN2CC[C@@H](Cc3cccc(I)c3)C2)n1 ZINC000600161975 566319773 /nfs/dbraw/zinc/31/97/73/566319773.db2.gz OAYCQUNWCRQJSA-AWEZNQCLSA-N 0 1 381.261 3.387 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)NCc2ccc(-c3csc(C)n3)s2)n[nH]1 ZINC000535701553 566320391 /nfs/dbraw/zinc/32/03/91/566320391.db2.gz PDRGTYPTOJCEFQ-VIFPVBQESA-N 0 1 376.511 3.421 10 0 GGAEMN O=C(NCCc1ccc2c(c1)OCO2)c1cc(Br)cc2nc[nH]c21 ZINC000669694131 566322788 /nfs/dbraw/zinc/32/27/88/566322788.db2.gz RIRXUSRODSZKTM-UHFFFAOYSA-N 0 1 388.221 3.027 10 0 GGAEMN COC(=O)Cc1ccc(CNCc2cc(OC)ccc2Br)cc1 ZINC000600188648 566322966 /nfs/dbraw/zinc/32/29/66/566322966.db2.gz ZZAFTGSHAOWRAW-UHFFFAOYSA-N 0 1 378.266 3.463 10 0 GGAEMN O=C(NCCC[C@@H]1CCCC[C@@H]1O)c1cc(Br)cc2nc[nH]c21 ZINC000669711752 566323585 /nfs/dbraw/zinc/32/35/85/566323585.db2.gz OHJIUGQVUDZEFY-NHYWBVRUSA-N 0 1 380.286 3.387 10 0 GGAEMN COC(=O)CCn1nc(C)c(CNCc2csc(C(F)(F)F)c2)c1C ZINC000600216524 566325007 /nfs/dbraw/zinc/32/50/07/566325007.db2.gz ZOZHNDTVLLHHLE-UHFFFAOYSA-N 0 1 375.416 3.433 10 0 GGAEMN CCOC(=O)[C@H]1c2ccoc2CCN1C(=O)c1cccc(Br)c1O ZINC000600245906 566327954 /nfs/dbraw/zinc/32/79/54/566327954.db2.gz UZNHYHNBDWNRMU-CQSZACIVSA-N 0 1 394.221 3.050 10 0 GGAEMN Cc1cc(Br)cc2cc(C(=O)NC3(c4nn[nH]n4)CCCC3)oc21 ZINC000535809565 566328474 /nfs/dbraw/zinc/32/84/74/566328474.db2.gz FZEHBIHECKXTND-UHFFFAOYSA-N 0 1 390.241 3.216 10 0 GGAEMN CS[C@H]1CN(C(=O)c2sc(C(F)(F)F)nc2C)C[C@H]1N1CCCC1 ZINC000462586786 566328460 /nfs/dbraw/zinc/32/84/60/566328460.db2.gz AYDKQUCCNSHTTQ-MNOVXSKESA-N 0 1 379.473 3.122 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)NC[C@H]1CCN1C1CCCC1 ZINC000625533161 566331788 /nfs/dbraw/zinc/33/17/88/566331788.db2.gz YNKAGKOHALUOEZ-GFCCVEGCSA-N 0 1 383.366 3.491 10 0 GGAEMN O=S(=O)(NC[C@@H]1CCN1C1CCCC1)c1ccc(F)cc1C(F)(F)F ZINC000625533960 566332013 /nfs/dbraw/zinc/33/20/13/566332013.db2.gz XAUJLSUKGXJSTE-ZDUSSCGKSA-N 0 1 380.407 3.140 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccsc2)sc1Br ZINC000625528391 566332094 /nfs/dbraw/zinc/33/20/94/566332094.db2.gz LSASKVFQVPBROC-DTWKUNHWSA-N 0 1 379.326 3.110 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)NC[C@@H]1CCN1C1CCCC1 ZINC000625533163 566332197 /nfs/dbraw/zinc/33/21/97/566332197.db2.gz YNKAGKOHALUOEZ-LBPRGKRZSA-N 0 1 383.366 3.491 10 0 GGAEMN CNC(=O)[C@@H]1CCN(Cc2csc(-c3ccc(Br)cc3)n2)C1 ZINC000420978544 566332892 /nfs/dbraw/zinc/33/28/92/566332892.db2.gz RVWXWXKSOVOILC-GFCCVEGCSA-N 0 1 380.311 3.141 10 0 GGAEMN O=S1(=O)CCC(CN2CCC[C@@H]2Cc2ccccc2Br)CC1 ZINC000420959628 566333661 /nfs/dbraw/zinc/33/36/61/566333661.db2.gz FTEOJQZMHOXRTA-MRXNPFEDSA-N 0 1 386.355 3.281 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCc2cc(Cl)ccc2Br)cn1 ZINC000648949188 566334271 /nfs/dbraw/zinc/33/42/71/566334271.db2.gz JERGXGXLNVBUCG-UHFFFAOYSA-N 0 1 382.689 3.489 10 0 GGAEMN Cc1ccc(O)c(CN[C@H]2CCN(c3ccc(Br)c(C)c3)C2=O)n1 ZINC000462636863 566334981 /nfs/dbraw/zinc/33/49/81/566334981.db2.gz AQBYUPLDINTIMX-HNNXBMFYSA-N 0 1 390.281 3.062 10 0 GGAEMN COC1([C@H](C)NCc2nnc(-c3ccccc3Br)o2)CCOCC1 ZINC000421028096 566335892 /nfs/dbraw/zinc/33/58/92/566335892.db2.gz HIWWOKIKVIWXSK-LBPRGKRZSA-N 0 1 396.285 3.173 10 0 GGAEMN CCCC[C@H](NS(=O)(=O)c1ccc(Br)o1)C(=O)OC(C)(C)C ZINC000462681755 566339440 /nfs/dbraw/zinc/33/94/40/566339440.db2.gz CDBUAJIGEKMFLF-JTQLQIEISA-N 0 1 396.303 3.221 10 0 GGAEMN COC(=O)c1ccc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000600470704 566339873 /nfs/dbraw/zinc/33/98/73/566339873.db2.gz HVYSFBYRFNCRLM-OAHLLOKOSA-N 0 1 384.263 3.141 10 0 GGAEMN Cc1cnn(CCN(CCc2ccc(Cl)cc2)C[C@H](O)C(F)(F)F)c1 ZINC000576379591 566339801 /nfs/dbraw/zinc/33/98/01/566339801.db2.gz LHVRCCUCRDEQMR-INIZCTEOSA-N 0 1 375.822 3.313 10 0 GGAEMN C[C@@H]1CN(C)C[C@@H](C)N1C(=O)COc1ccc(Br)cc1Cl ZINC000535927986 566340043 /nfs/dbraw/zinc/34/00/43/566340043.db2.gz GFRQDKRIJCKSCZ-GHMZBOCLSA-N 0 1 375.694 3.032 10 0 GGAEMN COC(=O)CCCCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600473954 566340101 /nfs/dbraw/zinc/34/01/01/566340101.db2.gz VKPNMQIYTWNUPG-HNNXBMFYSA-N 0 1 375.296 3.446 10 0 GGAEMN COC(=O)CSCCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600469574 566340323 /nfs/dbraw/zinc/34/03/23/566340323.db2.gz BZXZWNWMBYAYDR-CQSZACIVSA-N 0 1 393.336 3.009 10 0 GGAEMN CN(C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1)[C@@H]1CN2CCC1CC2 ZINC000600516788 566342785 /nfs/dbraw/zinc/34/27/85/566342785.db2.gz NRWSQWOUIGSAAT-QGZVFWFLSA-N 0 1 379.291 3.345 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)CN1[C@H](C)CC[C@H]1C ZINC000482957798 566344420 /nfs/dbraw/zinc/34/44/20/566344420.db2.gz IWFSTYFXCOZHNJ-CHWSQXEVSA-N 0 1 389.359 3.358 10 0 GGAEMN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)(F)F ZINC000556923055 566344654 /nfs/dbraw/zinc/34/46/54/566344654.db2.gz HYQNMHYCYFVKHX-CHWSQXEVSA-N 0 1 380.432 3.050 10 0 GGAEMN COc1ccc(Br)c(CNC[C@@H]2CS(=O)(=O)c3ccccc32)c1 ZINC000576430696 566345190 /nfs/dbraw/zinc/34/51/90/566345190.db2.gz DGMVPHKQWFBKCU-CYBMUJFWSA-N 0 1 396.306 3.118 10 0 GGAEMN COCCN(Cc1scnc1C)C(=O)c1cccc(Br)c1O ZINC000576449938 566346687 /nfs/dbraw/zinc/34/66/87/566346687.db2.gz CXRKNUGVXJWLQM-UHFFFAOYSA-N 0 1 385.283 3.208 10 0 GGAEMN Cc1n[nH]c(C(=O)NCCCOc2ncc(C(F)(F)F)cc2Cl)c1C ZINC000536061240 566348283 /nfs/dbraw/zinc/34/82/83/566348283.db2.gz FXFHVBQFQBKGEF-UHFFFAOYSA-N 0 1 376.766 3.293 10 0 GGAEMN CCCCN(C(=O)CCSc1nnc(C)[nH]1)[C@H]1CCc2ncsc2C1 ZINC000649161795 566349771 /nfs/dbraw/zinc/34/97/71/566349771.db2.gz HCCNUFGGCGRHAJ-ZDUSSCGKSA-N 0 1 379.555 3.238 10 0 GGAEMN C[C@H]1CCCN(CCNS(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509946945 566350872 /nfs/dbraw/zinc/35/08/72/566350872.db2.gz BHFTZYLKNUJHMV-NSHDSACASA-N 0 1 395.750 3.113 10 0 GGAEMN O=C([C@H]1CCCN(Cc2cc(Br)cc3c2OCC3)C1)N1CCCC1 ZINC000462786729 566352709 /nfs/dbraw/zinc/35/27/09/566352709.db2.gz BECJUSVKCWKVGQ-HNNXBMFYSA-N 0 1 393.325 3.218 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@H](NCc2ccccc2Br)C1 ZINC000509988510 566353452 /nfs/dbraw/zinc/35/34/52/566353452.db2.gz GIBOGSGLQDLGEI-INIZCTEOSA-N 0 1 389.293 3.219 10 0 GGAEMN O=C(c1cc(C(F)(F)F)[nH]n1)N1CCO[C@H](c2c(F)cccc2Cl)C1 ZINC000649206236 566354104 /nfs/dbraw/zinc/35/41/04/566354104.db2.gz TVGIJLOBCAOWMG-NSHDSACASA-N 0 1 377.725 3.435 10 0 GGAEMN O=C(N=c1cc(-c2cccs2)[nH][nH]1)c1cc(Br)cc2[nH]cnc21 ZINC000576521425 566354178 /nfs/dbraw/zinc/35/41/78/566354178.db2.gz NXQRMYQJPCFDCJ-UHFFFAOYSA-N 0 1 388.250 3.451 10 0 GGAEMN COC(=O)c1c(Cl)ccc(NS(=O)(=O)c2cn(C(C)C)cn2)c1Cl ZINC000600662668 566355636 /nfs/dbraw/zinc/35/56/36/566355636.db2.gz OPEUHXNIIJQFIZ-UHFFFAOYSA-N 0 1 392.264 3.358 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2ccc(I)cc2)[C@H]2CCC[C@@H]21 ZINC000600675503 566357184 /nfs/dbraw/zinc/35/71/84/566357184.db2.gz PUXYYVWHDVSTPJ-KFWWJZLASA-N 0 1 385.245 3.366 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(F)c(OC)c2)c(C(F)(F)F)n1 ZINC000670329570 566357950 /nfs/dbraw/zinc/35/79/50/566357950.db2.gz VVHYCYUWQZMKIT-UHFFFAOYSA-N 0 1 380.319 3.058 10 0 GGAEMN OC[C@@]1(NCc2noc3c2CCCC3)CCc2cc(Br)ccc2C1 ZINC000625795457 566359054 /nfs/dbraw/zinc/35/90/54/566359054.db2.gz WIGUEVUIJPSNMP-LJQANCHMSA-N 0 1 391.309 3.326 10 0 GGAEMN O=C(COc1ccc(Cl)c(Cl)c1)N1CCC[C@H](N2CCOCC2)CC1 ZINC000670393249 566359996 /nfs/dbraw/zinc/35/99/96/566359996.db2.gz SWPBMNGIDOBCHK-AWEZNQCLSA-N 0 1 387.307 3.086 10 0 GGAEMN O=C(Nc1c[nH]cc(Br)c1=O)c1ccc(C(F)(F)F)c(O)c1 ZINC000670419920 566361342 /nfs/dbraw/zinc/36/13/42/566361342.db2.gz YKNGWIACAJWBLH-UHFFFAOYSA-N 0 1 377.116 3.114 10 0 GGAEMN CC(C)c1nnc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000625796404 566361417 /nfs/dbraw/zinc/36/14/17/566361417.db2.gz KPICBQCXDJEENZ-KRWDZBQOSA-N 0 1 396.354 3.434 10 0 GGAEMN CC1(C)CN(CCOc2cc(F)cc(Br)c2)C[C@@]2(CCOC2)O1 ZINC000483184402 566362277 /nfs/dbraw/zinc/36/22/77/566362277.db2.gz LJHXIBWJVAVUOR-QGZVFWFLSA-N 0 1 388.277 3.237 10 0 GGAEMN CCN1C(=O)N=NC1C1CCN(Cc2ccc(C)cc2Br)CC1 ZINC000649390425 566362992 /nfs/dbraw/zinc/36/29/92/566362992.db2.gz VTSYJAIDTYMSBB-UHFFFAOYSA-N 0 1 379.302 3.454 10 0 GGAEMN CC(=O)NCCN(Cc1ccsc1)C(=O)c1[nH]nc2ccc(Cl)cc21 ZINC000510095428 566363750 /nfs/dbraw/zinc/36/37/50/566363750.db2.gz LTYHCWNIEXEBQE-UHFFFAOYSA-N 0 1 376.869 3.056 10 0 GGAEMN CC[C@@H]1CN(CCOc2cc(F)cc(Br)c2)C[C@]2(CCOC2)O1 ZINC000483200889 566364513 /nfs/dbraw/zinc/36/45/13/566364513.db2.gz QRSCVPKQLBGORL-WBVHZDCISA-N 0 1 388.277 3.237 10 0 GGAEMN C[C@@H](CN(C)C(=O)c1ccc2scc(Br)c2c1)c1nn[nH]n1 ZINC000649480425 566368061 /nfs/dbraw/zinc/36/80/61/566368061.db2.gz CSKTVNGEPVFADK-QMMMGPOBSA-N 0 1 380.271 3.053 10 0 GGAEMN CSc1cccnc1C(=O)Nc1cc(Cl)ccc1N1CCN(C)CC1 ZINC000649514009 566370541 /nfs/dbraw/zinc/37/05/41/566370541.db2.gz BKCQOTSUUJQUOP-UHFFFAOYSA-N 0 1 376.913 3.461 10 0 GGAEMN CN(C)C[C@@H](NCC(=O)N(C)Cc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000625983152 566372143 /nfs/dbraw/zinc/37/21/43/566372143.db2.gz HOALSNNUWHGFOE-QGZVFWFLSA-N 0 1 384.307 3.437 10 0 GGAEMN CN(C)C[C@H](NCC(=O)N(C)CC(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000625983309 566372320 /nfs/dbraw/zinc/37/23/20/566372320.db2.gz LELOPKZDYLKJHM-ZDUSSCGKSA-N 0 1 386.245 3.206 10 0 GGAEMN O=S(=O)(NC1CC1)c1ccc(CN2CCSC3(CCCCC3)C2)cc1 ZINC000649548621 566373062 /nfs/dbraw/zinc/37/30/62/566373062.db2.gz BXDMDNBOQCKKOC-UHFFFAOYSA-N 0 1 380.579 3.379 10 0 GGAEMN Cc1cc(Br)ccc1[C@@H]1CCCN1C[C@H](O)COC1CCOCC1 ZINC000626009251 566375061 /nfs/dbraw/zinc/37/50/61/566375061.db2.gz CBSFCJVVQXSOFZ-LPHOPBHVSA-N 0 1 398.341 3.451 10 0 GGAEMN OC[C@]12CCC[C@H]1CN(Cc1nc(-c3cccc(Br)c3)no1)C2 ZINC000626011228 566376794 /nfs/dbraw/zinc/37/67/94/566376794.db2.gz BBYNLHWTGXZJCE-SUMWQHHRSA-N 0 1 378.270 3.094 10 0 GGAEMN CSc1ccccc1CN(C)Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649595743 566377048 /nfs/dbraw/zinc/37/70/48/566377048.db2.gz XUZQBIAEFCHVLZ-UHFFFAOYSA-N 0 1 376.547 3.481 10 0 GGAEMN CC(C)(CNC(=O)c1nscc1Br)N1CCc2ccccc2C1 ZINC000649597917 566377218 /nfs/dbraw/zinc/37/72/18/566377218.db2.gz LJDWMBPFVOVPNT-UHFFFAOYSA-N 0 1 394.338 3.472 10 0 GGAEMN CC1(C)[C@H](C(F)(F)F)CCN1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649592103 566377394 /nfs/dbraw/zinc/37/73/94/566377394.db2.gz UQLPTZSZYSQHEZ-OAHLLOKOSA-N 0 1 376.444 3.290 10 0 GGAEMN COCc1ccccc1CS(=O)(=O)Nc1csc(-c2ccncc2)n1 ZINC000576783741 566377717 /nfs/dbraw/zinc/37/77/17/566377717.db2.gz PUFTVVKPPCWVJI-UHFFFAOYSA-N 0 1 375.475 3.293 10 0 GGAEMN COCCc1noc(CN2C[C@@H](c3ccc(Br)cc3)C[C@H]2C)n1 ZINC000626040940 566379027 /nfs/dbraw/zinc/37/90/27/566379027.db2.gz OHSFXMKTXXXSGM-OCCSQVGLSA-N 0 1 380.286 3.399 10 0 GGAEMN CCCc1c(NS(=O)(=O)c2c[nH]c(=O)s2)cnn1-c1cccc(C)c1 ZINC000649629476 566380604 /nfs/dbraw/zinc/38/06/04/566380604.db2.gz JHBJMGJQSIZXIW-UHFFFAOYSA-N 0 1 378.479 3.096 10 0 GGAEMN O=S(=O)(NC1CC1)c1ccc(CN2CCC[C@@H](CC(F)(F)F)C2)cc1 ZINC000649631676 566380629 /nfs/dbraw/zinc/38/06/29/566380629.db2.gz IPQWVSZWGHGYOD-AWEZNQCLSA-N 0 1 376.444 3.292 10 0 GGAEMN O=C([C@@H]1CCCN(Cc2nc3ccc(Br)cc3o2)C1)N1CCCC1 ZINC000463073771 566381468 /nfs/dbraw/zinc/38/14/68/566381468.db2.gz XRJUDRREDUQHBE-CYBMUJFWSA-N 0 1 392.297 3.425 10 0 GGAEMN CC[C@H](C)N[C@H](CNS(=O)(=O)c1ccc2ncsc2c1)c1ccco1 ZINC000510415646 566381530 /nfs/dbraw/zinc/38/15/30/566381530.db2.gz RAZYVVDNZKQIQE-SWLSCSKDSA-N 0 1 379.507 3.297 10 0 GGAEMN O=C([C@H]1CCCN(Cc2nc3ccc(Br)cc3o2)C1)N1CCCC1 ZINC000463073772 566381966 /nfs/dbraw/zinc/38/19/66/566381966.db2.gz XRJUDRREDUQHBE-ZDUSSCGKSA-N 0 1 392.297 3.425 10 0 GGAEMN O=C1N=NC([C@@H]2CCCN(c3ccc(Br)c(C(F)(F)F)n3)C2)O1 ZINC000670818171 566382855 /nfs/dbraw/zinc/38/28/55/566382855.db2.gz UJCXXVXIPBBRNG-SSDOTTSWSA-N 0 1 393.163 3.336 10 0 GGAEMN Cc1ccc(NC(=O)[C@H](C)N2CCN(CCCF)CC2)c(Br)c1 ZINC000626072126 566383288 /nfs/dbraw/zinc/38/32/88/566383288.db2.gz IARAKZIMKSYGKG-AWEZNQCLSA-N 0 1 386.309 3.062 10 0 GGAEMN O=C1N=NC([C@H]2CCCN(c3ccc(Br)c(C(F)(F)F)n3)C2)O1 ZINC000670818172 566383280 /nfs/dbraw/zinc/38/32/80/566383280.db2.gz UJCXXVXIPBBRNG-ZETCQYMHSA-N 0 1 393.163 3.336 10 0 GGAEMN COC[C@@H]1C[C@@H](O)CN1Cc1c(-c2ccc(Cl)cc2)nc2sccn12 ZINC000649741849 566388737 /nfs/dbraw/zinc/38/87/37/566388737.db2.gz GLPDFULUQHIOAM-LSDHHAIUSA-N 0 1 377.897 3.298 10 0 GGAEMN CC[C@H](c1ccc(Br)cc1)N1CCC[C@@H](CS(=O)(=O)NC)C1 ZINC000626167822 566391091 /nfs/dbraw/zinc/39/10/91/566391091.db2.gz DEIQRTOVHOREKZ-CZUORRHYSA-N 0 1 389.359 3.161 10 0 GGAEMN CC[C@H](c1ccc(Br)cc1)N1CCC[C@H](CS(=O)(=O)NC)C1 ZINC000626167823 566391153 /nfs/dbraw/zinc/39/11/53/566391153.db2.gz DEIQRTOVHOREKZ-XJKSGUPXSA-N 0 1 389.359 3.161 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN(CCSc2cc(Cl)ccc2Cl)C1 ZINC000626170145 566391973 /nfs/dbraw/zinc/39/19/73/566391973.db2.gz ZTDBFKLDQFHZTQ-GFCCVEGCSA-N 0 1 397.393 3.347 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN(CCSc2cc(Cl)ccc2Cl)C1 ZINC000626170146 566392203 /nfs/dbraw/zinc/39/22/03/566392203.db2.gz ZTDBFKLDQFHZTQ-LBPRGKRZSA-N 0 1 397.393 3.347 10 0 GGAEMN Ic1cnc(CN[C@@H](C2CCC2)[C@@H]2CCCO2)s1 ZINC000601156685 566393666 /nfs/dbraw/zinc/39/36/66/566393666.db2.gz WMOBQKPGBGHMRM-GWCFXTLKSA-N 0 1 378.279 3.185 10 0 GGAEMN Ic1cnc(CN[C@@H](C2CCC2)[C@H]2CCCO2)s1 ZINC000601156687 566394061 /nfs/dbraw/zinc/39/40/61/566394061.db2.gz WMOBQKPGBGHMRM-MFKMUULPSA-N 0 1 378.279 3.185 10 0 GGAEMN C[C@H]1C[C@H](C)CN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000463241839 566395254 /nfs/dbraw/zinc/39/52/54/566395254.db2.gz FNLMAFVEMGCSSV-UWVGGRQHSA-N 0 1 383.233 3.286 10 0 GGAEMN CN1CCN(c2ccc(Br)cc2NC(=O)C2(CCF)CC2)CC1 ZINC000463293434 566397208 /nfs/dbraw/zinc/39/72/08/566397208.db2.gz IWOYFHFJQZGAHO-UHFFFAOYSA-N 0 1 384.293 3.279 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc3ccc(=O)n(C)c3c2)c(Cl)cc1F ZINC000447262278 566397493 /nfs/dbraw/zinc/39/74/93/566397493.db2.gz CVFIADNBPJNAQX-UHFFFAOYSA-N 0 1 380.828 3.440 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)n[nH]1 ZINC000626303722 566400319 /nfs/dbraw/zinc/40/03/19/566400319.db2.gz NTBYUUIOHYRPCC-VFGSGVCASA-N 0 1 389.297 3.454 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1nc2cc(Br)ccc2o1 ZINC000510640055 566400565 /nfs/dbraw/zinc/40/05/65/566400565.db2.gz GVPDKULPRQRKPI-CYBMUJFWSA-N 0 1 380.286 3.471 10 0 GGAEMN O=C(NC(C1CC1)C1CC1)c1n[nH]c2ccc(I)cc21 ZINC000463328626 566400953 /nfs/dbraw/zinc/40/09/53/566400953.db2.gz KCPJYEBFFYOYJM-UHFFFAOYSA-N 0 1 381.217 3.086 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(-c2ccc(Br)cc2-n2cncn2)n1 ZINC000577063277 566401633 /nfs/dbraw/zinc/40/16/33/566401633.db2.gz DYJWCXZWSFDMHY-GFCCVEGCSA-N 0 1 377.246 3.126 10 0 GGAEMN Cc1cc(C[C@@H](C)Nc2ncnc(CC(C)C)c2I)[nH]n1 ZINC000557627710 566403173 /nfs/dbraw/zinc/40/31/73/566403173.db2.gz ZNNXQSBYOKSUTL-SNVBAGLBSA-N 0 1 399.280 3.354 10 0 GGAEMN CSc1cc(CNC(=O)c2n[nH]c3ccc(Br)cc32)ccn1 ZINC000536810392 566403499 /nfs/dbraw/zinc/40/34/99/566403499.db2.gz ISTQCYKFOHXWMW-UHFFFAOYSA-N 0 1 377.267 3.372 10 0 GGAEMN Cc1cc2ncc([C@@H](C)N[C@@H](CO)c3ccc(Br)cc3)c(C)n2n1 ZINC000536834825 566405020 /nfs/dbraw/zinc/40/50/20/566405020.db2.gz UPJUKXWPRODEQR-PXAZEXFGSA-N 0 1 389.297 3.493 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](N[C@@H]2CCCOc3cc(Br)ccc32)CC1=O ZINC000536868686 566406393 /nfs/dbraw/zinc/40/63/93/566406393.db2.gz HIEOMCFBDCNCOY-JMGFVUJMSA-N 0 1 379.298 3.262 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@H]2CCCOc3c(Br)cccc32)CC1=O ZINC000536875356 566406691 /nfs/dbraw/zinc/40/66/91/566406691.db2.gz IBCFCRAGNPCZAW-MPTQWLOMSA-N 0 1 379.298 3.262 10 0 GGAEMN C[C@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Cl)cc(Cl)c1 ZINC000536866475 566407418 /nfs/dbraw/zinc/40/74/18/566407418.db2.gz RYEPYCUTUAFIMM-BLLLJJGKSA-N 0 1 395.352 3.133 10 0 GGAEMN CN(C)Cc1ccsc1C(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000447433049 566411243 /nfs/dbraw/zinc/41/12/43/566411243.db2.gz YTVMWWGRDPGEMO-UHFFFAOYSA-N 0 1 383.970 3.483 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC[C@]2(C1)CCCOC2 ZINC000671237573 566411466 /nfs/dbraw/zinc/41/14/66/566411466.db2.gz BWQXVFHRKAEHEY-SFHVURJKSA-N 0 1 390.281 3.482 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC[C@@]2(C1)CCCOC2 ZINC000671237572 566411549 /nfs/dbraw/zinc/41/15/49/566411549.db2.gz BWQXVFHRKAEHEY-GOSISDBHSA-N 0 1 390.281 3.482 10 0 GGAEMN O=C1[C@@H](N2CC[C@@]3(C2)CCCOC3)CCN1c1cccc(Br)c1 ZINC000671254945 566412731 /nfs/dbraw/zinc/41/27/31/566412731.db2.gz PLQJDFNYNLHTNK-FUHWJXTLSA-N 0 1 379.298 3.057 10 0 GGAEMN O=C(NCCCCn1cc(Br)cn1)c1n[nH]c2ccc(Cl)cc21 ZINC000671281847 566414851 /nfs/dbraw/zinc/41/48/51/566414851.db2.gz WDUZNUMQQWEAJH-UHFFFAOYSA-N 0 1 396.676 3.386 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](N(C)CCCCO)C1=O ZINC000510813809 566414884 /nfs/dbraw/zinc/41/48/84/566414884.db2.gz ROABJFKDGOENNP-INIZCTEOSA-N 0 1 383.330 3.266 10 0 GGAEMN CS(=O)(=O)Cc1ccc(S(=O)(=O)Nc2csc3ccccc23)cc1 ZINC000484107925 566415554 /nfs/dbraw/zinc/41/55/54/566415554.db2.gz BAQXOJUKERDGFN-UHFFFAOYSA-N 0 1 381.500 3.247 10 0 GGAEMN Brc1ccc(CN2CC[C@@]3(C2)CCCOC3)c(N2CCOCC2)c1 ZINC000671312915 566416256 /nfs/dbraw/zinc/41/62/56/566416256.db2.gz ZPFXSBGSYSWWOE-LJQANCHMSA-N 0 1 395.341 3.288 10 0 GGAEMN COCc1ccccc1CS(=O)(=O)Nc1ccc(CN(C)C)c(Cl)c1 ZINC000577243169 566418135 /nfs/dbraw/zinc/41/81/35/566418135.db2.gz HYPFEKMZIMFHIU-UHFFFAOYSA-N 0 1 382.913 3.490 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1c(F)cncc1F ZINC000557784005 566418788 /nfs/dbraw/zinc/41/87/88/566418788.db2.gz JXWPXDQREWVQNT-SSDOTTSWSA-N 0 1 381.180 3.490 10 0 GGAEMN CSC1CCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000601694422 566419032 /nfs/dbraw/zinc/41/90/32/566419032.db2.gz HSNIVGJJSCULDB-UHFFFAOYSA-N 0 1 381.295 3.258 10 0 GGAEMN CN(CC1CCCC1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463581152 566419871 /nfs/dbraw/zinc/41/98/71/566419871.db2.gz BHGJQMCASSZAIA-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN OCC1(NCc2nc(-c3cccc(Br)c3)c[nH]2)Cc2ccccc2C1 ZINC000557800390 566419940 /nfs/dbraw/zinc/41/99/40/566419940.db2.gz ROZRXZUIIKDNNL-UHFFFAOYSA-N 0 1 398.304 3.459 10 0 GGAEMN Cc1ccc2nc(NC(=O)c3ccc(Br)cc3-n3cncn3)[nH]c2c1 ZINC000557815235 566421535 /nfs/dbraw/zinc/42/15/35/566421535.db2.gz PKKRIGWZOVEAOM-UHFFFAOYSA-N 0 1 397.236 3.467 10 0 GGAEMN CCC[C@H](NCCNS(=O)(=O)c1ccc(F)cc1Cl)c1ccccn1 ZINC000510959383 566422597 /nfs/dbraw/zinc/42/25/97/566422597.db2.gz OQSXIBNQOWLEMR-HNNXBMFYSA-N 0 1 385.892 3.283 10 0 GGAEMN CN(C(=O)c1c(Br)cccc1Br)[C@H]1CCCN(C)C1 ZINC000464053179 566444622 /nfs/dbraw/zinc/44/46/22/566444622.db2.gz LRMICUXBILKICJ-JTQLQIEISA-N 0 1 390.119 3.378 10 0 GGAEMN CN(C(=O)c1[nH]nc2ccc(I)cc21)C(C1CC1)C1CC1 ZINC000463636042 566423984 /nfs/dbraw/zinc/42/39/84/566423984.db2.gz ROOMBYLEJBBEHH-UHFFFAOYSA-N 0 1 395.244 3.428 10 0 GGAEMN O=C(NC[C@@H]1CC=CCC1)c1n[nH]c2ccc(I)cc21 ZINC000463659373 566424473 /nfs/dbraw/zinc/42/44/73/566424473.db2.gz FETQFADPBAFJRV-SNVBAGLBSA-N 0 1 381.217 3.254 10 0 GGAEMN O=C(c1cc(Br)cc2ccccc21)N1CCC[C@@H](c2nn[nH]n2)C1 ZINC000537125015 566424588 /nfs/dbraw/zinc/42/45/88/566424588.db2.gz RGLNTDCLTBUMAT-GFCCVEGCSA-N 0 1 386.253 3.135 10 0 GGAEMN CCN(CC(F)(F)F)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463652044 566424501 /nfs/dbraw/zinc/42/45/01/566424501.db2.gz XGJRRKWRCJTUFE-UHFFFAOYSA-N 0 1 397.138 3.192 10 0 GGAEMN CC(C)[C@H]1CCCN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463659741 566424977 /nfs/dbraw/zinc/42/49/77/566424977.db2.gz HOJDWNAWSQYMGK-CYBMUJFWSA-N 0 1 383.233 3.428 10 0 GGAEMN O=C(NC[C@H]1CC=CCC1)c1n[nH]c2ccc(I)cc21 ZINC000463659372 566425218 /nfs/dbraw/zinc/42/52/18/566425218.db2.gz FETQFADPBAFJRV-JTQLQIEISA-N 0 1 381.217 3.254 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)n[nH]1 ZINC000577343425 566425949 /nfs/dbraw/zinc/42/59/49/566425949.db2.gz AGPFBXCCFGZDKW-CIISACIHSA-N 0 1 377.286 3.267 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)CN(C)[C@@H]1CCSC1)CC2 ZINC000537170296 566427112 /nfs/dbraw/zinc/42/71/12/566427112.db2.gz KBYUNRYLIBFPGW-OAHLLOKOSA-N 0 1 383.355 3.080 10 0 GGAEMN C[C@@H]1[C@H](C)N(C(=O)Cc2noc3ccc(Br)cc32)[C@@H](C)CN1C ZINC000650155725 566427802 /nfs/dbraw/zinc/42/78/02/566427802.db2.gz FSOVVZWTKCYMTA-TUAOUCFPSA-N 0 1 380.286 3.072 10 0 GGAEMN CCCN(Cc1nc2ccc(Br)cc2[nH]1)[C@@H](COC)C(=O)OCC ZINC000484397686 566428129 /nfs/dbraw/zinc/42/81/29/566428129.db2.gz ZIUUCWUFXHSRPW-HNNXBMFYSA-N 0 1 398.301 3.116 10 0 GGAEMN COC[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000537175706 566428491 /nfs/dbraw/zinc/42/84/91/566428491.db2.gz XELCUIXEIQLWFA-WMZOPIPTSA-N 0 1 398.272 3.305 10 0 GGAEMN COC[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000537175705 566428640 /nfs/dbraw/zinc/42/86/40/566428640.db2.gz XELCUIXEIQLWFA-SJLPKXTDSA-N 0 1 398.272 3.305 10 0 GGAEMN COC[C@@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000537175704 566428843 /nfs/dbraw/zinc/42/88/43/566428843.db2.gz XELCUIXEIQLWFA-FUHWJXTLSA-N 0 1 398.272 3.305 10 0 GGAEMN COC(=O)c1cccc2nc(NC(=O)Cc3cscc3Br)[nH]c21 ZINC000484418325 566429210 /nfs/dbraw/zinc/42/92/10/566429210.db2.gz ZGKNNUUNPIYMSI-UHFFFAOYSA-N 0 1 394.250 3.355 10 0 GGAEMN O=S(=O)(NCc1cc(F)cc(Br)c1)c1c(F)cccc1F ZINC000511055699 566432617 /nfs/dbraw/zinc/43/26/17/566432617.db2.gz CLLVCPWGMPZYGY-UHFFFAOYSA-N 0 1 380.185 3.345 10 0 GGAEMN C[C@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H](S(=O)(=O)N(C)C)C1 ZINC000511059528 566432804 /nfs/dbraw/zinc/43/28/04/566432804.db2.gz MWROXYBSUAUXLV-IUODEOHRSA-N 0 1 380.432 3.002 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1CC[S@](=O)c1cc(Cl)ccc1Cl ZINC000577422354 566433655 /nfs/dbraw/zinc/43/36/55/566433655.db2.gz XQCNPXUXAANQBO-BSEYFRJRSA-N 0 1 391.364 3.482 10 0 GGAEMN CN(C)S(=O)(=O)[C@H]1CCCN(CCCSc2ccccc2Cl)C1 ZINC000511083436 566435784 /nfs/dbraw/zinc/43/57/84/566435784.db2.gz ZVGOHZIDGCGJQT-AWEZNQCLSA-N 0 1 376.975 3.178 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1cc2ccc(Br)cc2s1 ZINC000577467278 566437674 /nfs/dbraw/zinc/43/76/74/566437674.db2.gz OMNPABCOVKXWJG-UHFFFAOYSA-N 0 1 392.282 3.376 10 0 GGAEMN CC(F)(F)c1ccccc1NS(=O)(=O)c1ccc2c(c1)CS(=O)(=O)C2 ZINC000650204121 566438205 /nfs/dbraw/zinc/43/82/05/566438205.db2.gz BUZOBMJMPWPDEU-UHFFFAOYSA-N 0 1 387.429 3.028 10 0 GGAEMN CSc1cc(NS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)ccc1C ZINC000650222514 566438724 /nfs/dbraw/zinc/43/87/24/566438724.db2.gz LVUNELDNUGVYMG-UHFFFAOYSA-N 0 1 379.507 3.082 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1 ZINC000626686887 566441891 /nfs/dbraw/zinc/44/18/91/566441891.db2.gz RFPGPAWRALFDSU-CYBMUJFWSA-N 0 1 399.304 3.222 10 0 GGAEMN CN(C[C@@H]1CCC[N@@H+](CCc2cc(Cl)ccc2Cl)C1)S(C)(=O)=O ZINC000511142555 566442500 /nfs/dbraw/zinc/44/25/00/566442500.db2.gz YXPMXOLFHHFFQE-ZDUSSCGKSA-N 0 1 379.353 3.139 10 0 GGAEMN CN(C[C@@H]1CCCN(CCc2cc(Cl)ccc2Cl)C1)S(C)(=O)=O ZINC000511142555 566442504 /nfs/dbraw/zinc/44/25/04/566442504.db2.gz YXPMXOLFHHFFQE-ZDUSSCGKSA-N 0 1 379.353 3.139 10 0 GGAEMN O=C(NCCc1nnc(-c2ccc(Cl)cc2)[nH]1)c1coc(Br)c1 ZINC000511180356 566444146 /nfs/dbraw/zinc/44/41/46/566444146.db2.gz ABLAKRJOCIGVHB-UHFFFAOYSA-N 0 1 395.644 3.453 10 0 GGAEMN C[C@H]1CO[C@H](C(F)(F)F)CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000671714487 566444232 /nfs/dbraw/zinc/44/42/32/566444232.db2.gz WSEKPBWHHGIFOT-UFBFGSQYSA-N 0 1 378.192 3.477 10 0 GGAEMN C[C@@H]1C[C@H]1N1C[C@@H](NCc2cccc(Br)c2OC(F)F)CC1=O ZINC000537431889 566445301 /nfs/dbraw/zinc/44/53/01/566445301.db2.gz KYEIXSNJMQQGOS-SUZMYJTESA-N 0 1 389.240 3.149 10 0 GGAEMN COc1ccc(Cl)cc1CS(=O)(=O)N1CCC[C@H](c2cc(C)[nH]n2)C1 ZINC000511219866 566445640 /nfs/dbraw/zinc/44/56/40/566445640.db2.gz AMJNJVQFFACJHN-ZDUSSCGKSA-N 0 1 383.901 3.090 10 0 GGAEMN COc1ccc(Cl)cc1CS(=O)(=O)N1CCC[C@@H](c2cc(C)[nH]n2)C1 ZINC000511219865 566445750 /nfs/dbraw/zinc/44/57/50/566445750.db2.gz AMJNJVQFFACJHN-CYBMUJFWSA-N 0 1 383.901 3.090 10 0 GGAEMN Cc1cc(N2CCC[C@H](NCc3cnc(C)nc3)C2=O)ccc1Br ZINC000464089097 566446165 /nfs/dbraw/zinc/44/61/65/566446165.db2.gz VVGBFVVVLYPQPY-KRWDZBQOSA-N 0 1 389.297 3.141 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CN[C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000671769498 566448962 /nfs/dbraw/zinc/44/89/62/566448962.db2.gz CBPBMWFMNIDUSE-HIFRSBDPSA-N 0 1 377.337 3.384 10 0 GGAEMN OCCCN(Cc1ccccn1)C[C@H](O)COc1c(Cl)cccc1Cl ZINC000558104656 566450600 /nfs/dbraw/zinc/45/06/00/566450600.db2.gz ABXJTOQJZUZMQW-HNNXBMFYSA-N 0 1 385.291 3.013 10 0 GGAEMN O=c1[nH]nc2n1CCN(Cc1ccc(-c3cccc(Br)c3)o1)C2 ZINC000484752600 566452088 /nfs/dbraw/zinc/45/20/88/566452088.db2.gz OBZXNKZZQJGIDH-UHFFFAOYSA-N 0 1 375.226 3.022 10 0 GGAEMN O=C(NCCCc1nc[nH]n1)c1c(F)ccc(C(F)(F)F)c1Br ZINC000626820704 566453076 /nfs/dbraw/zinc/45/30/76/566453076.db2.gz VXDXBVIGSPURHK-UHFFFAOYSA-N 0 1 395.154 3.088 10 0 GGAEMN COCc1ccnc(NS(=O)(=O)c2cc(C)c(Br)cc2C)c1 ZINC000650495238 566460437 /nfs/dbraw/zinc/46/04/37/566460437.db2.gz HEBYHWVTMHJXHY-UHFFFAOYSA-N 0 1 385.283 3.408 10 0 GGAEMN Cc1cnc(C)c(NS(=O)(=O)c2cc3c(cc2Br)OCCO3)c1 ZINC000650489960 566460458 /nfs/dbraw/zinc/46/04/58/566460458.db2.gz BSAFHNDHDPTEFR-UHFFFAOYSA-N 0 1 399.266 3.033 10 0 GGAEMN Brc1cc(CN2CCC[C@H]([C@@H]3CCOC3)C2)cc2c1OCCO2 ZINC000537698508 566463899 /nfs/dbraw/zinc/46/38/99/566463899.db2.gz VMTIUMAOSKISGW-LSDHHAIUSA-N 0 1 382.298 3.469 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CN1CCSC[C@H]1CCO ZINC000537710251 566464384 /nfs/dbraw/zinc/46/43/84/566464384.db2.gz MJYCEJFEKWPBDU-QGZVFWFLSA-N 0 1 396.354 3.243 10 0 GGAEMN Cc1c(Br)c2ccccc2n1CC(=O)NCCN1CC=CCC1 ZINC000537722751 566465390 /nfs/dbraw/zinc/46/53/90/566465390.db2.gz KLPOBPCKQQPUIS-UHFFFAOYSA-N 0 1 376.298 3.090 10 0 GGAEMN C[C@@](CO)(NCC(=O)Nc1cccc(F)c1)c1ccc(Br)cc1 ZINC000511547238 566470222 /nfs/dbraw/zinc/47/02/22/566470222.db2.gz SVKMWFAIOCQCNW-KRWDZBQOSA-N 0 1 381.245 3.024 10 0 GGAEMN C[C@@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1cncc(Br)c1 ZINC000558424049 566471526 /nfs/dbraw/zinc/47/15/26/566471526.db2.gz UDOOAXFHPGPESP-HNAYVOBHSA-N 0 1 391.309 3.386 10 0 GGAEMN Cc1ccc(NC(=O)CN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511565593 566471739 /nfs/dbraw/zinc/47/17/39/566471739.db2.gz KJGLHHZZJDJZAV-GOSISDBHSA-N 0 1 377.282 3.193 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511603315 566475239 /nfs/dbraw/zinc/47/52/39/566475239.db2.gz AEURQQSLGKAXNH-IYOUNJFTSA-N 0 1 383.330 3.036 10 0 GGAEMN C[C@](CO)(NCC(=O)NCCC1CCCCC1)c1ccc(Br)cc1 ZINC000511594560 566475566 /nfs/dbraw/zinc/47/55/66/566475566.db2.gz OWXJDYMUKAXBGQ-LJQANCHMSA-N 0 1 397.357 3.333 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511603314 566475793 /nfs/dbraw/zinc/47/57/93/566475793.db2.gz AEURQQSLGKAXNH-HBUWYVDXSA-N 0 1 383.330 3.036 10 0 GGAEMN CCC(CC)(CNC(=O)[C@@H](N)CC(=O)OC)c1ccc(Cl)c(Cl)c1 ZINC000423147536 566478458 /nfs/dbraw/zinc/47/84/58/566478458.db2.gz CTAXDIPQCVXRJH-AWEZNQCLSA-N 0 1 375.296 3.058 10 0 GGAEMN CC[C@H](C(=O)[O-])[N@@H+](C)Cc1cc(Br)cc(Br)c1N ZINC000650805492 566479733 /nfs/dbraw/zinc/47/97/33/566479733.db2.gz BMAIRZFQCCLVSJ-SNVBAGLBSA-N 0 1 380.080 3.089 10 0 GGAEMN O=S(=O)(c1ccccc1)N1CC[C@H](NCc2cscc2C(F)(F)F)C1 ZINC000558489061 566480131 /nfs/dbraw/zinc/48/01/31/566480131.db2.gz XHPZXKAJQGYWSF-ZDUSSCGKSA-N 0 1 390.452 3.320 10 0 GGAEMN CCSc1ccc(CC(=O)N2CCc3nc[nH]c3C2)c(Br)c1 ZINC000627375025 566480555 /nfs/dbraw/zinc/48/05/55/566480555.db2.gz JXMVDBPWTSNIOU-UHFFFAOYSA-N 0 1 380.311 3.412 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000558498728 566481637 /nfs/dbraw/zinc/48/16/37/566481637.db2.gz HNQYUFYMZBKDTL-LLVKDONJSA-N 0 1 396.232 3.002 10 0 GGAEMN CC[C@H]1CN(C)CCCN1S(=O)(=O)c1cccc(Br)c1Cl ZINC000577987414 566482340 /nfs/dbraw/zinc/48/23/40/566482340.db2.gz GMYDEWLQGCKXPK-NSHDSACASA-N 0 1 395.750 3.207 10 0 GGAEMN COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2cccc3c2OCCC3)c1 ZINC000464540510 566482893 /nfs/dbraw/zinc/48/28/93/566482893.db2.gz KOBZFGSHSLAZTB-UHFFFAOYSA-N 0 1 381.837 3.252 10 0 GGAEMN CC[C@@H](C)Oc1ccc(NS(=O)(=O)c2ccccc2S(C)(=O)=O)cc1 ZINC000511698829 566483324 /nfs/dbraw/zinc/48/33/24/566483324.db2.gz CUVYWJXFGTZTNS-CYBMUJFWSA-N 0 1 383.491 3.068 10 0 GGAEMN CN1C[C@H]2CCN(C(=O)c3scc(Br)c3Br)[C@@H]2C1 ZINC000627487633 566483371 /nfs/dbraw/zinc/48/33/71/566483371.db2.gz HYHATZGDFUYZGC-VXNVDRBHSA-N 0 1 394.132 3.049 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NC1(C2CCC2)CC1 ZINC000650904718 566485058 /nfs/dbraw/zinc/48/50/58/566485058.db2.gz YNZPQNYUJAYKIJ-UHFFFAOYSA-N 0 1 390.285 3.366 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NC1(C2CCC2)CC1 ZINC000650904718 566485063 /nfs/dbraw/zinc/48/50/63/566485063.db2.gz YNZPQNYUJAYKIJ-UHFFFAOYSA-N 0 1 390.285 3.366 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCC12CCCC2 ZINC000650904399 566485334 /nfs/dbraw/zinc/48/53/34/566485334.db2.gz QHMURNQFAUNMHA-UHFFFAOYSA-N 0 1 390.285 3.462 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCC12CCCC2 ZINC000650904399 566485337 /nfs/dbraw/zinc/48/53/37/566485337.db2.gz QHMURNQFAUNMHA-UHFFFAOYSA-N 0 1 390.285 3.462 10 0 GGAEMN O=C(Nc1nc2cc(Br)ccc2[nH]1)c1cc(=O)c2ccccc2[nH]1 ZINC000464575542 566487612 /nfs/dbraw/zinc/48/76/12/566487612.db2.gz NEZQBLZYDOXWRL-UHFFFAOYSA-N 0 1 383.205 3.419 10 0 GGAEMN O=C(N[C@@H]1COc2ccc(F)cc2C1)c1cc(Br)cc2nc[nH]c21 ZINC000558578979 566488838 /nfs/dbraw/zinc/48/88/38/566488838.db2.gz LDIKIEGLWRAQRF-LBPRGKRZSA-N 0 1 390.212 3.198 10 0 GGAEMN CC[C@H](NC(=O)c1ccnc(N2CCN(C)CC2)c1)c1ccc(Cl)s1 ZINC000511862007 566493116 /nfs/dbraw/zinc/49/31/16/566493116.db2.gz XFDAADRVSDFQTR-AWEZNQCLSA-N 0 1 378.929 3.429 10 0 GGAEMN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CCN(C2CCCC2)CC1 ZINC000651072631 566493530 /nfs/dbraw/zinc/49/35/30/566493530.db2.gz YYAYZBCFQKOGLK-MRXNPFEDSA-N 0 1 393.325 3.402 10 0 GGAEMN CC[C@@H]1CN(CC)CCN1C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000627658476 566495247 /nfs/dbraw/zinc/49/52/47/566495247.db2.gz CPAYGEAOQFRRDB-ZYRRHWMLSA-N 0 1 377.326 3.278 10 0 GGAEMN Cn1ncc(Cl)c1S(=O)(=O)Nc1ccc(Oc2ccc(F)cc2)nc1 ZINC000485397212 566495704 /nfs/dbraw/zinc/49/57/04/566495704.db2.gz SORBMZLFCGPOEQ-UHFFFAOYSA-N 0 1 382.804 3.201 10 0 GGAEMN O=C(Nc1cnn(-c2ccccn2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000558630744 566495882 /nfs/dbraw/zinc/49/58/82/566495882.db2.gz OJPZWQFIFSWZIQ-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN CSc1ccccc1CSCC(=O)NC[C@@H]1CN(CC(C)C)CCO1 ZINC000511932432 566498152 /nfs/dbraw/zinc/49/81/52/566498152.db2.gz AIFOVDLJURXVFF-QGZVFWFLSA-N 0 1 382.595 3.115 10 0 GGAEMN Cn1nc2c(c1NS(=O)(=O)c1c(Cl)cccc1Br)CCC2 ZINC000558685476 566498398 /nfs/dbraw/zinc/49/83/98/566498398.db2.gz KDKQEKCNUJGGCM-UHFFFAOYSA-N 0 1 390.690 3.126 10 0 GGAEMN Fc1cc(CCNCc2ncc(I)s2)cc(F)c1F ZINC000511939425 566498464 /nfs/dbraw/zinc/49/84/64/566498464.db2.gz DBULCTZQBCLIDD-UHFFFAOYSA-N 0 1 398.191 3.497 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc2n[nH]cc2c1 ZINC000558704819 566500162 /nfs/dbraw/zinc/50/01/62/566500162.db2.gz NCXWGGWANMIUBC-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc2n[nH]cc2c1 ZINC000558704819 566500170 /nfs/dbraw/zinc/50/01/70/566500170.db2.gz NCXWGGWANMIUBC-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1ccc2cncn2c1)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000627714935 566501803 /nfs/dbraw/zinc/50/18/03/566501803.db2.gz IAVTXGWOTOUMQL-CGTJXYLNSA-N 0 1 382.261 3.299 10 0 GGAEMN Nc1nccc([C@@H]2CCCN(CCCc3ccccc3Br)C2)n1 ZINC000558735732 566502947 /nfs/dbraw/zinc/50/29/47/566502947.db2.gz VHKXPIKWOOIRFY-OAHLLOKOSA-N 0 1 375.314 3.464 10 0 GGAEMN Nc1nccc([C@H]2CCCN(CCCc3ccccc3Br)C2)n1 ZINC000558735728 566503837 /nfs/dbraw/zinc/50/38/37/566503837.db2.gz VHKXPIKWOOIRFY-HNNXBMFYSA-N 0 1 375.314 3.464 10 0 GGAEMN COc1nc(C)c(Br)cc1C(=O)NCc1nc2cccc(C)c2[nH]1 ZINC000485499601 566505030 /nfs/dbraw/zinc/50/50/30/566505030.db2.gz INVJLXOPHCZUTJ-UHFFFAOYSA-N 0 1 389.253 3.276 10 0 GGAEMN COc1ccc2nc(SCc3ccc(S(=O)(=O)N(C)C)s3)[nH]c2c1 ZINC000424062973 566507470 /nfs/dbraw/zinc/50/74/70/566507470.db2.gz IFQYAFXXKLTJAG-UHFFFAOYSA-N 0 1 383.520 3.176 10 0 GGAEMN Fc1ccc2c(Br)cnc(N3CCN(C[C@H]4CCCO4)CC3)c2c1 ZINC000651292516 566507773 /nfs/dbraw/zinc/50/77/73/566507773.db2.gz NORZSTATTCLCHK-CQSZACIVSA-N 0 1 394.288 3.437 10 0 GGAEMN N=c1[nH]oc2cc(CNC(=O)[C@@H]3[C@@H]4Cc5c(cccc5Br)[C@@H]43)ccc12 ZINC000627803115 566508219 /nfs/dbraw/zinc/50/82/19/566508219.db2.gz VNHCWRODYFPBQY-XOKHGSTOSA-N 0 1 398.260 3.205 10 0 GGAEMN COc1cccc(C[C@@H](C)NCc2ncc(I)s2)c1 ZINC000512052517 566508238 /nfs/dbraw/zinc/50/82/38/566508238.db2.gz MQTIGACZKRZCPL-SNVBAGLBSA-N 0 1 388.274 3.477 10 0 GGAEMN COCc1ccc(OC)c(S(=O)(=O)Nc2ccc(Cl)cc2COC)c1 ZINC000424082329 566509147 /nfs/dbraw/zinc/50/91/47/566509147.db2.gz LNADKGAEWYTETB-UHFFFAOYSA-N 0 1 385.869 3.442 10 0 GGAEMN COCc1cnc(CN[C@H]2CCN(c3ccc(Br)cc3)C2)s1 ZINC000538393166 566509618 /nfs/dbraw/zinc/50/96/18/566509618.db2.gz NSJGHLJQMSCXMA-ZDUSSCGKSA-N 0 1 382.327 3.421 10 0 GGAEMN COc1ccc(I)c(NC(=O)[C@@H]2CCCc3[nH]ncc32)c1 ZINC000578292426 566509771 /nfs/dbraw/zinc/50/97/71/566509771.db2.gz SNJANCRXOIGJEF-SNVBAGLBSA-N 0 1 397.216 3.082 10 0 GGAEMN CN1CCN(C)[C@@H](CNc2cc3nccc(Cl)c3cc2Br)C1 ZINC000651312605 566510952 /nfs/dbraw/zinc/51/09/52/566510952.db2.gz KZWVZPVDDKCHIB-NSHDSACASA-N 0 1 383.721 3.308 10 0 GGAEMN CCSc1ccc(CC(=O)N2CC[C@H](c3nc[nH]n3)C2)c(Br)c1 ZINC000627836701 566512289 /nfs/dbraw/zinc/51/22/89/566512289.db2.gz DJNLGIZFDQATIS-LBPRGKRZSA-N 0 1 395.326 3.238 10 0 GGAEMN CCCN1CCN(c2nnc(-c3ccc(Br)s3)n2CC)CC1 ZINC000558879843 566513229 /nfs/dbraw/zinc/51/32/29/566513229.db2.gz LACCBQXNPCCYNW-UHFFFAOYSA-N 0 1 384.347 3.321 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)Nc2ccnc(C)c2Br)n[nH]1 ZINC000558955665 566517065 /nfs/dbraw/zinc/51/70/65/566517065.db2.gz BCZWALSFPCVWRS-WPRPVWTQSA-N 0 1 381.278 3.089 10 0 GGAEMN OCC1(CNCc2cn(-c3ccccc3Br)nn2)CC2(CCC2)C1 ZINC000578404052 566519090 /nfs/dbraw/zinc/51/90/90/566519090.db2.gz CHLBHPUBQHDSDT-UHFFFAOYSA-N 0 1 391.313 3.062 10 0 GGAEMN C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@H]1C(=O)[O-] ZINC000424268526 566525348 /nfs/dbraw/zinc/52/53/48/566525348.db2.gz NLVPASQCEFNAGX-ZUZCIYMTSA-N 0 1 387.249 3.102 10 0 GGAEMN CC(C)(C)OC(=O)CCCNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000465275628 566525884 /nfs/dbraw/zinc/52/58/84/566525884.db2.gz DJUMDJHTCBTVFO-UHFFFAOYSA-N 0 1 382.258 3.177 10 0 GGAEMN CCCN1CCN(c2nnc([C@@H]3CCCS3)n2Cc2cccs2)CC1 ZINC000424361221 566528346 /nfs/dbraw/zinc/52/83/46/566528346.db2.gz UWGPTTZHGTYVDL-INIZCTEOSA-N 0 1 377.583 3.488 10 0 GGAEMN CC(C)N1CCN(c2nnc([C@H]3CCCS3)n2Cc2cccs2)CC1 ZINC000424360214 566528355 /nfs/dbraw/zinc/52/83/55/566528355.db2.gz ROBYURSGKGVYBD-MRXNPFEDSA-N 0 1 377.583 3.486 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(Br)cc2OC)[C@H]1n1cccn1 ZINC000578502964 566529063 /nfs/dbraw/zinc/52/90/63/566529063.db2.gz YMGNTYMEOLSHDI-DJIMGWMZSA-N 0 1 380.286 3.163 10 0 GGAEMN C[C@@H]1C[C@@H](NC(=O)c2ncsc2Br)CN1Cc1ccccc1 ZINC000673230552 566529355 /nfs/dbraw/zinc/52/93/55/566529355.db2.gz VJDMUGINMXUMGA-DGCLKSJQSA-N 0 1 380.311 3.298 10 0 GGAEMN O=C(N[C@H]1CCCc2cn[nH]c21)[C@H]1CCOc2ccc(Br)cc21 ZINC000651533102 566530307 /nfs/dbraw/zinc/53/03/07/566530307.db2.gz NASPLSUDNJUZRJ-JSGCOSHPSA-N 0 1 376.254 3.232 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000603504824 566530360 /nfs/dbraw/zinc/53/03/60/566530360.db2.gz RPWFDPIPMXCIFY-UHFFFAOYSA-N 0 1 380.832 3.051 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)NCc1n[nH]c(-c2ccc(F)cc2)n1 ZINC000603504824 566530364 /nfs/dbraw/zinc/53/03/64/566530364.db2.gz RPWFDPIPMXCIFY-UHFFFAOYSA-N 0 1 380.832 3.051 10 0 GGAEMN Cc1ccc2nc(CNc3cc(Br)cc(F)c3C(N)=O)[nH]c2c1 ZINC000538742995 566530697 /nfs/dbraw/zinc/53/06/97/566530697.db2.gz ONSSQOIWJSWZCD-UHFFFAOYSA-N 0 1 377.217 3.484 10 0 GGAEMN CC(C)Oc1cc(C(=O)N[C@H]2CCc3nc[nH]c3C2)ccc1Br ZINC000651546196 566532031 /nfs/dbraw/zinc/53/20/31/566532031.db2.gz KAFCNHRBMHLIIV-LBPRGKRZSA-N 0 1 378.270 3.247 10 0 GGAEMN CC(C)Oc1cc(C(=O)N[C@@H]2CCc3nc[nH]c3C2)ccc1Br ZINC000651546195 566532460 /nfs/dbraw/zinc/53/24/60/566532460.db2.gz KAFCNHRBMHLIIV-GFCCVEGCSA-N 0 1 378.270 3.247 10 0 GGAEMN COc1nccnc1CNCCSCCOc1cccc(Br)c1 ZINC000449156683 566533049 /nfs/dbraw/zinc/53/30/49/566533049.db2.gz OHFRYQYNOIRHAC-UHFFFAOYSA-N 0 1 398.326 3.150 10 0 GGAEMN CN1Cc2ccccc2[C@H](Nc2cc(Br)cc(F)c2C(N)=O)C1 ZINC000538764348 566535227 /nfs/dbraw/zinc/53/52/27/566535227.db2.gz BAAMXIJEVLELNH-OAHLLOKOSA-N 0 1 378.245 3.286 10 0 GGAEMN Cc1cc(Br)c(CNCc2cnc(N3CCOCC3)s2)s1 ZINC000651587105 566538323 /nfs/dbraw/zinc/53/83/23/566538323.db2.gz FXSWUCIDMPOMIJ-UHFFFAOYSA-N 0 1 388.356 3.402 10 0 GGAEMN O=S1(=O)CCCC[C@H]1CN[C@H]1CCc2c1ccc(F)c2Br ZINC000449232243 566538737 /nfs/dbraw/zinc/53/87/37/566538737.db2.gz HKPBROJKSRKCFV-HZMBPMFUSA-N 0 1 376.291 3.132 10 0 GGAEMN OCCC1(NCc2ncc(Br)cc2Br)CCCC1 ZINC000512496654 566540357 /nfs/dbraw/zinc/54/03/57/566540357.db2.gz MFWUYRKJHWVTHP-UHFFFAOYSA-N 0 1 378.108 3.391 10 0 GGAEMN O=C1[C@H](NCc2cc(F)cc(Br)c2)CCCN1c1cccnc1 ZINC000449241568 566540920 /nfs/dbraw/zinc/54/09/20/566540920.db2.gz SYLBGIDEGRQSHR-MRXNPFEDSA-N 0 1 378.245 3.268 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651609887 566542010 /nfs/dbraw/zinc/54/20/10/566542010.db2.gz OVLIABQZFPNAJN-PWSUYJOCSA-N 0 1 393.285 3.434 10 0 GGAEMN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ncsc2Br)C1 ZINC000512599158 566544286 /nfs/dbraw/zinc/54/42/86/566544286.db2.gz YSSDEGOVVYNGKG-YPMHNXCESA-N 0 1 380.311 3.471 10 0 GGAEMN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ncsc2Br)C1 ZINC000512599157 566544353 /nfs/dbraw/zinc/54/43/53/566544353.db2.gz YSSDEGOVVYNGKG-WCQYABFASA-N 0 1 380.311 3.471 10 0 GGAEMN CN(CC(=O)NCC/C=C/c1ccc(Br)cc1)[C@@H]1CCSC1 ZINC000628335249 566547599 /nfs/dbraw/zinc/54/75/99/566547599.db2.gz HVLNWHWMIANISS-WPTTZPOMSA-N 0 1 383.355 3.406 10 0 GGAEMN CN(CC(=O)NCC/C=C\c1ccc(Br)cc1)[C@H]1CCSC1 ZINC000628335248 566547798 /nfs/dbraw/zinc/54/77/98/566547798.db2.gz HVLNWHWMIANISS-OUMXJLHTSA-N 0 1 383.355 3.406 10 0 GGAEMN O=C(c1cc2cc(Cl)sc2[nH]1)N1CCC(CCN2CCOCC2)CC1 ZINC000486009616 566548520 /nfs/dbraw/zinc/54/85/20/566548520.db2.gz QWUDTCFZAOGONI-UHFFFAOYSA-N 0 1 381.929 3.457 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@@H](c2cccnc2)C2CC2)sc1Br ZINC000538941611 566549600 /nfs/dbraw/zinc/54/96/00/566549600.db2.gz DZICPGARSXMAOF-LLVKDONJSA-N 0 1 388.312 3.039 10 0 GGAEMN Cc1nnc(SCCC(=O)N2C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)[nH]1 ZINC000673645364 566550026 /nfs/dbraw/zinc/55/00/26/566550026.db2.gz APYUUGUCESUFNL-DTORHVGOSA-N 0 1 390.353 3.185 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1sccc1F ZINC000559448349 566550558 /nfs/dbraw/zinc/55/05/58/566550558.db2.gz GLGMPGMEYWTNLV-UHFFFAOYSA-N 0 1 381.230 3.365 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1sccc1F ZINC000559448349 566550565 /nfs/dbraw/zinc/55/05/65/566550565.db2.gz GLGMPGMEYWTNLV-UHFFFAOYSA-N 0 1 381.230 3.365 10 0 GGAEMN CNC(=O)[C@H](CCSC)N[C@H]1CCc2c1ccc(F)c2Br ZINC000449326966 566550579 /nfs/dbraw/zinc/55/05/79/566550579.db2.gz APOUDMCCBMIRSE-STQMWFEESA-N 0 1 375.307 3.033 10 0 GGAEMN Cc1nnc(SCCC(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)[nH]1 ZINC000673645366 566550973 /nfs/dbraw/zinc/55/09/73/566550973.db2.gz APYUUGUCESUFNL-RKDXNWHRSA-N 0 1 390.353 3.185 10 0 GGAEMN CNC(=O)[C@H](CCSC)N[C@@H]1CCc2c1ccc(F)c2Br ZINC000449326965 566551179 /nfs/dbraw/zinc/55/11/79/566551179.db2.gz APOUDMCCBMIRSE-OLZOCXBDSA-N 0 1 375.307 3.033 10 0 GGAEMN CCCOc1ccc(Br)cc1CN(C)[C@H]1CCN2CCO[C@H]1C2 ZINC000449362258 566551729 /nfs/dbraw/zinc/55/17/29/566551729.db2.gz KQMXMVJFIUJDQB-WMZOPIPTSA-N 0 1 383.330 3.143 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2cccc(Br)c2F)c2ccccc21 ZINC000449358867 566552954 /nfs/dbraw/zinc/55/29/54/566552954.db2.gz PAAAIIOWYVATFG-GFCCVEGCSA-N 0 1 384.270 3.249 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CC[C@H]3CC[C@@H](C2)S3)nn1 ZINC000628423035 566554132 /nfs/dbraw/zinc/55/41/32/566554132.db2.gz ZGBHZDRBSWTOEE-KGLIPLIRSA-N 0 1 379.327 3.500 10 0 GGAEMN Cc1cc(C(=O)NCCCCN2CCOCC2)cc(Cl)c1Br ZINC000559519385 566554424 /nfs/dbraw/zinc/55/44/24/566554424.db2.gz JKLDCYIKKITNGY-UHFFFAOYSA-N 0 1 389.721 3.253 10 0 GGAEMN CN(C)c1ccnc(NC(=O)[C@@H]2CCOc3ccc(Br)cc32)c1 ZINC000651709804 566554974 /nfs/dbraw/zinc/55/49/74/566554974.db2.gz JDXPEPNZAQDYDD-CYBMUJFWSA-N 0 1 376.254 3.415 10 0 GGAEMN C[C@H]1CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@@H]1C ZINC000465986704 566555181 /nfs/dbraw/zinc/55/51/81/566555181.db2.gz WYNQFCUOHGCANC-QWRGUYRKSA-N 0 1 378.274 3.032 10 0 GGAEMN C[C@H]1CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@@H]1C ZINC000465986704 566555186 /nfs/dbraw/zinc/55/51/86/566555186.db2.gz WYNQFCUOHGCANC-QWRGUYRKSA-N 0 1 378.274 3.032 10 0 GGAEMN CN(C)c1ccnc(NC(=O)[C@H]2CCOc3ccc(Br)cc32)c1 ZINC000651709805 566555217 /nfs/dbraw/zinc/55/52/17/566555217.db2.gz JDXPEPNZAQDYDD-ZDUSSCGKSA-N 0 1 376.254 3.415 10 0 GGAEMN O=S(=O)(Nc1ncc(C2CCC2)cc1Br)c1cnc2n1CCC2 ZINC000578835341 566557396 /nfs/dbraw/zinc/55/73/96/566557396.db2.gz MPLBZXPBSYSXLZ-UHFFFAOYSA-N 0 1 397.298 3.055 10 0 GGAEMN Cn1ccc(CN2CC[C@@H](Cc3cccc(I)c3)C2)n1 ZINC000449397671 566558296 /nfs/dbraw/zinc/55/82/96/566558296.db2.gz VNYXCOOKJOZBOX-AWEZNQCLSA-N 0 1 381.261 3.089 10 0 GGAEMN Cc1nc(CNC2CCN(C(=O)c3ccoc3)CC2)sc1Br ZINC000449403035 566558983 /nfs/dbraw/zinc/55/89/83/566558983.db2.gz USSHJBXTMDIVAV-UHFFFAOYSA-N 0 1 384.299 3.201 10 0 GGAEMN Cc1n[nH]c(C(=O)NC2(c3ccc(Br)cc3)CCOCC2)c1C ZINC000604317326 566560399 /nfs/dbraw/zinc/56/03/99/566560399.db2.gz XDGHWEJDPLOADR-UHFFFAOYSA-N 0 1 378.270 3.225 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1CC[C@@H](CO)[C@H]1CC ZINC000449425256 566560953 /nfs/dbraw/zinc/56/09/53/566560953.db2.gz PVQKAFRQQSVRJI-WMLDXEAASA-N 0 1 386.330 3.457 10 0 GGAEMN COc1ccc(Cl)cc1[C@@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000578891065 566561992 /nfs/dbraw/zinc/56/19/92/566561992.db2.gz DENTUFAKGZFPTB-OCCSQVGLSA-N 0 1 381.881 3.234 10 0 GGAEMN O=C(NCc1cc(F)cc(Br)c1)Nc1cnn(-c2ccncc2)c1 ZINC000673861302 566562078 /nfs/dbraw/zinc/56/20/78/566562078.db2.gz DDQZKFGAOIWOJX-UHFFFAOYSA-N 0 1 390.216 3.491 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000628495169 566562400 /nfs/dbraw/zinc/56/24/00/566562400.db2.gz KBHUXVCLKOCXAF-AWEZNQCLSA-N 0 1 382.913 3.361 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(F)c(-c3cccs3)c2)C1 ZINC000628496706 566562510 /nfs/dbraw/zinc/56/25/10/566562510.db2.gz XDISVJTYWNQXGK-OAHLLOKOSA-N 0 1 382.526 3.315 10 0 GGAEMN COc1ncc(C(=O)N2CCN(CCC(C)(C)C)CC2)cc1Br ZINC000424730022 566563593 /nfs/dbraw/zinc/56/35/93/566563593.db2.gz YBXNJPBBKLNJQT-UHFFFAOYSA-N 0 1 384.318 3.047 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(C)[C@H](C)c1ccccc1Br ZINC000578922129 566565155 /nfs/dbraw/zinc/56/51/55/566565155.db2.gz OLFXWKSICWHFSN-CYBMUJFWSA-N 0 1 377.348 3.114 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)Cc2noc3ccc(Br)cc32)C[C@H]1C ZINC000424747235 566566196 /nfs/dbraw/zinc/56/61/96/566566196.db2.gz MRDJLSUNGUPJEB-NEPJUHHUSA-N 0 1 380.286 3.074 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)Cc2noc3ccc(Br)cc32)C[C@@H]1C ZINC000424747236 566566884 /nfs/dbraw/zinc/56/68/84/566566884.db2.gz MRDJLSUNGUPJEB-NWDGAFQWSA-N 0 1 380.286 3.074 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2cc(F)ccc2Cl)c(Cl)c1 ZINC000578945849 566567108 /nfs/dbraw/zinc/56/71/08/566567108.db2.gz HEGUZAVORSNMCW-UHFFFAOYSA-N 0 1 379.196 3.115 10 0 GGAEMN COc1ccc(CNC(=O)CN[C@@H]2CCc3sc(Br)cc32)cc1 ZINC000559742626 566568595 /nfs/dbraw/zinc/56/85/95/566568595.db2.gz CQSGHTHAXYTCPI-CQSZACIVSA-N 0 1 395.322 3.413 10 0 GGAEMN CC[C@H](Cc1ccc(OC)c(OC)c1)NCc1nn(C)cc1Br ZINC000449487043 566569773 /nfs/dbraw/zinc/56/97/73/566569773.db2.gz WMVVEFOTQAHQFX-CYBMUJFWSA-N 0 1 382.302 3.311 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CNCc1cc(Br)ccc1Cl ZINC000512968844 566571384 /nfs/dbraw/zinc/57/13/84/566571384.db2.gz ZLWFTJLZMRRBCJ-ZDUSSCGKSA-N 0 1 395.750 3.006 10 0 GGAEMN OC1(C2CCN(Cc3ccc(Br)cc3N3CCOCC3)CC2)CC1 ZINC000651878033 566571514 /nfs/dbraw/zinc/57/15/14/566571514.db2.gz SIJMZZTYFLXHRR-UHFFFAOYSA-N 0 1 395.341 3.023 10 0 GGAEMN COc1ccc(CNC[C@@]2(CO)CCc3ccccc32)c(Br)c1O ZINC000651884667 566573435 /nfs/dbraw/zinc/57/34/35/566573435.db2.gz NNNKWMOTLAEHHB-LJQANCHMSA-N 0 1 392.293 3.129 10 0 GGAEMN COc1cc(Br)c(CNC[C@@]2(CO)CCc3ccccc32)cc1O ZINC000651885094 566573594 /nfs/dbraw/zinc/57/35/94/566573594.db2.gz YGVLSWAGPHHJKI-LJQANCHMSA-N 0 1 392.293 3.129 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CNCc1ccc(Br)cc1Cl ZINC000513022650 566573659 /nfs/dbraw/zinc/57/36/59/566573659.db2.gz WSJZSBLDHZEEQL-CYBMUJFWSA-N 0 1 395.750 3.006 10 0 GGAEMN CN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000486286966 566576154 /nfs/dbraw/zinc/57/61/54/566576154.db2.gz WECCONHUHSPQAS-GFCCVEGCSA-N 0 1 390.281 3.012 10 0 GGAEMN CN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000486286966 566576155 /nfs/dbraw/zinc/57/61/55/566576155.db2.gz WECCONHUHSPQAS-GFCCVEGCSA-N 0 1 390.281 3.012 10 0 GGAEMN O[C@@]1(CCNCc2csc(-c3cccc(Br)c3)n2)CCOC1 ZINC000651941847 566577723 /nfs/dbraw/zinc/57/77/23/566577723.db2.gz MCCLDHOWUVILGJ-INIZCTEOSA-N 0 1 383.311 3.204 10 0 GGAEMN CC[C@@H](C)N1CCN(C(=O)Cc2noc3ccc(Br)cc32)CC1 ZINC000424868993 566582783 /nfs/dbraw/zinc/58/27/83/566582783.db2.gz IYGSPWIBTQHLAR-GFCCVEGCSA-N 0 1 380.286 3.076 10 0 GGAEMN COC(=O)C[C@@](C)(NCc1ccnc(OC)c1)c1ccc(Br)cc1 ZINC000513147545 566582794 /nfs/dbraw/zinc/58/27/94/566582794.db2.gz BNMWXXQWGRUISP-GOSISDBHSA-N 0 1 393.281 3.421 10 0 GGAEMN O[C@H](COC[C@@H]1CCCO1)CN1CCc2sccc2[C@H]1c1cccs1 ZINC000674276912 566583029 /nfs/dbraw/zinc/58/30/29/566583029.db2.gz NCGJDGRFJALOFT-DOXZYTNZSA-N 0 1 379.547 3.314 10 0 GGAEMN CN(C)Cc1ccc(C(N)=O)cc1NC(=O)c1cc2cc(Cl)sc2[nH]1 ZINC000486382292 566582955 /nfs/dbraw/zinc/58/29/55/566582955.db2.gz QBSOJGUDGWBYSC-UHFFFAOYSA-N 0 1 376.869 3.296 10 0 GGAEMN CC[C@H]1CN(CC)CCN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000424871548 566583557 /nfs/dbraw/zinc/58/35/57/566583557.db2.gz MMNUPONNVBPCMO-ZDUSSCGKSA-N 0 1 380.286 3.076 10 0 GGAEMN NC(=O)c1ccc(NS(=O)(=O)c2cccc(Br)c2Cl)cc1 ZINC000560010256 566585392 /nfs/dbraw/zinc/58/53/92/566585392.db2.gz DNELXSYFDDYGAI-UHFFFAOYSA-N 0 1 389.658 3.002 10 0 GGAEMN CN1CCN(c2ccc(Br)cc2NC(=O)[C@@H]2CCC(C)(C)O2)CC1 ZINC000486435952 566588341 /nfs/dbraw/zinc/58/83/41/566588341.db2.gz RNYLJYOWSCEBOQ-INIZCTEOSA-N 0 1 396.329 3.097 10 0 GGAEMN CNC(=O)CC[C@@H]1CCCCN1Cc1nc2cc(Br)ccc2[nH]1 ZINC000513211496 566588604 /nfs/dbraw/zinc/58/86/04/566588604.db2.gz XIDIXBWAPCXMPX-ZDUSSCGKSA-N 0 1 379.302 3.206 10 0 GGAEMN CNC(=O)CC[C@@H]1CCCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000513211496 566588620 /nfs/dbraw/zinc/58/86/20/566588620.db2.gz XIDIXBWAPCXMPX-ZDUSSCGKSA-N 0 1 379.302 3.206 10 0 GGAEMN O=C(C1=Cc2cc(Br)ccc2OC1)N1CCC(c2cnc[nH]2)CC1 ZINC000674364295 566588748 /nfs/dbraw/zinc/58/87/48/566588748.db2.gz GBMZGONEQBDJLQ-UHFFFAOYSA-N 0 1 388.265 3.354 10 0 GGAEMN Cc1noc(CN2CCN(CC/C=C\c3ccc(Br)cc3)CC2)n1 ZINC000604997364 566589445 /nfs/dbraw/zinc/58/94/45/566589445.db2.gz OUKQOXDNMMCEGK-RQOWECAXSA-N 0 1 391.313 3.362 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1cccc(Br)c1Cl ZINC000560042032 566590921 /nfs/dbraw/zinc/59/09/21/566590921.db2.gz YPCANAIOORGOKT-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN COCc1cnc(CNC[C@@H](CO)Cc2cccc(Br)c2C)s1 ZINC000449683267 566591087 /nfs/dbraw/zinc/59/10/87/566591087.db2.gz NAPJFMQONHGGBC-ZDUSSCGKSA-N 0 1 399.354 3.301 10 0 GGAEMN Cn1nc(-c2ccsc2)cc1NS(=O)(=O)c1ccc2c(c1)CCCO2 ZINC000486563152 566598936 /nfs/dbraw/zinc/59/89/36/566598936.db2.gz GUOPVQQNPVAIQH-UHFFFAOYSA-N 0 1 375.475 3.274 10 0 GGAEMN CC(C)Cn1cnc(S(=O)(=O)Nc2cc(F)cc(Br)c2F)c1 ZINC000486565909 566598947 /nfs/dbraw/zinc/59/89/47/566598947.db2.gz MMTHTJAVWYCNRP-UHFFFAOYSA-N 0 1 394.241 3.381 10 0 GGAEMN O=S(=O)(Cc1ccc(Br)cc1)Nc1nc2ccc(F)cc2[nH]1 ZINC000486570619 566599079 /nfs/dbraw/zinc/59/90/79/566599079.db2.gz JYEOKPHJFKILGS-UHFFFAOYSA-N 0 1 384.230 3.406 10 0 GGAEMN Cc1noc(CCCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)n1 ZINC000628968725 566600018 /nfs/dbraw/zinc/60/00/18/566600018.db2.gz MVQQJWKTTGOGAE-HNNXBMFYSA-N 0 1 385.295 3.427 10 0 GGAEMN CN(C)C[C@H](NC(=O)CN1CCCCCC1=O)c1ccc(Cl)c(Cl)c1 ZINC000628968675 566600242 /nfs/dbraw/zinc/60/02/42/566600242.db2.gz MIGCPFJQLWCOER-INIZCTEOSA-N 0 1 386.323 3.115 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)Nc1cc(C)nn1C1CCOCC1 ZINC000486574462 566600387 /nfs/dbraw/zinc/60/03/87/566600387.db2.gz LLPAKRHRBBBXGP-UHFFFAOYSA-N 0 1 385.873 3.006 10 0 GGAEMN O[C@]1(CCN[C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CCOC1 ZINC000652262080 566600458 /nfs/dbraw/zinc/60/04/58/566600458.db2.gz PBXHKSVGRLQQPX-IAGOWNOFSA-N 0 1 384.245 3.402 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1cn(C2CCC2)nn1)c1ccc(Cl)c(Cl)c1 ZINC000628969146 566600517 /nfs/dbraw/zinc/60/05/17/566600517.db2.gz MKEHYUDVFQZCCY-OAHLLOKOSA-N 0 1 382.295 3.343 10 0 GGAEMN CCOCCO[C@H](C)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968615 566600527 /nfs/dbraw/zinc/60/05/27/566600527.db2.gz KYWVNFAJOYOPCV-MLGOLLRUSA-N 0 1 377.312 3.154 10 0 GGAEMN CCn1cc(S(=O)(=O)Nc2cc(F)cc(Br)c2F)nc1C ZINC000486575016 566600637 /nfs/dbraw/zinc/60/06/37/566600637.db2.gz XRTUAZJZICDWFP-UHFFFAOYSA-N 0 1 380.214 3.053 10 0 GGAEMN Cc1nccc(CCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)n1 ZINC000628969228 566600702 /nfs/dbraw/zinc/60/07/02/566600702.db2.gz PQXBVSUCZHUEBF-KRWDZBQOSA-N 0 1 381.307 3.444 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CC[C@@]1(C)CCC(=O)N1)c1ccc(Cl)c(Cl)c1 ZINC000628968307 566600729 /nfs/dbraw/zinc/60/07/29/566600729.db2.gz DCQAQUQXBHJWLU-QAPCUYQASA-N 0 1 386.323 3.161 10 0 GGAEMN CCCNC(=O)CCCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968372 566600749 /nfs/dbraw/zinc/60/07/49/566600749.db2.gz HFQXWGJASLXDMC-INIZCTEOSA-N 0 1 388.339 3.409 10 0 GGAEMN CC(=O)NCCCCCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968805 566600850 /nfs/dbraw/zinc/60/08/50/566600850.db2.gz QAZBBJYYOPGRGN-KRWDZBQOSA-N 0 1 388.339 3.409 10 0 GGAEMN CC(C)CCC(=O)NCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968770 566601023 /nfs/dbraw/zinc/60/10/23/566601023.db2.gz OXMBJJDOGRHYOI-MRXNPFEDSA-N 0 1 388.339 3.265 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@@H](O)Cc1ccccc1)c1ccc(Cl)c(Cl)c1 ZINC000628968704 566601046 /nfs/dbraw/zinc/60/10/46/566601046.db2.gz JGCCXTGMJQBWHF-MSOLQXFVSA-N 0 1 381.303 3.316 10 0 GGAEMN CC(C)(C)N1CCc2nc(NC(=O)c3cc(S(C)(=O)=O)cs3)sc2C1 ZINC000425075889 566602077 /nfs/dbraw/zinc/60/20/77/566602077.db2.gz FANZTGVGCQDBIC-UHFFFAOYSA-N 0 1 399.563 3.017 10 0 GGAEMN Cc1c(CCC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)cnn1C ZINC000628969847 566602616 /nfs/dbraw/zinc/60/26/16/566602616.db2.gz ZNLKDBFVWWRVND-QGZVFWFLSA-N 0 1 383.323 3.387 10 0 GGAEMN COc1cc(Br)ccc1CNC[C@@H]1CS(=O)(=O)c2ccccc21 ZINC000560140012 566603147 /nfs/dbraw/zinc/60/31/47/566603147.db2.gz DXNBSZLAJCCSFE-CYBMUJFWSA-N 0 1 396.306 3.118 10 0 GGAEMN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)N[C@H]1CCCN(C)C1 ZINC000674700304 566605030 /nfs/dbraw/zinc/60/50/30/566605030.db2.gz OQRRDUOQIIQQAB-LBPRGKRZSA-N 0 1 387.311 3.058 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@H](CCF)C1 ZINC000629020430 566605527 /nfs/dbraw/zinc/60/55/27/566605527.db2.gz TXKQYRUVPPDFAI-GFCCVEGCSA-N 0 1 382.233 3.040 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@H](CCF)C1 ZINC000629022431 566605920 /nfs/dbraw/zinc/60/59/20/566605920.db2.gz KQSNKBOXTCUTAT-CYBMUJFWSA-N 0 1 382.233 3.040 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(C)cc3Br)[nH]c2c1 ZINC000466919164 566609560 /nfs/dbraw/zinc/60/95/60/566609560.db2.gz ZVNYRVAMSCOFOQ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN CCN1CCN(CC(=O)N2CCC[C@@H]2c2ccc(Br)cc2C)CC1 ZINC000629076739 566609644 /nfs/dbraw/zinc/60/96/44/566609644.db2.gz AQZBNDPIURVIPA-GOSISDBHSA-N 0 1 394.357 3.059 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC(c3nc(C(F)(F)F)cs3)CC2)C1 ZINC000652418040 566610628 /nfs/dbraw/zinc/61/06/28/566610628.db2.gz PSUDGMCAJFLTPD-GFCCVEGCSA-N 0 1 376.448 3.145 10 0 GGAEMN O=C(c1cccc(Br)c1O)N(C[C@H]1CCCO1)[C@@H]1CCSC1 ZINC000539889257 566611654 /nfs/dbraw/zinc/61/16/54/566611654.db2.gz DJQGKHLKHBHCMI-VXGBXAGGSA-N 0 1 386.311 3.281 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1cc(Br)cc2ccccc21 ZINC000605529899 566612116 /nfs/dbraw/zinc/61/21/16/566612116.db2.gz DUMKLDYYJMBIGU-UHFFFAOYSA-N 0 1 386.253 3.315 10 0 GGAEMN Cc1cc(COCC(=O)Nc2cc(Br)cc(Cl)c2O)on1 ZINC000513603872 566613389 /nfs/dbraw/zinc/61/33/89/566613389.db2.gz CTDLGCDHQYXJBA-UHFFFAOYSA-N 0 1 375.606 3.260 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1C[C@@H]2CCC[C@]2(CO)C1 ZINC000629087987 566613420 /nfs/dbraw/zinc/61/34/20/566613420.db2.gz MICUZMNOYAHQGE-SCLBCKFNSA-N 0 1 390.281 3.074 10 0 GGAEMN CCOc1cc(CN2CCSC[C@H]2CCO)ccc1OCC(F)(F)F ZINC000539912332 566614060 /nfs/dbraw/zinc/61/40/60/566614060.db2.gz UETREQMEYGABMF-CQSZACIVSA-N 0 1 379.444 3.326 10 0 GGAEMN O=C([O-])CC[C@H]1CCC[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000652496166 566613969 /nfs/dbraw/zinc/61/39/69/566613969.db2.gz MEVLGGMVHLGZGX-OLZOCXBDSA-N 0 1 376.280 3.310 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H]1CCc2cc(Br)ccc2NC1=O ZINC000629095415 566614176 /nfs/dbraw/zinc/61/41/76/566614176.db2.gz AONQLJCNPBUZQR-LBPRGKRZSA-N 0 1 397.298 3.202 10 0 GGAEMN CCc1cc(CCC[N@H+]2Cc3cccc(Br)c3C[C@H]2C(=O)[O-])on1 ZINC000652489851 566614722 /nfs/dbraw/zinc/61/47/22/566614722.db2.gz MRHYZBMSTAJBCK-KRWDZBQOSA-N 0 1 393.281 3.444 10 0 GGAEMN O=C([O-])CC[C@@H]1CCC[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000652496168 566615110 /nfs/dbraw/zinc/61/51/10/566615110.db2.gz MEVLGGMVHLGZGX-STQMWFEESA-N 0 1 376.280 3.310 10 0 GGAEMN COc1cc2nccc(N3CCC(C(=O)N(C)C)CC3)c2cc1Br ZINC000425204130 566615221 /nfs/dbraw/zinc/61/52/21/566615221.db2.gz SWVOHWYJAQYTJR-UHFFFAOYSA-N 0 1 392.297 3.311 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)NCCc2ccccc2Br)n[nH]1 ZINC000560294029 566615564 /nfs/dbraw/zinc/61/55/64/566615564.db2.gz FKVLSMIXSBPQLS-LLVKDONJSA-N 0 1 380.290 3.294 10 0 GGAEMN O=C(COc1c(Cl)cc(Cl)cc1Cl)NC1(c2nn[nH]n2)CCCC1 ZINC000449922571 566616165 /nfs/dbraw/zinc/61/61/65/566616165.db2.gz BPYSXAGLIPTCFN-UHFFFAOYSA-N 0 1 390.658 3.124 10 0 GGAEMN COc1cc2nccc(N3C[C@H](C(N)=O)CC[C@@H]3C)c2cc1Br ZINC000425211508 566617304 /nfs/dbraw/zinc/61/73/04/566617304.db2.gz XDUVGYLXXHISAV-WDEREUQCSA-N 0 1 378.270 3.096 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC(c3ccc(OC)cn3)CC2)c1Br ZINC000652538095 566617603 /nfs/dbraw/zinc/61/76/03/566617603.db2.gz KFZWBDAWLNDATL-UHFFFAOYSA-N 0 1 393.285 3.158 10 0 GGAEMN O=C(N[C@H]1C[C@H](c2ccc(Br)cc2)C1)N[C@H]1CCc2nc[nH]c2C1 ZINC000579541291 566617721 /nfs/dbraw/zinc/61/77/21/566617721.db2.gz PZBSKQBHWNSSIF-QEJZJMRPSA-N 0 1 389.297 3.275 10 0 GGAEMN COC(=O)[C@H]1CCCN(c2ccnc3cc(OC)c(Br)cc32)C1 ZINC000425225499 566620494 /nfs/dbraw/zinc/62/04/94/566620494.db2.gz GKZKTZZTHGWSLE-NSHDSACASA-N 0 1 379.254 3.395 10 0 GGAEMN CCN(CC(=O)N1CCC[C@@H]1c1ccccc1I)C1CC1 ZINC000486803735 566623472 /nfs/dbraw/zinc/62/34/72/566623472.db2.gz JZWIFQPAQGESOY-MRXNPFEDSA-N 0 1 398.288 3.439 10 0 GGAEMN CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@H]1CCCc2[nH]ncc21 ZINC000467109745 566625486 /nfs/dbraw/zinc/62/54/86/566625486.db2.gz IBCDZGXTEKYFRJ-JTQLQIEISA-N 0 1 381.263 3.234 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cc(COc3c(Cl)cccc3Cl)on2)C1 ZINC000675155137 566627002 /nfs/dbraw/zinc/62/70/02/566627002.db2.gz ZVDKIFMBHOGXQR-LLVKDONJSA-N 0 1 384.263 3.384 10 0 GGAEMN O=C(CCc1cccc(F)c1Br)N1CCC[C@H](c2n[nH]c(=O)o2)C1 ZINC000425296073 566627229 /nfs/dbraw/zinc/62/72/29/566627229.db2.gz GJEKNNNBAWMJCP-NSHDSACASA-N 0 1 398.232 3.016 10 0 GGAEMN O=C(N[C@H](C1CC1)C1CCOCC1)c1n[nH]c2ccc(Br)cc21 ZINC000652769585 566627339 /nfs/dbraw/zinc/62/73/39/566627339.db2.gz KEARRCXFEHJVBZ-OAHLLOKOSA-N 0 1 378.270 3.260 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2csc(-c3ccc(Br)s3)n2)C1 ZINC000606366684 566627378 /nfs/dbraw/zinc/62/73/78/566627378.db2.gz LZYVATDZSHEBRN-SECBINFHSA-N 0 1 386.340 3.458 10 0 GGAEMN CN(CCOc1ccc(Br)cc1)C(=O)[C@H]1CCCc2[nH]ncc21 ZINC000467113278 566627717 /nfs/dbraw/zinc/62/77/17/566627717.db2.gz SFQHHNJRINSFMD-AWEZNQCLSA-N 0 1 378.270 3.130 10 0 GGAEMN CO[C@@H]1COCC[C@H]1CC(=O)Nc1cc(Cl)cc(Br)c1O ZINC000450047068 566628411 /nfs/dbraw/zinc/62/84/11/566628411.db2.gz UIGILHJMPHSZQU-QPUJVOFHSA-N 0 1 378.650 3.188 10 0 GGAEMN CO[C@H]1COCC[C@H]1CC(=O)Nc1cc(Cl)cc(Br)c1O ZINC000450047071 566628593 /nfs/dbraw/zinc/62/85/93/566628593.db2.gz UIGILHJMPHSZQU-UFBFGSQYSA-N 0 1 378.650 3.188 10 0 GGAEMN CO[C@@H]1COCC[C@@H]1CC(=O)Nc1cc(Cl)cc(Br)c1O ZINC000450047066 566628684 /nfs/dbraw/zinc/62/86/84/566628684.db2.gz UIGILHJMPHSZQU-PRHODGIISA-N 0 1 378.650 3.188 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCC[C@H]1c1ccc(Br)cn1 ZINC000560481934 566630059 /nfs/dbraw/zinc/63/00/59/566630059.db2.gz YCYXQHIROBSLND-WBMJQRKESA-N 0 1 375.270 3.351 10 0 GGAEMN O=C(c1ccc(I)cc1F)N1CCC(c2cnc[nH]2)CC1 ZINC000450064069 566630191 /nfs/dbraw/zinc/63/01/91/566630191.db2.gz WQPNOYBYAIHWNG-UHFFFAOYSA-N 0 1 399.207 3.173 10 0 GGAEMN CCN(C(=O)c1n[nH]c(-c2ccccc2)c1Br)[C@@H]1CCCOC1 ZINC000652816495 566630320 /nfs/dbraw/zinc/63/03/20/566630320.db2.gz DFLMIFWHFAWJFQ-CYBMUJFWSA-N 0 1 378.270 3.480 10 0 GGAEMN CN(C)C[C@H](N[C@@H](Cc1ccccc1)C(N)=O)c1ccc(Cl)c(Cl)c1 ZINC000629264478 566631193 /nfs/dbraw/zinc/63/11/93/566631193.db2.gz PCMLSZNNOWFQBJ-ROUUACIJSA-N 0 1 380.319 3.282 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCCN[C@@H](C)c2ccc(Cl)c(F)c2)s1 ZINC000540148752 566632435 /nfs/dbraw/zinc/63/24/35/566632435.db2.gz CKNAMTCICDPJNW-NSHDSACASA-N 0 1 376.906 3.478 10 0 GGAEMN Cc1ncc([C@@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C)n1 ZINC000540148503 566632836 /nfs/dbraw/zinc/63/28/36/566632836.db2.gz QVAPYINPECODRM-SNVBAGLBSA-N 0 1 387.285 3.492 10 0 GGAEMN Cc1ncc([C@@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)n1 ZINC000540148503 566632839 /nfs/dbraw/zinc/63/28/39/566632839.db2.gz QVAPYINPECODRM-SNVBAGLBSA-N 0 1 387.285 3.492 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1ccccc1Sc1nccn1C)C1CC1 ZINC000629287886 566634987 /nfs/dbraw/zinc/63/49/87/566634987.db2.gz BELFLNAVCJKPCE-HNNXBMFYSA-N 0 1 381.523 3.128 10 0 GGAEMN CN(C(=O)c1cccc(Br)c1O)[C@H]1CCN(c2ccccc2)C1=O ZINC000606533306 566636330 /nfs/dbraw/zinc/63/63/30/566636330.db2.gz UBCVAGDLUYLQQZ-HNNXBMFYSA-N 0 1 389.249 3.032 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1cc(Br)c(C)cc1OC)C1CC1 ZINC000629293997 566636664 /nfs/dbraw/zinc/63/66/64/566636664.db2.gz SGOCCDAFTKNNOY-OAHLLOKOSA-N 0 1 392.315 3.323 10 0 GGAEMN Cn1ncc(Br)c1CNCCOc1cccc(Br)c1 ZINC000486939205 566637748 /nfs/dbraw/zinc/63/77/48/566637748.db2.gz IUEMXZFJBXEPBM-UHFFFAOYSA-N 0 1 389.091 3.114 10 0 GGAEMN Cc1nnc(SCCC(=O)NC2(c3ccc(Cl)cc3)CCOCC2)[nH]1 ZINC000467291977 566637733 /nfs/dbraw/zinc/63/77/33/566637733.db2.gz QWCKONBAYXFJFG-UHFFFAOYSA-N 0 1 380.901 3.071 10 0 GGAEMN COCCN1CCN(C(=O)c2c[nH]c3cccc(Br)c23)C(C)(C)C1 ZINC000652926515 566637861 /nfs/dbraw/zinc/63/78/61/566637861.db2.gz BEGXFDQASIXVFX-UHFFFAOYSA-N 0 1 394.313 3.113 10 0 GGAEMN Cc1c(Cl)cccc1NC(=O)CCNCc1c(Br)cnn1C ZINC000486957426 566637913 /nfs/dbraw/zinc/63/79/13/566637913.db2.gz PXPJTZLDSUDNBX-UHFFFAOYSA-N 0 1 385.693 3.263 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1c(O)ccc(Br)c1C)C1CC1 ZINC000629302318 566638478 /nfs/dbraw/zinc/63/84/78/566638478.db2.gz BYGQZBJZAFOGGN-CYBMUJFWSA-N 0 1 378.288 3.020 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCC(=O)Nc1cccc(Br)c1 ZINC000467283588 566638682 /nfs/dbraw/zinc/63/86/82/566638682.db2.gz KESGOSIDXYSDAV-VMGRFDJRSA-N 0 1 395.297 3.051 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)N=c2[n-]nc(C3CC3)s2)[C@H]1c1cccs1 ZINC000579784705 566638966 /nfs/dbraw/zinc/63/89/66/566638966.db2.gz PPRKHYZPRALVRY-JSGCOSHPSA-N 0 1 377.539 3.104 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1cnc(-c2ccc(Cl)s2)nc1)C1CC1 ZINC000629302044 566639595 /nfs/dbraw/zinc/63/95/95/566639595.db2.gz WFWXLUOPTMKONE-LBPRGKRZSA-N 0 1 387.914 3.415 10 0 GGAEMN CCN1CCN(CC(=O)Nc2nc(-c3ccc(SC)cc3)cs2)CC1 ZINC000514063321 566639753 /nfs/dbraw/zinc/63/97/53/566639753.db2.gz WEHCHMYHGKYMFT-UHFFFAOYSA-N 0 1 376.551 3.108 10 0 GGAEMN CN(C)S(=O)(=O)c1ccc(CN(CCc2ccc(F)cc2)C2CC2)s1 ZINC000425400292 566640369 /nfs/dbraw/zinc/64/03/69/566640369.db2.gz FSKWKSOARXJLDM-UHFFFAOYSA-N 0 1 382.526 3.345 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1ccccc1Sc1ncccn1)C1CC1 ZINC000629303990 566641069 /nfs/dbraw/zinc/64/10/69/566641069.db2.gz PRIPXMMJLWSLPR-OAHLLOKOSA-N 0 1 379.507 3.185 10 0 GGAEMN C[C@H]1[C@H](Cc2ccccc2)CCN1Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000425426630 566641642 /nfs/dbraw/zinc/64/16/42/566641642.db2.gz SNAAELAMGHLVOB-RDJZCZTQSA-N 0 1 378.563 3.452 10 0 GGAEMN COc1ccccc1C[C@@H](C)N(C)Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000425424577 566641699 /nfs/dbraw/zinc/64/16/99/566641699.db2.gz XDRHOOWEILINAT-CQSZACIVSA-N 0 1 382.551 3.070 10 0 GGAEMN COc1ccc(Br)c(CN2CCCC[C@@H]2CN2CCOCC2)c1 ZINC000514084510 566641931 /nfs/dbraw/zinc/64/19/31/566641931.db2.gz QHYLWLZPKPVGIB-MRXNPFEDSA-N 0 1 383.330 3.144 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)[N-]c1ccc2[nH+]c(C)cn2c1 ZINC000606753548 566643334 /nfs/dbraw/zinc/64/33/34/566643334.db2.gz ZKVFKRLKMRCDIX-UHFFFAOYSA-N 0 1 396.266 3.215 10 0 GGAEMN COC(=O)c1cnc([C@H](C)NCc2nc3ccc(Br)cc3[nH]2)s1 ZINC000425479621 566646753 /nfs/dbraw/zinc/64/67/53/566646753.db2.gz DJTZTQFOPGFLFF-QMMMGPOBSA-N 0 1 395.282 3.419 10 0 GGAEMN C[C@H](c1ccc(CN2CCCC[C@@H]2CNS(C)(=O)=O)cc1)C(F)(F)F ZINC000450253759 566648710 /nfs/dbraw/zinc/64/87/10/566648710.db2.gz PVLWROSVLDTTKG-CZUORRHYSA-N 0 1 378.460 3.256 10 0 GGAEMN CCc1cc(CCCN2CCN(c3ccc(Br)cn3)CC2)on1 ZINC000450243524 566649902 /nfs/dbraw/zinc/64/99/02/566649902.db2.gz NWIFMACHTOKDIR-UHFFFAOYSA-N 0 1 379.302 3.149 10 0 GGAEMN Cn1c(C[N@@H+]2CC[C@H](C(=O)[O-])[C@@H]3CCC[C@H]32)nc2ccc(Br)cc21 ZINC000629377130 566652311 /nfs/dbraw/zinc/65/23/11/566652311.db2.gz LJHCRJHOWVNQPK-KCQAQPDRSA-N 0 1 392.297 3.411 10 0 GGAEMN Cn1c(C[N@H+]2CC[C@H](C(=O)[O-])[C@@H]3CCC[C@H]32)nc2ccc(Br)cc21 ZINC000629377130 566652318 /nfs/dbraw/zinc/65/23/18/566652318.db2.gz LJHCRJHOWVNQPK-KCQAQPDRSA-N 0 1 392.297 3.411 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)[C@H]2CCC[C@H]21 ZINC000629371510 566652489 /nfs/dbraw/zinc/65/24/89/566652489.db2.gz ABNBDBWPUOUOAQ-JFILPPLUSA-N 0 1 388.291 3.308 10 0 GGAEMN C[C@H]1C[C@@H](NC[C@H]2CS(=O)(=O)c3ccccc3O2)c2ccsc2S1 ZINC000579957518 566653773 /nfs/dbraw/zinc/65/37/73/566653773.db2.gz PEAVLWPHMQPHEK-SGMGOOAPSA-N 0 1 381.544 3.498 10 0 GGAEMN C[C@H]1C[C@H](NC[C@@H]2CS(=O)(=O)c3ccccc3O2)c2ccsc2S1 ZINC000579957516 566653943 /nfs/dbraw/zinc/65/39/43/566653943.db2.gz PEAVLWPHMQPHEK-SCRDCRAPSA-N 0 1 381.544 3.498 10 0 GGAEMN C[C@H]1C[C@H](NC[C@H]2CS(=O)(=O)c3ccccc3O2)c2ccsc2S1 ZINC000579957510 566654060 /nfs/dbraw/zinc/65/40/60/566654060.db2.gz PEAVLWPHMQPHEK-OBJOEFQTSA-N 0 1 381.544 3.498 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(Br)cc2C)CC1 ZINC000629416537 566654570 /nfs/dbraw/zinc/65/45/70/566654570.db2.gz CLHYAEVZKYJAAT-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccccc2Br)CC1 ZINC000629420893 566654653 /nfs/dbraw/zinc/65/46/53/566654653.db2.gz NSQPOTMCWAOUJP-UHFFFAOYSA-N 0 1 381.314 3.166 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(Br)s2)CC1 ZINC000629420249 566654712 /nfs/dbraw/zinc/65/47/12/566654712.db2.gz QWFDGPGLBDFSHX-UHFFFAOYSA-N 0 1 387.343 3.228 10 0 GGAEMN O=C([O-])[C@H]1Cc2c(Br)cccc2C[N@@H+]1C[C@H](O)C1CCCCC1 ZINC000579968204 566655176 /nfs/dbraw/zinc/65/51/76/566655176.db2.gz LWSHUUSJQPGDAJ-SJORKVTESA-N 0 1 382.298 3.202 10 0 GGAEMN Cn1cnc2cc(CN3CCN(c4ccc(Br)cn4)CC3)ccc21 ZINC000540506641 566656232 /nfs/dbraw/zinc/65/62/32/566656232.db2.gz ONVPLIVGFYUILV-UHFFFAOYSA-N 0 1 386.297 3.053 10 0 GGAEMN Cn1ncc(Br)c1CNCCCOc1cccc2cccnc21 ZINC000487282908 566661556 /nfs/dbraw/zinc/66/15/56/566661556.db2.gz WUHPCUFDZFHZKM-UHFFFAOYSA-N 0 1 375.270 3.290 10 0 GGAEMN Cn1ncc(Br)c1CNCCOc1ccccc1C(F)(F)F ZINC000487309426 566663513 /nfs/dbraw/zinc/66/35/13/566663513.db2.gz BOCGXWYKFXJQQQ-UHFFFAOYSA-N 0 1 378.192 3.370 10 0 GGAEMN COc1cc(Br)ccc1[C@@H]1CCCN1Cc1nc(C(C)(C)N)no1 ZINC000629558175 566665764 /nfs/dbraw/zinc/66/57/64/566665764.db2.gz CHVRNUZZGIMGLF-ZDUSSCGKSA-N 0 1 395.301 3.372 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)cc1NC(N)=O ZINC000487359145 566667298 /nfs/dbraw/zinc/66/72/98/566667298.db2.gz DFZLGSLPGOFWFZ-UHFFFAOYSA-N 0 1 387.820 3.088 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@@H](CCO)c2cc(Cl)cc(Cl)c2)cn1 ZINC000629585652 566667417 /nfs/dbraw/zinc/66/74/17/566667417.db2.gz BXWDDPNUIZRABT-KRWDZBQOSA-N 0 1 382.291 3.304 10 0 GGAEMN COc1ncc(Br)cc1CNCCC(=O)Nc1ccccc1F ZINC000629593755 566670307 /nfs/dbraw/zinc/67/03/07/566670307.db2.gz VSXVIVKVYWWQQC-UHFFFAOYSA-N 0 1 382.233 3.110 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1cccs1 ZINC000653481084 566670340 /nfs/dbraw/zinc/67/03/40/566670340.db2.gz ZKNWIWRVTKKNKL-OUCADQQQSA-N 0 1 379.448 3.150 10 0 GGAEMN O[C@@H](CNCc1ccc(Br)c(F)c1F)COCc1cccs1 ZINC000629597835 566671004 /nfs/dbraw/zinc/67/10/04/566671004.db2.gz PFUXBEAQEUDHIE-NSHDSACASA-N 0 1 392.265 3.456 10 0 GGAEMN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)N[C@H]1CCCN(C)C1 ZINC000607409303 566671826 /nfs/dbraw/zinc/67/18/26/566671826.db2.gz AFNUUABPJBYRFG-INIZCTEOSA-N 0 1 380.330 3.216 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 ZINC000561091169 566675091 /nfs/dbraw/zinc/67/50/91/566675091.db2.gz GVJUYKXOKRQCEY-BETUJISGSA-N 0 1 380.432 3.126 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2c(F)cccc2Cl)[C@@H]1O ZINC000561104647 566676868 /nfs/dbraw/zinc/67/68/68/566676868.db2.gz GAUCMMQJRPCOIR-RISCZKNCSA-N 0 1 391.873 3.092 10 0 GGAEMN C[C@@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccco1 ZINC000607641240 566677657 /nfs/dbraw/zinc/67/76/57/566677657.db2.gz VIQBMJHWRQRTPG-SNVBAGLBSA-N 0 1 375.226 3.247 10 0 GGAEMN C[C@@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccco1 ZINC000607641240 566677660 /nfs/dbraw/zinc/67/76/60/566677660.db2.gz VIQBMJHWRQRTPG-SNVBAGLBSA-N 0 1 375.226 3.247 10 0 GGAEMN CCO[C@@H]1C[C@H](NC(=O)c2n[nH]c3ccc(Br)cc32)C12CCC2 ZINC000607683073 566677720 /nfs/dbraw/zinc/67/77/20/566677720.db2.gz RMADLZRTVVZENZ-UONOGXRCSA-N 0 1 378.270 3.403 10 0 GGAEMN Cn1ncc(Br)c1CN[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 ZINC000487556148 566679329 /nfs/dbraw/zinc/67/93/29/566679329.db2.gz HIJUUUJXQICYLH-ZBFHGGJFSA-N 0 1 383.721 3.371 10 0 GGAEMN Cc1cc(C[C@H](C)NCc2c(Br)cnn2C)n(-c2ccccc2)n1 ZINC000487549527 566679724 /nfs/dbraw/zinc/67/97/24/566679724.db2.gz IDCPXDQETBZQBX-ZDUSSCGKSA-N 0 1 388.313 3.398 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)N1CCc2cc(F)cc(Br)c2C1 ZINC000629740245 566681339 /nfs/dbraw/zinc/68/13/39/566681339.db2.gz BESSVNYJNZPXRR-UHFFFAOYSA-N 0 1 381.249 3.004 10 0 GGAEMN Cn1ncc(Br)c1CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000487564924 566681392 /nfs/dbraw/zinc/68/13/92/566681392.db2.gz VBHWHDSEPWNUMH-SNVBAGLBSA-N 0 1 387.684 3.344 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCc3cc(F)cc(Br)c3C2)[nH]1 ZINC000629741419 566681751 /nfs/dbraw/zinc/68/17/51/566681751.db2.gz VCHIOGQRQRBHPF-UHFFFAOYSA-N 0 1 399.289 3.082 10 0 GGAEMN CCN1CCN(CC(=O)N[C@@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000468092973 566682185 /nfs/dbraw/zinc/68/21/85/566682185.db2.gz AQGZPGZXDSMPFG-LJQANCHMSA-N 0 1 394.357 3.044 10 0 GGAEMN CCN(CCNC(=O)N1CCO[C@H](c2ccsc2)C1)CCC(F)(F)F ZINC000425979294 566683910 /nfs/dbraw/zinc/68/39/10/566683910.db2.gz SALAAWMWNMIVMZ-AWEZNQCLSA-N 0 1 379.448 3.105 10 0 GGAEMN CCN(CCNC(=O)N1CCO[C@@H](c2ccsc2)C1)CCC(F)(F)F ZINC000425979295 566684876 /nfs/dbraw/zinc/68/48/76/566684876.db2.gz SALAAWMWNMIVMZ-CQSZACIVSA-N 0 1 379.448 3.105 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)C1 ZINC000607901027 566685949 /nfs/dbraw/zinc/68/59/49/566685949.db2.gz IRGJYACUXNUASW-NSHDSACASA-N 0 1 381.263 3.400 10 0 GGAEMN CCN(CCNC(=O)N1CCO[C@H](c2cccs2)C1)CCC(F)(F)F ZINC000425988981 566686458 /nfs/dbraw/zinc/68/64/58/566686458.db2.gz QCHVSIUABBXQAX-ZDUSSCGKSA-N 0 1 379.448 3.105 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOc2cc(O)ccc2C1 ZINC000561268198 566690316 /nfs/dbraw/zinc/69/03/16/566690316.db2.gz SVRHUXIVESISCR-UHFFFAOYSA-N 0 1 388.221 3.066 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)C1 ZINC000676420643 566692074 /nfs/dbraw/zinc/69/20/74/566692074.db2.gz MXSGMIPLCOANLN-RYUDHWBXSA-N 0 1 376.448 3.145 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2cc(C)c(Br)cc2C)cn1 ZINC000541082743 566694035 /nfs/dbraw/zinc/69/40/35/566694035.db2.gz GYFYJROMFRWOGE-UHFFFAOYSA-N 0 1 399.266 3.048 10 0 GGAEMN CO[C@@H](C)[C@H](C)NC(=O)c1sccc1S(=O)(=O)Nc1ccc(C)cc1 ZINC000468270016 566694500 /nfs/dbraw/zinc/69/45/00/566694500.db2.gz JMXHWPMUAOAAHT-STQMWFEESA-N 0 1 382.507 3.011 10 0 GGAEMN O=C(NCC(F)(F)F)[C@@H]1CCN(CCOc2c(Cl)cccc2Cl)C1 ZINC000426159744 566696273 /nfs/dbraw/zinc/69/62/73/566696273.db2.gz HKWZVMZGDCDRJX-SNVBAGLBSA-N 0 1 385.213 3.373 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](NCc2cc(Br)ccc2OC(F)F)CC1=O ZINC000608072770 566699128 /nfs/dbraw/zinc/69/91/28/566699128.db2.gz SMNOWZKIJUVWAD-ICCXJUOJSA-N 0 1 389.240 3.149 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCc2sc(-c3csc(C)n3)cc2C1 ZINC000561397342 566701916 /nfs/dbraw/zinc/70/19/16/566701916.db2.gz BSXPQUHBSLQCJA-UHFFFAOYSA-N 0 1 399.607 3.210 10 0 GGAEMN O=S(=O)(CCNCc1cnc(-c2ccncc2)s1)c1ccc(Cl)cc1 ZINC000561436009 566704645 /nfs/dbraw/zinc/70/46/45/566704645.db2.gz HAFVLZJMABGOFS-UHFFFAOYSA-N 0 1 393.921 3.422 10 0 GGAEMN Cc1[nH+]cc2n1C[C@H](C(=O)NCc1c(C(=O)[O-])sc3ccsc31)CC2 ZINC000630141280 566705386 /nfs/dbraw/zinc/70/53/86/566705386.db2.gz ZXCNBDZJPAKNDT-SNVBAGLBSA-N 0 1 375.475 3.045 10 0 GGAEMN OCCN(Cc1cc(Br)cs1)Cc1ccc(-n2cncn2)cc1 ZINC000426377784 566709156 /nfs/dbraw/zinc/70/91/56/566709156.db2.gz FCIYONVHLJSIHJ-UHFFFAOYSA-N 0 1 393.310 3.086 10 0 GGAEMN Cc1nc2ccc(CN(C)[C@@H](C)c3cccc(S(N)(=O)=O)c3)cc2s1 ZINC000426412596 566710955 /nfs/dbraw/zinc/71/09/55/566710955.db2.gz UNBOGYWOEQTFJP-LBPRGKRZSA-N 0 1 375.519 3.445 10 0 GGAEMN CC(=O)Nc1cc(F)c(S(=O)(=O)Nc2c(O)cccc2F)cc1Cl ZINC000608342120 566713931 /nfs/dbraw/zinc/71/39/31/566713931.db2.gz HQUPMECYSHSYEH-UHFFFAOYSA-N 0 1 376.768 3.083 10 0 GGAEMN O=C(Cc1ccc(Br)c(F)c1)Nc1cnn(-c2ccncc2)c1 ZINC000676875591 566714437 /nfs/dbraw/zinc/71/44/37/566714437.db2.gz IHIDGSZPTVKXFW-UHFFFAOYSA-N 0 1 375.201 3.350 10 0 GGAEMN Cc1onc(-c2cccc(Br)c2)c1C(=O)N[C@H]1CCCN(C)C1 ZINC000676877408 566714836 /nfs/dbraw/zinc/71/48/36/566714836.db2.gz ILMAWVQGEWKRFT-AWEZNQCLSA-N 0 1 378.270 3.237 10 0 GGAEMN CCOc1c(Br)cc(CN(CCOC)[C@@H]2CCOC2)cc1OC ZINC000426513230 566715293 /nfs/dbraw/zinc/71/52/93/566715293.db2.gz GVXBDOXQCLBLAQ-CQSZACIVSA-N 0 1 388.302 3.094 10 0 GGAEMN Cc1cc(NC(=O)CCN2CCC[C@@H]2c2ccc(Br)s2)no1 ZINC000541319028 566715308 /nfs/dbraw/zinc/71/53/08/566715308.db2.gz GTPNAWGVLIWION-LLVKDONJSA-N 0 1 384.299 3.395 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)cn1 ZINC000488221164 566716594 /nfs/dbraw/zinc/71/65/94/566716594.db2.gz VNWGOJDEJFWZJS-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN COC(=O)c1cn([C@@H]2CCCN(CCc3cc(Cl)ccc3Cl)C2)nn1 ZINC000488319797 566721281 /nfs/dbraw/zinc/72/12/81/566721281.db2.gz ZGUXXWIBKGRGOV-CQSZACIVSA-N 0 1 383.279 3.251 10 0 GGAEMN O=C([O-])c1csc(C[NH2+]Cc2ccc(OC(F)F)c(Br)c2)n1 ZINC000426675022 566724330 /nfs/dbraw/zinc/72/43/30/566724330.db2.gz ORHBEKHKLMPCAE-UHFFFAOYSA-N 0 1 393.209 3.495 10 0 GGAEMN COCCN(Cc1cc(Br)cc(Br)c1)[C@@H]1CCOC1 ZINC000580800344 566724261 /nfs/dbraw/zinc/72/42/61/566724261.db2.gz GAHFVIADJNZDMP-CQSZACIVSA-N 0 1 393.119 3.449 10 0 GGAEMN COCC[C@@H](Cc1ccco1)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000541439323 566724577 /nfs/dbraw/zinc/72/45/77/566724577.db2.gz OUJGBHOJYDVIFE-LBPRGKRZSA-N 0 1 392.253 3.296 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cccnc1C1CC1 ZINC000541429112 566724662 /nfs/dbraw/zinc/72/46/62/566724662.db2.gz UOSIJJWCBIVPQW-UHFFFAOYSA-N 0 1 398.264 3.437 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccnc1C1CC1 ZINC000541429112 566724665 /nfs/dbraw/zinc/72/46/65/566724665.db2.gz UOSIJJWCBIVPQW-UHFFFAOYSA-N 0 1 398.264 3.437 10 0 GGAEMN Clc1cc2nc(-c3cn(C[C@@H]4CCOC4)nn3)[nH]c2c(Br)c1 ZINC000630382048 566724885 /nfs/dbraw/zinc/72/48/85/566724885.db2.gz QFIXJDUMTYSGDO-QMMMGPOBSA-N 0 1 382.649 3.274 10 0 GGAEMN C[C@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@H](C(F)(F)F)O1 ZINC000608605718 566725646 /nfs/dbraw/zinc/72/56/46/566725646.db2.gz UJDVSMXRAZWNLR-WRWORJQWSA-N 0 1 392.175 3.117 10 0 GGAEMN C[C@@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@H](C(F)(F)F)O1 ZINC000608605713 566725681 /nfs/dbraw/zinc/72/56/81/566725681.db2.gz UJDVSMXRAZWNLR-HQJQHLMTSA-N 0 1 392.175 3.117 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H](C[C@H]1CCCO1)C(F)(F)F)c1ccsc1 ZINC000654288924 566725823 /nfs/dbraw/zinc/72/58/23/566725823.db2.gz VTFITEPHIPUSEN-MGPQQGTHSA-N 0 1 379.448 3.150 10 0 GGAEMN CCCOc1ccc(C(F)(F)F)cc1NS(=O)(=O)c1c[nH]c(=O)s1 ZINC000450973098 566726619 /nfs/dbraw/zinc/72/66/19/566726619.db2.gz SPNOOPOGFLJUQX-UHFFFAOYSA-N 0 1 382.385 3.457 10 0 GGAEMN CC[C@H]1CN(C(=O)NCCc2cccc(Cl)c2Cl)CCN1C[C@@H](C)O ZINC000541496312 566728501 /nfs/dbraw/zinc/72/85/01/566728501.db2.gz QXMFENAESRCAOA-HIFRSBDPSA-N 0 1 388.339 3.023 10 0 GGAEMN O=c1cc(CN2CCC(c3ccccn3)CC2)nc2ccc(Br)cn12 ZINC000677187333 566729135 /nfs/dbraw/zinc/72/91/35/566729135.db2.gz XBPNUVAFVOUKSE-UHFFFAOYSA-N 0 1 399.292 3.232 10 0 GGAEMN O=C(Nc1nnc(-c2ccsc2)s1)c1nnn(C2CC2)c1C(F)(F)F ZINC000608755677 566732925 /nfs/dbraw/zinc/73/29/25/566732925.db2.gz BQTWCCHOKKVTSM-UHFFFAOYSA-N 0 1 386.384 3.464 10 0 GGAEMN C[C@H]([NH2+]Cc1cc(Br)c2c(c1)OCCO2)c1nc(C(=O)[O-])cs1 ZINC000630465747 566734078 /nfs/dbraw/zinc/73/40/78/566734078.db2.gz XHKONGXATAHTMP-QMMMGPOBSA-N 0 1 399.266 3.226 10 0 GGAEMN CC1(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC=CC1 ZINC000654456670 566735080 /nfs/dbraw/zinc/73/50/80/566735080.db2.gz JNPUTMUPOQKOCM-UHFFFAOYSA-N 0 1 376.258 3.142 10 0 GGAEMN CC1(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC=CC1 ZINC000654456670 566735085 /nfs/dbraw/zinc/73/50/85/566735085.db2.gz JNPUTMUPOQKOCM-UHFFFAOYSA-N 0 1 376.258 3.142 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(C[C@H](O)COc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000677269323 566735942 /nfs/dbraw/zinc/73/59/42/566735942.db2.gz MSQKTLRQQURDCN-DECQCQTCSA-N 0 1 390.307 3.001 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCOc3cccc(Br)c3C2)n[nH]1 ZINC000654497570 566736281 /nfs/dbraw/zinc/73/62/81/566736281.db2.gz NYNPERUUYGXRMH-LLVKDONJSA-N 0 1 393.285 3.016 10 0 GGAEMN O=C([O-])[C@H]([NH2+]Cc1ccc(-c2cccc(Br)c2)o1)[C@@H]1CCCO1 ZINC000630470722 566736693 /nfs/dbraw/zinc/73/66/93/566736693.db2.gz WIHYOCFDATUKPA-JKSUJKDBSA-N 0 1 380.238 3.431 10 0 GGAEMN O=C([O-])[C@@H]([NH2+]Cc1ccc(-c2cccc(Br)c2)o1)[C@H]1CCCO1 ZINC000630470719 566737082 /nfs/dbraw/zinc/73/70/82/566737082.db2.gz WIHYOCFDATUKPA-CVEARBPZSA-N 0 1 380.238 3.431 10 0 GGAEMN COCCCOc1ccc(Cl)cc1S(=O)(=O)NC(C)(C)C(F)(F)F ZINC000451030600 566738760 /nfs/dbraw/zinc/73/87/60/566738760.db2.gz JBZHAGDMSWJHFW-UHFFFAOYSA-N 0 1 389.823 3.375 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1ccc(I)cc1 ZINC000608900539 566741939 /nfs/dbraw/zinc/74/19/39/566741939.db2.gz MOCVPNWSOZSFKB-UHFFFAOYSA-N 0 1 390.184 3.124 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1cccc(I)c1 ZINC000608901253 566742062 /nfs/dbraw/zinc/74/20/62/566742062.db2.gz WEFQPCJZPMNWGN-UHFFFAOYSA-N 0 1 390.184 3.124 10 0 GGAEMN COc1cccc([C@H](CNC(=O)c2c(F)cncc2Br)N(C)C)c1 ZINC000630577079 566742212 /nfs/dbraw/zinc/74/22/12/566742212.db2.gz HCSMHAIHERDEPJ-HNNXBMFYSA-N 0 1 396.260 3.025 10 0 GGAEMN CC(C)c1noc([C@H](C)n2cc([C@H](N)c3ccc(Br)cc3)nn2)n1 ZINC000630599369 566743045 /nfs/dbraw/zinc/74/30/45/566743045.db2.gz JXXFDWLVAFGRIE-IINYFYTJSA-N 0 1 391.273 3.204 10 0 GGAEMN CC(C)c1noc([C@@H](C)n2cc([C@H](N)c3ccc(Br)cc3)nn2)n1 ZINC000630599370 566743141 /nfs/dbraw/zinc/74/31/41/566743141.db2.gz JXXFDWLVAFGRIE-QMTHXVAHSA-N 0 1 391.273 3.204 10 0 GGAEMN COc1ccc(C(=O)N[C@H](c2nnc[nH]2)c2ccccc2)cc1Br ZINC000541747870 566744391 /nfs/dbraw/zinc/74/43/91/566744391.db2.gz OXNKOZARSXCMKB-HNNXBMFYSA-N 0 1 387.237 3.095 10 0 GGAEMN Brc1cccc(-c2ccc(CN3CCN4CCOC[C@@H]4C3)o2)c1 ZINC000541760415 566746118 /nfs/dbraw/zinc/74/61/18/566746118.db2.gz LTHGKIDEXBIQAU-INIZCTEOSA-N 0 1 377.282 3.226 10 0 GGAEMN OC1([C@H]2CCCCN2Cc2nc(-c3cccc(Br)c3)no2)CC1 ZINC000581117201 566751170 /nfs/dbraw/zinc/75/11/70/566751170.db2.gz MSRXQUPTRBDXNC-CQSZACIVSA-N 0 1 378.270 3.379 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)[C@H]1COc2ccc(Br)cc21 ZINC000677532710 566751621 /nfs/dbraw/zinc/75/16/21/566751621.db2.gz LLSNMWUVSURPOT-HNNXBMFYSA-N 0 1 385.221 3.145 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)N=c1cc(-c2cc(Cl)cc(Cl)c2)[nH][nH]1 ZINC000469020547 566753068 /nfs/dbraw/zinc/75/30/68/566753068.db2.gz PXWCVGAWSXIHLX-UHFFFAOYSA-N 0 1 379.251 3.275 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)Nc2cnn(C)c2C(F)F)cc1Cl ZINC000677552497 566753500 /nfs/dbraw/zinc/75/35/00/566753500.db2.gz VUNIAGIFKPRRIR-UHFFFAOYSA-N 0 1 386.207 3.474 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2C(C)(F)F)cc1 ZINC000451093262 566754540 /nfs/dbraw/zinc/75/45/40/566754540.db2.gz ZTPXJUBSOTZOEU-UHFFFAOYSA-N 0 1 389.445 3.393 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCc2cc[nH]c(=O)c2C1 ZINC000427197024 566755886 /nfs/dbraw/zinc/75/58/86/566755886.db2.gz OJPSNWWRDHUKPI-UHFFFAOYSA-N 0 1 399.248 3.138 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCCN(C[C@H]2CCCO2)CC1 ZINC000630846224 566756338 /nfs/dbraw/zinc/75/63/38/566756338.db2.gz ICUMNBKWVMUDCK-CYBMUJFWSA-N 0 1 387.343 3.146 10 0 GGAEMN Cn1ncc(NC(=O)c2cc(=O)c3cc(Br)ccc3[nH]2)c1C(F)F ZINC000677608964 566756260 /nfs/dbraw/zinc/75/62/60/566756260.db2.gz KXQLTLAZSDSKSM-UHFFFAOYSA-N 0 1 397.179 3.214 10 0 GGAEMN Cc1ccc([C@H](CNC(=O)c2cc[nH]c(=O)c2Br)N2CCCC2)o1 ZINC000469041819 566756568 /nfs/dbraw/zinc/75/65/68/566756568.db2.gz UDBQPDNFJWDWOW-ZDUSSCGKSA-N 0 1 394.269 3.018 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000562052923 566760583 /nfs/dbraw/zinc/76/05/83/566760583.db2.gz CJLLSVFBJDVGGG-MRXNPFEDSA-N 0 1 376.975 3.102 10 0 GGAEMN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@H](C(F)F)C1 ZINC000677729194 566761548 /nfs/dbraw/zinc/76/15/48/566761548.db2.gz AIVRILYPIHWSRY-DGCLKSJQSA-N 0 1 375.257 3.383 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@H]2CCN(c3cccc(Br)c3)C2=O)n1 ZINC000581251081 566762439 /nfs/dbraw/zinc/76/24/39/566762439.db2.gz XHMROBKFCYAYNM-ZIAGYGMSSA-N 0 1 393.285 3.399 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@H]2CCN(c3cccc(Br)c3)C2=O)n1 ZINC000581251079 566762544 /nfs/dbraw/zinc/76/25/44/566762544.db2.gz XHMROBKFCYAYNM-KGLIPLIRSA-N 0 1 393.285 3.399 10 0 GGAEMN COC(=O)[C@H](NS(=O)(=O)c1c(F)cccc1Cl)c1ccc(C)c(C)c1 ZINC000469117346 566763096 /nfs/dbraw/zinc/76/30/96/566763096.db2.gz SWXPIUJVEZQUJD-OAHLLOKOSA-N 0 1 385.844 3.289 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1oc2ccccc2c1Br ZINC000630932395 566764567 /nfs/dbraw/zinc/76/45/67/566764567.db2.gz JJUBCAGKVDLRAC-GFCCVEGCSA-N 0 1 381.270 3.036 10 0 GGAEMN CN(C)CCN(Cc1cccc(Cl)c1)S(=O)(=O)C[C@H]1CCCC1(F)F ZINC000451133022 566764807 /nfs/dbraw/zinc/76/48/07/566764807.db2.gz YEEYHGDHYHDDKY-OAHLLOKOSA-N 0 1 394.915 3.469 10 0 GGAEMN O=C(CN1CCC2(CCC(O)CC2)CC1)Nc1ccc(Br)cc1 ZINC000451148970 566766197 /nfs/dbraw/zinc/76/61/97/566766197.db2.gz XJPSXIUJHPXMDT-UHFFFAOYSA-N 0 1 381.314 3.405 10 0 GGAEMN Cc1cc(CNC(=O)NCc2ccc(Br)cc2C(F)(F)F)n[nH]1 ZINC000677859114 566767816 /nfs/dbraw/zinc/76/78/16/566767816.db2.gz PQCJALYDGJLEGU-UHFFFAOYSA-N 0 1 391.191 3.499 10 0 GGAEMN COC(=O)[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1cccs1 ZINC000609520701 566768628 /nfs/dbraw/zinc/76/86/28/566768628.db2.gz XGYNZOKFIBDYAU-CYBMUJFWSA-N 0 1 394.250 3.031 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(S[C@H]2CCN(C3CCC3)C2=O)n1 ZINC000631003442 566769015 /nfs/dbraw/zinc/76/90/15/566769015.db2.gz KNFDGMCBESCLLT-AWEZNQCLSA-N 0 1 378.885 3.379 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3ccc(Br)cn3)cccc21 ZINC000469200078 566769869 /nfs/dbraw/zinc/76/98/69/566769869.db2.gz LDACKEXRBDMMGD-OAHLLOKOSA-N 0 1 376.254 3.482 10 0 GGAEMN Brc1ccccc1-c1n[nH]c(SC[C@H]2CCc3ncnn32)n1 ZINC000631004076 566769973 /nfs/dbraw/zinc/76/99/73/566769973.db2.gz SGLLBOJXYFDNQH-SECBINFHSA-N 0 1 377.271 3.105 10 0 GGAEMN O=S(=O)(C[C@@H]1CCCC1(F)F)NCC1(N2CCSCC2)CCCCC1 ZINC000451189450 566773208 /nfs/dbraw/zinc/77/32/08/566773208.db2.gz FJBWBNNEONJVLR-HNNXBMFYSA-N 0 1 396.569 3.093 10 0 GGAEMN Cc1ccnc(CN2CC[C@@H](Cc3cccc(I)c3)C2)n1 ZINC000451190748 566774184 /nfs/dbraw/zinc/77/41/84/566774184.db2.gz LXYQVYMFOFBXHX-HNNXBMFYSA-N 0 1 393.272 3.454 10 0 GGAEMN FC(F)(F)CN1CC[C@@H](CNCc2ncc(Br)cc2Cl)C1 ZINC000631044803 566774541 /nfs/dbraw/zinc/77/45/41/566774541.db2.gz NRPZZBDIWNTMCS-VIFPVBQESA-N 0 1 386.643 3.471 10 0 GGAEMN CCN1CCC[C@H](NC(=O)c2ccc(Sc3ccccc3Cl)nn2)C1 ZINC000469243898 566775111 /nfs/dbraw/zinc/77/51/11/566775111.db2.gz ZTOSHIGBIJWLLX-ZDUSSCGKSA-N 0 1 376.913 3.495 10 0 GGAEMN Cc1nc(NS(=O)(=O)CCc2ccccc2Br)cc(C2CC2)n1 ZINC000562266218 566775605 /nfs/dbraw/zinc/77/56/05/566775605.db2.gz LCFIZCWBUPDFAA-UHFFFAOYSA-N 0 1 396.310 3.409 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)C(=O)c2ccc(Br)cc2)n[nH]1 ZINC000489262996 566777200 /nfs/dbraw/zinc/77/72/00/566777200.db2.gz VTIVFKNSWIMGEG-VHSXEESVSA-N 0 1 379.258 3.141 10 0 GGAEMN C[C@H]1C[C@H](N[C@@H]2CCCN(Cc3nccn3C)C2=O)c2ccsc2S1 ZINC000542156984 566777902 /nfs/dbraw/zinc/77/79/02/566777902.db2.gz IZPADBVYRHOWPW-CFVMTHIKSA-N 0 1 376.551 3.188 10 0 GGAEMN C[C@H](C(=O)N(CCO)Cc1cc(Br)cs1)N1CCCCCC1 ZINC000427555781 566778086 /nfs/dbraw/zinc/77/80/86/566778086.db2.gz LWFSIFUPRDLTHM-CYBMUJFWSA-N 0 1 389.359 3.096 10 0 GGAEMN CC(C)(C[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(N)=O ZINC000451216088 566778391 /nfs/dbraw/zinc/77/83/91/566778391.db2.gz LUNLGUNVCYSYRR-GFCCVEGCSA-N 0 1 393.329 3.439 10 0 GGAEMN Cc1nc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cs1 ZINC000678052780 566778708 /nfs/dbraw/zinc/77/87/08/566778708.db2.gz KZWOUCYKBWREJU-UHFFFAOYSA-N 0 1 393.270 3.321 10 0 GGAEMN Cc1nc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cs1 ZINC000678052780 566778711 /nfs/dbraw/zinc/77/87/11/566778711.db2.gz KZWOUCYKBWREJU-UHFFFAOYSA-N 0 1 393.270 3.321 10 0 GGAEMN CC(C)(CNCc1cn(C[C@@H]2CCOC2)nn1)c1ccccc1Br ZINC000631098580 566780426 /nfs/dbraw/zinc/78/04/26/566780426.db2.gz QIBMEBKHOOXRFG-AWEZNQCLSA-N 0 1 393.329 3.145 10 0 GGAEMN Clc1ccc(Br)c(CCNCc2cn(C[C@H]3CCOC3)nn2)c1 ZINC000631097612 566780620 /nfs/dbraw/zinc/78/06/20/566780620.db2.gz DLGUADDWHJBDSD-GFCCVEGCSA-N 0 1 399.720 3.063 10 0 GGAEMN COc1ccc(NC(=O)[C@H]2CCCc3[nH]ncc32)c(I)c1 ZINC000562329803 566781756 /nfs/dbraw/zinc/78/17/56/566781756.db2.gz FBTBBXVPFNIPFS-JTQLQIEISA-N 0 1 397.216 3.082 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)Cc2ccc(Br)c(F)c2)[nH]1 ZINC000427585437 566781940 /nfs/dbraw/zinc/78/19/40/566781940.db2.gz FZFUWNSUWUEHTH-UHFFFAOYSA-N 0 1 387.278 3.156 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)CC2CC(F)(F)C2)[C@H]1c1cccs1 ZINC000451243505 566782368 /nfs/dbraw/zinc/78/23/68/566782368.db2.gz PLDSDHWYJKDIHR-ZFWWWQNUSA-N 0 1 378.510 3.096 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000469337830 566782921 /nfs/dbraw/zinc/78/29/21/566782921.db2.gz MSTCNOFQKQRWNA-ZBEGNZNMSA-N 0 1 395.272 3.344 10 0 GGAEMN COCCc1ncc(CN[C@@](C)(CO)c2ccc(Br)cc2)s1 ZINC000631132911 566783694 /nfs/dbraw/zinc/78/36/94/566783694.db2.gz CFEVCEADUNALFN-INIZCTEOSA-N 0 1 385.327 3.092 10 0 GGAEMN O=C(N[C@H](C1CC1)[C@H]1CCCCO1)c1n[nH]c2ccc(Br)cc21 ZINC000655222837 566787553 /nfs/dbraw/zinc/78/75/53/566787553.db2.gz MNQSOFJIVPPXIB-HUUCEWRRSA-N 0 1 378.270 3.403 10 0 GGAEMN O=C(N[C@H](C1CC1)[C@H]1CCCCO1)c1cc(Br)cc2nc[nH]c21 ZINC000655221115 566787664 /nfs/dbraw/zinc/78/76/64/566787664.db2.gz DPOBXWXORRPYHG-HUUCEWRRSA-N 0 1 378.270 3.403 10 0 GGAEMN COc1cc(CN[C@@H]2CCCc3c2ccc(=O)n3C)c(F)cc1Br ZINC000631169581 566787815 /nfs/dbraw/zinc/78/78/15/566787815.db2.gz ZAJNOPYZJJVKAC-OAHLLOKOSA-N 0 1 395.272 3.463 10 0 GGAEMN O=C(CCOc1cccc(Cl)c1Cl)NCc1n[nH]c([C@@H]2CCCO2)n1 ZINC000655235639 566789334 /nfs/dbraw/zinc/78/93/34/566789334.db2.gz KOFCRNHADAIKKT-LBPRGKRZSA-N 0 1 385.251 3.048 10 0 GGAEMN Cc1cc(Br)cc(Cl)c1C(=O)NCc1n[nH]c([C@H]2CCCO2)n1 ZINC000655244344 566790644 /nfs/dbraw/zinc/79/06/44/566790644.db2.gz SUDRLHGESRGSSM-LLVKDONJSA-N 0 1 399.676 3.311 10 0 GGAEMN CSc1cc(Br)ccc1CNCc1n[nH]c(C2CCOCC2)n1 ZINC000631214416 566791131 /nfs/dbraw/zinc/79/11/31/566791131.db2.gz WPJXTHHIEJKEFV-UHFFFAOYSA-N 0 1 397.342 3.473 10 0 GGAEMN Clc1sc(CNCc2n[nH]c(C3CCOCC3)n2)cc1Br ZINC000631214032 566791371 /nfs/dbraw/zinc/79/13/71/566791371.db2.gz RNXFXOTVKXSLJB-UHFFFAOYSA-N 0 1 391.722 3.466 10 0 GGAEMN CCc1nc([C@@H]2CCCCN2C(=O)c2cccc(Br)c2O)no1 ZINC000678311668 566793421 /nfs/dbraw/zinc/79/34/21/566793421.db2.gz BYPIGPPPYGFUBM-LBPRGKRZSA-N 0 1 380.242 3.468 10 0 GGAEMN O=C(NCc1nc2ccc(Br)cc2o1)[C@H]1CCCc2[nH]ncc21 ZINC000516923062 566793982 /nfs/dbraw/zinc/79/39/82/566793982.db2.gz BGOMQIINKQNVJB-JTQLQIEISA-N 0 1 375.226 3.050 10 0 GGAEMN COc1ccc(OCc2nc(CNCC[C@H](O)C(F)(F)F)cs2)cc1 ZINC000581634936 566794920 /nfs/dbraw/zinc/79/49/20/566794920.db2.gz LZLRHHBXADSHOY-AWEZNQCLSA-N 0 1 376.400 3.134 10 0 GGAEMN CC(C)C(C)(C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000581639240 566794968 /nfs/dbraw/zinc/79/49/68/566794968.db2.gz FCTYLMQBKWHSCM-UHFFFAOYSA-N 0 1 380.290 3.468 10 0 GGAEMN CC(C)C(C)(C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000581639240 566794971 /nfs/dbraw/zinc/79/49/71/566794971.db2.gz FCTYLMQBKWHSCM-UHFFFAOYSA-N 0 1 380.290 3.468 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@@H]2Cc3ccccc3CN2)cc1Br ZINC000581668038 566798281 /nfs/dbraw/zinc/79/82/81/566798281.db2.gz YUIBNFQCLTVZCM-SFHVURJKSA-N 0 1 388.309 3.164 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)CN1[C@@H](C)CC[C@@H]1C ZINC000427807425 566799904 /nfs/dbraw/zinc/79/99/04/566799904.db2.gz ULLBSHPYKJVZLI-STQMWFEESA-N 0 1 389.359 3.358 10 0 GGAEMN CCN(CCc1nccs1)S(=O)(=O)c1cc(C(F)(F)F)ccc1O ZINC000451353040 566802107 /nfs/dbraw/zinc/80/21/07/566802107.db2.gz ZYGBXBQAQODBRR-UHFFFAOYSA-N 0 1 380.413 3.121 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2c(F)cccc2Cl)[C@H]1c1ccccc1 ZINC000451351231 566802596 /nfs/dbraw/zinc/80/25/96/566802596.db2.gz INDATWUIHHEXOA-QZTJIDSGSA-N 0 1 382.888 3.344 10 0 GGAEMN Cc1c(Br)csc1C(=O)Nc1cc(C(N)=O)ccc1CN(C)C ZINC000631423034 566803208 /nfs/dbraw/zinc/80/32/08/566803208.db2.gz ZMFVHJNHAORRCT-UHFFFAOYSA-N 0 1 396.310 3.232 10 0 GGAEMN CC(C)(C(=O)NCc1cc(Br)ccc1OC(F)F)c1cnc[nH]1 ZINC000469634562 566805353 /nfs/dbraw/zinc/80/53/53/566805353.db2.gz WGCNLWAGNWTTTG-UHFFFAOYSA-N 0 1 388.212 3.368 10 0 GGAEMN C[C@@H](CN1CCN(C)CC1)NC(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489720994 566805656 /nfs/dbraw/zinc/80/56/56/566805656.db2.gz ZLSCELQPURTOLH-NSHDSACASA-N 0 1 378.826 3.116 10 0 GGAEMN CN(Cc1ccc(O)cc1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000542491271 566805700 /nfs/dbraw/zinc/80/57/00/566805700.db2.gz VFWIKRCGOMJBKA-UHFFFAOYSA-N 0 1 387.233 3.268 10 0 GGAEMN C[C@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)c(F)c1 ZINC000678595584 566806087 /nfs/dbraw/zinc/80/60/87/566806087.db2.gz UQRLIVLAFODZCD-MEDUHNTESA-N 0 1 385.277 3.019 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2Br)n[nH]1)c1cccc2nccnc21 ZINC000542512625 566806366 /nfs/dbraw/zinc/80/63/66/566806366.db2.gz FGRVXNYJEKEMNO-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN Nc1ccncc1C(=O)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000655525312 566807725 /nfs/dbraw/zinc/80/77/25/566807725.db2.gz NISBUNVVNBNDHV-UHFFFAOYSA-N 0 1 385.682 3.417 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)c1ncc(C)cc1O ZINC000428038499 566812284 /nfs/dbraw/zinc/81/22/84/566812284.db2.gz YGOUOCCTKTTWBY-UHFFFAOYSA-N 0 1 381.226 3.136 10 0 GGAEMN Cc1ccc2c(c1)nc(CNC(=O)c1n[nH]c3ccc(Br)cc31)n2C ZINC000469780520 566812349 /nfs/dbraw/zinc/81/23/49/566812349.db2.gz ONLVSKYWAJKXPI-UHFFFAOYSA-N 0 1 398.264 3.451 10 0 GGAEMN CN(C)C(=O)C1(NCc2nc3cc(Br)ccc3[nH]2)CCCCC1 ZINC000451411574 566813378 /nfs/dbraw/zinc/81/33/78/566813378.db2.gz MUPIWLBVSPAUGR-UHFFFAOYSA-N 0 1 379.302 3.206 10 0 GGAEMN CN(C)C(=O)C1(NCc2nc3ccc(Br)cc3[nH]2)CCCCC1 ZINC000451411574 566813390 /nfs/dbraw/zinc/81/33/90/566813390.db2.gz MUPIWLBVSPAUGR-UHFFFAOYSA-N 0 1 379.302 3.206 10 0 GGAEMN COCCN(CCCc1ccc(Br)cc1OC)Cc1ccnn1C ZINC000489845388 566814577 /nfs/dbraw/zinc/81/45/77/566814577.db2.gz ORJZEYOUBGRJOY-UHFFFAOYSA-N 0 1 396.329 3.272 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccccc3Br)o2)C1 ZINC000517241425 566814683 /nfs/dbraw/zinc/81/46/83/566814683.db2.gz NGQRFAFBLPFBEN-NWDGAFQWSA-N 0 1 395.253 3.168 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@@H](C2CCC2)C1 ZINC000562713615 566814761 /nfs/dbraw/zinc/81/47/61/566814761.db2.gz XJSVSWJHRAAVGB-QGZVFWFLSA-N 0 1 390.281 3.480 10 0 GGAEMN CSCC[C@H](N[C@@H]1CCCc2ncc(C(F)(F)F)cc21)C(=O)N(C)C ZINC000489859410 566814835 /nfs/dbraw/zinc/81/48/35/566814835.db2.gz MSKOXXCXXHJAEJ-CABCVRRESA-N 0 1 375.460 3.277 10 0 GGAEMN O=C([C@H]1[C@@H]2c3ccc(Br)cc3C[C@H]12)N1CCC(c2cnc[nH]2)CC1 ZINC000631673174 566814980 /nfs/dbraw/zinc/81/49/80/566814980.db2.gz GJAKXZXBRVVGBN-CGTJXYLNSA-N 0 1 386.293 3.464 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@H](C2CCC2)C1 ZINC000562713614 566815571 /nfs/dbraw/zinc/81/55/71/566815571.db2.gz XJSVSWJHRAAVGB-KRWDZBQOSA-N 0 1 390.281 3.480 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 ZINC000610231331 566816644 /nfs/dbraw/zinc/81/66/44/566816644.db2.gz MUJIDZFUHAOVSL-STQMWFEESA-N 0 1 392.253 3.400 10 0 GGAEMN CC[C@@H]1CN(C)CCCN1S(=O)(=O)Cc1cccc(Br)c1C ZINC000655580781 566816622 /nfs/dbraw/zinc/81/66/22/566816622.db2.gz FXLZFVYULQLNMD-OAHLLOKOSA-N 0 1 389.359 3.003 10 0 GGAEMN C[C@H](NCc1n[nH]c(C2CCOCC2)n1)c1ccc(Br)c(F)c1 ZINC000631691820 566816809 /nfs/dbraw/zinc/81/68/09/566816809.db2.gz BSTOEHICMQFWEQ-JTQLQIEISA-N 0 1 383.265 3.451 10 0 GGAEMN Brc1cc2c(s1)CC[C@@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631696333 566817937 /nfs/dbraw/zinc/81/79/37/566817937.db2.gz PLNHRNKUCUFGOE-NSHDSACASA-N 0 1 383.315 3.300 10 0 GGAEMN Brc1cc2c(s1)CC[C@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631696329 566818148 /nfs/dbraw/zinc/81/81/48/566818148.db2.gz PLNHRNKUCUFGOE-LLVKDONJSA-N 0 1 383.315 3.300 10 0 GGAEMN C[C@@H](NCc1n[nH]c(C2CCOCC2)n1)c1ccc(F)cc1Br ZINC000631696865 566818365 /nfs/dbraw/zinc/81/83/65/566818365.db2.gz WBAQFSXMDBEQGO-SNVBAGLBSA-N 0 1 383.265 3.451 10 0 GGAEMN Cc1c([C@@H](C)NCC[C@H](O)C(F)F)nnn1-c1cccc(Br)c1 ZINC000631695588 566818487 /nfs/dbraw/zinc/81/84/87/566818487.db2.gz AILLPIFDGANJHH-RNCFNFMXSA-N 0 1 389.244 3.005 10 0 GGAEMN Cc1cc(OC[C@H](O)CN2CC[C@@](O)(C(F)F)C2)c(C(C)C)cc1Cl ZINC000451440418 566819474 /nfs/dbraw/zinc/81/94/74/566819474.db2.gz PTIQFYSHBKHQGI-ACJLOTCBSA-N 0 1 377.859 3.213 10 0 GGAEMN CCN1CCC(NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)CC1 ZINC000631729935 566820143 /nfs/dbraw/zinc/82/01/43/566820143.db2.gz LHNLAGWKCQOWBB-UHFFFAOYSA-N 0 1 386.386 3.103 10 0 GGAEMN Cc1nc(CN2CCN([C@H]3CCCc4ccc(Br)cc43)CC2)n[nH]1 ZINC000678888877 566823609 /nfs/dbraw/zinc/82/36/09/566823609.db2.gz JIOILRLQQDOWRC-KRWDZBQOSA-N 0 1 390.329 3.071 10 0 GGAEMN Cc1nc(CN2CCN([C@@H]3CCCc4ccc(Br)cc43)CC2)n[nH]1 ZINC000678888878 566824392 /nfs/dbraw/zinc/82/43/92/566824392.db2.gz JIOILRLQQDOWRC-QGZVFWFLSA-N 0 1 390.329 3.071 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1S(=O)(=O)N[C@H](c1ccccc1)C(F)(F)F ZINC000631762342 566824424 /nfs/dbraw/zinc/82/44/24/566824424.db2.gz BNHXUZQCLFJDCX-SNVBAGLBSA-N 0 1 387.305 3.021 10 0 GGAEMN COc1cccc(F)c1[C@H](C)N[C@H](C)Cn1cc(Br)ccc1=O ZINC000428229201 566825318 /nfs/dbraw/zinc/82/53/18/566825318.db2.gz NTUPNLXQQKQYMF-NEPJUHHUSA-N 0 1 383.261 3.498 10 0 GGAEMN COc1cccc(F)c1[C@@H](C)N[C@H](C)Cn1cc(Br)ccc1=O ZINC000428229208 566825458 /nfs/dbraw/zinc/82/54/58/566825458.db2.gz NTUPNLXQQKQYMF-VXGBXAGGSA-N 0 1 383.261 3.498 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccccc1OC(F)(F)F ZINC000517414256 566826002 /nfs/dbraw/zinc/82/60/02/566826002.db2.gz MOCHKQKRLQVPRN-STQMWFEESA-N 0 1 380.432 3.126 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccccc1OC(F)(F)F ZINC000517414255 566826033 /nfs/dbraw/zinc/82/60/33/566826033.db2.gz MOCHKQKRLQVPRN-CHWSQXEVSA-N 0 1 380.432 3.126 10 0 GGAEMN CCc1nc(CNC(=O)N2CCC[C@H]2c2ccc(Br)s2)n[nH]1 ZINC000582047879 566826434 /nfs/dbraw/zinc/82/64/34/566826434.db2.gz QCFAXCSSTKUUIF-VIFPVBQESA-N 0 1 384.303 3.238 10 0 GGAEMN CC(C)(CNC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1 ZINC000517449609 566826963 /nfs/dbraw/zinc/82/69/63/566826963.db2.gz VDAXALZTOXULQE-CQSZACIVSA-N 0 1 391.313 3.307 10 0 GGAEMN CC[C@@H](N[C@H]1CCCn2nccc21)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000631809367 566829467 /nfs/dbraw/zinc/82/94/67/566829467.db2.gz ICEUXKSALOVCBL-CABCVRRESA-N 0 1 382.917 3.020 10 0 GGAEMN COc1ccc(Cl)c(S(=O)(=O)N[C@H](C[C@@H]2CCCO2)C(F)(F)F)c1 ZINC000655661772 566829840 /nfs/dbraw/zinc/82/98/40/566829840.db2.gz IBLCDBQMJVVOQV-GXFFZTMASA-N 0 1 387.807 3.127 10 0 GGAEMN COc1ccc(Cl)c(S(=O)(=O)N[C@@H](C[C@H]2CCCO2)C(F)(F)F)c1 ZINC000655661773 566829886 /nfs/dbraw/zinc/82/98/86/566829886.db2.gz IBLCDBQMJVVOQV-MFKMUULPSA-N 0 1 387.807 3.127 10 0 GGAEMN COc1cccc2c1OCC[C@@H]2NS(=O)(=O)c1onc(C2CC2)c1Cl ZINC000631878755 566829977 /nfs/dbraw/zinc/82/99/77/566829977.db2.gz ZJMWHKHKKQLVIT-NSHDSACASA-N 0 1 384.841 3.016 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1cc(F)cc(Cl)c1 ZINC000655662605 566830309 /nfs/dbraw/zinc/83/03/09/566830309.db2.gz UAFFUGXIENNROD-PWSUYJOCSA-N 0 1 375.771 3.257 10 0 GGAEMN O=S(=O)(N[C@H](C[C@H]1CCCO1)C(F)(F)F)c1ccc(Cl)c(F)c1 ZINC000655662579 566830915 /nfs/dbraw/zinc/83/09/15/566830915.db2.gz SWBFECVKSMUDCB-PRHODGIISA-N 0 1 375.771 3.257 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)N[C@@H](C[C@H]1CCCO1)C(F)(F)F ZINC000655662880 566831509 /nfs/dbraw/zinc/83/15/09/566831509.db2.gz XRKAUJDTQQHHLW-MFKMUULPSA-N 0 1 387.807 3.127 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)N[C@@H](C[C@@H]1CCCO1)C(F)(F)F ZINC000655662878 566831991 /nfs/dbraw/zinc/83/19/91/566831991.db2.gz XRKAUJDTQQHHLW-GWCFXTLKSA-N 0 1 387.807 3.127 10 0 GGAEMN O=C(COc1ccc(Cl)cc1Cl)N1CCN(CC[C@@H]2CCCO2)CC1 ZINC000469982173 566833297 /nfs/dbraw/zinc/83/32/97/566833297.db2.gz NGAGSIWVZCSFQN-HNNXBMFYSA-N 0 1 387.307 3.086 10 0 GGAEMN CN(CC(=O)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1)[C@@H]1CCSC1 ZINC000490182810 566835452 /nfs/dbraw/zinc/83/54/52/566835452.db2.gz RKKSQORXZSHEKP-CZUORRHYSA-N 0 1 378.929 3.317 10 0 GGAEMN COC(C)(C)CCN1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1 ZINC000469995886 566835648 /nfs/dbraw/zinc/83/56/48/566835648.db2.gz GOOAQWMGCJBXQB-UHFFFAOYSA-N 0 1 389.323 3.332 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000490223495 566837589 /nfs/dbraw/zinc/83/75/89/566837589.db2.gz OJNQNQBSAJNUQY-SCLBCKFNSA-N 0 1 396.329 3.256 10 0 GGAEMN Brc1ccc(N2CC[C@@H](NCc3cc4n(n3)CCCC4)C2)cc1 ZINC000655729691 566839954 /nfs/dbraw/zinc/83/99/54/566839954.db2.gz IUVGJOLLCIBXKX-OAHLLOKOSA-N 0 1 375.314 3.350 10 0 GGAEMN Cc1sc2ncnc(SCC(=O)N(C)[C@H]3CCN(C4CC4)C3)c2c1C ZINC000517693389 566840262 /nfs/dbraw/zinc/84/02/62/566840262.db2.gz QPNYYGBKWYMBEA-AWEZNQCLSA-N 0 1 376.551 3.095 10 0 GGAEMN CCOc1ccc(Br)cc1S(=O)(=O)Nc1ncccc1F ZINC000679204345 566840983 /nfs/dbraw/zinc/84/09/83/566840983.db2.gz FFXHCFLRCMKZDW-UHFFFAOYSA-N 0 1 375.219 3.183 10 0 GGAEMN Cc1nc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)c(-c2ccccc2)s1 ZINC000632026751 566841173 /nfs/dbraw/zinc/84/11/73/566841173.db2.gz LLOLEPYZASFFNU-BBRMVZONSA-N 0 1 379.551 3.222 10 0 GGAEMN O[C@@H](CNCc1nnc2c(Cl)cc(C(F)(F)F)cn12)CC1CCCC1 ZINC000562985466 566841362 /nfs/dbraw/zinc/84/13/62/566841362.db2.gz LAWGQICPTFNQFT-GFCCVEGCSA-N 0 1 376.810 3.432 10 0 GGAEMN Cc1nc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(-c2ccccc2)s1 ZINC000632026753 566842228 /nfs/dbraw/zinc/84/22/28/566842228.db2.gz LLOLEPYZASFFNU-CZUORRHYSA-N 0 1 379.551 3.222 10 0 GGAEMN Cn1ccc([C@@H](NCCCn2cc(Br)cn2)c2ccc(F)cc2)n1 ZINC000490355960 566843792 /nfs/dbraw/zinc/84/37/92/566843792.db2.gz RWYKPWHHUWFADA-KRWDZBQOSA-N 0 1 392.276 3.288 10 0 GGAEMN Brc1ccc(-c2nc(CNCc3cc4n(n3)CCCC4)n[nH]2)cc1 ZINC000655746649 566843705 /nfs/dbraw/zinc/84/37/05/566843705.db2.gz ZMIATKOLWNEEBY-UHFFFAOYSA-N 0 1 387.285 3.057 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNCc3cc4n(n3)CCCC4)n2)cc1 ZINC000655746649 566843712 /nfs/dbraw/zinc/84/37/12/566843712.db2.gz ZMIATKOLWNEEBY-UHFFFAOYSA-N 0 1 387.285 3.057 10 0 GGAEMN C[C@H]1CN(Cc2ccc(-c3cccc(Br)c3)o2)CCN1CCO ZINC000428461006 566844475 /nfs/dbraw/zinc/84/44/75/566844475.db2.gz OGIPIWMRWOVKOJ-AWEZNQCLSA-N 0 1 379.298 3.208 10 0 GGAEMN CN(C)CCN(Cc1cccs1)S(=O)(=O)c1onc(C2CC2)c1Cl ZINC000632085083 566848091 /nfs/dbraw/zinc/84/80/91/566848091.db2.gz SJNXEVGNLJYBFP-UHFFFAOYSA-N 0 1 389.930 3.019 10 0 GGAEMN Brc1ccc2c(c1)[C@@H](NCc1n[nH]c([C@H]3CCCO3)n1)CCCO2 ZINC000655796922 566849548 /nfs/dbraw/zinc/84/95/48/566849548.db2.gz KWSAEYZVGINMEU-DZGCQCFKSA-N 0 1 393.285 3.422 10 0 GGAEMN OC[C@H](CNCc1cc2n(n1)CCCC2)Cc1cc(Br)ccc1F ZINC000655779064 566849942 /nfs/dbraw/zinc/84/99/42/566849942.db2.gz BGQJBPDQSPMZNS-ZDUSSCGKSA-N 0 1 396.304 3.062 10 0 GGAEMN C[C@@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)s1 ZINC000543085526 566850537 /nfs/dbraw/zinc/85/05/37/566850537.db2.gz QUNYBWMZNDRZQV-NEPJUHHUSA-N 0 1 397.342 3.086 10 0 GGAEMN O[C@H](CCNCc1nc(-c2ccc(Br)cc2)c[nH]1)C(F)(F)F ZINC000582327884 566851114 /nfs/dbraw/zinc/85/11/14/566851114.db2.gz BUUPSSBTVIMOSK-GFCCVEGCSA-N 0 1 378.192 3.242 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@H](c2ccc(Br)cc2)[C@H]2CCCO2)CC1=O ZINC000679354697 566851668 /nfs/dbraw/zinc/85/16/68/566851668.db2.gz YMIUROXHQZHZLZ-PITHAFQJSA-N 0 1 393.325 3.268 10 0 GGAEMN CC[C@H](CNC(=O)[C@H](C)CN1CCOCC1)Cc1cccc(Br)c1 ZINC000543111774 566852089 /nfs/dbraw/zinc/85/20/89/566852089.db2.gz IATVENKCOUFFRH-CVEARBPZSA-N 0 1 397.357 3.102 10 0 GGAEMN Brc1cncnc1N1CCC(c2cc(-c3ccncc3)[nH]n2)CC1 ZINC000582370460 566855092 /nfs/dbraw/zinc/85/50/92/566855092.db2.gz QGMSUPYQRCICFK-UHFFFAOYSA-N 0 1 385.269 3.408 10 0 GGAEMN C[C@@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC2(CCC2)O1 ZINC000582362236 566855393 /nfs/dbraw/zinc/85/53/93/566855393.db2.gz ADROTGXUUHAHDZ-LLVKDONJSA-N 0 1 391.265 3.074 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2cscc2C(F)(F)F)Oc2ccccc21 ZINC000563121792 566856235 /nfs/dbraw/zinc/85/62/35/566856235.db2.gz FXDQDKCONBLDNP-LLVKDONJSA-N 0 1 377.409 3.091 10 0 GGAEMN CCOc1cc(C[N@H+]2CC[C@@H](C)[C@H](C(=O)[O-])C2)cc(Br)c1OC ZINC000563131494 566857488 /nfs/dbraw/zinc/85/74/88/566857488.db2.gz LAKQKRHNHLXWCH-DGCLKSJQSA-N 0 1 386.286 3.399 10 0 GGAEMN O=S(=O)(Nc1ccc(OC(F)(F)F)c(Cl)c1)c1cnc2n1CCC2 ZINC000563135530 566857608 /nfs/dbraw/zinc/85/76/08/566857608.db2.gz MKWVRYDVFJRNJS-UHFFFAOYSA-N 0 1 381.763 3.182 10 0 GGAEMN C[C@H]([N-]S(=O)(=O)c1onc(C2CC2)c1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000632197026 566859947 /nfs/dbraw/zinc/85/99/47/566859947.db2.gz KJBKQMXINYFZPE-AAEUAGOBSA-N 0 1 387.933 3.137 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)Cc2csc(CCC(F)(F)F)n2)n[nH]1 ZINC000632198913 566861586 /nfs/dbraw/zinc/86/15/86/566861586.db2.gz QTAUJFKICXWGKA-VIFPVBQESA-N 0 1 375.420 3.299 10 0 GGAEMN NC(=O)CCN(Cc1cncc(Br)c1)[C@H]1CCOc2ccccc21 ZINC000451707310 566867312 /nfs/dbraw/zinc/86/73/12/566867312.db2.gz HWIDHVKDYVPQHA-INIZCTEOSA-N 0 1 390.281 3.045 10 0 GGAEMN Cc1cc(OC[C@@H](O)CN2CCSC[C@@H]2CCO)c(C(C)C)cc1Cl ZINC000470367200 566867707 /nfs/dbraw/zinc/86/77/07/566867707.db2.gz MIDZVVYJCROKGN-HOTGVXAUSA-N 0 1 387.973 3.311 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCC[C@H](OC(F)F)C1)c1ccc(Cl)cc1 ZINC000679698076 566868508 /nfs/dbraw/zinc/86/85/08/566868508.db2.gz DSVQTGLBGQHCIR-GJZGRUSLSA-N 0 1 375.847 3.356 10 0 GGAEMN O=C(CNC(=O)c1ccsc1)Nc1cc(Cl)cc(Br)c1O ZINC000470397195 566869472 /nfs/dbraw/zinc/86/94/72/566869472.db2.gz JDLAERQMZBIGLW-UHFFFAOYSA-N 0 1 389.658 3.238 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@@H]([C@H]3CCOC3)C2)nn1 ZINC000582518114 566870274 /nfs/dbraw/zinc/87/02/74/566870274.db2.gz ILQATHSFCREFQX-CABCVRRESA-N 0 1 391.313 3.278 10 0 GGAEMN Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000582520030 566870564 /nfs/dbraw/zinc/87/05/64/566870564.db2.gz WJKQFCJEEOYXGC-CYBMUJFWSA-N 0 1 377.286 3.146 10 0 GGAEMN O=C(NCc1ccc(OC(F)F)cn1)c1n[nH]c2ccc(Br)cc21 ZINC000470431148 566870673 /nfs/dbraw/zinc/87/06/73/566870673.db2.gz WURPEPGGECKZEQ-UHFFFAOYSA-N 0 1 397.179 3.252 10 0 GGAEMN CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1cc(Br)c(F)cc1[O-] ZINC000451726287 566870876 /nfs/dbraw/zinc/87/08/76/566870876.db2.gz RTANKMBKILJHFX-UHFFFAOYSA-N 0 1 399.260 3.481 10 0 GGAEMN O=C1C[C@H]([C@@H]2CCCCN2CC[S@](=O)c2cc(Cl)ccc2Cl)CN1 ZINC000490613878 566871040 /nfs/dbraw/zinc/87/10/40/566871040.db2.gz ZWZGJJRQZMVZBM-RJYMFLCHSA-N 0 1 389.348 3.092 10 0 GGAEMN O=C1C[C@H]([C@H]2CCCCN2CC[S@](=O)c2cc(Cl)ccc2Cl)CN1 ZINC000490613876 566871266 /nfs/dbraw/zinc/87/12/66/566871266.db2.gz ZWZGJJRQZMVZBM-CPXRIJMVSA-N 0 1 389.348 3.092 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)NCc1n[nH]c(C3CC3)n1)CC2 ZINC000656119731 566871847 /nfs/dbraw/zinc/87/18/47/566871847.db2.gz YCYOAPTZQSESPY-UHFFFAOYSA-N 0 1 390.285 3.021 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289663 566872531 /nfs/dbraw/zinc/87/25/31/566872531.db2.gz OCRKUDPRDJWHAO-QWRGUYRKSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289663 566872539 /nfs/dbraw/zinc/87/25/39/566872539.db2.gz OCRKUDPRDJWHAO-QWRGUYRKSA-N 0 1 394.212 3.115 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)C12CCC(CC1)C2 ZINC000543373232 566873836 /nfs/dbraw/zinc/87/38/36/566873836.db2.gz APUUNFGVHIQUMM-UHFFFAOYSA-N 0 1 375.270 3.431 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)C12CCC(CC1)C2 ZINC000543373232 566873844 /nfs/dbraw/zinc/87/38/44/566873844.db2.gz APUUNFGVHIQUMM-UHFFFAOYSA-N 0 1 375.270 3.431 10 0 GGAEMN CCOC(=O)c1ccc(S(=O)(=O)N[C@H]2CCCC[C@H]2CC(F)(F)F)o1 ZINC000451751008 566874294 /nfs/dbraw/zinc/87/42/94/566874294.db2.gz WSJFXOLCMWBOAD-QWRGUYRKSA-N 0 1 383.388 3.246 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN(C)CC(=O)NC(C)C ZINC000679816116 566874864 /nfs/dbraw/zinc/87/48/64/566874864.db2.gz CJRQTXMOTDSUCF-UHFFFAOYSA-N 0 1 398.345 3.241 10 0 GGAEMN COc1ccc(CNCc2cnnn2Cc2ccccc2)cc1Br ZINC000490767345 566877152 /nfs/dbraw/zinc/87/71/52/566877152.db2.gz FUGWSUXOHABJMD-UHFFFAOYSA-N 0 1 387.281 3.387 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@@H]1C[C@H]1C1CCC1 ZINC000518366885 566878862 /nfs/dbraw/zinc/87/88/62/566878862.db2.gz IALBAHLSERSKAG-UONOGXRCSA-N 0 1 390.285 3.222 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@@H]1C[C@H]1C1CCC1 ZINC000518366885 566878875 /nfs/dbraw/zinc/87/88/75/566878875.db2.gz IALBAHLSERSKAG-UONOGXRCSA-N 0 1 390.285 3.222 10 0 GGAEMN CSc1ccc([C@@H](C)NC[C@H]2CS(=O)(=O)c3ccccc3O2)cc1F ZINC000582605524 566879267 /nfs/dbraw/zinc/87/92/67/566879267.db2.gz CSEPBFWULOWEBE-OCCSQVGLSA-N 0 1 381.494 3.433 10 0 GGAEMN Cc1cc(C[C@@H](C)NS(=O)(=O)c2c(Cl)cccc2Br)n[nH]1 ZINC000632395350 566881482 /nfs/dbraw/zinc/88/14/82/566881482.db2.gz LWSWPVXVMOJQLQ-SECBINFHSA-N 0 1 392.706 3.044 10 0 GGAEMN CN(C(=O)CSCc1ccc(Br)cc1)[C@H]1CN2CCC1CC2 ZINC000518432056 566882237 /nfs/dbraw/zinc/88/22/37/566882237.db2.gz JITRLWGDIINNDX-INIZCTEOSA-N 0 1 383.355 3.235 10 0 GGAEMN CN(C(=O)CSCc1cc(-c2cccs2)on1)[C@@H]1CN2CCC1CC2 ZINC000518431818 566883214 /nfs/dbraw/zinc/88/32/14/566883214.db2.gz DUFRELSJJMNORM-OAHLLOKOSA-N 0 1 377.535 3.189 10 0 GGAEMN Brc1cnc(N2CCC(c3cc(-c4ccncc4)[nH]n3)CC2)nc1 ZINC000563426425 566883970 /nfs/dbraw/zinc/88/39/70/566883970.db2.gz UYNQOWMOLRKPCC-UHFFFAOYSA-N 0 1 385.269 3.408 10 0 GGAEMN C[C@@H](c1ccccc1)[C@H](NCc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000428838950 566884807 /nfs/dbraw/zinc/88/48/07/566884807.db2.gz ZFDUTRJKBYEIRF-GTNSWQLSSA-N 0 1 387.281 3.073 10 0 GGAEMN C[C@H](COc1ccc2cc(Br)ccc2c1)NCc1cn(C)nn1 ZINC000679993660 566885169 /nfs/dbraw/zinc/88/51/69/566885169.db2.gz NBMXJLXCOFSJNY-GFCCVEGCSA-N 0 1 375.270 3.288 10 0 GGAEMN O=c1[nH]c(N2CCN(c3cc(Cl)c(Cl)c(Cl)c3)CC2)nc2[nH]ncc21 ZINC000656225228 566886618 /nfs/dbraw/zinc/88/66/18/566886618.db2.gz FOOSIJXZRMNOGZ-UHFFFAOYSA-N 0 1 399.669 3.345 10 0 GGAEMN CC(C)[C@H]1C[C@H](CNS(=O)(=O)c2cc(C(F)(F)F)ccc2O)CCO1 ZINC000451817405 566887408 /nfs/dbraw/zinc/88/74/08/566887408.db2.gz LQRVRALFJWOQST-BXUZGUMPSA-N 0 1 381.416 3.141 10 0 GGAEMN CC(C)[C@H]1C[C@@H](CNS(=O)(=O)c2cc(C(F)(F)F)ccc2O)CCO1 ZINC000451817408 566887437 /nfs/dbraw/zinc/88/74/37/566887437.db2.gz LQRVRALFJWOQST-SMDDNHRTSA-N 0 1 381.416 3.141 10 0 GGAEMN CC(C)c1nc(S(=O)(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)c[nH]1 ZINC000680095368 566891734 /nfs/dbraw/zinc/89/17/34/566891734.db2.gz QHPBTEPUVOAETL-LBPRGKRZSA-N 0 1 383.342 3.393 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1cc(F)c(Br)c(Cl)c1)C1CC1 ZINC000582785461 566892807 /nfs/dbraw/zinc/89/28/07/566892807.db2.gz IKGBJWWEGQFJKF-LLVKDONJSA-N 0 1 386.670 3.408 10 0 GGAEMN O=C(Nc1cc(I)ccc1O)c1cccc2nc[nH]c21 ZINC000611156712 566894831 /nfs/dbraw/zinc/89/48/31/566894831.db2.gz PRBJQWXIVZGSJP-UHFFFAOYSA-N 0 1 379.157 3.125 10 0 GGAEMN COc1ccc(OC)c(CCNCc2c(Cl)cccc2S(C)(=O)=O)c1 ZINC000543650473 566896271 /nfs/dbraw/zinc/89/62/71/566896271.db2.gz AHAKKJVLZGQIOV-UHFFFAOYSA-N 0 1 383.897 3.093 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCCN2[C@H](C)CCC[C@@H]2C)c(Br)c1 ZINC000518622351 566896616 /nfs/dbraw/zinc/89/66/16/566896616.db2.gz OFUNCEDHUKZWMS-OKILXGFUSA-N 0 1 389.359 3.299 10 0 GGAEMN CN(C)c1ccnc(NC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)c1 ZINC000680259781 566899670 /nfs/dbraw/zinc/89/96/70/566899670.db2.gz LOKLUVUYGHCWPD-UHFFFAOYSA-N 0 1 387.237 3.416 10 0 GGAEMN CCc1nc(Cn2cc([C@@H](N)c3ccc(Br)cc3)nn2)cs1 ZINC000656449257 566902336 /nfs/dbraw/zinc/90/23/36/566902336.db2.gz ASCHLSRFXYDZIL-HNNXBMFYSA-N 0 1 378.299 3.156 10 0 GGAEMN O=C1C[C@H](N2CCC[C@@H](CCF)C2)C(=O)N1c1ccc(Br)cc1 ZINC000656477140 566902918 /nfs/dbraw/zinc/90/29/18/566902918.db2.gz HCUSTNXHQKTBHM-WFASDCNBSA-N 0 1 383.261 3.153 10 0 GGAEMN O[C@H]([C@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000451895699 566903187 /nfs/dbraw/zinc/90/31/87/566903187.db2.gz UFHDFZCCURJFSF-ISVAXAHUSA-N 0 1 378.192 3.071 10 0 GGAEMN O[C@@H]([C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000451895700 566903348 /nfs/dbraw/zinc/90/33/48/566903348.db2.gz UFHDFZCCURJFSF-OQPBUACISA-N 0 1 378.192 3.071 10 0 GGAEMN O=C(c1ccc2scc(Br)c2c1)N1CC[C@H](c2nc[nH]n2)C1 ZINC000582901002 566904164 /nfs/dbraw/zinc/90/41/64/566904164.db2.gz KVOQHISTXULWOP-JTQLQIEISA-N 0 1 377.267 3.412 10 0 GGAEMN CN(Cc1cccc2c(Br)cccc12)C[C@@H]1CCS(=O)(=O)C1 ZINC000429045523 566905075 /nfs/dbraw/zinc/90/50/75/566905075.db2.gz JTVKNRWEGXPIFG-ZDUSSCGKSA-N 0 1 382.323 3.469 10 0 GGAEMN O=C1[C@H](N2CCC[C@@]3(CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000451912889 566905725 /nfs/dbraw/zinc/90/57/25/566905725.db2.gz VFAKHUCUZWIEDS-SJLPKXTDSA-N 0 1 379.298 3.057 10 0 GGAEMN O=C1[C@@H](N2CCC[C@@]3(CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000451912886 566906079 /nfs/dbraw/zinc/90/60/79/566906079.db2.gz VFAKHUCUZWIEDS-FUHWJXTLSA-N 0 1 379.298 3.057 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)c(Cl)c1 ZINC000582937911 566907326 /nfs/dbraw/zinc/90/73/26/566907326.db2.gz XVFMOJHVQOZUTG-UHFFFAOYSA-N 0 1 393.223 3.423 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)c1cnccc1N(C)C ZINC000470830086 566907477 /nfs/dbraw/zinc/90/74/77/566907477.db2.gz GUVKGNWCPGQFNE-LLVKDONJSA-N 0 1 378.270 3.410 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cc(I)ccc2O)cc1 ZINC000611291311 566907505 /nfs/dbraw/zinc/90/75/05/566907505.db2.gz VSUWUSQAPGHZOR-UHFFFAOYSA-N 0 1 389.214 3.106 10 0 GGAEMN O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1n[nH]c2ccc(Br)cc21 ZINC000518919236 566909136 /nfs/dbraw/zinc/90/91/36/566909136.db2.gz LWHXBOHXTADIKJ-CYBMUJFWSA-N 0 1 387.237 3.233 10 0 GGAEMN O=C(COc1ccc2ccccc2c1Br)N1CCN2CCC1CC2 ZINC000470843390 566909257 /nfs/dbraw/zinc/90/92/57/566909257.db2.gz CBZSXXSZMOVWNH-UHFFFAOYSA-N 0 1 389.293 3.288 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@@H](C)[C@@H]1OCCc2sccc21 ZINC000429167373 566913088 /nfs/dbraw/zinc/91/30/88/566913088.db2.gz LGNPRFQZZAKALB-LRDDRELGSA-N 0 1 378.460 3.387 10 0 GGAEMN O=S(=O)(N[C@H]1COc2ccc(F)cc2C1)c1c(Cl)ccc(F)c1F ZINC000563766449 566914137 /nfs/dbraw/zinc/91/41/37/566914137.db2.gz MJCMADAVDVPHQQ-SNVBAGLBSA-N 0 1 377.771 3.039 10 0 GGAEMN O=C(c1ccccc1)N1CCC(NCc2ncc(Br)s2)CC1 ZINC000543852182 566915921 /nfs/dbraw/zinc/91/59/21/566915921.db2.gz KVDSZRFYDVDLGE-UHFFFAOYSA-N 0 1 380.311 3.300 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC(Oc3cccc(Br)c3)CC2)C1 ZINC000680555735 566918587 /nfs/dbraw/zinc/91/85/87/566918587.db2.gz XJZJUMPYFDCDNR-HNNXBMFYSA-N 0 1 396.329 3.096 10 0 GGAEMN C[C@H]1COCC[C@@H]1c1nc(-c2nc(-c3cccc(Br)c3)n[nH]2)no1 ZINC000519129801 566921284 /nfs/dbraw/zinc/92/12/84/566921284.db2.gz NYMHBOYUTMTODV-CABZTGNLSA-N 0 1 390.241 3.424 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000543908149 566921752 /nfs/dbraw/zinc/92/17/52/566921752.db2.gz DYTHMISOWNWDIE-YMXBGEKHSA-N 0 1 378.460 3.122 10 0 GGAEMN O=S1(=O)CC(CCSc2nc(-c3cc(Cl)cc(Cl)c3)n[nH]2)C1 ZINC000563860236 566923756 /nfs/dbraw/zinc/92/37/56/566923756.db2.gz YFWRTMCFDCYAMQ-UHFFFAOYSA-N 0 1 378.306 3.305 10 0 GGAEMN C[C@H](O)[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccccc1F ZINC000519155495 566923831 /nfs/dbraw/zinc/92/38/31/566923831.db2.gz FRXRIICGKNFPOT-YEWDVWPNSA-N 0 1 398.272 3.040 10 0 GGAEMN C[C@H](O)[C@@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccccc1F ZINC000519155494 566924203 /nfs/dbraw/zinc/92/42/03/566924203.db2.gz FRXRIICGKNFPOT-XAYKYTGQSA-N 0 1 398.272 3.040 10 0 GGAEMN CN(CC(=O)Nc1ccc(F)cc1Cl)C1CCN(CC(F)(F)F)CC1 ZINC000452034405 566924949 /nfs/dbraw/zinc/92/49/49/566924949.db2.gz SRPMEJQDASIRDJ-UHFFFAOYSA-N 0 1 381.801 3.376 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)Nc3cccc(Br)c3F)cn21 ZINC000656637052 566929605 /nfs/dbraw/zinc/92/96/05/566929605.db2.gz BHRXSKYPMNWKDR-VIFPVBQESA-N 0 1 388.262 3.483 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1ccc(Cl)cc1Br ZINC000544030281 566931650 /nfs/dbraw/zinc/93/16/50/566931650.db2.gz CHIFTAPYPNMZTK-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN COC[C@H]1CCCN(CC(=O)N(C)Cc2cc(Br)cs2)CC1 ZINC000452085089 566932302 /nfs/dbraw/zinc/93/23/02/566932302.db2.gz NJSMTJGQIHHLQN-ZDUSSCGKSA-N 0 1 389.359 3.218 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@H]2C[C@H]2c2cccc(F)c2)sc1Br ZINC000583254306 566933118 /nfs/dbraw/zinc/93/31/18/566933118.db2.gz DPURVDQPBDIEMU-QWRGUYRKSA-N 0 1 391.287 3.188 10 0 GGAEMN CC(C)N(CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)C[C@@H](C)O ZINC000519340005 566934115 /nfs/dbraw/zinc/93/41/15/566934115.db2.gz KHJRTKBHIRZHAC-SNVBAGLBSA-N 0 1 397.235 3.498 10 0 GGAEMN C[C@@H]1[C@@H](NC(=O)c2c(F)cncc2Br)CCN1Cc1ccccc1 ZINC000633096840 566934129 /nfs/dbraw/zinc/93/41/29/566934129.db2.gz MDNIENXSFOXQAP-WBMJQRKESA-N 0 1 392.272 3.376 10 0 GGAEMN O[C@@H](CNCc1cnc(C(F)(F)F)nc1)COc1cc(Cl)ccc1Cl ZINC000656704407 566935326 /nfs/dbraw/zinc/93/53/26/566935326.db2.gz IXPNSUIXDXTEDD-NSHDSACASA-N 0 1 396.196 3.332 10 0 GGAEMN CN(CCCc1nc(-c2cccs2)no1)[C@@H]1CCCC[C@H]1S(C)(=O)=O ZINC000471228138 566937138 /nfs/dbraw/zinc/93/71/38/566937138.db2.gz VACGXEHOGLTFEC-UKRRQHHQSA-N 0 1 383.539 3.018 10 0 GGAEMN CN(CCCc1nc(-c2cccs2)no1)[C@H]1CCCC[C@H]1S(C)(=O)=O ZINC000471228136 566937649 /nfs/dbraw/zinc/93/76/49/566937649.db2.gz VACGXEHOGLTFEC-DZGCQCFKSA-N 0 1 383.539 3.018 10 0 GGAEMN CC[C@H](C)Oc1cccc(S(=O)(=O)Nc2n[nH]c(C)c2Br)c1 ZINC000656735424 566942544 /nfs/dbraw/zinc/94/25/44/566942544.db2.gz OQURVYMUZMQEAQ-VIFPVBQESA-N 0 1 388.287 3.459 10 0 GGAEMN COc1cc(Br)ccc1CCCN1CC[C@@](O)(C(F)(F)F)C1 ZINC000544146734 566943622 /nfs/dbraw/zinc/94/36/22/566943622.db2.gz UBRPKFKRBNADQW-AWEZNQCLSA-N 0 1 382.220 3.389 10 0 GGAEMN Cc1ccc(Br)c(NS(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)n1 ZINC000656739339 566944658 /nfs/dbraw/zinc/94/46/58/566944658.db2.gz LZYHUFZJBBJTPL-JTQLQIEISA-N 0 1 385.287 3.047 10 0 GGAEMN Cc1ccnc(NS(=O)(=O)c2cccc3c2OCCCO3)c1Br ZINC000656741486 566946386 /nfs/dbraw/zinc/94/63/86/566946386.db2.gz OVTQQKXBFIHODO-UHFFFAOYSA-N 0 1 399.266 3.115 10 0 GGAEMN COc1ccc(CCC(=O)Nc2cc(CN(C)C)ccn2)c(Br)c1 ZINC000611970800 566947017 /nfs/dbraw/zinc/94/70/17/566947017.db2.gz RMRRTVOVQJJIIB-UHFFFAOYSA-N 0 1 392.297 3.486 10 0 GGAEMN O=C([O-])CC[N@@H+](CCO[C@H]1CC1(F)F)Cc1cccc(Br)c1 ZINC000656757534 566948617 /nfs/dbraw/zinc/94/86/17/566948617.db2.gz TVJKLSGVCGWUSM-ZDUSSCGKSA-N 0 1 378.213 3.150 10 0 GGAEMN O=C([O-])CC[N@@H+](CCO[C@@H]1CC1(F)F)Cc1cccc(Br)c1 ZINC000656757533 566949068 /nfs/dbraw/zinc/94/90/68/566949068.db2.gz TVJKLSGVCGWUSM-CYBMUJFWSA-N 0 1 378.213 3.150 10 0 GGAEMN CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc(Br)c(F)cc2[O-])CC1 ZINC000519582758 566950594 /nfs/dbraw/zinc/95/05/94/566950594.db2.gz VQWCZFZCENBTKJ-UHFFFAOYSA-N 0 1 387.293 3.486 10 0 GGAEMN C[C@@H]1C[C@@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CN1C1CC1 ZINC000612103527 566952621 /nfs/dbraw/zinc/95/26/21/566952621.db2.gz IUBIEMNGUQWVLZ-RNFRBKRXSA-N 0 1 395.194 3.361 10 0 GGAEMN Cc1nc(C(C)C)sc1[C@@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564209728 566955224 /nfs/dbraw/zinc/95/52/24/566955224.db2.gz DMYDOEMRQZKBKT-OCCSQVGLSA-N 0 1 380.535 3.460 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@H]2[C@@H]3c4ccc(Br)cc4C[C@H]23)n[nH]1 ZINC000633396821 566955649 /nfs/dbraw/zinc/95/56/49/566955649.db2.gz FZVJGYDYMHKBFH-NWANDNLSSA-N 0 1 389.297 3.067 10 0 GGAEMN O=C(c1cc(Cl)cc(Cl)c1F)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000633410518 566959086 /nfs/dbraw/zinc/95/90/86/566959086.db2.gz PPFAPRUPZHOSAY-UHFFFAOYSA-N 0 1 375.271 3.459 10 0 GGAEMN C[C@H]1SCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)[C@H]1C ZINC000544389680 566959246 /nfs/dbraw/zinc/95/92/46/566959246.db2.gz ATCSQXCVYHZQRA-VHSXEESVSA-N 0 1 381.295 3.257 10 0 GGAEMN CC[C@@H](COCC(F)(F)F)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000452327471 566962806 /nfs/dbraw/zinc/96/28/06/566962806.db2.gz NQCDAGPGMCJPPB-VIFPVBQESA-N 0 1 394.191 3.413 10 0 GGAEMN CC[C@H](COCC(F)(F)F)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000452327470 566963336 /nfs/dbraw/zinc/96/33/36/566963336.db2.gz NQCDAGPGMCJPPB-SECBINFHSA-N 0 1 394.191 3.413 10 0 GGAEMN CCO[C@@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(C)C ZINC000471594593 566963985 /nfs/dbraw/zinc/96/39/85/566963985.db2.gz QKYAOTQSBIDMRU-AWEZNQCLSA-N 0 1 395.301 3.302 10 0 GGAEMN CCO[C@@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(C)C ZINC000471594593 566963989 /nfs/dbraw/zinc/96/39/89/566963989.db2.gz QKYAOTQSBIDMRU-AWEZNQCLSA-N 0 1 395.301 3.302 10 0 GGAEMN CCO[C@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(C)C ZINC000471594595 566964135 /nfs/dbraw/zinc/96/41/35/566964135.db2.gz QKYAOTQSBIDMRU-CQSZACIVSA-N 0 1 395.301 3.302 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N(CCN(C)C)Cc1ccc(F)cc1 ZINC000656881547 566964112 /nfs/dbraw/zinc/96/41/12/566964112.db2.gz XKBUWEFTQDAHCG-CYBMUJFWSA-N 0 1 384.439 3.108 10 0 GGAEMN CCO[C@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(C)C ZINC000471594595 566964141 /nfs/dbraw/zinc/96/41/41/566964141.db2.gz QKYAOTQSBIDMRU-CQSZACIVSA-N 0 1 395.301 3.302 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000656883840 566964321 /nfs/dbraw/zinc/96/43/21/566964321.db2.gz SIYRVVYVWWEJTK-IIAWOOMASA-N 0 1 378.460 3.330 10 0 GGAEMN CC[C@H](COCC(F)(F)F)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000452334612 566965104 /nfs/dbraw/zinc/96/51/04/566965104.db2.gz IOZWRARIMUTWPH-SECBINFHSA-N 0 1 394.191 3.413 10 0 GGAEMN COc1cc(Br)c(CN[C@@H]2COc3ccc(F)cc3C2)cc1O ZINC000564329575 566965317 /nfs/dbraw/zinc/96/53/17/566965317.db2.gz AWGQEJPIOARHIE-ZDUSSCGKSA-N 0 1 382.229 3.396 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccnc2ccncc21 ZINC000493972290 566965346 /nfs/dbraw/zinc/96/53/46/566965346.db2.gz UNBGMOYSLZBFAC-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN Cc1c(Br)cccc1C(=O)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633526593 566968345 /nfs/dbraw/zinc/96/83/45/566968345.db2.gz UAQWHQSODYAVGT-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN Cc1cc(Br)ccc1C(=O)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633525997 566968407 /nfs/dbraw/zinc/96/84/07/566968407.db2.gz JQHZSNVZGRIJNO-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN O=C(NC1CC1)c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000583636084 566968959 /nfs/dbraw/zinc/96/89/59/566968959.db2.gz HYIOMOIYWSIWGU-UHFFFAOYSA-N 0 1 399.248 3.470 10 0 GGAEMN O=C(c1ccc(F)c(Br)c1)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633524990 566969163 /nfs/dbraw/zinc/96/91/63/566969163.db2.gz AHWHFGNNFQYGME-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN O=C(c1cccc(F)c1Br)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633528061 566969446 /nfs/dbraw/zinc/96/94/46/566969446.db2.gz MVYWJDVBXNCMKV-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN Cc1cccc(CN(CCN(C)C)S(=O)(=O)C[C@@H](C)CC(F)(F)F)c1 ZINC000656895437 566969429 /nfs/dbraw/zinc/96/94/29/566969429.db2.gz VLEXOXXQUYCWKU-HNNXBMFYSA-N 0 1 380.476 3.277 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000656904662 566970278 /nfs/dbraw/zinc/97/02/78/566970278.db2.gz KSFCJWUTFLDCBI-GOEBONIOSA-N 0 1 378.460 3.159 10 0 GGAEMN COCc1cc(Cl)cc(S(=O)(=O)NCc2nc3cccc(C)c3[nH]2)c1 ZINC000564395114 566970600 /nfs/dbraw/zinc/97/06/00/566970600.db2.gz KGBAWRZCZYZANN-UHFFFAOYSA-N 0 1 379.869 3.150 10 0 GGAEMN Cc1cc(Br)cc2cc(C(=O)NC[C@H]3CCCCN3CCO)oc21 ZINC000452377294 566970937 /nfs/dbraw/zinc/97/09/37/566970937.db2.gz MKCDPDREBFDBOC-OAHLLOKOSA-N 0 1 395.297 3.080 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)cc(Br)c2)CCN1C ZINC000656915671 566973868 /nfs/dbraw/zinc/97/38/68/566973868.db2.gz NLWWFWHKAKBJTJ-MFKMUULPSA-N 0 1 395.750 3.206 10 0 GGAEMN O=C(NC[C@@H]1CCCCN1CCO)c1csc(-c2ccccc2Cl)n1 ZINC000452395924 566974956 /nfs/dbraw/zinc/97/49/56/566974956.db2.gz XHYYNKJVNSKSFX-ZDUSSCGKSA-N 0 1 379.913 3.040 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)c[nH]2)C[C@@H]1C(=O)[O-] ZINC000564453044 566976636 /nfs/dbraw/zinc/97/66/36/566976636.db2.gz LWXFJBMHVGQUAH-FZMZJTMJSA-N 0 1 378.270 3.382 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)NCc1n[nH]c(C2CC2)n1 ZINC000452419618 566979140 /nfs/dbraw/zinc/97/91/40/566979140.db2.gz FYVLZWRXASOZJM-UHFFFAOYSA-N 0 1 399.289 3.133 10 0 GGAEMN O=C(CCc1c[nH]nn1)N[C@@H]1CCCSc2ccc(Br)cc21 ZINC000633681080 566979096 /nfs/dbraw/zinc/97/90/96/566979096.db2.gz KSWCUSUMVATBMF-CYBMUJFWSA-N 0 1 381.299 3.243 10 0 GGAEMN O=C(CCc1cnn[nH]1)N[C@@H]1CCCSc2ccc(Br)cc21 ZINC000633681080 566979097 /nfs/dbraw/zinc/97/90/97/566979097.db2.gz KSWCUSUMVATBMF-CYBMUJFWSA-N 0 1 381.299 3.243 10 0 GGAEMN O=S(=O)(N[C@@H]1CCCc2cn[nH]c21)c1cc(Cl)cc(Br)c1 ZINC000656939345 566980376 /nfs/dbraw/zinc/98/03/76/566980376.db2.gz VFSAAJOBUHCYPR-GFCCVEGCSA-N 0 1 390.690 3.182 10 0 GGAEMN C[N@H+]1CC[C@@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@@H]1c1ccccc1 ZINC000656945202 566981938 /nfs/dbraw/zinc/98/19/38/566981938.db2.gz LZARZFVAMAAMFU-MSOLQXFVSA-N 0 1 382.888 3.344 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@@H]1c1ccccc1 ZINC000656945202 566981942 /nfs/dbraw/zinc/98/19/42/566981942.db2.gz LZARZFVAMAAMFU-MSOLQXFVSA-N 0 1 382.888 3.344 10 0 GGAEMN CC(C)(C)OC(=O)CCCN(CCO)Cc1cc(Br)cs1 ZINC000494279768 566982438 /nfs/dbraw/zinc/98/24/38/566982438.db2.gz NYNQDPCVBUQLMA-UHFFFAOYSA-N 0 1 378.332 3.427 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(OC)c(C)c2)c(C(F)(F)F)n1 ZINC000681548505 566982819 /nfs/dbraw/zinc/98/28/19/566982819.db2.gz KSWXZCYVLJNTNJ-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN CCCc1c(NS(=O)(=O)c2c[nH]c(=O)s2)cnn1-c1ccc(C)cc1 ZINC000564531956 566982974 /nfs/dbraw/zinc/98/29/74/566982974.db2.gz PDWNHHGDMKAUTH-UHFFFAOYSA-N 0 1 378.479 3.096 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2cc(Br)cc(N3CCCC3)c2)n[nH]1 ZINC000612601558 566983976 /nfs/dbraw/zinc/98/39/76/566983976.db2.gz QUVBQVKTUSWFKG-GFCCVEGCSA-N 0 1 391.313 3.442 10 0 GGAEMN CCN(CC)[C@@H](CNC(=O)Nc1ccnc(C)c1Br)c1ccco1 ZINC000583791955 566984079 /nfs/dbraw/zinc/98/40/79/566984079.db2.gz MCHAFRAWMAGXAZ-AWEZNQCLSA-N 0 1 395.301 3.372 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N(CCCO)Cc1ccc(Cl)c(Cl)c1 ZINC000612623445 566985973 /nfs/dbraw/zinc/98/59/73/566985973.db2.gz KWKKHNMODGHVNV-CYBMUJFWSA-N 0 1 382.291 3.233 10 0 GGAEMN Cc1cc(S(=O)(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(C)s1 ZINC000520125363 566985982 /nfs/dbraw/zinc/98/59/82/566985982.db2.gz ZSQXEVYDRBWIDV-UHFFFAOYSA-N 0 1 388.505 3.396 10 0 GGAEMN CC(C)[C@H](CC(F)(F)F)NS(=O)(=O)c1ncccc1Br ZINC000656968761 566986530 /nfs/dbraw/zinc/98/65/30/566986530.db2.gz UWKTXOISIBBVBO-VIFPVBQESA-N 0 1 375.210 3.099 10 0 GGAEMN C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C[C@@H]1C(=O)[O-] ZINC000520229631 566989956 /nfs/dbraw/zinc/98/99/56/566989956.db2.gz ZNKFKUQQEMJORD-ONGXEEELSA-N 0 1 378.778 3.340 10 0 GGAEMN C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C[C@H]1C(=O)[O-] ZINC000520229630 566990412 /nfs/dbraw/zinc/99/04/12/566990412.db2.gz ZNKFKUQQEMJORD-MWLCHTKSSA-N 0 1 378.778 3.340 10 0 GGAEMN O=C(Cc1ccc(F)cc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000681595393 566992862 /nfs/dbraw/zinc/99/28/62/566992862.db2.gz CZXUPTXRUKJMIA-UHFFFAOYSA-N 0 1 375.201 3.350 10 0 GGAEMN CC[C@@H](NCC(=O)N1CCOC[C@H]1C1CC1)c1cc(F)cc(Br)c1 ZINC000681596389 566993426 /nfs/dbraw/zinc/99/34/26/566993426.db2.gz KCOZCBSMWOIBQT-SJORKVTESA-N 0 1 399.304 3.266 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@H](C)NCc2ccc3nc(C)sc3c2)c1 ZINC000494362800 566993944 /nfs/dbraw/zinc/99/39/44/566993944.db2.gz BOKYWVQTQOJIEB-LBPRGKRZSA-N 0 1 375.519 3.364 10 0 GGAEMN C[C@@H](COCC(F)(F)F)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000520339258 566997324 /nfs/dbraw/zinc/99/73/24/566997324.db2.gz KXRYFUDRQYIAEL-ZETCQYMHSA-N 0 1 380.164 3.023 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)c1cnccc1N(C)C ZINC000544820795 566997292 /nfs/dbraw/zinc/99/72/92/566997292.db2.gz CNHJBHXKBDMUFN-UHFFFAOYSA-N 0 1 392.297 3.281 10 0 GGAEMN CC[C@@H](CNS(=O)(=O)c1ncccc1Br)CC(F)(F)F ZINC000657012672 566997662 /nfs/dbraw/zinc/99/76/62/566997662.db2.gz HWQMUBNQJOZZOE-MRVPVSSYSA-N 0 1 375.210 3.101 10 0 GGAEMN CC[C@H](CNS(=O)(=O)c1ncccc1Br)CC(F)(F)F ZINC000657012673 566997728 /nfs/dbraw/zinc/99/77/28/566997728.db2.gz HWQMUBNQJOZZOE-QMMMGPOBSA-N 0 1 375.210 3.101 10 0 GGAEMN O=C(NCc1ccn(-c2ccccc2)n1)c1n[nH]c2ccc(Br)cc21 ZINC000520331864 566998027 /nfs/dbraw/zinc/99/80/27/566998027.db2.gz KQORZOBGVNPHGL-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN OC[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccsc1 ZINC000472077505 566998511 /nfs/dbraw/zinc/99/85/11/566998511.db2.gz HVOWHKIMKIVUNQ-CQSZACIVSA-N 0 1 384.295 3.495 10 0 GGAEMN CC(C)N(C)CC(=O)N1CC2(CCOCC2)c2ccc(Br)cc21 ZINC000633847798 566998772 /nfs/dbraw/zinc/99/87/72/566998772.db2.gz XTAYABIFJSRUHJ-UHFFFAOYSA-N 0 1 381.314 3.184 10 0 GGAEMN CC[C@@H]1Cc2c(Br)cccc2CN1C[C@H](O)COC[C@H]1CCCO1 ZINC000583974090 566999151 /nfs/dbraw/zinc/99/91/51/566999151.db2.gz GYDUTPCNIJUAJX-IXDOHACOSA-N 0 1 398.341 3.142 10 0 GGAEMN Cc1[nH]ncc1C(=O)N1CC2(CCOCC2)c2ccc(Br)cc21 ZINC000633847809 566999565 /nfs/dbraw/zinc/99/95/65/566999565.db2.gz YLBHLAKZEJNTOK-UHFFFAOYSA-N 0 1 376.254 3.189 10 0 GGAEMN COC(=O)C(C)(C)N1CCN(CC/C=C/c2ccc(Br)cc2)CC1 ZINC000494470479 567003047 /nfs/dbraw/zinc/00/30/47/567003047.db2.gz FPCHUWWQGBHFTM-GQCTYLIASA-N 0 1 395.341 3.422 10 0 GGAEMN Cc1c(Br)cccc1CS(=O)(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000657033697 567003569 /nfs/dbraw/zinc/00/35/69/567003569.db2.gz GOWIEEFNEUWXEA-AWEZNQCLSA-N 0 1 389.359 3.050 10 0 GGAEMN C[C@H](NC[C@H]1CS(=O)(=O)c2ccccc2O1)c1cccc(Br)c1 ZINC000520406507 567003658 /nfs/dbraw/zinc/00/36/58/567003658.db2.gz JECBWYHEFMSVAW-WFASDCNBSA-N 0 1 396.306 3.335 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1cccc(Br)c1F ZINC000430277773 567003769 /nfs/dbraw/zinc/00/37/69/567003769.db2.gz GYVAYQZNKXYJPB-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000452670518 567004372 /nfs/dbraw/zinc/00/43/72/567004372.db2.gz YOIJINUYZPNEKJ-KCPJHIHWSA-N 0 1 378.270 3.091 10 0 GGAEMN CC(C)OCC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000472176602 567006382 /nfs/dbraw/zinc/00/63/82/567006382.db2.gz UUOXNUGXRVMQSZ-QGZVFWFLSA-N 0 1 389.367 3.330 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1c(Cl)cccc1Br ZINC000633987378 567008192 /nfs/dbraw/zinc/00/81/92/567008192.db2.gz FZCXCOPNCJQYKX-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN CCSc1cc(Cl)ccc1C(=O)NCc1n[nH]c(C2CCOCC2)n1 ZINC000633990433 567009058 /nfs/dbraw/zinc/00/90/58/567009058.db2.gz PVBWLBPFVURFEQ-UHFFFAOYSA-N 0 1 380.901 3.394 10 0 GGAEMN O[C@H](C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1)C(F)(F)F ZINC000564794140 567009909 /nfs/dbraw/zinc/00/99/09/567009909.db2.gz ZEAAZVPZLVCQAL-CQSZACIVSA-N 0 1 392.219 3.461 10 0 GGAEMN O=C(CCSc1cccc(Cl)c1)NCc1n[nH]c(C2CCOCC2)n1 ZINC000634003401 567010619 /nfs/dbraw/zinc/01/06/19/567010619.db2.gz BJZRMEJBTJLPKP-UHFFFAOYSA-N 0 1 380.901 3.151 10 0 GGAEMN O=C(Nc1cc(Br)cc(Cl)c1O)C1(N2CCOCC2)CCC1 ZINC000544943668 567011092 /nfs/dbraw/zinc/01/10/92/567011092.db2.gz SDUBZRLBRGODIV-UHFFFAOYSA-N 0 1 389.677 3.002 10 0 GGAEMN C[C@@H]1CN(C)C[C@H](C)N1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000613008559 567011404 /nfs/dbraw/zinc/01/14/04/567011404.db2.gz MHFLOOKOLMPAGW-OKILXGFUSA-N 0 1 380.330 3.214 10 0 GGAEMN COCC1(C2CC2)CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)C1 ZINC000634049480 567013597 /nfs/dbraw/zinc/01/35/97/567013597.db2.gz BIWMPFFEEHOTCH-UHFFFAOYSA-N 0 1 390.281 3.338 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)Nc1ccc(C)cc1Br ZINC000494622293 567013839 /nfs/dbraw/zinc/01/38/39/567013839.db2.gz ANIOSDJNVFOYGE-AWEZNQCLSA-N 0 1 383.311 3.389 10 0 GGAEMN CCN(C(=O)CN[C@@H](CO)c1sccc1C)c1nc2ccccc2s1 ZINC000494651073 567014794 /nfs/dbraw/zinc/01/47/94/567014794.db2.gz AIURRJOHIPWANV-AWEZNQCLSA-N 0 1 375.519 3.342 10 0 GGAEMN C[C@@H](O)C[C@H]1CCCCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000584130040 567015208 /nfs/dbraw/zinc/01/52/08/567015208.db2.gz DYKNXCPHBDPMQV-DGCLKSJQSA-N 0 1 380.286 3.481 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@@H](C)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000494655681 567015535 /nfs/dbraw/zinc/01/55/35/567015535.db2.gz LJDAZHNTBBDJHX-GXFFZTMASA-N 0 1 379.482 3.456 10 0 GGAEMN CC(C)CCCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000520643043 567015877 /nfs/dbraw/zinc/01/58/77/567015877.db2.gz QIFARYAUNSADBO-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN CC(C)CCCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000520643043 567015882 /nfs/dbraw/zinc/01/58/82/567015882.db2.gz QIFARYAUNSADBO-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1cnc2ncc(Br)cc2c1 ZINC000681983674 567020043 /nfs/dbraw/zinc/02/00/43/567020043.db2.gz SWKMIOBMARYAAP-UHFFFAOYSA-N 0 1 395.220 3.225 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1cnc2ncc(Br)cc2c1 ZINC000681995973 567021525 /nfs/dbraw/zinc/02/15/25/567021525.db2.gz MDWKXKZALIMFKB-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCc3c(Br)cccc3C2)CC1 ZINC000545150895 567022599 /nfs/dbraw/zinc/02/25/99/567022599.db2.gz BQDZDLVHFPENLO-UHFFFAOYSA-N 0 1 378.314 3.169 10 0 GGAEMN C[C@@H]1[C@H](C)N(C)CCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000613226387 567023209 /nfs/dbraw/zinc/02/32/09/567023209.db2.gz MDEOVGHKIKRJEU-UONOGXRCSA-N 0 1 380.330 3.214 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000520779912 567023444 /nfs/dbraw/zinc/02/34/44/567023444.db2.gz ZHJVLPYPWHKUTR-TXEJJXNPSA-N 0 1 396.887 3.483 10 0 GGAEMN C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ncnc2cccc(I)c21 ZINC000545164836 567024376 /nfs/dbraw/zinc/02/43/76/567024376.db2.gz YSIGKAIFLOHPOP-YGRLFVJLSA-N 0 1 394.260 3.129 10 0 GGAEMN C[C@H]1C[C@@H](Nc2ncnc3cccc(I)c32)C[N@H+]1C1CC1 ZINC000545163194 567024434 /nfs/dbraw/zinc/02/44/34/567024434.db2.gz AWMRTOJVSVECBC-WDEREUQCSA-N 0 1 394.260 3.272 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2cc(Br)cc(F)c2C1 ZINC000613257962 567026413 /nfs/dbraw/zinc/02/64/13/567026413.db2.gz LJZFTKNEBQZRMO-LLVKDONJSA-N 0 1 378.245 3.001 10 0 GGAEMN C[C@@]1(CNS(=O)(=O)c2cc(F)c(Br)cc2F)CC1(F)F ZINC000657157749 567027003 /nfs/dbraw/zinc/02/70/03/567027003.db2.gz XYOKZHCZAXITCA-JTQLQIEISA-N 0 1 376.169 3.051 10 0 GGAEMN COc1cnccc1[C@H](C)NC[C@@H](O)COc1cc(F)cc(Br)c1 ZINC000584270531 567027754 /nfs/dbraw/zinc/02/77/54/567027754.db2.gz GIPZYFTZBRIMDU-SMDDNHRTSA-N 0 1 399.260 3.082 10 0 GGAEMN C[C@@]1(CCNS(=O)(=O)c2cc(Br)c(F)cc2F)CC1(F)F ZINC000657160775 567028712 /nfs/dbraw/zinc/02/87/12/567028712.db2.gz VHOKSEAZQNGFCG-LLVKDONJSA-N 0 1 390.196 3.441 10 0 GGAEMN O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)[C@H]1CCc2[nH]cnc2C1 ZINC000613306264 567029944 /nfs/dbraw/zinc/02/99/44/567029944.db2.gz YNBBMDGVERBNEN-NWDGAFQWSA-N 0 1 379.291 3.217 10 0 GGAEMN CC(C)(C)OC(=O)[C@H]1CCCN(C(=O)c2cccc(Br)c2O)C1 ZINC000545254999 567032467 /nfs/dbraw/zinc/03/24/67/567032467.db2.gz AVMKKZHOJYODFV-NSHDSACASA-N 0 1 384.270 3.349 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](O)[C@@H]2CCCC[C@H]21 ZINC000634492701 567036424 /nfs/dbraw/zinc/03/64/24/567036424.db2.gz KHIPWHLJWWYEMW-DFBGVHRSSA-N 0 1 378.270 3.091 10 0 GGAEMN C[C@@]1(NC(=O)c2ncsc2Br)CCN(Cc2ccccc2)C1 ZINC000565065747 567036842 /nfs/dbraw/zinc/03/68/42/567036842.db2.gz XKVDBNBHDOEUNS-MRXNPFEDSA-N 0 1 380.311 3.300 10 0 GGAEMN O[C@@H](COc1cc(F)cc(Br)c1)CN1CCC[C@@H](OC(F)F)C1 ZINC000682219800 567037738 /nfs/dbraw/zinc/03/77/38/567037738.db2.gz VAQWGLCEWWEDPH-CHWSQXEVSA-N 0 1 398.219 3.032 10 0 GGAEMN CCc1nc([C@H](C)Sc2nc3sc4c(c3c(=O)n2C)CCCC4)n[nH]1 ZINC000657217984 567037895 /nfs/dbraw/zinc/03/78/95/567037895.db2.gz UNFPPGQGPMBVHA-VIFPVBQESA-N 0 1 375.523 3.408 10 0 GGAEMN O[C@H](COc1cc(F)cc(Br)c1)CN1CCC[C@H](OC(F)F)C1 ZINC000682219803 567038450 /nfs/dbraw/zinc/03/84/50/567038450.db2.gz VAQWGLCEWWEDPH-STQMWFEESA-N 0 1 398.219 3.032 10 0 GGAEMN CO[C@@H](CSc1nc(-c2ccccc2Br)n[nH]1)[C@@H]1CCOC1 ZINC000657233141 567039363 /nfs/dbraw/zinc/03/93/63/567039363.db2.gz RREFRDNRVSEIHR-MFKMUULPSA-N 0 1 384.299 3.378 10 0 GGAEMN CCCn1c(=O)[nH]nc1SCC(=O)c1c[nH]c2ncc(Br)cc12 ZINC000657231687 567039722 /nfs/dbraw/zinc/03/97/22/567039722.db2.gz KQROFGYCOYYXGJ-UHFFFAOYSA-N 0 1 396.270 3.008 10 0 GGAEMN NC(=O)[C@H](NCC1([C@H]2CCCCO2)CCC1)c1cccc(Br)c1 ZINC000634580163 567039990 /nfs/dbraw/zinc/03/99/90/567039990.db2.gz ZZKGWVDAJNVPLS-HZPDHXFCSA-N 0 1 381.314 3.305 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCc1ncc(Br)cc1Cl ZINC000657234313 567040031 /nfs/dbraw/zinc/04/00/31/567040031.db2.gz NEAPSXJSWSMJEA-UHFFFAOYSA-N 0 1 393.694 3.123 10 0 GGAEMN NC(=O)[C@@H](NCC1([C@@H]2CCCCO2)CCC1)c1ccc(Br)cc1 ZINC000634579287 567040490 /nfs/dbraw/zinc/04/04/90/567040490.db2.gz BMDYLLNIEHQFOV-HOTGVXAUSA-N 0 1 381.314 3.305 10 0 GGAEMN COC(=O)c1cccc(NC(=O)NCCN2CC=C(C)CC2)c1Br ZINC000495037230 567040554 /nfs/dbraw/zinc/04/05/54/567040554.db2.gz JYAUFDOVSCRYPN-UHFFFAOYSA-N 0 1 396.285 3.009 10 0 GGAEMN NC(=O)[C@H](NCC1([C@H]2CCCCO2)CCC1)c1ccc(Br)cc1 ZINC000634579288 567040827 /nfs/dbraw/zinc/04/08/27/567040827.db2.gz BMDYLLNIEHQFOV-HZPDHXFCSA-N 0 1 381.314 3.305 10 0 GGAEMN C[C@](O)(C[C@H](O)CSc1nc(-c2ccccc2Br)n[nH]1)C1CC1 ZINC000634639363 567042922 /nfs/dbraw/zinc/04/29/22/567042922.db2.gz HNJNNMCUVRWSMM-ZBEGNZNMSA-N 0 1 398.326 3.238 10 0 GGAEMN Fc1cncc(Br)c1CNC[C@@H](c1ccccc1)N1CCOCC1 ZINC000657299248 567044030 /nfs/dbraw/zinc/04/40/30/567044030.db2.gz UGFJLWPBBQLGRU-SFHVURJKSA-N 0 1 394.288 3.146 10 0 GGAEMN O[C@H](CNCc1cnc(C(F)(F)F)nc1)COc1cc(Cl)cc(Cl)c1 ZINC000634649006 567045149 /nfs/dbraw/zinc/04/51/49/567045149.db2.gz DMXMPRQKCLKVLK-GFCCVEGCSA-N 0 1 396.196 3.332 10 0 GGAEMN Brc1ccc(N2CC[C@@H](CNCc3cn(C4CCC4)nn3)C2)cc1 ZINC000657325396 567046110 /nfs/dbraw/zinc/04/61/10/567046110.db2.gz DUVYZJUFOGSXMK-AWEZNQCLSA-N 0 1 390.329 3.382 10 0 GGAEMN CCC(CC)[C@H](CNCc1c(F)cncc1Br)N1CCOCC1 ZINC000657305517 567046321 /nfs/dbraw/zinc/04/63/21/567046321.db2.gz ZODXHUBWMJOQTA-KRWDZBQOSA-N 0 1 388.325 3.210 10 0 GGAEMN COc1cc(CNCc2c(C3CCC3)cnn2C)cc(Br)c1O ZINC000657344259 567048852 /nfs/dbraw/zinc/04/88/52/567048852.db2.gz IZBDIWNIQBOPQH-UHFFFAOYSA-N 0 1 380.286 3.454 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1 ZINC000545418676 567049085 /nfs/dbraw/zinc/04/90/85/567049085.db2.gz PAZJVABHDYDUOZ-GFCCVEGCSA-N 0 1 379.291 3.463 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@@H]1Cc2ccccc2CN1 ZINC000584531150 567050269 /nfs/dbraw/zinc/05/02/69/567050269.db2.gz VZORQWUMVODYBM-SJCJKPOMSA-N 0 1 389.293 3.349 10 0 GGAEMN COc1ccc(-c2cnc(NCc3c(Br)cnn3C)n2C)cc1 ZINC000453055382 567050650 /nfs/dbraw/zinc/05/06/50/567050650.db2.gz ZLMPGRXHSOOYCI-UHFFFAOYSA-N 0 1 376.258 3.204 10 0 GGAEMN OC[C@@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Br)c1 ZINC000657398710 567053964 /nfs/dbraw/zinc/05/39/64/567053964.db2.gz FOJUKCNUQSMHQM-RTBURBONSA-N 0 1 392.293 3.440 10 0 GGAEMN O[C@H](CN[C@@H](c1ccsc1)c1ccc(Cl)cc1)CC1(O)CCOCC1 ZINC000634700930 567054042 /nfs/dbraw/zinc/05/40/42/567054042.db2.gz HRIPCVKTDNKCLQ-ZWKOTPCHSA-N 0 1 381.925 3.373 10 0 GGAEMN Cc1nc(C)c(S(=O)(=O)N[C@]2(C(F)(F)F)CCc3ccccc32)s1 ZINC000545466286 567054105 /nfs/dbraw/zinc/05/41/05/567054105.db2.gz HGGCOBITPISGHT-CQSZACIVSA-N 0 1 376.425 3.442 10 0 GGAEMN CN(C)c1ccncc1C(=O)NCCc1c[nH]c2cccc(Br)c12 ZINC000521322428 567054090 /nfs/dbraw/zinc/05/40/90/567054090.db2.gz OQEFSUZSYSANDX-UHFFFAOYSA-N 0 1 387.281 3.364 10 0 GGAEMN CN1CCC[C@H](CNC(=O)c2cccc([S@](C)=O)c2)[C@@H]1c1cccs1 ZINC000613711008 567056832 /nfs/dbraw/zinc/05/68/32/567056832.db2.gz XXVWPTOCNLNVQK-JTJQLJSMSA-N 0 1 376.547 3.298 10 0 GGAEMN Cc1cc(Br)cn2cc(CCNCc3cn(C4CCC4)nn3)nc12 ZINC000657436018 567057079 /nfs/dbraw/zinc/05/70/79/567057079.db2.gz RLZVRPVHQQKYFI-UHFFFAOYSA-N 0 1 389.301 3.054 10 0 GGAEMN CN(CCO)Cc1cc(NCc2c(C(F)(F)F)cnn2C)ccc1Cl ZINC000657455002 567057994 /nfs/dbraw/zinc/05/79/94/567057994.db2.gz FIEDIGKSAIBRNR-UHFFFAOYSA-N 0 1 376.810 3.129 10 0 GGAEMN Cc1ccc(NCc2c(F)cncc2Br)cc1N1CC[NH+]=C1[O-] ZINC000657451738 567058967 /nfs/dbraw/zinc/05/89/67/567058967.db2.gz HBDZOJSUANUJPB-UHFFFAOYSA-N 0 1 379.233 3.433 10 0 GGAEMN COC(=O)c1cccc(Cl)c1S(=O)(=O)Nc1cc(F)cc(F)c1F ZINC000431159546 567060168 /nfs/dbraw/zinc/06/01/68/567060168.db2.gz IAQJJGZBLVUSGE-UHFFFAOYSA-N 0 1 379.743 3.345 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCc3cc(Br)c(Cl)cc32)[nH]1 ZINC000682570264 567060846 /nfs/dbraw/zinc/06/08/46/567060846.db2.gz KZQPHTNUESWVEI-UHFFFAOYSA-N 0 1 387.690 3.210 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CCc3cc(Br)c(Cl)cc32)n1 ZINC000682570264 567060852 /nfs/dbraw/zinc/06/08/52/567060852.db2.gz KZQPHTNUESWVEI-UHFFFAOYSA-N 0 1 387.690 3.210 10 0 GGAEMN Cc1c(Br)cccc1C[C@@H](CO)CNCc1cn(C2CCC2)nn1 ZINC000657485848 567061333 /nfs/dbraw/zinc/06/13/33/567061333.db2.gz SIFPFIDGNWFIFD-CQSZACIVSA-N 0 1 393.329 3.015 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@H](c2cccc(F)c2)N(C)C)c1Br ZINC000584700190 567061380 /nfs/dbraw/zinc/06/13/80/567061380.db2.gz QJWFTGGPBNHOPD-OAHLLOKOSA-N 0 1 395.276 3.138 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)Cc2ccc(Br)c(Cl)c2)[nH]n1 ZINC000682608398 567062697 /nfs/dbraw/zinc/06/26/97/567062697.db2.gz CQHUOTAYIHKBGY-UHFFFAOYSA-N 0 1 394.660 3.407 10 0 GGAEMN CC(C)(C)[N@@H+]1CC[C@@H]1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000657527641 567065592 /nfs/dbraw/zinc/06/55/92/567065592.db2.gz WYQNAEMLVDBUJO-QGZVFWFLSA-N 0 1 396.373 3.248 10 0 GGAEMN COc1ccc(Br)cc1CNCc1ccc(CNC(C)=O)cc1 ZINC000657541605 567067875 /nfs/dbraw/zinc/06/78/75/567067875.db2.gz QIQSLELYRDMCGL-UHFFFAOYSA-N 0 1 377.282 3.384 10 0 GGAEMN O=C(N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1)[C@H]1CCc2[nH]cnc2C1 ZINC000613903254 567071143 /nfs/dbraw/zinc/07/11/43/567071143.db2.gz YUAFNURHMPFDKD-AAEUAGOBSA-N 0 1 379.291 3.217 10 0 GGAEMN COc1cc(CNCc2cccnc2N2CCCC2)cc(Br)c1O ZINC000657571372 567071034 /nfs/dbraw/zinc/07/10/34/567071034.db2.gz QEOJJXACPHNROM-UHFFFAOYSA-N 0 1 392.297 3.448 10 0 GGAEMN CC[C@H](CNS(C)(=O)=O)N[C@H](C)c1cc2cc(Br)ccc2o1 ZINC000453272581 567071117 /nfs/dbraw/zinc/07/11/17/567071117.db2.gz BAEDRLUNUQOEDN-ZWNOBZJWSA-N 0 1 389.315 3.174 10 0 GGAEMN COC[C@H](NCc1cn(-c2ccc(Cl)c(Cl)c2)nn1)C1CCOCC1 ZINC000657565717 567071219 /nfs/dbraw/zinc/07/12/19/567071219.db2.gz UFNSULHFPPNXCR-KRWDZBQOSA-N 0 1 385.295 3.105 10 0 GGAEMN C[C@@H](Oc1ccccc1)c1noc(CNS(=O)(=O)c2ccc(Cl)s2)n1 ZINC000545724390 567071609 /nfs/dbraw/zinc/07/16/09/567071609.db2.gz OMXJRDVTGALIKZ-SNVBAGLBSA-N 0 1 399.881 3.403 10 0 GGAEMN CN(CCc1ccc(Br)cc1)CC(=O)N1CCO[C@H]2CCCC[C@@H]21 ZINC000521656459 567071747 /nfs/dbraw/zinc/07/17/47/567071747.db2.gz KTOQUHYPPNHKOY-ROUUACIJSA-N 0 1 395.341 3.093 10 0 GGAEMN CN(C)[C@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccc(F)cc1 ZINC000431323434 567074925 /nfs/dbraw/zinc/07/49/25/567074925.db2.gz MQRLKSUNFJDRQY-MRXNPFEDSA-N 0 1 395.272 3.255 10 0 GGAEMN COC[C@]1(C(=O)[O-])CC[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000565543832 567077489 /nfs/dbraw/zinc/07/74/89/567077489.db2.gz JLJFLQXHDZKRCZ-SFHVURJKSA-N 0 1 380.897 3.310 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(CN3CCOCC3)CC2)c(C)c1Br ZINC000682864333 567078224 /nfs/dbraw/zinc/07/82/24/567078224.db2.gz FBOMABNEJNKLMF-UHFFFAOYSA-N 0 1 395.341 3.250 10 0 GGAEMN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN[C@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657639660 567078337 /nfs/dbraw/zinc/07/83/37/567078337.db2.gz SZIUZAMYRULXBY-LRDDRELGSA-N 0 1 381.929 3.198 10 0 GGAEMN CCCOc1c(Cl)cc(CN[C@@H]2CC[C@H](C)S(=O)(=O)C2)cc1OC ZINC000657634599 567078565 /nfs/dbraw/zinc/07/85/65/567078565.db2.gz JIHDGNGVWBBGLZ-GXTWGEPZSA-N 0 1 375.918 3.193 10 0 GGAEMN C[C@@H]1CC[C@H](NCc2ccc(OC(F)F)c(Br)c2)CS1(=O)=O ZINC000657638731 567078785 /nfs/dbraw/zinc/07/87/85/567078785.db2.gz OQYGYZSHLISSFE-KOLCDFICSA-N 0 1 398.269 3.106 10 0 GGAEMN CN(C)c1ncc(CN[C@@H]2CSCc3ccc(Br)cc32)n1C ZINC000657641415 567080139 /nfs/dbraw/zinc/08/01/39/567080139.db2.gz FCQIJBNQNSHNDE-OAHLLOKOSA-N 0 1 381.343 3.326 10 0 GGAEMN COCCn1cc(CN[C@H]2CSCc3ccc(Br)cc32)cn1 ZINC000657642145 567080240 /nfs/dbraw/zinc/08/02/40/567080240.db2.gz VJJDDIQNRXOXAA-INIZCTEOSA-N 0 1 382.327 3.370 10 0 GGAEMN C[C@@H]1CC[C@@H](NCC2=Cc3cc(Cl)cc(Cl)c3OC2)CS1(=O)=O ZINC000657640067 567080760 /nfs/dbraw/zinc/08/07/60/567080760.db2.gz WXMAUPAYWPWEAR-QMTHXVAHSA-N 0 1 376.305 3.325 10 0 GGAEMN Cc1ccc(C(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)c(C)c1Br ZINC000682899823 567080802 /nfs/dbraw/zinc/08/08/02/567080802.db2.gz OHXJLOXOYLRHJD-KRWDZBQOSA-N 0 1 396.373 3.068 10 0 GGAEMN CS(=O)(=O)C1(CNCc2ccccc2OCC(F)(F)F)CCCCC1 ZINC000657653604 567082822 /nfs/dbraw/zinc/08/28/22/567082822.db2.gz OPFWFAGDFWNEFK-UHFFFAOYSA-N 0 1 379.444 3.465 10 0 GGAEMN Cc1nc(S(=O)(=O)NC2CC(c3ccccc3)C2)sc1Br ZINC000545896835 567084709 /nfs/dbraw/zinc/08/47/09/567084709.db2.gz AHRIVINIWMZOFT-UHFFFAOYSA-N 0 1 387.324 3.439 10 0 GGAEMN O=C(NCCc1cc(Cl)ccc1Br)N[C@@H]1CCc2nc[nH]c2C1 ZINC000565632310 567084757 /nfs/dbraw/zinc/08/47/57/567084757.db2.gz WOARELVJKWHDMQ-GFCCVEGCSA-N 0 1 397.704 3.225 10 0 GGAEMN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635187250 567085656 /nfs/dbraw/zinc/08/56/56/567085656.db2.gz TWKZIEZLRPDFLY-GHMZBOCLSA-N 0 1 381.263 3.307 10 0 GGAEMN CC(C)(CNC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1cccc(Br)c1 ZINC000521948165 567088444 /nfs/dbraw/zinc/08/84/44/567088444.db2.gz YVJKYKHEWFQYKW-CQSZACIVSA-N 0 1 391.313 3.307 10 0 GGAEMN COC(=O)c1ccc(CNc2cnn(-c3ccncc3)c2)c(Br)c1 ZINC000585766819 567089143 /nfs/dbraw/zinc/08/91/43/567089143.db2.gz UGHPOPVITCOSNK-UHFFFAOYSA-N 0 1 387.237 3.429 10 0 GGAEMN CCOC(=O)CCN(Cc1nc2cc(Br)ccc2[nH]1)CC1CC1 ZINC000614163342 567089416 /nfs/dbraw/zinc/08/94/16/567089416.db2.gz ZOLMYDAANSZDQO-UHFFFAOYSA-N 0 1 380.286 3.491 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)Nc1c(O)cccc1F ZINC000586574114 567092692 /nfs/dbraw/zinc/09/26/92/567092692.db2.gz MMTIYBAQQZUEMQ-UHFFFAOYSA-N 0 1 394.207 3.426 10 0 GGAEMN CCS(=O)(=O)C1(CNCc2c(C)nn(-c3ccc(Cl)cc3)c2C)CC1 ZINC000657758065 567093215 /nfs/dbraw/zinc/09/32/15/567093215.db2.gz XGIZHWCWYQKNLZ-UHFFFAOYSA-N 0 1 381.929 3.199 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000431580932 567093853 /nfs/dbraw/zinc/09/38/53/567093853.db2.gz YEHOBCMQDMBMSG-LBPRGKRZSA-N 0 1 397.298 3.054 10 0 GGAEMN CCS(=O)(=O)c1c(Cl)cccc1CNCC1(O)CCC(F)(F)CC1 ZINC000657777499 567094121 /nfs/dbraw/zinc/09/41/21/567094121.db2.gz RYJRBECRIRVWDB-UHFFFAOYSA-N 0 1 381.872 3.164 10 0 GGAEMN CC(C)(CNCc1ncc(I)s1)[C@H]1CCCCO1 ZINC000586778436 567096511 /nfs/dbraw/zinc/09/65/11/567096511.db2.gz INENYTMJNWPGOE-SNVBAGLBSA-N 0 1 380.295 3.433 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H]2C[C@H]2c2ccccc2Br)n[nH]1 ZINC000565752577 567096535 /nfs/dbraw/zinc/09/65/35/567096535.db2.gz YENMLAGLRAFTCX-FUEDEBDSSA-N 0 1 377.286 3.267 10 0 GGAEMN O=C(Nc1nnc(SCc2ccc(F)cc2)s1)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635405112 567098216 /nfs/dbraw/zinc/09/82/16/567098216.db2.gz FMPCFMITKKSZLN-VXGBXAGGSA-N 0 1 375.454 3.435 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)[C@H](C)C1 ZINC000497479569 567100156 /nfs/dbraw/zinc/10/01/56/567100156.db2.gz QIIUPLHHBREGNV-BFQNTYOBSA-N 0 1 386.323 3.077 10 0 GGAEMN OCCN(Cc1cc(Br)cs1)Cc1ccccc1-n1cncn1 ZINC000683163904 567101505 /nfs/dbraw/zinc/10/15/05/567101505.db2.gz WGHDPRJVMRZVQV-UHFFFAOYSA-N 0 1 393.310 3.086 10 0 GGAEMN Cc1cn2cc(NC(=O)c3cc(=O)c4cc(Br)ccc4[nH]3)ccc2n1 ZINC000522153049 567102080 /nfs/dbraw/zinc/10/20/80/567102080.db2.gz MWXJFCBWAKSDBX-UHFFFAOYSA-N 0 1 397.232 3.499 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)s[n-]1 ZINC000473827422 567104719 /nfs/dbraw/zinc/10/47/19/567104719.db2.gz HUJPUPYGHVBRMJ-YPMHNXCESA-N 0 1 379.555 3.239 10 0 GGAEMN CCN(CCOc1ccc(Br)cc1)C(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635611280 567105804 /nfs/dbraw/zinc/10/58/04/567105804.db2.gz NKAWPJWVZDPLLX-HUUCEWRRSA-N 0 1 378.270 3.203 10 0 GGAEMN O=C(N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)[C@@H]1CCc2[nH]cnc2C1 ZINC000614358929 567106369 /nfs/dbraw/zinc/10/63/69/567106369.db2.gz AYPIQFQZFJKTTF-JHJVBQTASA-N 0 1 392.272 3.479 10 0 GGAEMN C[C@H](Cc1cc(Br)ccc1F)NC(=O)c1cnccc1N(C)C ZINC000546129374 567107721 /nfs/dbraw/zinc/10/77/21/567107721.db2.gz QOXYIPAHQFHZQV-LLVKDONJSA-N 0 1 380.261 3.410 10 0 GGAEMN O[C@H](CNCc1cn2cc(Cl)ccc2n1)COCc1ccc(Cl)cc1 ZINC000565887188 567108291 /nfs/dbraw/zinc/10/82/91/567108291.db2.gz HKGZYRLYXHZJEH-QGZVFWFLSA-N 0 1 380.275 3.308 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)c1cnccc1N(C)C ZINC000546134996 567108941 /nfs/dbraw/zinc/10/89/41/567108941.db2.gz MEXJGBBBWDPFRG-SJCJKPOMSA-N 0 1 392.297 3.416 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635763582 567111638 /nfs/dbraw/zinc/11/16/38/567111638.db2.gz BGUBOCRJWCBRDM-DVUFPGTOSA-N 0 1 378.270 3.168 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635763584 567111718 /nfs/dbraw/zinc/11/17/18/567111718.db2.gz BGUBOCRJWCBRDM-YDEYXMKJSA-N 0 1 378.270 3.168 10 0 GGAEMN CCOCCOc1ccc(Br)cc1NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635780749 567111834 /nfs/dbraw/zinc/11/18/34/567111834.db2.gz SMRAKOYHUVZJLI-CHWSQXEVSA-N 0 1 394.269 3.330 10 0 GGAEMN Cc1nc([C@](C)(NC(=O)c2n[nH]c3ccc(Br)cc32)C2CC2)no1 ZINC000497604149 567112351 /nfs/dbraw/zinc/11/23/51/567112351.db2.gz LUTGUNNDTXTWFC-MRXNPFEDSA-N 0 1 390.241 3.072 10 0 GGAEMN O=C(c1c(Cl)cc(F)cc1Cl)N1CCC[C@@H](N2CCOCC2)CC1 ZINC000614435316 567112551 /nfs/dbraw/zinc/11/25/51/567112551.db2.gz CWLGCNIVLMQNQM-CYBMUJFWSA-N 0 1 375.271 3.459 10 0 GGAEMN CN(C)[C@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccsc1 ZINC000431881439 567113818 /nfs/dbraw/zinc/11/38/18/567113818.db2.gz GMAIMFXIXIQNGZ-CQSZACIVSA-N 0 1 383.311 3.178 10 0 GGAEMN CCCCSc1ccc(Cl)cc1C(=O)NC[C@@H]1CN2CCN1CCC2 ZINC000614501422 567116959 /nfs/dbraw/zinc/11/69/59/567116959.db2.gz DUVCBNUUCMQFGE-MRXNPFEDSA-N 0 1 381.973 3.352 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCC[C@@H](Nc2cccc(Br)c2)C1 ZINC000635874342 567117610 /nfs/dbraw/zinc/11/76/10/567117610.db2.gz NJGQEUPAMGJOTP-BZUAXINKSA-N 0 1 389.297 3.379 10 0 GGAEMN O=C1NCC[C@@H]1N[C@H]1CCCc2c(Br)cc(Br)cc21 ZINC000658053367 567118588 /nfs/dbraw/zinc/11/85/88/567118588.db2.gz WTNTYCFHVXZIFW-STQMWFEESA-N 0 1 388.103 3.067 10 0 GGAEMN C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Cc1ccc(Br)cc1O ZINC000431992775 567121584 /nfs/dbraw/zinc/12/15/84/567121584.db2.gz GQPDDKDXUHXQHA-CQSZACIVSA-N 0 1 383.330 3.468 10 0 GGAEMN CC[C@H](COCC1CC1)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658092607 567121996 /nfs/dbraw/zinc/12/19/96/567121996.db2.gz QSLKXPPDFHTRKP-ZYHUDNBSSA-N 0 1 395.352 3.497 10 0 GGAEMN CN(C(=O)c1ncc(Br)s1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000683411804 567122267 /nfs/dbraw/zinc/12/22/67/567122267.db2.gz PQAOVBHMCMNGFE-ZDUSSCGKSA-N 0 1 380.311 3.252 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@H](CO)N[C@H](C)c2ncc(Br)cc2F)C1 ZINC000658117313 567124979 /nfs/dbraw/zinc/12/49/79/567124979.db2.gz ZXUOIOKCNHVSGQ-OICBVUGWSA-N 0 1 375.282 3.200 10 0 GGAEMN COCc1nc(CN[C@H](c2ccc(Br)o2)c2ccc(F)cc2)n[nH]1 ZINC000658156577 567126626 /nfs/dbraw/zinc/12/66/26/567126626.db2.gz JYQTXGOGMQOFRR-INIZCTEOSA-N 0 1 395.232 3.325 10 0 GGAEMN COCc1nc(CN[C@@H](c2ccco2)c2ccc(Br)cc2)n[nH]1 ZINC000658157761 567126707 /nfs/dbraw/zinc/12/67/07/567126707.db2.gz DIIDSARGUFNEJK-MRXNPFEDSA-N 0 1 377.242 3.186 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCOc2ccccc2C1 ZINC000683472329 567128028 /nfs/dbraw/zinc/12/80/28/567128028.db2.gz LYXAENHSKUJSSZ-UHFFFAOYSA-N 0 1 399.244 3.325 10 0 GGAEMN CN(C)C[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000614634170 567128224 /nfs/dbraw/zinc/12/82/24/567128224.db2.gz YEQHYUHYHLXWOV-HNNXBMFYSA-N 0 1 387.332 3.445 10 0 GGAEMN C[C@@]1(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1(F)F ZINC000658216864 567129239 /nfs/dbraw/zinc/12/92/39/567129239.db2.gz DBTIWWYXTURDOW-AAEUAGOBSA-N 0 1 380.254 3.303 10 0 GGAEMN Cc1cc(Br)c(CN[C@H](C)c2ccc(S(N)(=O)=O)cc2)s1 ZINC000658225212 567129805 /nfs/dbraw/zinc/12/98/05/567129805.db2.gz HYRCTSRXZLLPNW-SNVBAGLBSA-N 0 1 389.340 3.317 10 0 GGAEMN Cc1cc(Br)c(CN[C@@H](C)c2ccc(S(N)(=O)=O)cc2)s1 ZINC000658225211 567129944 /nfs/dbraw/zinc/12/99/44/567129944.db2.gz HYRCTSRXZLLPNW-JTQLQIEISA-N 0 1 389.340 3.317 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cc1F ZINC000588628667 567130202 /nfs/dbraw/zinc/13/02/02/567130202.db2.gz TUHTWSBUGKHKTM-UHFFFAOYSA-N 0 1 387.816 3.450 10 0 GGAEMN Cc1nc(CC(=O)N2c3ccc(Br)cc3[C@@H]3CCCC[C@@H]32)n[nH]1 ZINC000614687608 567131599 /nfs/dbraw/zinc/13/15/99/567131599.db2.gz UUQVSNBWGAUMPP-JSGCOSHPSA-N 0 1 375.270 3.491 10 0 GGAEMN CC[N@H+]1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)[C@H](C)C1 ZINC000614710175 567132902 /nfs/dbraw/zinc/13/29/02/567132902.db2.gz KEJLNNFIBGDATP-CQSZACIVSA-N 0 1 380.330 3.216 10 0 GGAEMN CCN1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)[C@H](C)C1 ZINC000614710175 567132909 /nfs/dbraw/zinc/13/29/09/567132909.db2.gz KEJLNNFIBGDATP-CQSZACIVSA-N 0 1 380.330 3.216 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@@H]2CCc3c2ccc(F)c3Br)CC1 ZINC000658301805 567134456 /nfs/dbraw/zinc/13/44/56/567134456.db2.gz MFUPMCOOCQAGPA-CYBMUJFWSA-N 0 1 376.291 3.132 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@H]2CCCOc3cc(Br)ccc32)CC1 ZINC000658300210 567134497 /nfs/dbraw/zinc/13/44/97/567134497.db2.gz SUVVWVNBERPIHW-AWEZNQCLSA-N 0 1 388.327 3.220 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000658297947 567134600 /nfs/dbraw/zinc/13/46/00/567134600.db2.gz BLZXTRBQBSVVRE-CQSZACIVSA-N 0 1 388.327 3.220 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@H](C)c2cnn(-c3cccc(Cl)c3)c2C)CC1 ZINC000658300199 567134611 /nfs/dbraw/zinc/13/46/11/567134611.db2.gz SRUDJXCNFJFTFX-CYBMUJFWSA-N 0 1 381.929 3.452 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@H](C)[C@H](C)O1 ZINC000474110212 567135004 /nfs/dbraw/zinc/13/50/04/567135004.db2.gz NNQJFMVZQHNUDG-UTUOFQBUSA-N 0 1 378.270 3.477 10 0 GGAEMN CC1=CCN(CCNC(=O)NCCc2cc(Br)ccc2F)CC1 ZINC000546566072 567137320 /nfs/dbraw/zinc/13/73/20/567137320.db2.gz GBPGWKNDVMOAPX-UHFFFAOYSA-N 0 1 384.293 3.082 10 0 GGAEMN NC1(c2noc([C@@H](c3cc(Cl)cc(Cl)c3)N3CCOCC3)n2)CCC1 ZINC000566216306 567138639 /nfs/dbraw/zinc/13/86/39/567138639.db2.gz BALCOYWZDNHMSX-CQSZACIVSA-N 0 1 383.279 3.136 10 0 GGAEMN C[C@H]1CC[N@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@H]1C(=O)[O-] ZINC000566221307 567139345 /nfs/dbraw/zinc/13/93/45/567139345.db2.gz NOQLYWALGMBXDR-GXSJLCMTSA-N 0 1 389.677 3.084 10 0 GGAEMN C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@H]1C(=O)[O-] ZINC000566221307 567139354 /nfs/dbraw/zinc/13/93/54/567139354.db2.gz NOQLYWALGMBXDR-GXSJLCMTSA-N 0 1 389.677 3.084 10 0 GGAEMN CC1=CCN(CCNC(=O)Nc2ccc(I)cc2)CC1 ZINC000546575117 567140005 /nfs/dbraw/zinc/14/00/05/567140005.db2.gz IVHKFNRYCYFEFU-UHFFFAOYSA-N 0 1 385.249 3.065 10 0 GGAEMN C[C@H]1CC[C@H](C(N)=O)CN1Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000474150695 567140104 /nfs/dbraw/zinc/14/01/04/567140104.db2.gz BIRBOSIGSYACBZ-ONGXEEELSA-N 0 1 395.219 3.434 10 0 GGAEMN Cc1ccc(I)c(C(=O)N2CCN(C)C[C@H]2C(C)C)c1 ZINC000523132580 567144432 /nfs/dbraw/zinc/14/44/32/567144432.db2.gz JNQAOYSDYVAKMV-HNNXBMFYSA-N 0 1 386.277 3.012 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)C(C)(C)c2cccc(Br)c2)C1 ZINC000523287747 567148995 /nfs/dbraw/zinc/14/89/95/567148995.db2.gz YPOGTBWZBZLTRP-QGZVFWFLSA-N 0 1 397.357 3.200 10 0 GGAEMN O=C(NCCc1c[nH]c2cccc(Br)c12)[C@@H]1CCc2[nH]cnc2C1 ZINC000614980379 567150224 /nfs/dbraw/zinc/15/02/24/567150224.db2.gz BVAIDFYFPMQHLM-LLVKDONJSA-N 0 1 387.281 3.117 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC[C@@H]1C(F)(F)F ZINC000615029364 567152420 /nfs/dbraw/zinc/15/24/20/567152420.db2.gz HOHLIORWIWNQEM-LLVKDONJSA-N 0 1 375.144 3.067 10 0 GGAEMN CC(C)Sc1cccc(Cl)c1CN1CCN(CCC(=O)N(C)C)CC1 ZINC000474258292 567152872 /nfs/dbraw/zinc/15/28/72/567152872.db2.gz IGVBLFWIQBTDSL-UHFFFAOYSA-N 0 1 383.989 3.436 10 0 GGAEMN O=C(COc1ccc(F)cc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000589074967 567153648 /nfs/dbraw/zinc/15/36/48/567153648.db2.gz GVLKEXOCXAWKEC-UHFFFAOYSA-N 0 1 391.200 3.186 10 0 GGAEMN CC[C@@H](CO)N1CCN(Cc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000474267235 567154160 /nfs/dbraw/zinc/15/41/60/567154160.db2.gz PGPLTXGKTBAXEL-AWEZNQCLSA-N 0 1 395.263 3.356 10 0 GGAEMN O=C(Cc1cscc1Br)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000498209167 567158090 /nfs/dbraw/zinc/15/80/90/567158090.db2.gz WUGWXGXZPRJUKK-CQSZACIVSA-N 0 1 377.267 3.077 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC(N3CCOC[C@@H]3C)CC2)c(Br)c1 ZINC000615083546 567158301 /nfs/dbraw/zinc/15/83/01/567158301.db2.gz IZMADPCTNACJTM-HNNXBMFYSA-N 0 1 395.341 3.012 10 0 GGAEMN O=C(CCOc1cccc(Br)c1)Nc1cnn(-c2ccncc2)c1 ZINC000589132294 567158651 /nfs/dbraw/zinc/15/86/51/567158651.db2.gz IMNRLVWQFJRZTC-UHFFFAOYSA-N 0 1 387.237 3.437 10 0 GGAEMN C[C@@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)[C@H](C)[C@@H](C)O1 ZINC000474330802 567159108 /nfs/dbraw/zinc/15/91/08/567159108.db2.gz LBCPSCIEQZPCTH-IJLUTSLNSA-N 0 1 378.270 3.477 10 0 GGAEMN C[C@@H](CNC(=O)c1cnccc1N(C)C)Oc1ccc(Br)cc1 ZINC000546796194 567159718 /nfs/dbraw/zinc/15/97/18/567159718.db2.gz SZJDVNGFLRLKIH-LBPRGKRZSA-N 0 1 378.270 3.107 10 0 GGAEMN CCN(CCOc1ccc(Br)cc1)C(=O)c1cnccc1N(C)C ZINC000546797088 567159795 /nfs/dbraw/zinc/15/97/95/567159795.db2.gz RNTFCTAUOFYFRI-UHFFFAOYSA-N 0 1 392.297 3.451 10 0 GGAEMN Cc1nc(C)c(CN2CCC[C@@H](C(=O)Nc3ccc(Br)cn3)C2)o1 ZINC000683898292 567160308 /nfs/dbraw/zinc/16/03/08/567160308.db2.gz LVILUPZPHNVGJC-CYBMUJFWSA-N 0 1 393.285 3.300 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(OC)c(F)c2)c(C(F)(F)F)n1 ZINC000683902102 567161087 /nfs/dbraw/zinc/16/10/87/567161087.db2.gz PHWVRALHXJJQQG-UHFFFAOYSA-N 0 1 380.319 3.058 10 0 GGAEMN Cc1cccc([C@@H]2C(=O)NCCN2Cc2nc3ccc(Br)cc3[nH]2)c1 ZINC000566486984 567161192 /nfs/dbraw/zinc/16/11/92/567161192.db2.gz MDZUNAWLRWQUOE-GOSISDBHSA-N 0 1 399.292 3.307 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)c1cnccc1N(C)C ZINC000546830442 567162975 /nfs/dbraw/zinc/16/29/75/567162975.db2.gz JVOMYMZKDPUABA-LLVKDONJSA-N 0 1 380.261 3.410 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1C[C@@H](OC)C[C@@H]1CC(=O)[O-] ZINC000566566413 567168469 /nfs/dbraw/zinc/16/84/69/567168469.db2.gz IKWGZXCEUVCBLD-CABCVRRESA-N 0 1 386.286 3.302 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)Nc1ccc2n[nH]nc2c1 ZINC000474413572 567168448 /nfs/dbraw/zinc/16/84/48/567168448.db2.gz RQJYMCUURLRNPO-UHFFFAOYSA-N 0 1 381.255 3.138 10 0 GGAEMN O=C(CCOc1cccc(Cl)c1Cl)N1CCN(C2CCOCC2)CC1 ZINC000474460632 567173370 /nfs/dbraw/zinc/17/33/70/567173370.db2.gz SPFLFRHVTGWEAF-UHFFFAOYSA-N 0 1 387.307 3.086 10 0 GGAEMN C[C@@H]1CC[C@@H](CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000474446354 567173612 /nfs/dbraw/zinc/17/36/12/567173612.db2.gz BFMXTUAHBNZYIG-VXGBXAGGSA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@@H]1CC[C@@H](CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000474446354 567173620 /nfs/dbraw/zinc/17/36/20/567173620.db2.gz BFMXTUAHBNZYIG-VXGBXAGGSA-N 0 1 392.301 3.470 10 0 GGAEMN CN1CC[C@@H](NC(=O)c2cn3ccc(Br)cc3n2)[C@@H]1c1ccccc1 ZINC000566635556 567174304 /nfs/dbraw/zinc/17/43/04/567174304.db2.gz GREPLGCNHIULDW-QAPCUYQASA-N 0 1 399.292 3.272 10 0 GGAEMN CSc1cc(Br)ccc1C(=O)N1CCOC[C@H]1[C@H]1CCC[N@H+]1C ZINC000615274783 567174660 /nfs/dbraw/zinc/17/46/60/567174660.db2.gz KEHXJHFNWOCKJG-CABCVRRESA-N 0 1 399.354 3.106 10 0 GGAEMN O=C(CNCc1ccc(Br)cc1C(F)(F)F)NCc1ccco1 ZINC000474474133 567174916 /nfs/dbraw/zinc/17/49/16/567174916.db2.gz QZBZNNUCEIRUOO-UHFFFAOYSA-N 0 1 391.187 3.467 10 0 GGAEMN C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277545 567175580 /nfs/dbraw/zinc/17/55/80/567175580.db2.gz WLSULDHXXSAZRS-JFTQMJAMSA-N 0 1 383.319 3.419 10 0 GGAEMN Cc1cccc2nc(CNC(=O)COc3ccc(F)cc3Br)[nH]c21 ZINC000498398411 567176447 /nfs/dbraw/zinc/17/64/47/567176447.db2.gz DKDQDCQEGXOWKC-UHFFFAOYSA-N 0 1 392.228 3.468 10 0 GGAEMN O=C(NCc1n[nH]c(COc2ccccc2)n1)c1csc(Br)c1 ZINC000474597437 567180763 /nfs/dbraw/zinc/18/07/63/567180763.db2.gz WTWRNEWKHNQKBW-UHFFFAOYSA-N 0 1 393.266 3.138 10 0 GGAEMN O=C(NC[C@@H]1COc2ccccc2O1)c1cn[nH]c1-c1ccc(Cl)s1 ZINC000474593562 567181262 /nfs/dbraw/zinc/18/12/62/567181262.db2.gz CDUIVZIAFWZMRF-SNVBAGLBSA-N 0 1 375.837 3.361 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC[C@@H](C2CC2)C1 ZINC000589526506 567181506 /nfs/dbraw/zinc/18/15/06/567181506.db2.gz PPYKEJPBQNJZRE-LLVKDONJSA-N 0 1 395.244 3.430 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(Br)cc(N3CCCC3)c2)C[C@H](C)N1C ZINC000615370597 567182310 /nfs/dbraw/zinc/18/23/10/567182310.db2.gz RBLYHESVTNFUFX-OKILXGFUSA-N 0 1 380.330 3.214 10 0 GGAEMN O=C(NCCc1ccc(Br)cc1Cl)[C@@H]1CCc2[nH]cnc2C1 ZINC000615406101 567183188 /nfs/dbraw/zinc/18/31/88/567183188.db2.gz MJXIHLUMBKIINW-LLVKDONJSA-N 0 1 382.689 3.289 10 0 GGAEMN O=C(Nc1nc(CC(F)(F)F)cs1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000615410914 567183630 /nfs/dbraw/zinc/18/36/30/567183630.db2.gz QKIYUGYJGOWPTF-BDAKNGLRSA-N 0 1 392.321 3.170 10 0 GGAEMN C[C@@H](NC[C@H](O)COc1ccccc1Br)c1cn2ccccc2n1 ZINC000566746831 567184305 /nfs/dbraw/zinc/18/43/05/567184305.db2.gz AXKOAELMGLXIRK-KGLIPLIRSA-N 0 1 390.281 3.187 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2c(F)ccc(Br)c2C1 ZINC000615453604 567185332 /nfs/dbraw/zinc/18/53/32/567185332.db2.gz NYRSKJMPMSOOJC-JTQLQIEISA-N 0 1 378.245 3.001 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C[C@H]1C ZINC000498567223 567186042 /nfs/dbraw/zinc/18/60/42/567186042.db2.gz MSCVLSJJTBSYIQ-NEPJUHHUSA-N 0 1 392.297 3.258 10 0 GGAEMN COc1ccc(CN2CCCC[C@@H]2CN2CCOCC2)c(Br)c1 ZINC000566764057 567187289 /nfs/dbraw/zinc/18/72/89/567187289.db2.gz BKAIIJSVAFNODR-MRXNPFEDSA-N 0 1 383.330 3.144 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@H]1C ZINC000498570880 567188275 /nfs/dbraw/zinc/18/82/75/567188275.db2.gz HVZZHORZYGJVHJ-CHWSQXEVSA-N 0 1 386.277 3.154 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@H]1C ZINC000498570881 567188621 /nfs/dbraw/zinc/18/86/21/567188621.db2.gz HVZZHORZYGJVHJ-OLZOCXBDSA-N 0 1 386.277 3.154 10 0 GGAEMN COC(=O)c1cccc(Br)c1CN1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000432776548 567190344 /nfs/dbraw/zinc/19/03/44/567190344.db2.gz PBVPFOJLGLHQAR-UONOGXRCSA-N 0 1 382.298 3.484 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000659250338 567194846 /nfs/dbraw/zinc/19/48/46/567194846.db2.gz KFJNHSFYUSMVAY-ZWKOTPCHSA-N 0 1 391.309 3.407 10 0 GGAEMN CC1=CCN(CCNC(=O)NCCc2ccc(F)c(Br)c2)CC1 ZINC000547273399 567195193 /nfs/dbraw/zinc/19/51/93/567195193.db2.gz WAKJRPKCIRZQJL-UHFFFAOYSA-N 0 1 384.293 3.082 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)Nc1nc(-c2cccc(Br)c2)cs1 ZINC000659263353 567196655 /nfs/dbraw/zinc/19/66/55/567196655.db2.gz WZAFTQBPTVZJGJ-LBPRGKRZSA-N 0 1 384.299 3.263 10 0 GGAEMN CC(C)(C)c1nc(CN2CCN(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000432833877 567196835 /nfs/dbraw/zinc/19/68/35/567196835.db2.gz YZSDWDCBURHZLT-UHFFFAOYSA-N 0 1 392.345 3.183 10 0 GGAEMN CCc1ncc(S(=O)(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000547304189 567198745 /nfs/dbraw/zinc/19/87/45/567198745.db2.gz FZYGININFQFALL-WBMJQRKESA-N 0 1 385.580 3.128 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)c(OC)c1OC ZINC000589939772 567199806 /nfs/dbraw/zinc/19/98/06/567199806.db2.gz OZIMYVAUJYYNSW-UHFFFAOYSA-N 0 1 375.805 3.306 10 0 GGAEMN COc1ccccc1-c1n[nH]c(NC(=O)Cc2cscc2Br)n1 ZINC000432894976 567202677 /nfs/dbraw/zinc/20/26/77/567202677.db2.gz YVDOPWURPXTVIQ-UHFFFAOYSA-N 0 1 393.266 3.486 10 0 GGAEMN O=C(Nc1cnoc1)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1 ZINC000590036080 567204096 /nfs/dbraw/zinc/20/40/96/567204096.db2.gz LNSQGCJDMSLEAU-UHFFFAOYSA-N 0 1 377.809 3.381 10 0 GGAEMN CN1CCN(c2ccc(Br)cc2NC(=O)CCC(F)F)CC1 ZINC000684410963 567205507 /nfs/dbraw/zinc/20/55/07/567205507.db2.gz OLVPKTMKSLFKPE-UHFFFAOYSA-N 0 1 376.245 3.185 10 0 GGAEMN COCCN1CCC[C@H](NC(=O)c2cc(F)c(Br)cc2Cl)C1 ZINC000684435283 567207632 /nfs/dbraw/zinc/20/76/32/567207632.db2.gz SPOBXFMKVZMEHL-JTQLQIEISA-N 0 1 393.684 3.082 10 0 GGAEMN COCCN1CCC[C@@H](NC(=O)c2cc(F)c(Br)cc2Cl)C1 ZINC000684435284 567207697 /nfs/dbraw/zinc/20/76/97/567207697.db2.gz SPOBXFMKVZMEHL-SNVBAGLBSA-N 0 1 393.684 3.082 10 0 GGAEMN CC(C)n1nccc1CNCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000474896410 567208146 /nfs/dbraw/zinc/20/81/46/567208146.db2.gz QDDFUAQBZWAEIY-UHFFFAOYSA-N 0 1 375.274 3.301 10 0 GGAEMN CC(C)n1nccc1CNCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000474896410 567208153 /nfs/dbraw/zinc/20/81/53/567208153.db2.gz QDDFUAQBZWAEIY-UHFFFAOYSA-N 0 1 375.274 3.301 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1csc(-c2cccc(Cl)c2)n1 ZINC000590122578 567210119 /nfs/dbraw/zinc/21/01/19/567210119.db2.gz OYGPAXMXKHVWEY-OAHLLOKOSA-N 0 1 379.913 3.304 10 0 GGAEMN O=C(N[C@@H]1CCc2c1ccc(F)c2Br)[C@H]1CCc2[nH]cnc2C1 ZINC000615871002 567211599 /nfs/dbraw/zinc/21/15/99/567211599.db2.gz IGLFMJKQUCXZOZ-TVQRCGJNSA-N 0 1 378.245 3.220 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)s1 ZINC000432967046 567211666 /nfs/dbraw/zinc/21/16/66/567211666.db2.gz NWRHIJWXFZRJJH-LBPRGKRZSA-N 0 1 397.371 3.098 10 0 GGAEMN CN(C)[C@H](CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccc(Cl)cc1 ZINC000547474557 567213802 /nfs/dbraw/zinc/21/38/02/567213802.db2.gz BAHFYDFWNMFEKP-JKSUJKDBSA-N 0 1 378.929 3.184 10 0 GGAEMN CN1CCC[C@@H]1C(=O)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000474961700 567214203 /nfs/dbraw/zinc/21/42/03/567214203.db2.gz HRHFROXOFAUWSB-QZTJIDSGSA-N 0 1 388.309 3.338 10 0 GGAEMN CC(C)[C@@H](C)CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000524800939 567215432 /nfs/dbraw/zinc/21/54/32/567215432.db2.gz MJNKEHDQKZVRLP-NSHDSACASA-N 0 1 380.290 3.326 10 0 GGAEMN CC(C)[C@@H](C)CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000524800939 567215440 /nfs/dbraw/zinc/21/54/40/567215440.db2.gz MJNKEHDQKZVRLP-NSHDSACASA-N 0 1 380.290 3.326 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@H]2CCOc3ccc(Br)cc32)C[C@@H]1C ZINC000498977172 567216379 /nfs/dbraw/zinc/21/63/79/567216379.db2.gz XYCDKCKEKXQBFH-XEZPLFJOSA-N 0 1 396.329 3.397 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NS(=O)(=O)c2ccc3nc(C)sc3c2)n[nH]1 ZINC000567101073 567218368 /nfs/dbraw/zinc/21/83/68/567218368.db2.gz SSSYUSHTVYTVGR-ZJUUUORDSA-N 0 1 379.511 3.276 10 0 GGAEMN C[C@@H](c1cccc(Cl)c1F)N(C)CCOc1ccc(S(N)(=O)=O)cc1 ZINC000433063039 567219116 /nfs/dbraw/zinc/21/91/16/567219116.db2.gz WIIXHILBECUGID-LBPRGKRZSA-N 0 1 386.876 3.198 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccnc(SC)c2)c(Br)c1 ZINC000684608465 567220893 /nfs/dbraw/zinc/22/08/93/567220893.db2.gz QZYUTVYVQRWPND-UHFFFAOYSA-N 0 1 389.296 3.375 10 0 GGAEMN CN(CC[N@@H+](C)C1CCCCC1)C(=O)Cc1ccc(Br)cc1O ZINC000433110277 567223495 /nfs/dbraw/zinc/22/34/95/567223495.db2.gz OOBQMOQCZHMZGU-UHFFFAOYSA-N 0 1 383.330 3.420 10 0 GGAEMN O=C([O-])[C@@H](C1CC1)[N@@H+]1CCc2cc(Br)c(Br)cc2C1 ZINC000659803135 567226214 /nfs/dbraw/zinc/22/62/14/567226214.db2.gz DFLDMMRJOABQRN-CYBMUJFWSA-N 0 1 389.087 3.433 10 0 GGAEMN O=C([O-])[C@@H](C1CC1)[N@H+]1CCc2cc(Br)c(Br)cc2C1 ZINC000659803135 567226218 /nfs/dbraw/zinc/22/62/18/567226218.db2.gz DFLDMMRJOABQRN-CYBMUJFWSA-N 0 1 389.087 3.433 10 0 GGAEMN Cc1cc([C@@H]2CCCN2C[C@@H](O)COC[C@H]2CCCO2)ccc1Br ZINC000684668080 567226637 /nfs/dbraw/zinc/22/66/37/567226637.db2.gz AGXZLNZEZPDCOU-LMMKCTJWSA-N 0 1 398.341 3.451 10 0 GGAEMN Cc1cc([C@@H]2CCCN2C[C@H](O)COC[C@@H]2CCCO2)ccc1Br ZINC000684668081 567227221 /nfs/dbraw/zinc/22/72/21/567227221.db2.gz AGXZLNZEZPDCOU-LNLFQRSKSA-N 0 1 398.341 3.451 10 0 GGAEMN CO[C@H]1CN(Cc2ccc(Br)cc2N2CCOCC2)CC[C@@H]1C ZINC000475127658 567227423 /nfs/dbraw/zinc/22/74/23/567227423.db2.gz DEGWVSDTPWPFTH-KSSFIOAISA-N 0 1 383.330 3.143 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(C(=O)c3cccc(Cl)c3Cl)CC2)n[nH]1 ZINC000659843622 567230502 /nfs/dbraw/zinc/23/05/02/567230502.db2.gz XBDWVPLRCJUCRO-NSHDSACASA-N 0 1 382.295 3.193 10 0 GGAEMN CCc1nc([C@H](C)N(C)CC(=O)Nc2ccc(Br)cc2C)n[nH]1 ZINC000659832831 567230594 /nfs/dbraw/zinc/23/05/94/567230594.db2.gz BUYKZZNIGQMADQ-NSHDSACASA-N 0 1 380.290 3.070 10 0 GGAEMN CC[C@@H]1CN(CC)CCN1C(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000455078705 567231469 /nfs/dbraw/zinc/23/14/69/567231469.db2.gz RVQZRTOKSIJORX-CYBMUJFWSA-N 0 1 398.301 3.184 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(C(=O)c3c(Cl)cccc3Cl)CC2)n[nH]1 ZINC000659854073 567232436 /nfs/dbraw/zinc/23/24/36/567232436.db2.gz WIKZDKJMRXRBOB-NSHDSACASA-N 0 1 382.295 3.193 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(C(=O)c3c(Cl)cccc3Cl)CC2)n[nH]1 ZINC000659854072 567232658 /nfs/dbraw/zinc/23/26/58/567232658.db2.gz WIKZDKJMRXRBOB-LLVKDONJSA-N 0 1 382.295 3.193 10 0 GGAEMN CO[C@H](CN1CCN(C(=O)c2ccc(Br)cc2)CC1)C1CCC1 ZINC000659869488 567233368 /nfs/dbraw/zinc/23/33/68/567233368.db2.gz WAJTYGMMBCMRSO-QGZVFWFLSA-N 0 1 381.314 3.022 10 0 GGAEMN O=C1[C@@H](N2CCC[C@@]3(CCCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433266214 567237916 /nfs/dbraw/zinc/23/79/16/567237916.db2.gz RSYNHZGRHNBFAG-PKOBYXMFSA-N 0 1 393.325 3.447 10 0 GGAEMN O=C1[C@H](N2CCC[C@@]3(CCCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433266212 567238706 /nfs/dbraw/zinc/23/87/06/567238706.db2.gz RSYNHZGRHNBFAG-IEBWSBKVSA-N 0 1 393.325 3.447 10 0 GGAEMN O=C1[C@H](N2CCC[C@]3(CCCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433266213 567239046 /nfs/dbraw/zinc/23/90/46/567239046.db2.gz RSYNHZGRHNBFAG-MJGOQNOKSA-N 0 1 393.325 3.447 10 0 GGAEMN CC1(C)CCc2sc(NC(=O)C(C[C@H]3COCCO3)C(F)(F)F)nc21 ZINC000616372766 567241280 /nfs/dbraw/zinc/24/12/80/567241280.db2.gz WHAOCIJKLQBIKL-VHSXEESVSA-N 0 1 378.416 3.289 10 0 GGAEMN CN(CCNC(=O)Cc1ccc(Br)cc1O)Cc1ccc(F)cc1 ZINC000547749479 567243538 /nfs/dbraw/zinc/24/35/38/567243538.db2.gz BTVOYUAUGDAHCC-UHFFFAOYSA-N 0 1 395.272 3.085 10 0 GGAEMN C[C@@H]1[C@H](C(F)(F)F)CCN1Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000547771103 567245091 /nfs/dbraw/zinc/24/50/91/567245091.db2.gz QZNBEPGZAPCQPH-BXKDBHETSA-N 0 1 390.203 3.230 10 0 GGAEMN Brc1ccc2oc(CN[C@@H]3CCCN(c4ncccn4)C3)nc2c1 ZINC000638379461 567246768 /nfs/dbraw/zinc/24/67/68/567246768.db2.gz CTMLULUDIBQUEU-CYBMUJFWSA-N 0 1 388.269 3.139 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000660010856 567247502 /nfs/dbraw/zinc/24/75/02/567247502.db2.gz QTNMQUMUOWGREX-ZDUSSCGKSA-N 0 1 378.318 3.008 10 0 GGAEMN Cc1c(Br)ccc(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c1F ZINC000433389732 567247883 /nfs/dbraw/zinc/24/78/83/567247883.db2.gz XYPVMCHHHWAELR-UHFFFAOYSA-N 0 1 391.200 3.124 10 0 GGAEMN NS(=O)(=O)c1cc(CNC2(c3ccc(Br)cc3)CCCC2)co1 ZINC000660032610 567250683 /nfs/dbraw/zinc/25/06/83/567250683.db2.gz NFEPKGNKOANAKJ-UHFFFAOYSA-N 0 1 399.310 3.249 10 0 GGAEMN CC(C)[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C1(CO)CCC1 ZINC000567523054 567252713 /nfs/dbraw/zinc/25/27/13/567252713.db2.gz JJNFNFRWYGQBBZ-HNNXBMFYSA-N 0 1 380.286 3.242 10 0 GGAEMN CCc1ccc([C@@H]2CNCCN2C(=O)c2cc(Br)cn2C)cc1 ZINC000567604812 567261495 /nfs/dbraw/zinc/26/14/95/567261495.db2.gz FPGJFFINWJXYBE-KRWDZBQOSA-N 0 1 376.298 3.137 10 0 GGAEMN Ic1ccc(CN2CCC[C@H]2CNCc2cocn2)cc1 ZINC000475631983 567263468 /nfs/dbraw/zinc/26/34/68/567263468.db2.gz CYQNUACQFAXLFN-INIZCTEOSA-N 0 1 397.260 3.033 10 0 GGAEMN C[C@@H]1C[C@H]1CNS(=O)(=O)c1scc(Br)c1Br ZINC000433639833 567264077 /nfs/dbraw/zinc/26/40/77/567264077.db2.gz OICYXYCRQTUFGR-RITPCOANSA-N 0 1 389.134 3.207 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@@H](c2ccco2)N2CCCC2)c1Br ZINC000525845758 567268482 /nfs/dbraw/zinc/26/84/82/567268482.db2.gz YIKPOSZLIOBCPI-AWEZNQCLSA-N 0 1 393.285 3.126 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@H](c2cccs2)N(C)C)c1Br ZINC000525847203 567269652 /nfs/dbraw/zinc/26/96/52/567269652.db2.gz KKHFRSOQMTUNKT-GFCCVEGCSA-N 0 1 383.315 3.060 10 0 GGAEMN O=C(NCc1cc(Cl)cc(Br)c1)N[C@H]1CCc2nc[nH]c2C1 ZINC000567708054 567270561 /nfs/dbraw/zinc/27/05/61/567270561.db2.gz RCFWXYWMGNMNQZ-LBPRGKRZSA-N 0 1 383.677 3.182 10 0 GGAEMN C/C(=C/c1cccc(C(F)(F)F)c1)CN1CCC(NS(C)(=O)=O)CC1 ZINC000685409127 567271578 /nfs/dbraw/zinc/27/15/78/567271578.db2.gz LGMPTRWMFJBZGL-RAXLEYEMSA-N 0 1 376.444 3.122 10 0 GGAEMN CN(c1nc(CSc2nc(O)cc(=O)n2C2CCCC2)cs1)C1CC1 ZINC000475756738 567272741 /nfs/dbraw/zinc/27/27/41/567272741.db2.gz QAADMYSIHGLMIF-UHFFFAOYSA-N 0 1 378.523 3.411 10 0 GGAEMN CN(C(=O)c1cccc2nn[nH]c21)[C@H]1CCOc2ccc(Br)cc21 ZINC000525873826 567273304 /nfs/dbraw/zinc/27/33/04/567273304.db2.gz NVUNOZZUCYKKCV-AWEZNQCLSA-N 0 1 387.237 3.316 10 0 GGAEMN CN(C)S(=O)(=O)[C@H]1CCCN(Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000685437127 567276050 /nfs/dbraw/zinc/27/60/50/567276050.db2.gz NAOJBPKLFRSOEC-KRWDZBQOSA-N 0 1 382.526 3.410 10 0 GGAEMN CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000685437128 567276295 /nfs/dbraw/zinc/27/62/95/567276295.db2.gz NAOJBPKLFRSOEC-QGZVFWFLSA-N 0 1 382.526 3.410 10 0 GGAEMN Cc1sc2ncnc(SCC(=O)NC[C@@H]3CCN3C(C)(C)C)c2c1C ZINC000617020384 567276754 /nfs/dbraw/zinc/27/67/54/567276754.db2.gz AJORPPQLXWPLHW-ZDUSSCGKSA-N 0 1 378.567 3.389 10 0 GGAEMN CCc1nc([C@H](C)N[C@H](C)c2cc3c(cc2Br)OCCO3)n[nH]1 ZINC000660189153 567278454 /nfs/dbraw/zinc/27/84/54/567278454.db2.gz XZGUODJJYTWVQM-ZJUUUORDSA-N 0 1 381.274 3.313 10 0 GGAEMN NS(=O)(=O)c1cc(CN[C@H](c2ccc(Br)cc2)C2CCC2)co1 ZINC000660191312 567279079 /nfs/dbraw/zinc/27/90/79/567279079.db2.gz ZSTIMLUKNQFLEK-INIZCTEOSA-N 0 1 399.310 3.321 10 0 GGAEMN CC(C)[C@H]1CN(C)CCN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000499880701 567279443 /nfs/dbraw/zinc/27/94/43/567279443.db2.gz PSBNJBXDQSGYIY-CQSZACIVSA-N 0 1 375.257 3.068 10 0 GGAEMN CO[C@@H](C(=O)Nc1nc2ccc(Br)cc2[nH]1)c1ccc(O)cc1 ZINC000499871781 567279624 /nfs/dbraw/zinc/27/96/24/567279624.db2.gz DTZVZECJHHXSHX-CQSZACIVSA-N 0 1 376.210 3.357 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N1CCSC[C@@H]1c1nccs1)C2 ZINC000526014133 567283308 /nfs/dbraw/zinc/28/33/08/567283308.db2.gz WOHMVCOYAZFPGQ-SWLSCSKDSA-N 0 1 376.551 3.411 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCSC[C@H]1c1nccs1)C2 ZINC000526014131 567283633 /nfs/dbraw/zinc/28/36/33/567283633.db2.gz WOHMVCOYAZFPGQ-DOMZBBRYSA-N 0 1 376.551 3.411 10 0 GGAEMN COc1ccc([C@@H](C)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)c(Cl)c1 ZINC000567857558 567285113 /nfs/dbraw/zinc/28/51/13/567285113.db2.gz IOLXIQUWAKPEFI-TZMCWYRMSA-N 0 1 381.881 3.234 10 0 GGAEMN COc1ccccc1[C@H](CO)NCc1nc2ccc(Br)cc2[nH]1 ZINC000548158729 567285477 /nfs/dbraw/zinc/28/54/77/567285477.db2.gz IZUVIRVKYUQORB-HNNXBMFYSA-N 0 1 376.254 3.157 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@@H](c2ccsc2)N(C)C)C[C@H](CC(F)(F)F)O1 ZINC000660313413 567287299 /nfs/dbraw/zinc/28/72/99/567287299.db2.gz XTXROTCKBFWPNV-XBFCOCLRSA-N 0 1 379.448 3.102 10 0 GGAEMN CN(C)[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)c1cccs1 ZINC000499950620 567287788 /nfs/dbraw/zinc/28/77/88/567287788.db2.gz QZCVFMXFMPJIHT-CYBMUJFWSA-N 0 1 393.310 3.420 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@@H](c2ccc(F)cc2)N(C)C)c1Br ZINC000526095501 567291223 /nfs/dbraw/zinc/29/12/23/567291223.db2.gz WHHUIHGSPRXVLM-HNNXBMFYSA-N 0 1 395.276 3.138 10 0 GGAEMN Cc1nccc(NC(=O)NCc2ccc(F)c(CN(C)C)c2)c1Br ZINC000526097009 567291501 /nfs/dbraw/zinc/29/15/01/567291501.db2.gz VIUZBEPQQBFMCU-UHFFFAOYSA-N 0 1 395.276 3.097 10 0 GGAEMN Clc1cc(Br)cnc1CN[C@H]1CCCC[C@@H]1N1CCOCC1 ZINC000660387516 567292257 /nfs/dbraw/zinc/29/22/57/567292257.db2.gz KEUMBSWFCATIDH-HOCLYGCPSA-N 0 1 388.737 3.231 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N1CCc2ccc(Cl)c(Cl)c2C1 ZINC000660402021 567293092 /nfs/dbraw/zinc/29/30/92/567293092.db2.gz AVHKGWHFABPGGF-UHFFFAOYSA-N 0 1 386.323 3.174 10 0 GGAEMN CC[C@H]1[C@@H](C)CCN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000476061582 567294167 /nfs/dbraw/zinc/29/41/67/567294167.db2.gz MKUCJWMDSRCHEF-ZANVPECISA-N 0 1 383.233 3.428 10 0 GGAEMN CC[C@H]1[C@H](C)CCN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000476061580 567294653 /nfs/dbraw/zinc/29/46/53/567294653.db2.gz MKUCJWMDSRCHEF-RNCFNFMXSA-N 0 1 383.233 3.428 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H](c1nccs1)C(F)(F)F)c1ccsc1 ZINC000455664995 567294619 /nfs/dbraw/zinc/29/46/19/567294619.db2.gz USPWVUZBZKGRBE-GHMZBOCLSA-N 0 1 378.445 3.410 10 0 GGAEMN Cc1sc(CNC(=O)N(C)CC2CN(C)C2)nc1-c1ccc(Cl)cc1 ZINC000660457086 567297490 /nfs/dbraw/zinc/29/74/90/567297490.db2.gz VOEAOZUZJQJAOY-UHFFFAOYSA-N 0 1 378.929 3.475 10 0 GGAEMN O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)c1csc(Br)c1 ZINC000591806235 567298027 /nfs/dbraw/zinc/29/80/27/567298027.db2.gz APKJBWRNWLAAFE-UHFFFAOYSA-N 0 1 381.230 3.365 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(F)cc2)n1)c1csc(Br)c1 ZINC000591806235 567298034 /nfs/dbraw/zinc/29/80/34/567298034.db2.gz APKJBWRNWLAAFE-UHFFFAOYSA-N 0 1 381.230 3.365 10 0 GGAEMN C[S@](=O)c1ccc(C(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)cc1 ZINC000591801572 567298205 /nfs/dbraw/zinc/29/82/05/567298205.db2.gz UBWIWBRSMZSKLK-VWLOTQADSA-N 0 1 377.535 3.289 10 0 GGAEMN C[C@@H](c1ccccc1)[C@@H](CO)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000685816697 567299174 /nfs/dbraw/zinc/29/91/74/567299174.db2.gz OTUFMPQBAOZAGM-MEDUHNTESA-N 0 1 388.265 3.220 10 0 GGAEMN O=C1N[C@@H]2CCCC[C@@H]2C[C@@H]1N[C@@H]1CCOc2c(Br)cccc21 ZINC000660481608 567299705 /nfs/dbraw/zinc/29/97/05/567299705.db2.gz SFIXOJMLXGBNFF-MPESAESLSA-N 0 1 379.298 3.310 10 0 GGAEMN CSc1ccc(Cl)c(NC(=O)c2cccc(N3CCN(C)CC3)n2)c1 ZINC000617360833 567301420 /nfs/dbraw/zinc/30/14/20/567301420.db2.gz GWSZJLVTYFFUSU-UHFFFAOYSA-N 0 1 376.913 3.461 10 0 GGAEMN CC[C@H](CO)N1CCN(Cc2cc(C(F)(F)F)ccc2Br)CC1 ZINC000685838665 567302826 /nfs/dbraw/zinc/30/28/26/567302826.db2.gz UFKNEBWHEBXLFA-CQSZACIVSA-N 0 1 395.263 3.356 10 0 GGAEMN CC[C@@H](CO)N1CCN(Cc2cc(C(F)(F)F)ccc2Br)CC1 ZINC000685838664 567302932 /nfs/dbraw/zinc/30/29/32/567302932.db2.gz UFKNEBWHEBXLFA-AWEZNQCLSA-N 0 1 395.263 3.356 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000568074509 567303111 /nfs/dbraw/zinc/30/31/11/567303111.db2.gz KTHXGFKLXVIIPL-KBPBESRZSA-N 0 1 395.253 3.168 10 0 GGAEMN OCC[C@@H]1CCCCCN1Cc1cn(-c2ccccc2Br)nn1 ZINC000685846865 567304147 /nfs/dbraw/zinc/30/41/47/567304147.db2.gz RPCUVHMDPLCFCK-HNNXBMFYSA-N 0 1 379.302 3.157 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@@H](C)c3cn[nH]c3)C2=O)ccc1Br ZINC000548298576 567305914 /nfs/dbraw/zinc/30/59/14/567305914.db2.gz MSNYZLQTIXPITM-LRDDRELGSA-N 0 1 377.286 3.327 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(Oc3ccc(Br)cc3)nc2)C1 ZINC000617415853 567306785 /nfs/dbraw/zinc/30/67/85/567306785.db2.gz RWFXHRRDJAEPDP-HNNXBMFYSA-N 0 1 390.281 3.460 10 0 GGAEMN CCCOc1c(Br)cc(C(=O)N[C@@H]2CCCN(C)C2)cc1OC ZINC000617411572 567306871 /nfs/dbraw/zinc/30/68/71/567306871.db2.gz ORIKEJBREBDRMJ-CYBMUJFWSA-N 0 1 385.302 3.071 10 0 GGAEMN Cn1cc2c(n1)CCC[C@H]2NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000527066540 567311081 /nfs/dbraw/zinc/31/10/81/567311081.db2.gz ITSQTZCIINILBI-CQSZACIVSA-N 0 1 387.285 3.135 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NC[C@@H](C)CC(F)F ZINC000592066859 567311493 /nfs/dbraw/zinc/31/14/93/567311493.db2.gz ICENDITVVGZQGH-ZETCQYMHSA-N 0 1 390.235 3.350 10 0 GGAEMN CCc1nc([C@@H](C)N[C@H](C)c2ccc(Br)cc2OCCCO)n[nH]1 ZINC000660595014 567311622 /nfs/dbraw/zinc/31/16/22/567311622.db2.gz BKNRRFNSNRSUIX-VXGBXAGGSA-N 0 1 397.317 3.303 10 0 GGAEMN CCc1nc([C@@H](C)N[C@@H](C)c2ccc(Br)cc2OCCCO)n[nH]1 ZINC000660595012 567311716 /nfs/dbraw/zinc/31/17/16/567311716.db2.gz BKNRRFNSNRSUIX-NWDGAFQWSA-N 0 1 397.317 3.303 10 0 GGAEMN C[C@@H](NCCc1ccc2c(c1)OC(F)(F)O2)c1ncc(Br)cn1 ZINC000660624508 567313001 /nfs/dbraw/zinc/31/30/01/567313001.db2.gz ANYUEEKXDRSOMQ-SECBINFHSA-N 0 1 386.196 3.454 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000476311307 567313397 /nfs/dbraw/zinc/31/33/97/567313397.db2.gz WYYDPZYKSVJEOD-NSHDSACASA-N 0 1 381.217 3.381 10 0 GGAEMN COCCN1CCC[C@@H](NC(=O)CSc2cccc(C(F)(F)F)c2)C1 ZINC000592096582 567314786 /nfs/dbraw/zinc/31/47/86/567314786.db2.gz BXQGSIXDLMMIBF-CQSZACIVSA-N 0 1 376.444 3.025 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2nc3ccc(F)cc3s2)[C@@H]1SC ZINC000592174238 567319661 /nfs/dbraw/zinc/31/96/61/567319661.db2.gz JEPOVANDOWGCOA-FWHFQCOYSA-N 0 1 383.514 3.261 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2nc3ccc(Br)cc3n2C)[C@@H]1SC ZINC000592173399 567319717 /nfs/dbraw/zinc/31/97/17/567319717.db2.gz SCAOGWXDTFDRSE-XPKDYRNWSA-N 0 1 384.343 3.334 10 0 GGAEMN CCN(C(=O)c1nc(C)n(-c2c(Cl)cccc2Cl)n1)[C@@H]1CCN(C)C1 ZINC000617556549 567321110 /nfs/dbraw/zinc/32/11/10/567321110.db2.gz SKRFBWXEFCHEFE-GFCCVEGCSA-N 0 1 382.295 3.049 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3cc(Br)cc(F)c3C2)n[nH]1 ZINC000527226246 567322243 /nfs/dbraw/zinc/32/22/43/567322243.db2.gz DEYDFEBRPMXHQW-JTQLQIEISA-N 0 1 395.276 3.319 10 0 GGAEMN CCN(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)[C@@H]1CCN(C)C1 ZINC000617560164 567323513 /nfs/dbraw/zinc/32/35/13/567323513.db2.gz IWRPKSHVKFFBLH-CQSZACIVSA-N 0 1 380.901 3.035 10 0 GGAEMN Brc1ccc2nc(CN3CCC[C@H](n4ccnn4)CC3)[nH]c2c1 ZINC000639816032 567325068 /nfs/dbraw/zinc/32/50/68/567325068.db2.gz BSJWKHQVZMVVKR-ZDUSSCGKSA-N 0 1 375.274 3.144 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(F)cc2I)[C@@H]1SC ZINC000592376701 567334052 /nfs/dbraw/zinc/33/40/52/567334052.db2.gz FFFMVNSIGZDAHV-MCIONIFRSA-N 0 1 395.281 3.429 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 ZINC000617776349 567334495 /nfs/dbraw/zinc/33/44/95/567334495.db2.gz QOBSJXWXYBAQOP-CYBMUJFWSA-N 0 1 379.291 3.485 10 0 GGAEMN C[C@H]1[C@H](NC(=O)c2ncsc2Br)CCN1Cc1ccccc1 ZINC000568550892 567337382 /nfs/dbraw/zinc/33/73/82/567337382.db2.gz MVXVGQMAICUTCE-WCQYABFASA-N 0 1 380.311 3.298 10 0 GGAEMN O=C1C[C@H](c2cccc(NS(=O)(=O)c3cc(Cl)ccc3Cl)c2)CN1 ZINC000435145993 567343347 /nfs/dbraw/zinc/34/33/47/567343347.db2.gz VQNXTUUOMCEXSS-NSHDSACASA-N 0 1 385.272 3.398 10 0 GGAEMN O=C1C[C@H](c2cccc(NS(=O)(=O)c3cccc(Cl)c3Cl)c2)CN1 ZINC000435146296 567343460 /nfs/dbraw/zinc/34/34/60/567343460.db2.gz KPXRPCKZLMPTFI-NSHDSACASA-N 0 1 385.272 3.398 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)c(Cl)cc1F ZINC000435131659 567343484 /nfs/dbraw/zinc/34/34/84/567343484.db2.gz DRRXDYBFANVKCJ-LBPRGKRZSA-N 0 1 382.844 3.192 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3ccc(F)c(Br)c3C2)n[nH]1 ZINC000527594330 567344650 /nfs/dbraw/zinc/34/46/50/567344650.db2.gz JUWMKCBGPIUBJJ-SNVBAGLBSA-N 0 1 395.276 3.319 10 0 GGAEMN CCOC(=O)c1sc([C@H](C)NC(=O)[C@@H](N)c2cccc(Cl)c2)nc1C ZINC000592538546 567345477 /nfs/dbraw/zinc/34/54/77/567345477.db2.gz TZZBNJREZPTYIR-GWCFXTLKSA-N 0 1 381.885 3.159 10 0 GGAEMN CC(C)(C(=O)N1CCO[C@H](c2ccc(Br)cc2)C1)c1c[nH]cn1 ZINC000548741680 567347196 /nfs/dbraw/zinc/34/71/96/567347196.db2.gz HOMNEUPGCXKHQP-AWEZNQCLSA-N 0 1 378.270 3.050 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1 ZINC000568683509 567348229 /nfs/dbraw/zinc/34/82/29/567348229.db2.gz MELVICFKSJFYAV-UHFFFAOYSA-N 0 1 385.917 3.065 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N3CCN(C4CCC4)C[C@H](C)C3)cc2s1 ZINC000568706286 567349568 /nfs/dbraw/zinc/34/95/68/567349568.db2.gz OSFPQUSGOMGLQC-ZDUSSCGKSA-N 0 1 379.551 3.100 10 0 GGAEMN Cc1ccccc1[C@H](N)C(=O)N1CCc2ccc(F)c(Br)c2C1 ZINC000527616581 567349504 /nfs/dbraw/zinc/34/95/04/567349504.db2.gz GWNMUIBAKHAYLC-KRWDZBQOSA-N 0 1 377.257 3.481 10 0 GGAEMN CN(C)C[C@H]1CCCN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000435215775 567349879 /nfs/dbraw/zinc/34/98/79/567349879.db2.gz HSCIAGYHIKDSSJ-CQSZACIVSA-N 0 1 385.942 3.178 10 0 GGAEMN COCC1(C2CCC2)CN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000617983114 567349909 /nfs/dbraw/zinc/34/99/09/567349909.db2.gz BTUBRWQYQUKKIZ-UHFFFAOYSA-N 0 1 378.270 3.214 10 0 GGAEMN O=C(N[C@H](Cc1nc[nH]n1)c1ccccc1)c1csc(Br)c1 ZINC000476815137 567350206 /nfs/dbraw/zinc/35/02/06/567350206.db2.gz BWEOERASCKQHDX-GFCCVEGCSA-N 0 1 377.267 3.343 10 0 GGAEMN O=C([C@@H]1Cc2ccccc2CN1)N1CCc2ccc(F)c(Br)c2C1 ZINC000527617455 567350217 /nfs/dbraw/zinc/35/02/17/567350217.db2.gz LRIAKFZEDLVWHM-KRWDZBQOSA-N 0 1 389.268 3.187 10 0 GGAEMN Cc1ccc([C@H](N)C(=O)N2CCc3ccc(F)c(Br)c3C2)cc1 ZINC000527617053 567350882 /nfs/dbraw/zinc/35/08/82/567350882.db2.gz BLEOFOWKTNEUMU-KRWDZBQOSA-N 0 1 377.257 3.481 10 0 GGAEMN Brc1ccc(-c2cnc(CN3CC[C@@H](Cn4ccnn4)C3)o2)cc1 ZINC000661145944 567353423 /nfs/dbraw/zinc/35/34/23/567353423.db2.gz WIKSRFRETDFCTJ-CYBMUJFWSA-N 0 1 388.269 3.218 10 0 GGAEMN Brc1ccc(-c2nc(CN3CC[C@@H](Cn4ccnn4)C3)co2)cc1 ZINC000661142457 567353533 /nfs/dbraw/zinc/35/35/33/567353533.db2.gz BEQWNQSXPIGNQM-CYBMUJFWSA-N 0 1 388.269 3.218 10 0 GGAEMN CC(C)Oc1cc(Cl)c(CN[C@@H]2CCCN(S(C)(=O)=O)C2)cc1Cl ZINC000527649498 567354505 /nfs/dbraw/zinc/35/45/05/567354505.db2.gz QMEYMSBROYTYBV-CYBMUJFWSA-N 0 1 395.352 3.294 10 0 GGAEMN O=C(Nc1ncn(Cc2ccccc2)n1)c1cc(Br)cc2nc[nH]c21 ZINC000548861887 567357098 /nfs/dbraw/zinc/35/70/98/567357098.db2.gz MNMMCFGSNKXOIZ-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2c(F)ccc(Br)c2F)C1 ZINC000661218536 567357119 /nfs/dbraw/zinc/35/71/19/567357119.db2.gz ZQWZCLUFNLDHOW-HFAKWTLXSA-N 0 1 378.257 3.383 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@H](CO)NCc2nc3ccc(Br)cc3o2)C1 ZINC000661215043 567357754 /nfs/dbraw/zinc/35/77/54/567357754.db2.gz DRDWUSNVRHVJFH-LNSITVRQSA-N 0 1 383.286 3.246 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)N1CC[C@@H]1c1ccc(Br)cc1 ZINC000661204302 567357869 /nfs/dbraw/zinc/35/78/69/567357869.db2.gz HTDDZLMFVLHMFC-CZUORRHYSA-N 0 1 375.270 3.186 10 0 GGAEMN COC[C@@H](CCO)NCc1cc(Br)c(C)cc1Br ZINC000527663505 567358000 /nfs/dbraw/zinc/35/80/00/567358000.db2.gz CGCSYSJIJJWOTF-LLVKDONJSA-N 0 1 381.108 3.007 10 0 GGAEMN CC[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000661204072 567358187 /nfs/dbraw/zinc/35/81/87/567358187.db2.gz BUJKMVOSEMHJJZ-HUUCEWRRSA-N 0 1 391.313 3.350 10 0 GGAEMN CS(=O)(=O)[C@H]1CCC[C@@H](NCc2ccc(Br)c(F)c2F)C1 ZINC000527665938 567358518 /nfs/dbraw/zinc/35/85/18/567358518.db2.gz RWJOTMCAPYGSAT-MNOVXSKESA-N 0 1 382.270 3.173 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(Br)cc2ccccc21 ZINC000592738360 567359265 /nfs/dbraw/zinc/35/92/65/567359265.db2.gz CSAJFOPKIISQKF-UHFFFAOYSA-N 0 1 391.309 3.445 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2ncc(Br)cc2F)C1 ZINC000527676216 567359936 /nfs/dbraw/zinc/35/99/36/567359936.db2.gz XHLXYCKEELWGPZ-CYBMUJFWSA-N 0 1 380.261 3.360 10 0 GGAEMN COCCN1CCC[C@H](NC(=O)c2cc(Br)cc3ccccc32)C1 ZINC000592765431 567360374 /nfs/dbraw/zinc/36/03/74/567360374.db2.gz NEGPTTULVSWRHQ-INIZCTEOSA-N 0 1 391.309 3.443 10 0 GGAEMN C[C@@H](Cn1ncc2ccccc2c1=O)NCc1ccsc1Br ZINC000527686732 567360972 /nfs/dbraw/zinc/36/09/72/567360972.db2.gz IWIKXWXYWKJNIU-NSHDSACASA-N 0 1 378.295 3.399 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1cc(COc2c(Cl)cccc2Cl)on1 ZINC000618192482 567362377 /nfs/dbraw/zinc/36/23/77/567362377.db2.gz OCZYAYKUPYGVOH-UHFFFAOYSA-N 0 1 384.263 3.194 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)CCc1ncc(-c2ccccc2Br)o1 ZINC000618194910 567362462 /nfs/dbraw/zinc/36/24/62/567362462.db2.gz NNHBREUPZFYNOH-UHFFFAOYSA-N 0 1 392.297 3.057 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1ccc(Oc2cccc(Br)c2)nc1 ZINC000618195373 567362723 /nfs/dbraw/zinc/36/27/23/567362723.db2.gz GJRDYYDAWKDDJL-UHFFFAOYSA-N 0 1 390.281 3.270 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@@H]1C ZINC000501077393 567363065 /nfs/dbraw/zinc/36/30/65/567363065.db2.gz URHMDGKZXFXZIP-NEPJUHHUSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@@H]1C ZINC000501077393 567363074 /nfs/dbraw/zinc/36/30/74/567363074.db2.gz URHMDGKZXFXZIP-NEPJUHHUSA-N 0 1 392.301 3.422 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)CCc1nc2cc(Br)ccc2s1 ZINC000618193101 567363107 /nfs/dbraw/zinc/36/31/07/567363107.db2.gz JGVGQUDUDIIHFS-UHFFFAOYSA-N 0 1 382.327 3.011 10 0 GGAEMN OC[C@@H](CNCc1ncc(Br)cc1F)Cc1ccc(F)c(F)c1 ZINC000527700767 567364307 /nfs/dbraw/zinc/36/43/07/567364307.db2.gz SEDRLNBVFXWCJT-LLVKDONJSA-N 0 1 389.215 3.202 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@@H](NCc2ccsc2Br)C1 ZINC000527706751 567366233 /nfs/dbraw/zinc/36/62/33/567366233.db2.gz ZSMQAQURIVKUDO-CQSZACIVSA-N 0 1 395.322 3.280 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)NCc2c(Cl)cccc2Cl)CC1 ZINC000527707417 567366468 /nfs/dbraw/zinc/36/64/68/567366468.db2.gz KTFCRXMQTFTNHX-UHFFFAOYSA-N 0 1 386.323 3.390 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CC1)c1ccc(-c2ccc(Br)s2)s1 ZINC000477048858 567367271 /nfs/dbraw/zinc/36/72/71/567367271.db2.gz YXHZNNZNRIRLEH-UHFFFAOYSA-N 0 1 396.295 3.171 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCC2(C1)Oc1ccccc1O2 ZINC000568938130 567367698 /nfs/dbraw/zinc/36/76/98/567367698.db2.gz BOPJXVXLYNUIJK-UHFFFAOYSA-N 0 1 376.206 3.168 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC[C@@](O)(C2CC2)C1 ZINC000618288774 567370043 /nfs/dbraw/zinc/37/00/43/567370043.db2.gz HEQLAVQVYZWVNY-SFHVURJKSA-N 0 1 390.281 3.216 10 0 GGAEMN CO[C@]1(CO)CCCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000661396920 567370939 /nfs/dbraw/zinc/37/09/39/567370939.db2.gz UFLPFVXLGKRSKX-ZJNRKIDTSA-N 0 1 389.323 3.032 10 0 GGAEMN Cn1cc(NS(=O)(=O)c2c(Cl)cc(F)cc2Cl)cc(Cl)c1=O ZINC000435478380 567371148 /nfs/dbraw/zinc/37/11/48/567371148.db2.gz GQLUCZYFUOMCIA-UHFFFAOYSA-N 0 1 385.631 3.285 10 0 GGAEMN FC(F)(F)[C@H](CNCc1ccc(I)cc1)n1cccn1 ZINC000527740342 567372097 /nfs/dbraw/zinc/37/20/97/567372097.db2.gz ZSLMLJXTKYAJEE-LBPRGKRZSA-N 0 1 395.166 3.381 10 0 GGAEMN FC(F)(F)[C@H](CNCc1cnc2ccc(Br)cn12)n1cccn1 ZINC000527742385 567372434 /nfs/dbraw/zinc/37/24/34/567372434.db2.gz KKLLUXQXUPUNFM-LBPRGKRZSA-N 0 1 388.191 3.187 10 0 GGAEMN COc1ccc(C(C)(C)NCc2ccc(S(N)(=O)=O)c(Cl)c2)cc1F ZINC000527780032 567373692 /nfs/dbraw/zinc/37/36/92/567373692.db2.gz ARMJVSUBAFHQAL-UHFFFAOYSA-N 0 1 386.876 3.160 10 0 GGAEMN CS[C@H]1CN(S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@H]1N1CCCC1 ZINC000477135903 567373871 /nfs/dbraw/zinc/37/38/71/567373871.db2.gz BTCYNHOZJZFGKQ-KGLIPLIRSA-N 0 1 395.377 3.194 10 0 GGAEMN COc1cc(Br)ccc1CNC[C@@H]1c2ccccc2C(=O)N1C ZINC000527807896 567375319 /nfs/dbraw/zinc/37/53/19/567375319.db2.gz QBOPDTCWLGCHLD-MRXNPFEDSA-N 0 1 375.266 3.374 10 0 GGAEMN COc1ccc(Br)c(CNC[C@H]2c3ccccc3C(=O)N2C)c1 ZINC000527805022 567375797 /nfs/dbraw/zinc/37/57/97/567375797.db2.gz HJVKBKLODGGVSK-KRWDZBQOSA-N 0 1 375.266 3.374 10 0 GGAEMN CC1=C[C@H](C)CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000569062838 567376681 /nfs/dbraw/zinc/37/66/81/567376681.db2.gz KLABUOJFAVRGGL-NSHDSACASA-N 0 1 390.285 3.342 10 0 GGAEMN CC1=C[C@H](C)CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000569062838 567376688 /nfs/dbraw/zinc/37/66/88/567376688.db2.gz KLABUOJFAVRGGL-NSHDSACASA-N 0 1 390.285 3.342 10 0 GGAEMN CC(C)(CO)[C@@H](NCC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1cccs1 ZINC000569054906 567376900 /nfs/dbraw/zinc/37/69/00/567376900.db2.gz RDLASZMPAKSDCC-DOMZBBRYSA-N 0 1 378.460 3.198 10 0 GGAEMN O=C(N[C@@H]1CSCc2ccc(Br)cc21)[C@@H]1CCCc2n[nH]nc21 ZINC000618359916 567378200 /nfs/dbraw/zinc/37/82/00/567378200.db2.gz ICGPIUTYXGGVFH-BXUZGUMPSA-N 0 1 393.310 3.091 10 0 GGAEMN O=C(c1cc(-c2ccoc2)[nH]n1)N1CCOc2ccc(Br)cc2C1 ZINC000549188987 567378649 /nfs/dbraw/zinc/37/86/49/567378649.db2.gz ZELFRXIUTSDRFS-UHFFFAOYSA-N 0 1 388.221 3.467 10 0 GGAEMN CO[C@H](CN1CCO[C@H](c2ccc(Br)cc2)[C@H]1C)[C@@H]1CCOC1 ZINC000661517987 567378947 /nfs/dbraw/zinc/37/89/47/567378947.db2.gz ZXJTXDLCTJJJLM-UWIFEVILSA-N 0 1 384.314 3.262 10 0 GGAEMN O=C(N[C@@H]1CSCc2ccc(Br)cc21)c1[nH]nc2c1CCC2 ZINC000618361315 567379332 /nfs/dbraw/zinc/37/93/32/567379332.db2.gz JRVNADMMNXBWNR-CQSZACIVSA-N 0 1 378.295 3.379 10 0 GGAEMN CC1(C)NC(=O)CC[C@H]1NCc1cc(Cl)ccc1I ZINC000593030216 567379857 /nfs/dbraw/zinc/37/98/57/567379857.db2.gz JOSQFMZVZMZGCA-GFCCVEGCSA-N 0 1 392.668 3.091 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOC[C@H]1c1ccc(Br)cc1 ZINC000618364267 567383003 /nfs/dbraw/zinc/38/30/03/567383003.db2.gz FWNXKQXKCZQNGP-YOEHRIQHSA-N 0 1 390.281 3.192 10 0 GGAEMN O[C@@]1(C2CC2)CCCN(Cc2cc3c(cc2Br)OCCCO3)C1 ZINC000661628927 567384440 /nfs/dbraw/zinc/38/44/40/567384440.db2.gz WKSAPPGPLZUKLQ-SFHVURJKSA-N 0 1 382.298 3.347 10 0 GGAEMN O[C@@]1(C2CC2)CCCN(Cc2nc(-c3cccc(Br)c3)no2)C1 ZINC000661635613 567384610 /nfs/dbraw/zinc/38/46/10/567384610.db2.gz PQGZVLIDRRYPFW-KRWDZBQOSA-N 0 1 378.270 3.236 10 0 GGAEMN O[C@]1(C2CC2)CCCN(Cc2nc(-c3cccc(Br)c3)no2)C1 ZINC000661635615 567384703 /nfs/dbraw/zinc/38/47/03/567384703.db2.gz PQGZVLIDRRYPFW-QGZVFWFLSA-N 0 1 378.270 3.236 10 0 GGAEMN C[C@H](N[C@H]1[C@@H](C)[C@H](C)O[C@H]1C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000528006917 567389593 /nfs/dbraw/zinc/38/95/93/567389593.db2.gz PNHSSIUJRGXAFZ-JSLVTQLMSA-N 0 1 381.325 3.103 10 0 GGAEMN O=C(Cc1cscc1Br)N[C@H](Cc1nc[nH]n1)c1ccccc1 ZINC000501460237 567391664 /nfs/dbraw/zinc/39/16/64/567391664.db2.gz ANDJDAZLBAZJJM-CQSZACIVSA-N 0 1 391.294 3.271 10 0 GGAEMN CC(C)(C)c1nc(CN2CCOC[C@H]2c2cccc(Br)c2)n[nH]1 ZINC000661733903 567391971 /nfs/dbraw/zinc/39/19/71/567391971.db2.gz QRIDAELOPORODW-AWEZNQCLSA-N 0 1 379.302 3.438 10 0 GGAEMN O=C(NCc1nccn1-c1ccccc1)c1cc(Br)cc2nc[nH]c21 ZINC000549448032 567392286 /nfs/dbraw/zinc/39/22/86/567392286.db2.gz CJJLMUDJIQCIDL-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN CNC(=O)Nc1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000501520881 567393992 /nfs/dbraw/zinc/39/39/92/567393992.db2.gz MVLRMFYVZBVKCM-UHFFFAOYSA-N 0 1 388.225 3.329 10 0 GGAEMN COC(=O)Cc1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000501524314 567394701 /nfs/dbraw/zinc/39/47/01/567394701.db2.gz QOEDYDVMUOUKHO-UHFFFAOYSA-N 0 1 388.221 3.293 10 0 GGAEMN CNC(=O)c1cccc(CN[C@H]2CCOc3c(Br)cccc32)c1 ZINC000501561647 567396503 /nfs/dbraw/zinc/39/65/03/567396503.db2.gz MPNHIGIHQJKJLY-INIZCTEOSA-N 0 1 375.266 3.422 10 0 GGAEMN CC(C)Sc1ccccc1NS(=O)(=O)c1ccc2c(c1)CS(=O)(=O)C2 ZINC000593204006 567396983 /nfs/dbraw/zinc/39/69/83/567396983.db2.gz FBWKROXGWSBPTA-UHFFFAOYSA-N 0 1 397.543 3.416 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000618538871 567397638 /nfs/dbraw/zinc/39/76/38/567397638.db2.gz NLSLAJOSSJACFH-UHFFFAOYSA-N 0 1 391.313 3.419 10 0 GGAEMN O=C(NCC1(Cc2ccc(Br)cc2)CC1)[C@@H]1CCCc2n[nH]nc21 ZINC000618540601 567398089 /nfs/dbraw/zinc/39/80/89/567398089.db2.gz XIRNEJGJLYBEDL-CQSZACIVSA-N 0 1 389.297 3.126 10 0 GGAEMN COc1ccc([C@H](C)[NH+]=c2[n-]nc3ccc(Br)cn32)c(OC)c1 ZINC000528154354 567398479 /nfs/dbraw/zinc/39/84/79/567398479.db2.gz OVQLRIGSDURHIV-JTQLQIEISA-N 0 1 377.242 3.104 10 0 GGAEMN CN1CCN(c2cc(C(=O)NCc3ccc(Cl)c(Cl)c3)ccn2)CC1 ZINC000618541505 567399273 /nfs/dbraw/zinc/39/92/73/567399273.db2.gz YNCSNDSCAADWNJ-UHFFFAOYSA-N 0 1 379.291 3.070 10 0 GGAEMN C[C@@H](Cc1cnc[nH]1)C(=O)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000618545520 567399630 /nfs/dbraw/zinc/39/96/30/567399630.db2.gz PEAFCDIGSMUKKA-ZDUSSCGKSA-N 0 1 376.298 3.490 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1CC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000456683271 567401676 /nfs/dbraw/zinc/40/16/76/567401676.db2.gz IEJPXFOHDMEHSB-KRTXAFLBSA-N 0 1 379.791 3.177 10 0 GGAEMN CN(C)C(=O)N(C)[C@H]1CCN(CCCC(=O)c2ccc(Br)cc2)C1 ZINC000662006824 567403328 /nfs/dbraw/zinc/40/33/28/567403328.db2.gz DAEAQWSUVZFXSE-INIZCTEOSA-N 0 1 396.329 3.100 10 0 GGAEMN CCC(CC)CCCN(C)CC(=O)Nc1cc(S(N)(=O)=O)ccc1Cl ZINC000662035180 567404529 /nfs/dbraw/zinc/40/45/29/567404529.db2.gz CIZDBBSKULKHSN-UHFFFAOYSA-N 0 1 389.949 3.074 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)CN1CCC(c2ccon2)CC1 ZINC000662043863 567406668 /nfs/dbraw/zinc/40/66/68/567406668.db2.gz MSXINUGLWUMKFK-HNNXBMFYSA-N 0 1 381.270 3.056 10 0 GGAEMN CCCN(C)[C@H](CNS(=O)(=O)CC(C)(C)OC)c1ccc(Cl)cc1 ZINC000569464634 567406936 /nfs/dbraw/zinc/40/69/36/567406936.db2.gz RVMFTBOHKKIQBP-MRXNPFEDSA-N 0 1 376.950 3.067 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NC[C@H](O)COc2ccccc2Cl)[C@@H]1O ZINC000569485465 567407483 /nfs/dbraw/zinc/40/74/83/567407483.db2.gz IKZCLQUVESIFNI-CXMBCZLWSA-N 0 1 383.897 3.004 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCC[C@@]2(CCOC2)C1 ZINC000456720116 567409901 /nfs/dbraw/zinc/40/99/01/567409901.db2.gz MXTMVWCZHBDLTQ-GOSISDBHSA-N 0 1 390.281 3.482 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)N1CCC(c2nnc(-c3ccccc3)[nH]2)CC1 ZINC000528335191 567412263 /nfs/dbraw/zinc/41/22/63/567412263.db2.gz CJOVPLQIJFGUOJ-KDOFPFPSSA-N 0 1 389.297 3.351 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc(Br)cc2)C1 ZINC000662112937 567412818 /nfs/dbraw/zinc/41/28/18/567412818.db2.gz BSEOJYHIWVMAAV-UONOGXRCSA-N 0 1 396.329 3.013 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000662115373 567413354 /nfs/dbraw/zinc/41/33/54/567413354.db2.gz JGMDGKVQWYIXHG-GFCCVEGCSA-N 0 1 379.302 3.062 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOC[C@@H]1c1cccc(Br)c1 ZINC000618772592 567413368 /nfs/dbraw/zinc/41/33/68/567413368.db2.gz KBDCYNHGALUREH-WMLDXEAASA-N 0 1 390.281 3.192 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN([C@@H](C)C(=O)Nc2cccc(Br)c2)C1 ZINC000662113526 567413426 /nfs/dbraw/zinc/41/34/26/567413426.db2.gz NXKAPNFBDAXUIX-UONOGXRCSA-N 0 1 396.329 3.013 10 0 GGAEMN COc1ccc(Br)cc1[C@@H]1CCCN1C[C@H](O)CC1(O)CCC1 ZINC000528364421 567415254 /nfs/dbraw/zinc/41/52/54/567415254.db2.gz MPHRSYKNEYHZTB-ZBFHGGJFSA-N 0 1 384.314 3.261 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CCCC12CC2 ZINC000528361967 567415517 /nfs/dbraw/zinc/41/55/17/567415517.db2.gz DBPBXTXEIIHLIJ-ZDUSSCGKSA-N 0 1 375.270 3.431 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCCC12CC2 ZINC000528361967 567415525 /nfs/dbraw/zinc/41/55/25/567415525.db2.gz DBPBXTXEIIHLIJ-ZDUSSCGKSA-N 0 1 375.270 3.431 10 0 GGAEMN Cc1nccc(NCc2ccccc2CS(=O)(=O)N2CCCC2)c1Cl ZINC000502009881 567416099 /nfs/dbraw/zinc/41/60/99/567416099.db2.gz LGCXUHCPGOZINU-UHFFFAOYSA-N 0 1 379.913 3.003 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)c1cccc(N2CCN(C)CC2)n1 ZINC000502071094 567417648 /nfs/dbraw/zinc/41/76/48/567417648.db2.gz KUDLJNLFTRBVIY-UHFFFAOYSA-N 0 1 389.297 3.157 10 0 GGAEMN COCCN(Cc1ccc(F)c(Cl)c1)C(=O)CCSc1nnc(C)[nH]1 ZINC000456876342 567422276 /nfs/dbraw/zinc/42/22/76/567422276.db2.gz GQYCTCPSBHHHKO-UHFFFAOYSA-N 0 1 386.880 3.063 10 0 GGAEMN Cc1cc(Br)c(C(=O)N[C@H]2CCCN(C)C2)cc1Br ZINC000528434891 567423302 /nfs/dbraw/zinc/42/33/02/567423302.db2.gz DJQHSAHLXYHMPL-JTQLQIEISA-N 0 1 390.119 3.344 10 0 GGAEMN Cc1cc(Br)c(C(=O)N[C@@H]2CCCN(C)C2)cc1Br ZINC000528434892 567423380 /nfs/dbraw/zinc/42/33/80/567423380.db2.gz DJQHSAHLXYHMPL-SNVBAGLBSA-N 0 1 390.119 3.344 10 0 GGAEMN Brc1ccc2nc(CN3C[C@]45COC[C@@]4(C3)CCCC5)cn2c1 ZINC000662315021 567425707 /nfs/dbraw/zinc/42/57/07/567425707.db2.gz GHYDTISFAJUDCF-HDICACEKSA-N 0 1 376.298 3.489 10 0 GGAEMN O=S(=O)(Nc1ccc(-c2nncs2)cc1)c1ccc(C(F)(F)F)nc1 ZINC000436480621 567426210 /nfs/dbraw/zinc/42/62/10/567426210.db2.gz ZARUNDUHMLFLAQ-UHFFFAOYSA-N 0 1 386.380 3.420 10 0 GGAEMN O=S(=O)(NC[C@@H]1CCN1C1CCCCC1)c1ccccc1Br ZINC000528471355 567427129 /nfs/dbraw/zinc/42/71/29/567427129.db2.gz CEVPTWRDGMFXFE-AWEZNQCLSA-N 0 1 387.343 3.134 10 0 GGAEMN Brc1ccc(-c2nnc(CN3C[C@]45COC[C@@]4(C3)CCCC5)o2)o1 ZINC000662316266 567427391 /nfs/dbraw/zinc/42/73/91/567427391.db2.gz VOPGXRRHMRQYOF-CALCHBBNSA-N 0 1 394.269 3.485 10 0 GGAEMN CO[C@@H]1CCCC[C@H]1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000550111073 567427487 /nfs/dbraw/zinc/42/74/87/567427487.db2.gz ZLIFIGDBXBLFOR-ZIAGYGMSSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@@H]1CCCC[C@H]1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550111073 567427491 /nfs/dbraw/zinc/42/74/91/567427491.db2.gz ZLIFIGDBXBLFOR-ZIAGYGMSSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@@H]1CCCC[C@@H]1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000550111072 567428260 /nfs/dbraw/zinc/42/82/60/567428260.db2.gz ZLIFIGDBXBLFOR-UONOGXRCSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@@H]1CCCC[C@@H]1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550111072 567428267 /nfs/dbraw/zinc/42/82/67/567428267.db2.gz ZLIFIGDBXBLFOR-UONOGXRCSA-N 0 1 393.285 3.056 10 0 GGAEMN CC1CCN([C@@H](CNS(=O)(=O)N2CCC[C@@H](C)C2)c2cccs2)CC1 ZINC000502322301 567428355 /nfs/dbraw/zinc/42/83/55/567428355.db2.gz YDJMMRLQHWLCNQ-SJORKVTESA-N 0 1 385.599 3.087 10 0 GGAEMN O=C(NCc1cc(Cl)ccc1N1CCOCC1)c1ccc(O)c(Cl)c1 ZINC000436484768 567428614 /nfs/dbraw/zinc/42/86/14/567428614.db2.gz FJPDXFAVUFGXQD-UHFFFAOYSA-N 0 1 381.259 3.466 10 0 GGAEMN Fc1c(Br)ccc(CN2CCC[C@H](N3CCOCC3)CC2)c1F ZINC000528492723 567429359 /nfs/dbraw/zinc/42/93/59/567429359.db2.gz SDGZSJNTFUQDEI-AWEZNQCLSA-N 0 1 389.284 3.414 10 0 GGAEMN C[N@@H+]1CC[C@@H](NC(=O)c2ccc(Br)cc2[O-])[C@H]1c1ccccc1 ZINC000436524734 567431203 /nfs/dbraw/zinc/43/12/03/567431203.db2.gz KJKBJQGNVUORHO-NVXWUHKLSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)cc2[O-])[C@H]1c1ccccc1 ZINC000436524734 567431207 /nfs/dbraw/zinc/43/12/07/567431207.db2.gz KJKBJQGNVUORHO-NVXWUHKLSA-N 0 1 375.266 3.330 10 0 GGAEMN O[C@H](COc1cc(F)ccc1Br)CN1CCc2ccccc2C1 ZINC000550177509 567432104 /nfs/dbraw/zinc/43/21/04/567432104.db2.gz ZHXDDLDKZVFQCY-INIZCTEOSA-N 0 1 380.257 3.386 10 0 GGAEMN CO[C@@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550209201 567433744 /nfs/dbraw/zinc/43/37/44/567433744.db2.gz GXWZSLRXXIBMSK-CHWSQXEVSA-N 0 1 379.258 3.378 10 0 GGAEMN NC(=O)C1(NCc2ccc(Br)c(F)c2F)C2CC3CC(C2)CC1C3 ZINC000528516735 567434288 /nfs/dbraw/zinc/43/42/88/567434288.db2.gz AOOQGLBWJYSQCY-UHFFFAOYSA-N 0 1 399.279 3.497 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000528546360 567435462 /nfs/dbraw/zinc/43/54/62/567435462.db2.gz DEQCXEDZZUSKCY-AWEZNQCLSA-N 0 1 377.337 3.430 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)NC[C@@H]1CCN1C1CCCC1 ZINC000528546360 567435465 /nfs/dbraw/zinc/43/54/65/567435465.db2.gz DEQCXEDZZUSKCY-AWEZNQCLSA-N 0 1 377.337 3.430 10 0 GGAEMN COC[C@@H]1CCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000457076147 567437657 /nfs/dbraw/zinc/43/76/57/567437657.db2.gz IMUTWFZQEZHDKZ-GFCCVEGCSA-N 0 1 393.281 3.179 10 0 GGAEMN O=S(=O)(NC[C@H]1CCN1C1CCCC1)c1ccc(CC(F)(F)F)cc1 ZINC000528553087 567437668 /nfs/dbraw/zinc/43/76/68/567437668.db2.gz QPGIXCJDXMHEBD-OAHLLOKOSA-N 0 1 376.444 3.087 10 0 GGAEMN COC[C@H]1CCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000457076148 567438167 /nfs/dbraw/zinc/43/81/67/567438167.db2.gz IMUTWFZQEZHDKZ-LBPRGKRZSA-N 0 1 393.281 3.179 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N(Cc2cccc(Br)c2)C2CC2)on1 ZINC000662478663 567439448 /nfs/dbraw/zinc/43/94/48/567439448.db2.gz SHAPOFTWXRFQNC-UHFFFAOYSA-N 0 1 378.270 3.436 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cc(Br)cc3c2OCC3)[C@@H]1n1cccn1 ZINC000550325272 567441521 /nfs/dbraw/zinc/44/15/21/567441521.db2.gz RJMJSTPZOJOCQN-BBWFWOEESA-N 0 1 392.297 3.089 10 0 GGAEMN COc1ccc(Br)c(CN2CC3(CCOCC3)CC[C@@H]2CO)c1 ZINC000528646946 567444291 /nfs/dbraw/zinc/44/42/91/567444291.db2.gz YXMCFSMASQYDKS-OAHLLOKOSA-N 0 1 384.314 3.211 10 0 GGAEMN NC(=O)[C@H](NCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1 ZINC000502657319 567444872 /nfs/dbraw/zinc/44/48/72/567444872.db2.gz YOQOCLSPZLUXOT-OAHLLOKOSA-N 0 1 387.199 3.225 10 0 GGAEMN NC(=O)[C@H](NCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1 ZINC000502649893 567445244 /nfs/dbraw/zinc/44/52/44/567445244.db2.gz FUVOSYJHCYRCIB-OAHLLOKOSA-N 0 1 387.199 3.225 10 0 GGAEMN CCN1CC[C@H]2OCCN(C(=O)CSc3cc(Cl)ccc3Cl)[C@H]2C1 ZINC000502659545 567446462 /nfs/dbraw/zinc/44/64/62/567446462.db2.gz DOEKAISDSKRTMJ-LSDHHAIUSA-N 0 1 389.348 3.407 10 0 GGAEMN Cc1cc([C@@H]2CCN(C(=O)c3csc(=NC4CC4)[nH]3)C2)c(O)cc1Cl ZINC000619373818 567448616 /nfs/dbraw/zinc/44/86/16/567448616.db2.gz FNLVGZILLGFMPG-LLVKDONJSA-N 0 1 377.897 3.436 10 0 GGAEMN O=C(NCCCOc1ccc(Cl)cc1Cl)N[C@H]1CCc2nc[nH]c2C1 ZINC000570018766 567452405 /nfs/dbraw/zinc/45/24/05/567452405.db2.gz AEVRFLGBSPPMRO-LBPRGKRZSA-N 0 1 383.279 3.342 10 0 GGAEMN CN(C)C[C@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000528766525 567453176 /nfs/dbraw/zinc/45/31/76/567453176.db2.gz NLFAIIFPJLPOKJ-KGLIPLIRSA-N 0 1 398.256 3.349 10 0 GGAEMN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)c1cc(C(C)(C)N)no1 ZINC000662627380 567454394 /nfs/dbraw/zinc/45/43/94/567454394.db2.gz XSVOULSRMKTTPY-UHFFFAOYSA-N 0 1 392.297 3.435 10 0 GGAEMN CCN(CCOc1ccc(Br)cc1)C(=O)c1cc(C(C)(C)N)no1 ZINC000662635897 567454482 /nfs/dbraw/zinc/45/44/82/567454482.db2.gz OQQOPDHQOIFIQY-UHFFFAOYSA-N 0 1 396.285 3.172 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccc(F)cc1OCCC(F)(F)F)C1CC1 ZINC000570044343 567454313 /nfs/dbraw/zinc/45/43/13/567454313.db2.gz FWWRAWDJUNBGLW-CQSZACIVSA-N 0 1 385.379 3.324 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000594030828 567454399 /nfs/dbraw/zinc/45/43/99/567454399.db2.gz SFEVGRUNKPHOIF-VXGBXAGGSA-N 0 1 382.423 3.386 10 0 GGAEMN Cc1cc(C(=O)N2CCN(C(=O)c3ccc(Cl)c(Cl)c3)[C@H](C)C2)n[nH]1 ZINC000457305930 567455174 /nfs/dbraw/zinc/45/51/74/567455174.db2.gz ZSRCGTKFQPMFNI-LLVKDONJSA-N 0 1 381.263 3.012 10 0 GGAEMN O=c1ccc([C@H]2CCCN2CCOc2cc(F)cc(Br)c2)n[nH]1 ZINC000528790173 567456692 /nfs/dbraw/zinc/45/66/92/567456692.db2.gz UZYNDDUIHNZSBB-OAHLLOKOSA-N 0 1 382.233 3.300 10 0 GGAEMN CCC[C@@H]1CNCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000570091650 567457103 /nfs/dbraw/zinc/45/71/03/567457103.db2.gz SASAUALRMNPBFA-MRXNPFEDSA-N 0 1 391.313 3.157 10 0 GGAEMN C[C@](N)(C(=O)Nc1ccc2c(c1)CCOC2)c1ccc(Br)cc1 ZINC000662691082 567457776 /nfs/dbraw/zinc/45/77/76/567457776.db2.gz FSMVFTOHZNVQNP-GOSISDBHSA-N 0 1 375.266 3.334 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCC[C@H]2c2ccc(Br)cn2)cn1 ZINC000457329108 567457943 /nfs/dbraw/zinc/45/79/43/567457943.db2.gz NQAAUAGSVZFWIA-KRWDZBQOSA-N 0 1 389.297 3.278 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCC[C@@H]2c2ccc(Br)cn2)cn1 ZINC000457329110 567457994 /nfs/dbraw/zinc/45/79/94/567457994.db2.gz NQAAUAGSVZFWIA-QGZVFWFLSA-N 0 1 389.297 3.278 10 0 GGAEMN C[C@](N)(C(=O)N1CCC(c2ccon2)CC1)c1ccc(Br)cc1 ZINC000662713291 567458040 /nfs/dbraw/zinc/45/80/40/567458040.db2.gz OPZFNYAKLPAKKT-QGZVFWFLSA-N 0 1 378.270 3.017 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@H](O)COc2c(Cl)cccc2Cl)n[nH]1 ZINC000528794421 567458677 /nfs/dbraw/zinc/45/86/77/567458677.db2.gz ZERSZGUURAGJJN-XHDPSFHLSA-N 0 1 384.263 3.066 10 0 GGAEMN C[C@](N)(C(=O)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12)c1ccc(Br)cc1 ZINC000662740164 567459565 /nfs/dbraw/zinc/45/95/65/567459565.db2.gz RYQLPIWWADNIRY-DODZYUBVSA-N 0 1 389.268 3.217 10 0 GGAEMN C[C@](CO)(NC(=O)c1cc(Br)cc2nc[nH]c21)C1CCCCC1 ZINC000502862686 567459583 /nfs/dbraw/zinc/45/95/83/567459583.db2.gz UESHSEHSNCPMHW-QGZVFWFLSA-N 0 1 380.286 3.387 10 0 GGAEMN CCC[C@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)OCC ZINC000570128882 567460347 /nfs/dbraw/zinc/46/03/47/567460347.db2.gz RJRFQOXKCDKBKL-SNVBAGLBSA-N 0 1 382.258 3.035 10 0 GGAEMN CC[N@@H+]1CC[C@@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C[C@H]1C ZINC000662743901 567460431 /nfs/dbraw/zinc/46/04/31/567460431.db2.gz WZXTUZKPQNZWEZ-GHMZBOCLSA-N 0 1 386.359 3.059 10 0 GGAEMN Cc1ccccc1[C@H](N)C(=O)N1CCOc2cc(Br)ccc2C1 ZINC000662743047 567461112 /nfs/dbraw/zinc/46/11/12/567461112.db2.gz YRJYSMZUAWHTIK-KRWDZBQOSA-N 0 1 375.266 3.179 10 0 GGAEMN Cc1ccccc1[C@@H](N)C(=O)N1CCOc2cc(Br)ccc2C1 ZINC000662743049 567461271 /nfs/dbraw/zinc/46/12/71/567461271.db2.gz YRJYSMZUAWHTIK-QGZVFWFLSA-N 0 1 375.266 3.179 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)Nc2cccc(Br)c2)CC1 ZINC000528848829 567462507 /nfs/dbraw/zinc/46/25/07/567462507.db2.gz DQNLCGDOHZSXTE-UHFFFAOYSA-N 0 1 382.302 3.168 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)c2cc(C(C)(C)N)no2)CC1 ZINC000662821186 567462701 /nfs/dbraw/zinc/46/27/01/567462701.db2.gz UQLMONRZQOTDHW-UHFFFAOYSA-N 0 1 394.269 3.059 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)Nc2ccccc2Br)CC1 ZINC000528848657 567462914 /nfs/dbraw/zinc/46/29/14/567462914.db2.gz CRNIIKNTUUUUHR-UHFFFAOYSA-N 0 1 382.302 3.168 10 0 GGAEMN CCO[C@@H]1C[C@H](NC(=O)c2cc(Br)cc3nc[nH]c32)C12CCC2 ZINC000502992670 567463555 /nfs/dbraw/zinc/46/35/55/567463555.db2.gz AATXPYWZBYTWAH-UONOGXRCSA-N 0 1 378.270 3.403 10 0 GGAEMN Cc1ccc2nc(CNC(=O)c3cc(Br)cc4[nH]cnc43)[nH]c2c1 ZINC000502988431 567463853 /nfs/dbraw/zinc/46/38/53/567463853.db2.gz CMNXEXCSIWIWLT-UHFFFAOYSA-N 0 1 384.237 3.440 10 0 GGAEMN CC(C)(C)Cc1cc(=NC(=O)c2cc(Br)cc3[nH]cnc32)[nH][nH]1 ZINC000503010320 567465576 /nfs/dbraw/zinc/46/55/76/567465576.db2.gz BDJUMQLVSUXSOE-UHFFFAOYSA-N 0 1 376.258 3.311 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)N1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000528898905 567467267 /nfs/dbraw/zinc/46/72/67/567467267.db2.gz BAZAEGPLYXKZTG-AHIWAGSCSA-N 0 1 375.270 3.309 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)n[nH]1 ZINC000528898905 567467270 /nfs/dbraw/zinc/46/72/70/567467270.db2.gz BAZAEGPLYXKZTG-AHIWAGSCSA-N 0 1 375.270 3.309 10 0 GGAEMN Cc1ccc([C@H](N)C(=O)N2CCOc3cc(Br)ccc3C2)cc1 ZINC000662939613 567470436 /nfs/dbraw/zinc/47/04/36/567470436.db2.gz PZNCOIMLHHOBGT-KRWDZBQOSA-N 0 1 375.266 3.179 10 0 GGAEMN O=C([C@H]1NCCc2ccccc21)N1CCOc2cc(Br)ccc2C1 ZINC000662940970 567470646 /nfs/dbraw/zinc/47/06/46/567470646.db2.gz ZVFFNHMAIYUANI-SFHVURJKSA-N 0 1 387.277 3.057 10 0 GGAEMN COC(=O)C1(NC(=O)c2cc(Br)cc3nc[nH]c32)CCCCCC1 ZINC000503157916 567470810 /nfs/dbraw/zinc/47/08/10/567470810.db2.gz JXBBRZDKRHNTFP-UHFFFAOYSA-N 0 1 394.269 3.321 10 0 GGAEMN O=C(NCCOc1ccc(F)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000503161425 567471078 /nfs/dbraw/zinc/47/10/78/567471078.db2.gz XSBRPHZIGXJENJ-UHFFFAOYSA-N 0 1 378.201 3.273 10 0 GGAEMN O=C(NCCOc1cccc(F)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503169260 567471148 /nfs/dbraw/zinc/47/11/48/567471148.db2.gz TVPQLPLXRPVGKE-UHFFFAOYSA-N 0 1 378.201 3.273 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(-c2n[nH]c3ccc(I)cc32)n1 ZINC000570279560 567471721 /nfs/dbraw/zinc/47/17/21/567471721.db2.gz RMYOVRZKYXSAJL-SNVBAGLBSA-N 0 1 397.220 3.263 10 0 GGAEMN C[C@](N)(C(=O)N1C[C@]23COC[C@@]2(C1)CCCC3)c1ccc(Br)cc1 ZINC000662980356 567472159 /nfs/dbraw/zinc/47/21/59/567472159.db2.gz ONDPECUATWBJTE-QRVBRYPASA-N 0 1 393.325 3.042 10 0 GGAEMN O=C(Nc1ccccc1Cn1cncn1)c1cc(Br)cc2nc[nH]c21 ZINC000503182767 567472343 /nfs/dbraw/zinc/47/23/43/567472343.db2.gz SVVLAMOLRNESEA-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN O=C(NCc1ccn(-c2ccccc2)n1)c1cc(Br)cc2nc[nH]c21 ZINC000503174714 567472391 /nfs/dbraw/zinc/47/23/91/567472391.db2.gz VPIBDCIKSMXFDM-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN O=S(=O)(NCC(F)(F)F)c1ccc(Br)cc1C(F)(F)F ZINC000551000245 567472690 /nfs/dbraw/zinc/47/26/90/567472690.db2.gz JTUWCMWWRSYQJW-UHFFFAOYSA-N 0 1 386.111 3.309 10 0 GGAEMN C[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC(C)(C)C ZINC000594388304 567473321 /nfs/dbraw/zinc/47/33/21/567473321.db2.gz BAGRSKHYRZCJAA-VIFPVBQESA-N 0 1 382.258 3.033 10 0 GGAEMN O=S(=O)(Nc1cnc(CC2CC2)nc1)c1ccc(OC(F)F)c(Cl)c1 ZINC000551037648 567473647 /nfs/dbraw/zinc/47/36/47/567473647.db2.gz VWDIEYUPVLAPRN-UHFFFAOYSA-N 0 1 389.811 3.485 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)N1CCC[C@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000528977742 567473802 /nfs/dbraw/zinc/47/38/02/567473802.db2.gz BTTCBQSIUBEALP-IYOUNJFTSA-N 0 1 389.297 3.351 10 0 GGAEMN COC(=O)c1csc(S(=O)(=O)N[C@H](c2ccc(C)o2)C(F)(F)F)c1 ZINC000594481268 567480905 /nfs/dbraw/zinc/48/09/05/567480905.db2.gz KTRSVRBYEVUDKQ-LLVKDONJSA-N 0 1 383.369 3.018 10 0 GGAEMN Cc1cccn2cc(CNC(=O)c3cc(Br)cc4nc[nH]c43)nc12 ZINC000503350739 567482104 /nfs/dbraw/zinc/48/21/04/567482104.db2.gz YNSNWPQLFXNYEA-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN Ic1cnc(CN[C@H](C2CC2)[C@@H]2CCCCO2)s1 ZINC000594509993 567482995 /nfs/dbraw/zinc/48/29/95/567482995.db2.gz MNHXSMJZVAVDIL-GXFFZTMASA-N 0 1 378.279 3.185 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOC(C2CC2)(C2CC2)C1 ZINC000619952643 567488228 /nfs/dbraw/zinc/48/82/28/567488228.db2.gz NTXUVIWBHPWJIZ-UHFFFAOYSA-N 0 1 390.281 3.357 10 0 GGAEMN CC(=O)c1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)nc1C ZINC000503508961 567489907 /nfs/dbraw/zinc/48/99/07/567489907.db2.gz MEBJZXUZHYLEGC-UHFFFAOYSA-N 0 1 387.237 3.161 10 0 GGAEMN O=C(NCc1ccccc1-n1ccnc1)c1cc(Br)cc2nc[nH]c21 ZINC000503508464 567489933 /nfs/dbraw/zinc/48/99/33/567489933.db2.gz BFTXQANZHQJUJF-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN Cc1ccsc1[C@H](CO)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503512795 567490034 /nfs/dbraw/zinc/49/00/34/567490034.db2.gz YWEZUKPHSAVASW-LBPRGKRZSA-N 0 1 380.267 3.159 10 0 GGAEMN COC(=O)CC1(NCc2cn(-c3ccccc3Br)nc2C)CC1 ZINC000594606639 567490102 /nfs/dbraw/zinc/49/01/02/567490102.db2.gz MRGSSPSNSGMHPF-UHFFFAOYSA-N 0 1 378.270 3.129 10 0 GGAEMN COC(=O)c1cc(CNCCC(=O)Nc2ccc(Br)cc2)c(C)o1 ZINC000594613412 567490371 /nfs/dbraw/zinc/49/03/71/567490371.db2.gz IKSCGRHOJLIKIQ-UHFFFAOYSA-N 0 1 395.253 3.256 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)Cc2c(F)ccc(Br)c2F)n[nH]1 ZINC000503520002 567491321 /nfs/dbraw/zinc/49/13/21/567491321.db2.gz YZTYSHKGEMYKSW-QMMMGPOBSA-N 0 1 387.228 3.389 10 0 GGAEMN CC[C@H](C)n1[nH]c(=NC(=O)c2cc(Br)cc3[nH]cnc32)cc1C ZINC000503539404 567492770 /nfs/dbraw/zinc/49/27/70/567492770.db2.gz VHXMECIWEONDKM-VIFPVBQESA-N 0 1 376.258 3.476 10 0 GGAEMN O=C(c1cc(Br)cc2nc[nH]c21)N1CCN2CCOc3cccc1c32 ZINC000503538855 567492857 /nfs/dbraw/zinc/49/28/57/567492857.db2.gz MAMCJMZGOZLWGB-UHFFFAOYSA-N 0 1 399.248 3.185 10 0 GGAEMN CCc1ccc([C@H](COC)N[C@H](C)Cn2cc(Br)ccc2=O)o1 ZINC000551282869 567493034 /nfs/dbraw/zinc/49/30/34/567493034.db2.gz GJCKCITUZDSRAK-DOMZBBRYSA-N 0 1 383.286 3.132 10 0 GGAEMN COC(=O)CCN1CCC[C@@H](N[C@H]2CCSc3ccc(Cl)cc32)C1=O ZINC000594661038 567493134 /nfs/dbraw/zinc/49/31/34/567493134.db2.gz KKLYZOMWIAHDRL-LSDHHAIUSA-N 0 1 382.913 3.021 10 0 GGAEMN COC(=O)CCN1CCC[C@@H](N[C@@H]2CCSc3ccc(Cl)cc32)C1=O ZINC000594661037 567493569 /nfs/dbraw/zinc/49/35/69/567493569.db2.gz KKLYZOMWIAHDRL-HUUCEWRRSA-N 0 1 382.913 3.021 10 0 GGAEMN CC(C)c1nc(C[S@@](=O)Cc2ncc(Br)cc2Cl)n[nH]1 ZINC000594675039 567494668 /nfs/dbraw/zinc/49/46/68/567494668.db2.gz JRZFVNMRPDHOCF-FQEVSTJZSA-N 0 1 377.695 3.188 10 0 GGAEMN CC(C)(C)c1nc(C[S@@](=O)Cc2ncc(Br)cc2Cl)n[nH]1 ZINC000594676580 567495016 /nfs/dbraw/zinc/49/50/16/567495016.db2.gz UVKZEILLENFRQW-NRFANRHFSA-N 0 1 391.722 3.362 10 0 GGAEMN CO[C@H](CNCc1cc(Cl)ccc1I)[C@H]1CCOC1 ZINC000594954427 567529192 /nfs/dbraw/zinc/52/91/92/567529192.db2.gz ZSUDIGVYWKKROF-IINYFYTJSA-N 0 1 395.668 3.086 10 0 GGAEMN CC(C)CC[C@@](C)(O)CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479052677 567498077 /nfs/dbraw/zinc/49/80/77/567498077.db2.gz BOWNSOCCDCWIQY-BDJLRTHQSA-N 0 1 397.368 3.479 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)[C@H]1Cc3ccccc3CN1)CC2 ZINC000570633455 567501081 /nfs/dbraw/zinc/50/10/81/567501081.db2.gz WESSDXQLGYBBNK-LJQANCHMSA-N 0 1 385.305 3.357 10 0 GGAEMN CCOc1c(Cl)cc(NS(=O)(=O)c2cnc3n2CCC3)cc1Cl ZINC000437647278 567503135 /nfs/dbraw/zinc/50/31/35/567503135.db2.gz BVAIDPFDPTUAGA-UHFFFAOYSA-N 0 1 376.265 3.336 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3cc(Br)cc4nc[nH]c43)n(C)c21 ZINC000503715455 567503317 /nfs/dbraw/zinc/50/33/17/567503317.db2.gz IETVPSXCMQVIDD-UHFFFAOYSA-N 0 1 398.264 3.451 10 0 GGAEMN CC(C)[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC(C)(C)C ZINC000503715377 567503758 /nfs/dbraw/zinc/50/37/58/567503758.db2.gz GYVSGTULKJGHBI-ZDUSSCGKSA-N 0 1 396.285 3.422 10 0 GGAEMN CCc1noc(CC)c1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503724408 567503957 /nfs/dbraw/zinc/50/39/57/567503957.db2.gz CCCLQQFWXGOKBM-UHFFFAOYSA-N 0 1 377.242 3.368 10 0 GGAEMN CC(C)Cn1cnc(S(=O)(=O)N[C@H](c2ccc(F)cc2)C(F)(F)F)c1 ZINC000479115648 567504535 /nfs/dbraw/zinc/50/45/35/567504535.db2.gz MDTYSNXESPJCFK-CQSZACIVSA-N 0 1 379.379 3.260 10 0 GGAEMN Cc1nc(CCNC(=O)c2cc(Br)cc3nc[nH]c32)sc1C ZINC000503760277 567504703 /nfs/dbraw/zinc/50/47/03/567504703.db2.gz TUNNDUOUVJZZDK-UHFFFAOYSA-N 0 1 379.283 3.371 10 0 GGAEMN Cc1cc2n[nH]cc2cc1NS(=O)(=O)c1cc2c(cc1Cl)OCCO2 ZINC000479124455 567505767 /nfs/dbraw/zinc/50/57/67/567505767.db2.gz DKCZJUPJHDROND-UHFFFAOYSA-N 0 1 379.825 3.097 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1cc2c[nH]nc2cc1C ZINC000479128221 567505829 /nfs/dbraw/zinc/50/58/29/567505829.db2.gz INDBTQAYXQWJSE-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)cc3cccnc32)C1 ZINC000570730032 567508497 /nfs/dbraw/zinc/50/84/97/567508497.db2.gz WRSMKSNBVGMAPZ-HUUCEWRRSA-N 0 1 379.254 3.061 10 0 GGAEMN C[C@H](NC(=O)N1C[C@H]2CCC[C@@H](C1)N2)c1cc(F)c(Br)cc1F ZINC000529351209 567509062 /nfs/dbraw/zinc/50/90/62/567509062.db2.gz REKODUBKYQSOCX-GARJFASQSA-N 0 1 388.256 3.324 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1 ZINC000437801003 567509383 /nfs/dbraw/zinc/50/93/83/567509383.db2.gz YJLVLNLJIABYMW-DLBZAZTESA-N 0 1 378.314 3.256 10 0 GGAEMN COc1c(NS(=O)(=O)c2cccc(C(C)C)c2)cc(Cl)cc1C(N)=O ZINC000551473863 567510646 /nfs/dbraw/zinc/51/06/46/567510646.db2.gz SKAMZNFZVQSYHH-UHFFFAOYSA-N 0 1 382.869 3.372 10 0 GGAEMN O=C(N[C@H](CO)c1ccc(Br)cc1)c1n[nH]c2ccc(Cl)cc21 ZINC000503884801 567510971 /nfs/dbraw/zinc/51/09/71/567510971.db2.gz MBTPHEKSOKKNKO-CQSZACIVSA-N 0 1 394.656 3.442 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)CCc2cccc(F)c2Br)n[nH]1 ZINC000458019486 567513910 /nfs/dbraw/zinc/51/39/10/567513910.db2.gz DUTDZQCLSQPPBZ-UHFFFAOYSA-N 0 1 383.265 3.253 10 0 GGAEMN CCOc1cc(CN2CC[C@@H](Cc3cnn(C)c3)C2)cc(Br)c1O ZINC000570799735 567515644 /nfs/dbraw/zinc/51/56/44/567515644.db2.gz LWMOEKUQPPDWAA-ZDUSSCGKSA-N 0 1 394.313 3.352 10 0 GGAEMN CNC(=O)c1ccc(C)c(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503992559 567517643 /nfs/dbraw/zinc/51/76/43/567517643.db2.gz VESALDUJGZLQBU-UHFFFAOYSA-N 0 1 387.237 3.246 10 0 GGAEMN C[C@H](N[C@H](CO)C[C@@H](O)C(C)(C)C)c1ccccc1I ZINC000551573021 567518654 /nfs/dbraw/zinc/51/86/54/567518654.db2.gz YUGJUNUGCHGTQD-SLEUVZQESA-N 0 1 391.293 3.100 10 0 GGAEMN O=S(=O)(c1ccccc1)N1CC[C@H](NCc2ccccc2Br)C1 ZINC000570881776 567521259 /nfs/dbraw/zinc/52/12/59/567521259.db2.gz TXELXRCNXHEYLK-HNNXBMFYSA-N 0 1 395.322 3.002 10 0 GGAEMN Cc1cc(Br)cc(C)c1CNC(=O)NCc1n[nH]c(C(C)(C)C)n1 ZINC000458113160 567522066 /nfs/dbraw/zinc/52/20/66/567522066.db2.gz PZXYAADTFACUJF-UHFFFAOYSA-N 0 1 394.317 3.481 10 0 GGAEMN Cc1[nH]ncc1CNC(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000663690970 567522169 /nfs/dbraw/zinc/52/21/69/567522169.db2.gz WYPYWTRXQBWBGU-AWEZNQCLSA-N 0 1 381.299 3.268 10 0 GGAEMN COC[C@@]1(C(=O)[O-])CCC[N@@H+]1Cc1ccc(Br)c2cccnc12 ZINC000643878439 567522543 /nfs/dbraw/zinc/52/25/43/567522543.db2.gz UDPCZEDVGYTCBQ-QGZVFWFLSA-N 0 1 379.254 3.063 10 0 GGAEMN COC[C@@]1(C(=O)[O-])CCC[N@H+]1Cc1ccc(Br)c2cccnc12 ZINC000643878439 567522550 /nfs/dbraw/zinc/52/25/50/567522550.db2.gz UDPCZEDVGYTCBQ-QGZVFWFLSA-N 0 1 379.254 3.063 10 0 GGAEMN CN(C)C(=O)C1CCN(Cc2c[nH]nc2-c2ccc(Br)s2)CC1 ZINC000529522376 567523535 /nfs/dbraw/zinc/52/35/35/567523535.db2.gz YYSVLGPPUJCCQX-UHFFFAOYSA-N 0 1 397.342 3.201 10 0 GGAEMN COC(=O)[C@@H]1C[C@@H]1[C@@H](C)N[C@@H](C)c1cc2c(cc1Br)OCCO2 ZINC000594922651 567524905 /nfs/dbraw/zinc/52/49/05/567524905.db2.gz GYYRJHRVLSSBPW-LSCVPOLPSA-N 0 1 384.270 3.069 10 0 GGAEMN CCN1CCN(c2nnc([C@H]3CCCS3)n2Cc2cccs2)C[C@@H]1C ZINC000643965961 567525252 /nfs/dbraw/zinc/52/52/52/567525252.db2.gz XPYQKIGQFKRWBL-GOEBONIOSA-N 0 1 377.583 3.486 10 0 GGAEMN Brc1cccc(-c2n[nH]c(-c3noc(C=C[C@H]4CCCO4)n3)n2)c1 ZINC000643966522 567525862 /nfs/dbraw/zinc/52/58/62/567525862.db2.gz XVSPJWVSRMXIDO-NNNHXZLVSA-N 0 1 388.225 3.476 10 0 GGAEMN CCN1CCN(c2nnc([C@@H]3CCCS3)n2Cc2cccs2)C[C@@H]1C ZINC000643965962 567526164 /nfs/dbraw/zinc/52/61/64/567526164.db2.gz XPYQKIGQFKRWBL-HOCLYGCPSA-N 0 1 377.583 3.486 10 0 GGAEMN COc1ccc([C@@H](C)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)cc1Cl ZINC000570964011 567526793 /nfs/dbraw/zinc/52/67/93/567526793.db2.gz BOVJAKGMGJVWLE-TZMCWYRMSA-N 0 1 381.881 3.234 10 0 GGAEMN C[S@](=O)[C@H]1CCC[C@@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000594959640 567529145 /nfs/dbraw/zinc/52/91/45/567529145.db2.gz GFXZQLGFISMSTF-GTVBZTTRSA-N 0 1 387.336 3.353 10 0 GGAEMN CN1CCN(C(C)(C)CNC(=O)N[C@H]2CCCc3sc(Cl)cc32)CC1 ZINC000644100930 567531018 /nfs/dbraw/zinc/53/10/18/567531018.db2.gz IKMHYDQPVGAVSD-AWEZNQCLSA-N 0 1 384.977 3.104 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)c1n[nH]nc1-c1ccccc1 ZINC000504338434 567531237 /nfs/dbraw/zinc/53/12/37/567531237.db2.gz KGBOXSLLCCMSDV-AWEZNQCLSA-N 0 1 399.248 3.488 10 0 GGAEMN Fc1ccc2c(c1)C[C@@H]1[C@H](NCc3ncc(I)s3)[C@H]21 ZINC000594994008 567532606 /nfs/dbraw/zinc/53/26/06/567532606.db2.gz CYWMXKHAZJKVRC-GDLCADMTSA-N 0 1 386.233 3.315 10 0 GGAEMN Cc1ccc2c(c1Br)CN(C(=O)c1csc(=NC3CC3)[nH]1)C2 ZINC000620653930 567533847 /nfs/dbraw/zinc/53/38/47/567533847.db2.gz XESUUQQHEVKPKL-UHFFFAOYSA-N 0 1 378.295 3.366 10 0 GGAEMN COc1ncccc1CN[C@@H]1CCc2ccc(I)cc21 ZINC000595006216 567534537 /nfs/dbraw/zinc/53/45/37/567534537.db2.gz HEGOUFJCDNMFQT-OAHLLOKOSA-N 0 1 380.229 3.472 10 0 GGAEMN C[C@@H](NC[C@@H]1CCC(C)(C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479430529 567534853 /nfs/dbraw/zinc/53/48/53/567534853.db2.gz KZUMLGXFYHTSMC-ZJUUUORDSA-N 0 1 381.325 3.249 10 0 GGAEMN CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2cc(F)c(Br)cc2F)C1 ZINC000529661397 567537328 /nfs/dbraw/zinc/53/73/28/567537328.db2.gz CMAVIPRZTPAALL-GHMZBOCLSA-N 0 1 382.270 3.173 10 0 GGAEMN CS(=O)(=O)[C@H]1CCC[C@@H](NCc2cc(F)c(Br)cc2F)C1 ZINC000529661409 567538226 /nfs/dbraw/zinc/53/82/26/567538226.db2.gz CMAVIPRZTPAALL-MNOVXSKESA-N 0 1 382.270 3.173 10 0 GGAEMN CNC(=O)c1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1Cl ZINC000479497551 567541017 /nfs/dbraw/zinc/54/10/17/567541017.db2.gz ASBSCSNFZDTDSX-UHFFFAOYSA-N 0 1 381.866 3.110 10 0 GGAEMN O=C(Cc1sccc1Br)NC[C@@H]1CCN1Cc1ccccc1 ZINC000620777081 567541491 /nfs/dbraw/zinc/54/14/91/567541491.db2.gz CWOIDNYGDRTBKT-AWEZNQCLSA-N 0 1 379.323 3.444 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)NC[C@H]1CCN1Cc1ccccc1 ZINC000620778672 567541722 /nfs/dbraw/zinc/54/17/22/567541722.db2.gz HGPKXKYDXYLRCN-QGZVFWFLSA-N 0 1 389.293 3.088 10 0 GGAEMN C[C@H]1CN(C(=O)c2cccc(Br)c2O)C[C@@H](CC(F)(F)F)O1 ZINC000620801653 567542837 /nfs/dbraw/zinc/54/28/37/567542837.db2.gz QEAYHFVITAANDZ-DTWKUNHWSA-N 0 1 382.176 3.337 10 0 GGAEMN CC(C)[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)c1s[n-]c(=O)c1Cl ZINC000529703667 567543328 /nfs/dbraw/zinc/54/33/28/567543328.db2.gz XHFLAWBOGPPVGW-CQSZACIVSA-N 0 1 379.913 3.485 10 0 GGAEMN CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)c1s[n-]c(=O)c1Cl ZINC000529703667 567543336 /nfs/dbraw/zinc/54/33/36/567543336.db2.gz XHFLAWBOGPPVGW-CQSZACIVSA-N 0 1 379.913 3.485 10 0 GGAEMN COC[C@H](CN1CCC[C@@H]1c1ccc(I)cc1)OC ZINC000595333577 567554664 /nfs/dbraw/zinc/55/46/64/567554664.db2.gz KMUGHOSHGMTNGI-LSDHHAIUSA-N 0 1 375.250 3.090 10 0 GGAEMN C[C@@H](NC(=O)[C@H]1CCc2[nH]cnc2C1)c1cc(F)c(Br)cc1F ZINC000529750529 567545086 /nfs/dbraw/zinc/54/50/86/567545086.db2.gz MJSDRKFHOSYMIJ-BDAKNGLRSA-N 0 1 384.224 3.433 10 0 GGAEMN CN(CC1=CCSC1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000620852195 567547798 /nfs/dbraw/zinc/54/77/98/567547798.db2.gz YTAZQKRGKGSMOO-UHFFFAOYSA-N 0 1 379.279 3.036 10 0 GGAEMN Fc1ccc([C@H](NCCNc2cccc(Br)c2)c2c[nH]nn2)cc1 ZINC000438825442 567548695 /nfs/dbraw/zinc/54/86/95/567548695.db2.gz ITAPYYLWKCKJPO-KRWDZBQOSA-N 0 1 390.260 3.497 10 0 GGAEMN O=C(NC1(c2ccc(Br)cc2)CCOCC1)c1[nH]nc2c1CCC2 ZINC000620893773 567548883 /nfs/dbraw/zinc/54/88/83/567548883.db2.gz PSDRRQOJQVRSMF-UHFFFAOYSA-N 0 1 390.281 3.097 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCC[C@@H]2c2ccc(Br)cn2)n[nH]1 ZINC000458541305 567552049 /nfs/dbraw/zinc/55/20/49/567552049.db2.gz ANKDFXLKDHASAW-MEDUHNTESA-N 0 1 392.301 3.353 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)CCc2cccc(Br)c2)CC1 ZINC000529911960 567555055 /nfs/dbraw/zinc/55/50/55/567555055.db2.gz GDNCRIINMKTCEE-UHFFFAOYSA-N 0 1 395.341 3.095 10 0 GGAEMN Cc1c(Br)scc1C(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000529909231 567555238 /nfs/dbraw/zinc/55/52/38/567555238.db2.gz GZXCSVPZNRSOES-UHFFFAOYSA-N 0 1 387.343 3.146 10 0 GGAEMN Cc1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc(OCCO)c1 ZINC000505072425 567557469 /nfs/dbraw/zinc/55/74/69/567557469.db2.gz WXRJPHDCKUQVCL-UHFFFAOYSA-N 0 1 390.237 3.257 10 0 GGAEMN C[C@@H](CC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000571373064 567557885 /nfs/dbraw/zinc/55/78/85/567557885.db2.gz UVOCVINYVNQVHQ-JQWIXIFHSA-N 0 1 380.261 3.479 10 0 GGAEMN CCC[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OCC ZINC000505081359 567558591 /nfs/dbraw/zinc/55/85/91/567558591.db2.gz XUASLFYFLBCQNQ-JTQLQIEISA-N 0 1 382.258 3.035 10 0 GGAEMN CN(C(=O)NCc1ccc(Cl)cn1)C1CCN(CCC(F)(F)F)CC1 ZINC000458625790 567558801 /nfs/dbraw/zinc/55/88/01/567558801.db2.gz UFTKVDJFDAQFJG-UHFFFAOYSA-N 0 1 378.826 3.293 10 0 GGAEMN CCC[C@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OCC ZINC000505081363 567558875 /nfs/dbraw/zinc/55/88/75/567558875.db2.gz XUASLFYFLBCQNQ-SNVBAGLBSA-N 0 1 382.258 3.035 10 0 GGAEMN CN1CC[C@H](CNC(=O)N2C[C@@H]3C[C@H]2CS3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000458628112 567560069 /nfs/dbraw/zinc/56/00/69/567560069.db2.gz WFWSMIUKRZPUBG-FHIRATQRSA-N 0 1 383.920 3.371 10 0 GGAEMN CCOC(=O)CC1(NC(=O)c2cc(Br)cc3nc[nH]c32)CCCC1 ZINC000505118137 567560107 /nfs/dbraw/zinc/56/01/07/567560107.db2.gz UCFAEIIPBGBVAB-UHFFFAOYSA-N 0 1 394.269 3.321 10 0 GGAEMN CO[C@@H](CCNC(=O)c1cc(Br)cc2nc[nH]c21)C(F)(F)F ZINC000505114708 567560370 /nfs/dbraw/zinc/56/03/70/567560370.db2.gz RJMJDIWOXGEPPF-JTQLQIEISA-N 0 1 380.164 3.023 10 0 GGAEMN CC[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC(C)(C)C ZINC000571418955 567560719 /nfs/dbraw/zinc/56/07/19/567560719.db2.gz KUWGODDOMQFVHF-LLVKDONJSA-N 0 1 382.258 3.176 10 0 GGAEMN Cc1cc(Br)cc(Cl)c1C(=O)NCCCCN1CCOCC1 ZINC000479814309 567561126 /nfs/dbraw/zinc/56/11/26/567561126.db2.gz KFQPHNBBGSUMBF-UHFFFAOYSA-N 0 1 389.721 3.253 10 0 GGAEMN C[C@@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@](C)(C(F)F)O1 ZINC000621129698 567561719 /nfs/dbraw/zinc/56/17/19/567561719.db2.gz NPBXZPDAIDHBKP-GLEZIHRCSA-N 0 1 388.212 3.210 10 0 GGAEMN C[C@@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@](C)(C(F)F)O1 ZINC000621129696 567562003 /nfs/dbraw/zinc/56/20/03/567562003.db2.gz NPBXZPDAIDHBKP-ANRSDYALSA-N 0 1 388.212 3.210 10 0 GGAEMN COc1ccc([C@@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C2CC2)cc1 ZINC000571426695 567562164 /nfs/dbraw/zinc/56/21/64/567562164.db2.gz ZFSVFXGTNVXEEN-SFHVURJKSA-N 0 1 380.535 3.248 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031410 567562209 /nfs/dbraw/zinc/56/22/09/567562209.db2.gz IKLNZILZZVMENS-PXAZEXFGSA-N 0 1 381.307 3.241 10 0 GGAEMN COc1ccc([C@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C2CC2)cc1 ZINC000571426694 567562592 /nfs/dbraw/zinc/56/25/92/567562592.db2.gz ZFSVFXGTNVXEEN-GOSISDBHSA-N 0 1 380.535 3.248 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530031413 567562612 /nfs/dbraw/zinc/56/26/12/567562612.db2.gz IKLNZILZZVMENS-YVEFUNNKSA-N 0 1 381.307 3.241 10 0 GGAEMN O[C@H](CCNCc1ncc(Br)cc1Br)C(F)(F)F ZINC000571448789 567563692 /nfs/dbraw/zinc/56/36/92/567563692.db2.gz WZJNFRXOVIBABE-SECBINFHSA-N 0 1 392.013 3.010 10 0 GGAEMN O[C@@H](CCNCc1ncc(Br)cc1Br)C(F)(F)F ZINC000571448790 567563562 /nfs/dbraw/zinc/56/35/62/567563562.db2.gz WZJNFRXOVIBABE-VIFPVBQESA-N 0 1 392.013 3.010 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1cn(C(C)(C)C)nn1)c1ccc(Cl)c(Cl)c1 ZINC000530032143 567563757 /nfs/dbraw/zinc/56/37/57/567563757.db2.gz FWYHYSYGTZXQEZ-CQSZACIVSA-N 0 1 384.311 3.373 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000552143579 567563973 /nfs/dbraw/zinc/56/39/73/567563973.db2.gz DETFKZZGUMHRCJ-HNNXBMFYSA-N 0 1 382.291 3.256 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc(Cl)c(Cl)c1 ZINC000530033640 567564217 /nfs/dbraw/zinc/56/42/17/567564217.db2.gz PYIMUAZNTBKQSI-HNNXBMFYSA-N 0 1 382.295 3.028 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)NCc1n[nH]c(C(C)C)n1 ZINC000458686312 567564376 /nfs/dbraw/zinc/56/43/76/567564376.db2.gz FYKLRULYVAWNDJ-SNVBAGLBSA-N 0 1 396.289 3.260 10 0 GGAEMN O=C(NC[C@@H](CO)CC1CCCC1)c1cc(Br)cc2nc[nH]c21 ZINC000505185587 567564413 /nfs/dbraw/zinc/56/44/13/567564413.db2.gz RBMHDPXWKFMSNW-LBPRGKRZSA-N 0 1 380.286 3.244 10 0 GGAEMN O=C(Nc1ccc(N2CCC2=O)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000505247805 567567226 /nfs/dbraw/zinc/56/72/26/567567226.db2.gz SKLUKPQURJRZAS-UHFFFAOYSA-N 0 1 385.221 3.314 10 0 GGAEMN C[C@]12CCN(C(=O)c3c[nH]c4ccc(Br)cc4c3=O)C[C@H]1C2(F)F ZINC000552226426 567569055 /nfs/dbraw/zinc/56/90/55/567569055.db2.gz YUHSWTXTPSUIGK-CJNGLKHVSA-N 0 1 397.219 3.408 10 0 GGAEMN C[C@@]12CCN(C(=O)c3c[nH]c4ccc(Br)cc4c3=O)C[C@@H]1C2(F)F ZINC000552226428 567569200 /nfs/dbraw/zinc/56/92/00/567569200.db2.gz YUHSWTXTPSUIGK-XJKSGUPXSA-N 0 1 397.219 3.408 10 0 GGAEMN CCOc1c(Br)cc(Cl)cc1NC(=O)N(C)Cc1nnc[nH]1 ZINC000479915368 567569379 /nfs/dbraw/zinc/56/93/79/567569379.db2.gz RLQQSGIVXNHLLS-UHFFFAOYSA-N 0 1 388.653 3.283 10 0 GGAEMN COCCC1CCN(CN2CC[C@@H](c3cccc(Br)c3)C2=O)CC1 ZINC000530093930 567570816 /nfs/dbraw/zinc/57/08/16/567570816.db2.gz GRHSLMDMKZPWKM-SFHVURJKSA-N 0 1 395.341 3.471 10 0 GGAEMN Brc1cnc(NC2(CN3CCN(c4ccccc4)CC3)CC2)nc1 ZINC000664465297 567570868 /nfs/dbraw/zinc/57/08/68/567570868.db2.gz KABYWUIQQPRCLR-UHFFFAOYSA-N 0 1 388.313 3.006 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)N1CCOc2cc(Br)ccc2C1 ZINC000664471303 567570900 /nfs/dbraw/zinc/57/09/00/567570900.db2.gz ZNUHCODKAFHGID-CQSZACIVSA-N 0 1 391.269 3.154 10 0 GGAEMN NC(=O)[C@H](NC[C@H]1CCN1C1CCCCC1)c1ccc(Br)cc1F ZINC000530128909 567571822 /nfs/dbraw/zinc/57/18/22/567571822.db2.gz DDMJAOFIEYWJKR-RHSMWYFYSA-N 0 1 398.320 3.111 10 0 GGAEMN Cc1ccc(CCS(=O)(=O)c2nc3cc(Br)c(C)[nH]c-3n2)cc1 ZINC000479976908 567573356 /nfs/dbraw/zinc/57/33/56/567573356.db2.gz SFUHKIYOOORBBV-UHFFFAOYSA-N 0 1 394.294 3.354 10 0 GGAEMN CN(CCc1nnnn1-c1ccccc1)Cc1cc(Br)ccc1F ZINC000621276265 567573258 /nfs/dbraw/zinc/57/32/58/567573258.db2.gz JIVQFMBIYDGBDZ-UHFFFAOYSA-N 0 1 390.260 3.238 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(F)c(Br)c1 ZINC000439231130 567573537 /nfs/dbraw/zinc/57/35/37/567573537.db2.gz AHXYYSDDCKKHAY-TXEJJXNPSA-N 0 1 393.322 3.129 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccc(F)c(Br)c1 ZINC000439231132 567573890 /nfs/dbraw/zinc/57/38/90/567573890.db2.gz AHXYYSDDCKKHAY-VXGBXAGGSA-N 0 1 393.322 3.129 10 0 GGAEMN CC(C)c1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)on1 ZINC000505417336 567574531 /nfs/dbraw/zinc/57/45/31/567574531.db2.gz XQEXDTZSOCVJAT-UHFFFAOYSA-N 0 1 390.241 3.276 10 0 GGAEMN CC(C)c1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)on1 ZINC000505417336 567574537 /nfs/dbraw/zinc/57/45/37/567574537.db2.gz XQEXDTZSOCVJAT-UHFFFAOYSA-N 0 1 390.241 3.276 10 0 GGAEMN COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(CCOc2ccc(SC)cc2)C1 ZINC000595628918 567575305 /nfs/dbraw/zinc/57/53/05/567575305.db2.gz LLJUYTLBMJOKPP-OLZOCXBDSA-N 0 1 377.428 3.461 10 0 GGAEMN Cc1c(Br)c2ccccc2n1CC(=O)NCc1n[nH]c(C2CC2)n1 ZINC000571613873 567576505 /nfs/dbraw/zinc/57/65/05/567576505.db2.gz SLOVAOWTRSORGT-UHFFFAOYSA-N 0 1 388.269 3.024 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166711 567577402 /nfs/dbraw/zinc/57/74/02/567577402.db2.gz SJVPNVUKNDZNDK-RYUDHWBXSA-N 0 1 376.678 3.475 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166711 567577405 /nfs/dbraw/zinc/57/74/05/567577405.db2.gz SJVPNVUKNDZNDK-RYUDHWBXSA-N 0 1 376.678 3.475 10 0 GGAEMN CCn1nc(C)cc1NS(=O)(=O)c1cc(Cl)ccc1OCCCOC ZINC000530157667 567578456 /nfs/dbraw/zinc/57/84/56/567578456.db2.gz HINMIHNBFOGFIP-UHFFFAOYSA-N 0 1 387.889 3.081 10 0 GGAEMN CN1CCN(C(=O)c2n[nH]c3ccc(Br)cc32)C2(CCCCC2)C1 ZINC000480059679 567578886 /nfs/dbraw/zinc/57/88/86/567578886.db2.gz INFRIICLMPNVED-UHFFFAOYSA-N 0 1 391.313 3.416 10 0 GGAEMN C[C@@H](NCC(=O)Nc1nc2c(s1)CCCC2)[C@@H]1OCCc2sccc21 ZINC000644785618 567579379 /nfs/dbraw/zinc/57/93/79/567579379.db2.gz FTXLONOYAUBGAR-DIFFPNOSSA-N 0 1 377.535 3.314 10 0 GGAEMN C[C@@H](NCC(=O)Nc1nc2c(s1)CCCC2)[C@H]1OCCc2sccc21 ZINC000644785620 567579513 /nfs/dbraw/zinc/57/95/13/567579513.db2.gz FTXLONOYAUBGAR-PIGZYNQJSA-N 0 1 377.535 3.314 10 0 GGAEMN O=C([O-])[C@@H]1c2ccoc2CC[N@@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000530171162 567579916 /nfs/dbraw/zinc/57/99/16/567579916.db2.gz WITOHVHUQCQSRO-ZBEGNZNMSA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)[N@@H+]1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000530180114 567579960 /nfs/dbraw/zinc/57/99/60/567579960.db2.gz RPOZLSQZEOEAJL-GFQSEFKGSA-N 0 1 376.280 3.307 10 0 GGAEMN O=C([O-])[C@@H]1c2ccoc2CC[N@@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000530169714 567580241 /nfs/dbraw/zinc/58/02/41/567580241.db2.gz RRHAJYZLWPBFBX-BONVTDFDSA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cc(Cl)ccc1OC(F)F ZINC000552340022 567580708 /nfs/dbraw/zinc/58/07/08/567580708.db2.gz JFDMUGLEJKAPCQ-WCQYABFASA-N 0 1 396.887 3.406 10 0 GGAEMN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1nc(-c2ccccc2)cs1 ZINC000552340453 567580842 /nfs/dbraw/zinc/58/08/42/567580842.db2.gz VICJRXLQVYBZLO-GOEBONIOSA-N 0 1 379.551 3.275 10 0 GGAEMN COc1cc(CCCNCc2c(F)cncc2Br)cc(OC)c1O ZINC000621391446 567582733 /nfs/dbraw/zinc/58/27/33/567582733.db2.gz FRWCHSWTOMMGLZ-UHFFFAOYSA-N 0 1 399.260 3.428 10 0 GGAEMN Ic1ccc(-c2nc(CN3CCC4(COC4)C3)co2)cc1 ZINC000595832086 567585676 /nfs/dbraw/zinc/58/56/76/567585676.db2.gz BEWKARJQNZYEAG-UHFFFAOYSA-N 0 1 396.228 3.169 10 0 GGAEMN O=S1(=O)C[C@H](CN[C@@H]2CCSc3ccc(F)cc32)Oc2ccccc21 ZINC000571761664 567586553 /nfs/dbraw/zinc/58/65/53/567586553.db2.gz NHEPFLMHIQYFQF-DZGCQCFKSA-N 0 1 379.478 3.187 10 0 GGAEMN COc1cc2nccc(N3CCC(OCCCO)CC3)c2cc1Br ZINC000644872095 567586550 /nfs/dbraw/zinc/58/65/50/567586550.db2.gz FIPCKMCTFLGXNF-UHFFFAOYSA-N 0 1 395.297 3.374 10 0 GGAEMN Cc1csc([C@H](C)NC[C@@H](O)COc2cc(F)cc(Br)c2)n1 ZINC000439451097 567587103 /nfs/dbraw/zinc/58/71/03/567587103.db2.gz LIQYFQBKERBHNI-GXFFZTMASA-N 0 1 389.290 3.444 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC[C@@H](c2ccncc2)C1 ZINC000552396323 567587696 /nfs/dbraw/zinc/58/76/96/567587696.db2.gz MVFQRZOZWKHGTL-CYBMUJFWSA-N 0 1 398.260 3.315 10 0 GGAEMN C[C@@H](O)CN1CCN(c2nnc(-c3cc(Cl)cc(Cl)c3)s2)[C@@H](C)C1 ZINC000480197957 567587801 /nfs/dbraw/zinc/58/78/01/567587801.db2.gz HSOURFCNVXKOMT-WDEREUQCSA-N 0 1 387.336 3.403 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC[C@H](O)CC12CCC2 ZINC000571788494 567589202 /nfs/dbraw/zinc/58/92/02/567589202.db2.gz XXHPVKAFMGIAKX-ZDUSSCGKSA-N 0 1 390.281 3.359 10 0 GGAEMN CCCc1ncc(CNC[C@@H](O)COc2cc(F)cc(Br)c2)o1 ZINC000571791285 567589663 /nfs/dbraw/zinc/58/96/63/567589663.db2.gz WGFOVIFWZPTONL-CYBMUJFWSA-N 0 1 387.249 3.058 10 0 GGAEMN O=C(NCc1ccnc(OC(F)F)c1)c1cc(Br)cc2nc[nH]c21 ZINC000552433419 567590227 /nfs/dbraw/zinc/59/02/27/567590227.db2.gz INBBEYSUFMXGPZ-UHFFFAOYSA-N 0 1 397.179 3.252 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CC[C@H](Cc3ccc(Br)cc3)C2)C1 ZINC000644943368 567592449 /nfs/dbraw/zinc/59/24/49/567592449.db2.gz JWNXCPWEZOPHIU-NVXWUHKLSA-N 0 1 380.330 3.117 10 0 GGAEMN Cc1nccc(NC(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1Br ZINC000530354405 567595241 /nfs/dbraw/zinc/59/52/41/567595241.db2.gz CXCSHUWXWIKKSM-NVXWUHKLSA-N 0 1 389.297 3.141 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2ccn(-c3ccc(Br)cc3)n2)n[nH]1 ZINC000480319483 567595951 /nfs/dbraw/zinc/59/59/51/567595951.db2.gz LNYQQOWSFXEJDV-LLVKDONJSA-N 0 1 388.269 3.027 10 0 GGAEMN O=C1c2ccccc2C(=O)N1CCN[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000552576508 567597570 /nfs/dbraw/zinc/59/75/70/567597570.db2.gz ZDUDGLPNLAZDKQ-CQSZACIVSA-N 0 1 377.227 3.313 10 0 GGAEMN O=C(Nc1ccn(-c2ccncc2)n1)c1cc2c(cccc2Br)[nH]1 ZINC000505819587 567598090 /nfs/dbraw/zinc/59/80/90/567598090.db2.gz OHDHABQPGFKEEH-UHFFFAOYSA-N 0 1 382.221 3.185 10 0 GGAEMN COCc1nc(CNC(=O)N[C@@H](c2c(Cl)cccc2Cl)C2CC2)n[nH]1 ZINC000664918833 567598975 /nfs/dbraw/zinc/59/89/75/567598975.db2.gz CAFSGGXCKNJDJY-OAHLLOKOSA-N 0 1 384.267 3.208 10 0 GGAEMN COCc1nnc(CNC(=O)N[C@@H](c2c(Cl)cccc2Cl)C2CC2)[nH]1 ZINC000664918833 567598977 /nfs/dbraw/zinc/59/89/77/567598977.db2.gz CAFSGGXCKNJDJY-OAHLLOKOSA-N 0 1 384.267 3.208 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000530413855 567599068 /nfs/dbraw/zinc/59/90/68/567599068.db2.gz MUNTYMOPIRUVKA-HIFRSBDPSA-N 0 1 379.917 3.133 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000530413855 567599071 /nfs/dbraw/zinc/59/90/71/567599071.db2.gz MUNTYMOPIRUVKA-HIFRSBDPSA-N 0 1 379.917 3.133 10 0 GGAEMN Cc1ccc2c(c1Br)CN(C(=O)NCc1n[nH]c(C(C)C)n1)C2 ZINC000664990581 567604839 /nfs/dbraw/zinc/60/48/39/567604839.db2.gz OIZSPCMWNOTJEV-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN CN(C(=O)[C@@H]1CCCc2[nH]ncc21)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000480443121 567606133 /nfs/dbraw/zinc/60/61/33/567606133.db2.gz SGLGJDUHHJMZER-LWNYNHHKSA-N 0 1 380.275 3.253 10 0 GGAEMN CC1(C)CCC[C@@](O)(CNC(=O)c2cc(Br)cc3nc[nH]c32)C1 ZINC000506015285 567606215 /nfs/dbraw/zinc/60/62/15/567606215.db2.gz RIRGONQPRCMZBE-KRWDZBQOSA-N 0 1 380.286 3.387 10 0 GGAEMN COCCN1CCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621752312 567608326 /nfs/dbraw/zinc/60/83/26/567608326.db2.gz XUXRABSCPDCKHL-CABCVRRESA-N 0 1 377.273 3.456 10 0 GGAEMN C[C@@H](CN[C@@H](c1ccc(Br)cc1)C(F)F)CN1CCOCC1 ZINC000621752960 567608771 /nfs/dbraw/zinc/60/87/71/567608771.db2.gz FQSOVIXOPFPXQP-WFASDCNBSA-N 0 1 377.273 3.313 10 0 GGAEMN OCCCN1CCC[C@@H](N[C@@H](c2ccc(Br)cc2)C(F)F)C1 ZINC000621762402 567609872 /nfs/dbraw/zinc/60/98/72/567609872.db2.gz BLBMZVXTZCAKAB-CABCVRRESA-N 0 1 377.273 3.192 10 0 GGAEMN OCCN1CCCC[C@@H]1CN[C@H](c1ccc(Br)cc1)C(F)F ZINC000621763251 567610713 /nfs/dbraw/zinc/61/07/13/567610713.db2.gz UPXBMJRKXSPKDB-HUUCEWRRSA-N 0 1 377.273 3.192 10 0 GGAEMN CC(C)CCOCCNC(=O)CN[C@@H](C)c1ccc(F)c(Br)c1 ZINC000645195201 567611311 /nfs/dbraw/zinc/61/13/11/567611311.db2.gz VNSHRXWPCUOPSP-ZDUSSCGKSA-N 0 1 389.309 3.418 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1ccc(F)c(Br)c1 ZINC000645194471 567611396 /nfs/dbraw/zinc/61/13/96/567611396.db2.gz YFQIBRDUMLYPBM-ZLIFDBKOSA-N 0 1 399.304 3.409 10 0 GGAEMN CC(C)N1C(=O)CN(Cc2nc3ccc(Br)cc3[nH]2)CC1(C)C ZINC000480550688 567611354 /nfs/dbraw/zinc/61/13/54/567611354.db2.gz MGMKTTKYFRLVSJ-UHFFFAOYSA-N 0 1 379.302 3.157 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1ccc(F)c(Br)c1 ZINC000645194469 567612044 /nfs/dbraw/zinc/61/20/44/567612044.db2.gz YFQIBRDUMLYPBM-JCURWCKSSA-N 0 1 399.304 3.409 10 0 GGAEMN O=C(NC[C@@H]([NH2+]Cc1ccccc1)c1ccco1)c1s[n-]c(=O)c1Cl ZINC000552870733 567614774 /nfs/dbraw/zinc/61/47/74/567614774.db2.gz PNFHSUJAIJKZMB-GFCCVEGCSA-N 0 1 377.853 3.356 10 0 GGAEMN CS[C@H]1CN(c2nc(C3CC3)ncc2Br)C[C@@H]1N1CCCC1 ZINC000596195015 567615015 /nfs/dbraw/zinc/61/50/15/567615015.db2.gz KTSBNQZKRGVYPT-KBPBESRZSA-N 0 1 383.359 3.133 10 0 GGAEMN O=S(=O)(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000440098610 567617070 /nfs/dbraw/zinc/61/70/70/567617070.db2.gz PAJUYZQSVBVHMJ-UHFFFAOYSA-N 0 1 397.287 3.300 10 0 GGAEMN O=C(NCCCN1CCN(c2cccc(Cl)c2)CC1)c1sccc1F ZINC000645331447 567619189 /nfs/dbraw/zinc/61/91/89/567619189.db2.gz AZYLVHBHGBKTCA-UHFFFAOYSA-N 0 1 381.904 3.483 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)C(C)(C)c1cnc[nH]1 ZINC000621942193 567623089 /nfs/dbraw/zinc/62/30/89/567623089.db2.gz NXGKNUOCVCSVQK-NHYWBVRUSA-N 0 1 380.286 3.342 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)C(C)(C)c1cnc[nH]1 ZINC000621942194 567623821 /nfs/dbraw/zinc/62/38/21/567623821.db2.gz NXGKNUOCVCSVQK-XHDPSFHLSA-N 0 1 380.286 3.342 10 0 GGAEMN O=S(=O)(CCCC1CCOCC1)NC[C@H](c1cccs1)N1CCCC1 ZINC000645434241 567624695 /nfs/dbraw/zinc/62/46/95/567624695.db2.gz KSNYMNYAQATUCU-QGZVFWFLSA-N 0 1 386.583 3.011 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNCc3cnc(C4CC4)nc3)n2)cc1 ZINC000459457346 567625825 /nfs/dbraw/zinc/62/58/25/567625825.db2.gz GRFLFELMRVTAIJ-UHFFFAOYSA-N 0 1 385.269 3.191 10 0 GGAEMN CCc1ccc(S(=O)(=O)N(CCN(C)C)Cc2cccc(OC)c2)s1 ZINC000480745927 567626109 /nfs/dbraw/zinc/62/61/09/567626109.db2.gz AMORDEJNKXCSQT-UHFFFAOYSA-N 0 1 382.551 3.072 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NCc1cn2cccnc2n1 ZINC000459465492 567627012 /nfs/dbraw/zinc/62/70/12/567627012.db2.gz NLRKHZHFRLLRRM-MLGOLLRUSA-N 0 1 375.270 3.358 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NCc1cn2cccnc2n1 ZINC000459465489 567627746 /nfs/dbraw/zinc/62/77/46/567627746.db2.gz NLRKHZHFRLLRRM-BLLLJJGKSA-N 0 1 375.270 3.358 10 0 GGAEMN N#Cc1ccc(S(=O)(=O)CCN[C@H](c2ccc(Cl)cc2)C2CC2)nc1 ZINC000572279164 567628224 /nfs/dbraw/zinc/62/82/24/567628224.db2.gz VUDBRZBBGLBGJX-SFHVURJKSA-N 0 1 375.881 3.121 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3cc(Br)c[nH]c3=O)cccc21 ZINC000621980132 567628237 /nfs/dbraw/zinc/62/82/37/567628237.db2.gz KEFPRFVGCLFLSN-CQSZACIVSA-N 0 1 392.253 3.187 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3cc(Br)c[nH]c3=O)cccc21 ZINC000621980131 567628250 /nfs/dbraw/zinc/62/82/50/567628250.db2.gz KEFPRFVGCLFLSN-AWEZNQCLSA-N 0 1 392.253 3.187 10 0 GGAEMN COc1cccc([C@H](CNC(=O)c2cncc(Br)c2C)N(C)C)c1 ZINC000665536838 567628669 /nfs/dbraw/zinc/62/86/69/567628669.db2.gz ZVQJDKHSXYYKPO-KRWDZBQOSA-N 0 1 392.297 3.194 10 0 GGAEMN N#Cc1ccc(S(=O)(=O)CCN[C@@H](c2ccc(Cl)cc2)C2CC2)nc1 ZINC000572279163 567628702 /nfs/dbraw/zinc/62/87/02/567628702.db2.gz VUDBRZBBGLBGJX-GOSISDBHSA-N 0 1 375.881 3.121 10 0 GGAEMN COc1cccc([C@@H](CNC(=O)c2cncc(Br)c2C)N(C)C)c1 ZINC000665536839 567628754 /nfs/dbraw/zinc/62/87/54/567628754.db2.gz ZVQJDKHSXYYKPO-QGZVFWFLSA-N 0 1 392.297 3.194 10 0 GGAEMN [O-]c1cccc(C[NH2+]C[C@@H](CO)Cc2ccc(F)c(F)c2)c1Br ZINC000459509058 567633003 /nfs/dbraw/zinc/63/30/03/567633003.db2.gz BGCSYBZNQDYNQM-LBPRGKRZSA-N 0 1 386.236 3.374 10 0 GGAEMN Cc1ccsc1[C@H](CO)NC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C ZINC000530994597 567635304 /nfs/dbraw/zinc/63/53/04/567635304.db2.gz MDMKHOKALXWPLI-JKSUJKDBSA-N 0 1 381.929 3.345 10 0 GGAEMN CC[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCN1CC(F)F ZINC000480857583 567636225 /nfs/dbraw/zinc/63/62/25/567636225.db2.gz ZCEORUGXRSZVHB-LBPRGKRZSA-N 0 1 387.272 3.487 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@H](C)NC(=O)c2ccc(Br)s2)n1 ZINC000572403489 567637141 /nfs/dbraw/zinc/63/71/41/567637141.db2.gz MHRCKRBKTSRIRM-DTWKUNHWSA-N 0 1 387.303 3.431 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2ccc(-c3csc(C)n3)s2)[nH]1 ZINC000531043878 567639094 /nfs/dbraw/zinc/63/90/94/567639094.db2.gz LJNGXMHKZGTGPA-UHFFFAOYSA-N 0 1 379.536 3.405 10 0 GGAEMN O=C1NCCN(Cc2nc3ccc(Br)cc3[nH]2)[C@@H]1c1cccs1 ZINC000480888287 567640421 /nfs/dbraw/zinc/64/04/21/567640421.db2.gz HTGCKQNVJMDQSR-OAHLLOKOSA-N 0 1 391.294 3.060 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000596622837 567644169 /nfs/dbraw/zinc/64/41/69/567644169.db2.gz JKRZAPCKJZPQPR-JTQLQIEISA-N 0 1 381.217 3.066 10 0 GGAEMN CO[C@H](CS(=O)(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)C(C)C ZINC000645596055 567645096 /nfs/dbraw/zinc/64/50/96/567645096.db2.gz DWGJTIONQYTBBX-HZPDHXFCSA-N 0 1 385.917 3.354 10 0 GGAEMN Cc1cccc2nc(CNC[C@@H](O)COc3c(Cl)cccc3Cl)cn21 ZINC000572512166 567645453 /nfs/dbraw/zinc/64/54/53/567645453.db2.gz IKHBCMRLQSUOIC-CQSZACIVSA-N 0 1 380.275 3.479 10 0 GGAEMN NC1(c2noc(-c3ccc4cc(I)ccc4n3)n2)CCC1 ZINC000572521712 567646647 /nfs/dbraw/zinc/64/66/47/567646647.db2.gz QJBLXCPDEGGCDP-UHFFFAOYSA-N 0 1 392.200 3.227 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)Cc2ccc(Br)cc2O)n[nH]1 ZINC000506863204 567646943 /nfs/dbraw/zinc/64/69/43/567646943.db2.gz VSPZDCHYQLFQKX-NXEZZACHSA-N 0 1 381.274 3.206 10 0 GGAEMN O=C(NCCOc1cccc(Br)c1)c1cc2[nH]cnc2cc1F ZINC000553368817 567647691 /nfs/dbraw/zinc/64/76/91/567647691.db2.gz PXFZETPZLQZQEM-UHFFFAOYSA-N 0 1 378.201 3.273 10 0 GGAEMN CC1(C)C[N@H+](C2(CNC(=O)c3s[n-]c(=O)c3Cl)CCCCC2)CCO1 ZINC000622362401 567647847 /nfs/dbraw/zinc/64/78/47/567647847.db2.gz UUGJWBVPBSUIAE-UHFFFAOYSA-N 0 1 387.933 3.046 10 0 GGAEMN C[C@@H](C1CC1)N(C)S(=O)(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000531244993 567649341 /nfs/dbraw/zinc/64/93/41/567649341.db2.gz IOLAGVPRNPSZMQ-ZBEGNZNMSA-N 0 1 382.917 3.328 10 0 GGAEMN O=S(=O)(NCCOc1ccc(F)cc1F)c1c(Cl)ccc(F)c1F ZINC000553424791 567652503 /nfs/dbraw/zinc/65/25/03/567652503.db2.gz SNWCZDWWLSLGJA-UHFFFAOYSA-N 0 1 383.750 3.254 10 0 GGAEMN CCN(Cc1cc(Br)ccc1F)C(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000666087060 567654505 /nfs/dbraw/zinc/65/45/05/567654505.db2.gz MHLALDOWUDZYOL-NSHDSACASA-N 0 1 380.261 3.465 10 0 GGAEMN OC[C@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000459719677 567655289 /nfs/dbraw/zinc/65/52/89/567655289.db2.gz NVTYWIFQPDWVTN-KRWDZBQOSA-N 0 1 382.323 3.497 10 0 GGAEMN COCc1nc(CNC(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)n[nH]1 ZINC000666122741 567655470 /nfs/dbraw/zinc/65/54/70/567655470.db2.gz VESNSDPEFBAYDJ-UHFFFAOYSA-N 0 1 384.267 3.132 10 0 GGAEMN COCc1nnc(CNC(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)[nH]1 ZINC000666122741 567655472 /nfs/dbraw/zinc/65/54/72/567655472.db2.gz VESNSDPEFBAYDJ-UHFFFAOYSA-N 0 1 384.267 3.132 10 0 GGAEMN OC[C@@H](NCc1nc2ccc(Br)cc2[nH]1)c1c(F)cccc1F ZINC000481068519 567655858 /nfs/dbraw/zinc/65/58/58/567655858.db2.gz IIFLJJLQKFDSQN-CQSZACIVSA-N 0 1 382.208 3.427 10 0 GGAEMN CC(C)N1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CC1 ZINC000666141121 567656874 /nfs/dbraw/zinc/65/68/74/567656874.db2.gz QDMSJFGSRSYUPI-UHFFFAOYSA-N 0 1 380.330 3.216 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000666167379 567657648 /nfs/dbraw/zinc/65/76/48/567657648.db2.gz SFORFPRPHJRTOY-NSHDSACASA-N 0 1 399.292 3.343 10 0 GGAEMN Cc1cc(NC(=O)CN2CCC[C@@H]([C@H]3CCOC3)C2)ccc1Br ZINC000441201924 567658018 /nfs/dbraw/zinc/65/80/18/567658018.db2.gz QRGYMJBADXLQIY-CABCVRRESA-N 0 1 381.314 3.445 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cc(F)c(OC)c(F)c2)cc1Cl ZINC000441331312 567660640 /nfs/dbraw/zinc/66/06/40/567660640.db2.gz HKHKHZSZVDVUNT-UHFFFAOYSA-N 0 1 391.779 3.214 10 0 GGAEMN Brc1ccc(-c2nnc(CN3CCC[C@@H]([C@@H]4CCOC4)C3)o2)o1 ZINC000441290978 567660824 /nfs/dbraw/zinc/66/08/24/567660824.db2.gz VNKANIMMKQVLKY-VXGBXAGGSA-N 0 1 382.258 3.341 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCC[C@H](c2nncn2C2CC2)C1 ZINC000531490633 567660974 /nfs/dbraw/zinc/66/09/74/567660974.db2.gz QBIDAVXCGGNKEJ-NSHDSACASA-N 0 1 391.269 3.101 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCO[C@H](COc2ccccc2)C1 ZINC000572813217 567666799 /nfs/dbraw/zinc/66/67/99/567666799.db2.gz CEOPLPKNYVJEOQ-AWEZNQCLSA-N 0 1 392.249 3.075 10 0 GGAEMN O=C(N[C@H]1COc2ccc(F)cc2C1)c1n[nH]c2ccc(Br)cc21 ZINC000572808102 567667757 /nfs/dbraw/zinc/66/77/57/567667757.db2.gz YVKCOHPZPVSUOX-GFCCVEGCSA-N 0 1 390.212 3.198 10 0 GGAEMN Cc1ccoc1CN(C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000553606337 567670605 /nfs/dbraw/zinc/67/06/05/567670605.db2.gz ZGMXAWXRQLQQJQ-UHFFFAOYSA-N 0 1 375.222 3.464 10 0 GGAEMN C[C@H]1CCN(CC(=O)Nc2c(-c3ccc(Br)cc3)ncn2C)C1 ZINC000572854376 567671214 /nfs/dbraw/zinc/67/12/14/567671214.db2.gz ACKQRTLENGRFMG-LBPRGKRZSA-N 0 1 377.286 3.130 10 0 GGAEMN C[C@@H]1CCC[N@@H+](CCCCNC(=O)N=c2nc(-c3ccsc3)[n-]s2)C1 ZINC000460131225 567673632 /nfs/dbraw/zinc/67/36/32/567673632.db2.gz XTYPCVQHAHXJBQ-CYBMUJFWSA-N 0 1 379.555 3.322 10 0 GGAEMN C[C@](O)(CNC(=O)c1n[nH]c2ccc(Br)cc21)C1CCCCC1 ZINC000481359516 567673821 /nfs/dbraw/zinc/67/38/21/567673821.db2.gz LERDKZZXPQYYFT-KRWDZBQOSA-N 0 1 380.286 3.387 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000572967175 567678099 /nfs/dbraw/zinc/67/80/99/567678099.db2.gz RSLADYPHRVLUKY-MRXNPFEDSA-N 0 1 389.359 3.258 10 0 GGAEMN CC(=O)NCCN(CCC[C@H]1CCOC1)Cc1ccc(Br)s1 ZINC000645898055 567678968 /nfs/dbraw/zinc/67/89/68/567678968.db2.gz RKWSDFCSNOYAEQ-AWEZNQCLSA-N 0 1 389.359 3.265 10 0 GGAEMN CCn1c(-c2cc(F)ccc2Br)nnc1N1CCN(CC)CC1 ZINC000460218417 567679025 /nfs/dbraw/zinc/67/90/25/567679025.db2.gz CETUFNAIEOWVCF-UHFFFAOYSA-N 0 1 382.281 3.009 10 0 GGAEMN CC1=CCN(CCNC(=O)NC2(c3ccc(Br)cc3)CC2)CC1 ZINC000460222971 567679235 /nfs/dbraw/zinc/67/92/35/567679235.db2.gz WKAFVNQUYZZHMB-UHFFFAOYSA-N 0 1 378.314 3.389 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1ccc(OC(F)(F)F)cc1Br ZINC000666454032 567679310 /nfs/dbraw/zinc/67/93/10/567679310.db2.gz GWISPKNOCPYYKX-UHFFFAOYSA-N 0 1 396.207 3.373 10 0 GGAEMN CCCN1CCN(c2nnc(-c3cc(F)ccc3Br)n2CC)CC1 ZINC000572978770 567679540 /nfs/dbraw/zinc/67/95/40/567679540.db2.gz YVEIYTJPVRXHIF-UHFFFAOYSA-N 0 1 396.308 3.399 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCc3cc(Br)cc(F)c32)CC1 ZINC000460235525 567680096 /nfs/dbraw/zinc/68/00/96/567680096.db2.gz XTRSKIXALJOVKJ-UHFFFAOYSA-N 0 1 382.277 3.312 10 0 GGAEMN C[C@H](CSc1nc(-c2ccc(Br)cc2)n[nH]1)CS(C)(=O)=O ZINC000531813537 567680636 /nfs/dbraw/zinc/68/06/36/567680636.db2.gz NBFXGZQAIXFOAA-SECBINFHSA-N 0 1 390.328 3.007 10 0 GGAEMN C[C@H](NC(=O)c1cccc(Br)c1O)c1cn(-c2ccccc2)nn1 ZINC000531880592 567684829 /nfs/dbraw/zinc/68/48/29/567684829.db2.gz DDUGHMJCHJLYHW-NSHDSACASA-N 0 1 387.237 3.226 10 0 GGAEMN CC[C@H](NCc1ccc(C(=O)OC)c(Cl)c1)C(=O)NCc1cccs1 ZINC000597157877 567684992 /nfs/dbraw/zinc/68/49/92/567684992.db2.gz STEJKWANTOOGBW-INIZCTEOSA-N 0 1 380.897 3.373 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCn2c(C)csc2=O)CC1 ZINC000645974142 567686138 /nfs/dbraw/zinc/68/61/38/567686138.db2.gz TVTFOXRACWDLKS-UHFFFAOYSA-N 0 1 383.311 3.268 10 0 GGAEMN COC(=O)[C@@H]1OCC[C@@H]1NCc1ccc(-c2cccc(Br)c2)o1 ZINC000597192887 567686789 /nfs/dbraw/zinc/68/67/89/567686789.db2.gz PTWYMTYTCZCMTF-GOEBONIOSA-N 0 1 380.238 3.129 10 0 GGAEMN COC(=O)[C@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000531900332 567687059 /nfs/dbraw/zinc/68/70/59/567687059.db2.gz QGVRGLYEYXNYAY-BBRMVZONSA-N 0 1 385.291 3.152 10 0 GGAEMN Cc1ccc2nc(NC(=O)CNC(=O)c3ccc(Br)s3)[nH]c2c1 ZINC000553812383 567687214 /nfs/dbraw/zinc/68/72/14/567687214.db2.gz WJGIVPUXKPVBFP-UHFFFAOYSA-N 0 1 393.266 3.064 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)n[nH]1 ZINC000532010073 567693182 /nfs/dbraw/zinc/69/31/82/567693182.db2.gz MHYFZXLCAKSMML-HNHYXYPQSA-N 0 1 377.286 3.267 10 0 GGAEMN COC(=O)C1(C(=O)Nc2nc3ccc(Br)cc3[nH]2)CC2(CCC2)C1 ZINC000597313927 567694563 /nfs/dbraw/zinc/69/45/63/567694563.db2.gz OWEWMIVIVOVTMD-UHFFFAOYSA-N 0 1 392.253 3.387 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(CCOc2cc(Cl)ccc2Cl)C1 ZINC000646108117 567695501 /nfs/dbraw/zinc/69/55/01/567695501.db2.gz OEKGOQRSFAZSBM-AWEZNQCLSA-N 0 1 385.213 3.373 10 0 GGAEMN NS(=O)(=O)C[C@H]1CCCN1Cc1cccc(SCc2ccccc2)c1 ZINC000553888566 567696055 /nfs/dbraw/zinc/69/60/55/567696055.db2.gz IZKCJFNPMMIURP-GOSISDBHSA-N 0 1 376.547 3.232 10 0 GGAEMN C[C@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1cc2cc(Cl)ccc2o1 ZINC000573211300 567696560 /nfs/dbraw/zinc/69/65/60/567696560.db2.gz KSKYAXXNPIZADP-SWLSCSKDSA-N 0 1 385.917 3.008 10 0 GGAEMN O=C(N[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Br)c1O ZINC000532078875 567696900 /nfs/dbraw/zinc/69/69/00/567696900.db2.gz VTJODRADDJSTGS-SNVBAGLBSA-N 0 1 396.672 3.212 10 0 GGAEMN COc1cccc(NC(=O)CCN2CCc3nccc(Br)c3C2)c1 ZINC000623286911 567698169 /nfs/dbraw/zinc/69/81/69/567698169.db2.gz IIPOHVYKSRYRAZ-UHFFFAOYSA-N 0 1 390.281 3.240 10 0 GGAEMN COc1ccc(NC(=O)CCN2CCc3nccc(Br)c3C2)cc1 ZINC000623286034 567698874 /nfs/dbraw/zinc/69/88/74/567698874.db2.gz BFXMOSJFUXPQPL-UHFFFAOYSA-N 0 1 390.281 3.240 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)C[C@H]1C(=O)[O-] ZINC000573249137 567699256 /nfs/dbraw/zinc/69/92/56/567699256.db2.gz WPVLDAITSXYIOX-BLLLJJGKSA-N 0 1 378.270 3.177 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)C[C@@H]1C(=O)[O-] ZINC000573249138 567699357 /nfs/dbraw/zinc/69/93/57/567699357.db2.gz WPVLDAITSXYIOX-LRDDRELGSA-N 0 1 378.270 3.177 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000460718430 567699950 /nfs/dbraw/zinc/69/99/50/567699950.db2.gz LEWYCWYWCAYYOB-KGLIPLIRSA-N 0 1 383.330 3.237 10 0 GGAEMN O=C(Nc1cc(Cl)c(O)cc1F)[C@H]1CSCN1C(=O)c1ccccc1 ZINC000573275432 567701271 /nfs/dbraw/zinc/70/12/71/567701271.db2.gz LTZRTKKMPLTLED-CQSZACIVSA-N 0 1 380.828 3.339 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2c(F)cccc2Cl)C1 ZINC000507793775 567705554 /nfs/dbraw/zinc/70/55/54/567705554.db2.gz NBLRHJPFRRPYDC-CQSZACIVSA-N 0 1 388.936 3.185 10 0 GGAEMN COc1ccc(Br)c2[nH]c(C(=O)N[C@@H](C)Cc3cc(C)[nH]n3)cc21 ZINC000532272065 567706112 /nfs/dbraw/zinc/70/61/12/567706112.db2.gz OWFVICUXANEDGH-VIFPVBQESA-N 0 1 391.269 3.332 10 0 GGAEMN CC[C@@H]1C[C@@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000507807196 567706512 /nfs/dbraw/zinc/70/65/12/567706512.db2.gz UBZUNJZROFNDTD-MAUKXSAKSA-N 0 1 395.341 3.412 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@H]1Cc2ccccc21 ZINC000460852723 567706780 /nfs/dbraw/zinc/70/67/80/567706780.db2.gz DXHPWNMBDNDXMD-HNNXBMFYSA-N 0 1 383.249 3.190 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1Cc2ccccc21 ZINC000460852723 567706782 /nfs/dbraw/zinc/70/67/82/567706782.db2.gz DXHPWNMBDNDXMD-HNNXBMFYSA-N 0 1 383.249 3.190 10 0 GGAEMN CC(C)Oc1cc(Cl)c(CNCC(C)(C)NS(C)(=O)=O)cc1Cl ZINC000623411665 567707025 /nfs/dbraw/zinc/70/70/25/567707025.db2.gz IZBWKCQYFUCFEF-UHFFFAOYSA-N 0 1 383.341 3.198 10 0 GGAEMN Cc1ccc(CS(=O)(=O)NCC2(N3CCSCC3)CCCC2)cc1C ZINC000573356748 567707115 /nfs/dbraw/zinc/70/71/15/567707115.db2.gz TZRZQPWWUMNKFY-UHFFFAOYSA-N 0 1 382.595 3.084 10 0 GGAEMN CC(C)N1CCN(C(=O)N[C@@H]2CCOc3c(Br)cccc32)CC1 ZINC000507794952 567707192 /nfs/dbraw/zinc/70/71/92/567707192.db2.gz IBUQFKCFGNIOGD-OAHLLOKOSA-N 0 1 382.302 3.008 10 0 GGAEMN O=C(Nc1nc2c(s1)CCCCC2)C(C[C@H]1COCCO1)C(F)(F)F ZINC000666896421 567711404 /nfs/dbraw/zinc/71/14/04/567711404.db2.gz PFVRCQQDACVDEM-QWRGUYRKSA-N 0 1 378.416 3.335 10 0 GGAEMN Cc1cc(CN[C@@H](C)Cn2ncc3ccccc3c2=O)ncc1Br ZINC000623477290 567712929 /nfs/dbraw/zinc/71/29/29/567712929.db2.gz FDBFJYPZGIIVGK-ZDUSSCGKSA-N 0 1 387.281 3.041 10 0 GGAEMN COC(=O)c1cc(NS(=O)(=O)c2ccsc2)ccc1Br ZINC000507885941 567713665 /nfs/dbraw/zinc/71/36/65/567713665.db2.gz GIUJKFCDPROIKX-UHFFFAOYSA-N 0 1 376.253 3.098 10 0 GGAEMN CC(C)OCCNCc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000623491178 567714946 /nfs/dbraw/zinc/71/49/46/567714946.db2.gz IIASJNOIZNXELZ-UHFFFAOYSA-N 0 1 391.339 3.219 10 0 GGAEMN COC(=O)c1cc(Br)cc(NC(=O)[C@@H]2CCc3[nH]cnc3C2)c1C ZINC000597783313 567716582 /nfs/dbraw/zinc/71/65/82/567716582.db2.gz INCRPZSGCJHXOQ-SNVBAGLBSA-N 0 1 392.253 3.011 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@H]3COCC[C@H]32)nn1 ZINC000573497215 567717570 /nfs/dbraw/zinc/71/75/70/567717570.db2.gz YHOUGLOXWNHNKZ-XJKSGUPXSA-N 0 1 377.286 3.031 10 0 GGAEMN COc1ccc([C@@H](N[C@H]2CCCNC2=O)c2ccccc2)cc1Br ZINC000532441500 567717596 /nfs/dbraw/zinc/71/75/96/567717596.db2.gz TYPXNGYARYVXIQ-WMZOPIPTSA-N 0 1 389.293 3.415 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@H]3COCC[C@@H]32)nn1 ZINC000573497201 567717815 /nfs/dbraw/zinc/71/78/15/567717815.db2.gz YHOUGLOXWNHNKZ-BBRMVZONSA-N 0 1 377.286 3.031 10 0 GGAEMN CS(=O)(=O)C1(CNCc2cccc(F)c2OCC(F)(F)F)CCCC1 ZINC000623523921 567719351 /nfs/dbraw/zinc/71/93/51/567719351.db2.gz VHRPBMNKQNYIOB-UHFFFAOYSA-N 0 1 383.407 3.214 10 0 GGAEMN CN(C)c1cnn(C2CCN(C(=O)c3c(O)cc(Cl)cc3Cl)CC2)c1 ZINC000646491401 567720182 /nfs/dbraw/zinc/72/01/82/567720182.db2.gz FBSQPENRVCZNHF-UHFFFAOYSA-N 0 1 383.279 3.439 10 0 GGAEMN CNC(=O)C[C@H](C)NCc1cc(Br)c(C)cc1Br ZINC000623541525 567721030 /nfs/dbraw/zinc/72/10/30/567721030.db2.gz NRSYIEJFCBFTJA-VIFPVBQESA-N 0 1 378.108 3.134 10 0 GGAEMN Cc1csc(C(=O)NC[C@@H]2CCN2C(C)(C)C)c1I ZINC000597860275 567721194 /nfs/dbraw/zinc/72/11/94/567721194.db2.gz MZKLGUIWGPYQSA-JTQLQIEISA-N 0 1 392.306 3.264 10 0 GGAEMN O=S(=O)(CCc1ccccc1Br)Nc1cc(C(F)(F)F)[nH]n1 ZINC000461108073 567721700 /nfs/dbraw/zinc/72/17/00/567721700.db2.gz MERCYHAQSMOQJC-UHFFFAOYSA-N 0 1 398.204 3.175 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2csc(C(F)(F)F)c2)Oc2ccccc21 ZINC000623556655 567722338 /nfs/dbraw/zinc/72/23/38/567722338.db2.gz RJXHCBQZJAHLNU-LLVKDONJSA-N 0 1 377.409 3.091 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN(C[C@@H](C)OC)C(C)C ZINC000532576280 567722644 /nfs/dbraw/zinc/72/26/44/567722644.db2.gz DHNFAXHQMVEFNF-LLVKDONJSA-N 0 1 391.295 3.464 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CN(C[C@H](C)OC)C(C)C ZINC000532576351 567723389 /nfs/dbraw/zinc/72/33/89/567723389.db2.gz DHNFAXHQMVEFNF-NSHDSACASA-N 0 1 391.295 3.464 10 0 GGAEMN FC(F)(F)[C@@H](CNCc1cc2c(c(Br)c1)OCO2)n1cccn1 ZINC000623596043 567725350 /nfs/dbraw/zinc/72/53/50/567725350.db2.gz CHMKADWXCMPJKX-GFCCVEGCSA-N 0 1 392.175 3.268 10 0 GGAEMN Brc1ccccc1-n1cc(CNC[C@@H]2Cc3ccccc3CO2)nn1 ZINC000623603268 567725639 /nfs/dbraw/zinc/72/56/39/567725639.db2.gz UKVWZZKXWVJAEJ-KRWDZBQOSA-N 0 1 399.292 3.261 10 0 GGAEMN COc1cccc(N2C[C@H](NCc3ccc(Br)cc3F)CC2=O)c1 ZINC000508073172 567725684 /nfs/dbraw/zinc/72/56/84/567725684.db2.gz VSBUYXBDSZFBBJ-CQSZACIVSA-N 0 1 393.256 3.492 10 0 GGAEMN C[N@@H+]1CCC[C@@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@H]1c1cccs1 ZINC000532640810 567726069 /nfs/dbraw/zinc/72/60/69/567726069.db2.gz HNLNWDJGIFTOQP-LRDDRELGSA-N 0 1 376.551 3.014 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@H]1c1cccs1 ZINC000532640810 567726075 /nfs/dbraw/zinc/72/60/75/567726075.db2.gz HNLNWDJGIFTOQP-LRDDRELGSA-N 0 1 376.551 3.014 10 0 GGAEMN CCOCc1nc([C@H](C)NC(=O)c2cn[nH]c2-c2ccc(Cl)s2)no1 ZINC000461221305 567726017 /nfs/dbraw/zinc/72/60/17/567726017.db2.gz VRYVMZKVIBESMI-QMMMGPOBSA-N 0 1 381.845 3.202 10 0 GGAEMN COc1ccc(CN2CC[C@@H]2CNCc2c(F)cncc2Br)cc1 ZINC000623640943 567726175 /nfs/dbraw/zinc/72/61/75/567726175.db2.gz BFIASUSTSLQRBE-CQSZACIVSA-N 0 1 394.288 3.356 10 0 GGAEMN C[N@@H+]1CCC[C@@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@@H]1c1cccs1 ZINC000532640809 567726322 /nfs/dbraw/zinc/72/63/22/567726322.db2.gz HNLNWDJGIFTOQP-BLLLJJGKSA-N 0 1 376.551 3.014 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@@H]1c1cccs1 ZINC000532640809 567726331 /nfs/dbraw/zinc/72/63/31/567726331.db2.gz HNLNWDJGIFTOQP-BLLLJJGKSA-N 0 1 376.551 3.014 10 0 GGAEMN O=C(Nc1cnc(-c2ccc(Cl)s2)nc1)N1CC[C@H](N2CC=CC2)C1 ZINC000646543614 567727595 /nfs/dbraw/zinc/72/75/95/567727595.db2.gz ZUQDASJMOBKFRN-ZDUSSCGKSA-N 0 1 375.885 3.337 10 0 GGAEMN OC[C@@]1(NCc2nccn2C(F)F)CCc2cc(Br)ccc2C1 ZINC000623644469 567727828 /nfs/dbraw/zinc/72/78/28/567727828.db2.gz YSTIUNCCZXEOSQ-MRXNPFEDSA-N 0 1 386.240 3.050 10 0 GGAEMN NC(=O)c1cccc(S(=O)(=O)Nc2cc(Cl)ccc2C(F)(F)F)c1 ZINC000508089379 567727893 /nfs/dbraw/zinc/72/78/93/567727893.db2.gz PCISQFOSDHUBMA-UHFFFAOYSA-N 0 1 378.759 3.259 10 0 GGAEMN COc1ccc(CN2CC[C@H]2CNCc2ncc(Br)cc2F)cc1 ZINC000623641071 567727929 /nfs/dbraw/zinc/72/79/29/567727929.db2.gz HWWAFCUIECMGGG-HNNXBMFYSA-N 0 1 394.288 3.356 10 0 GGAEMN Clc1ccc(N2CCO[C@@H](CNCc3ccc(Br)cn3)C2)cc1 ZINC000623654849 567728368 /nfs/dbraw/zinc/72/83/68/567728368.db2.gz KMQLYCDEYDNPIY-KRWDZBQOSA-N 0 1 396.716 3.493 10 0 GGAEMN COC(=O)c1cccc(F)c1NS(=O)(=O)c1ccc(C(F)(F)F)s1 ZINC000461345033 567731080 /nfs/dbraw/zinc/73/10/80/567731080.db2.gz XPOQZMGFXMGUCG-UHFFFAOYSA-N 0 1 383.344 3.493 10 0 GGAEMN COc1ccc(-c2n[nH]c(NC(=O)c3coc(Br)c3)n2)c(OC)c1 ZINC000623739964 567734646 /nfs/dbraw/zinc/73/46/46/567734646.db2.gz QBQDEYRXIQHRLG-UHFFFAOYSA-N 0 1 393.197 3.097 10 0 GGAEMN O=c1[nH]cc(C(F)(F)F)cc1NS(=O)(=O)c1cnccc1C(F)(F)F ZINC000443141165 567735190 /nfs/dbraw/zinc/73/51/90/567735190.db2.gz LYYYMDOSEVUGJT-UHFFFAOYSA-N 0 1 387.261 3.021 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2cc(Br)cc3nc[nH]c32)[C@@H]2CCCO[C@H]21 ZINC000554562852 567735608 /nfs/dbraw/zinc/73/56/08/567735608.db2.gz CMQDPPOHWJXHKT-COLVAYQJSA-N 0 1 378.270 3.259 10 0 GGAEMN CC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000554561429 567735684 /nfs/dbraw/zinc/73/56/84/567735684.db2.gz LIKTWVSHLVPVEB-OAHLLOKOSA-N 0 1 386.249 3.256 10 0 GGAEMN CN(C)Cc1ccc(NS(=O)(=O)c2ccsc2)cc1Br ZINC000508188545 567735833 /nfs/dbraw/zinc/73/58/33/567735833.db2.gz WLWIGHWKLLPNEJ-UHFFFAOYSA-N 0 1 375.313 3.373 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2cc(Br)cc3nc[nH]c32)[C@@H]2CCCO[C@@H]21 ZINC000554562858 567736231 /nfs/dbraw/zinc/73/62/31/567736231.db2.gz CMQDPPOHWJXHKT-VQISRLSMSA-N 0 1 378.270 3.259 10 0 GGAEMN CC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000554561428 567736277 /nfs/dbraw/zinc/73/62/77/567736277.db2.gz LIKTWVSHLVPVEB-HNNXBMFYSA-N 0 1 386.249 3.256 10 0 GGAEMN O=C(Nc1ccc(I)cc1F)[C@H]1CCCc2[nH]ncc21 ZINC000598068272 567738307 /nfs/dbraw/zinc/73/83/07/567738307.db2.gz HNACIEHBCVIRBL-VIFPVBQESA-N 0 1 385.180 3.212 10 0 GGAEMN Cc1noc([C@@H]2OCC[C@@H]2NCC2=Cc3cc(Br)ccc3OC2)n1 ZINC000623814822 567738678 /nfs/dbraw/zinc/73/86/78/567738678.db2.gz SXRRHPLXZIEVSA-GOEBONIOSA-N 0 1 392.253 3.036 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H](C)Cc2cc(Br)ccc2F)n[nH]1 ZINC000532848325 567739016 /nfs/dbraw/zinc/73/90/16/567739016.db2.gz GBMCNNZEOCJAET-GHMZBOCLSA-N 0 1 397.292 3.481 10 0 GGAEMN CSc1cc(Br)ccc1CN[C@@H]1CCO[C@@H]1c1nc(C)no1 ZINC000623815960 567739072 /nfs/dbraw/zinc/73/90/72/567739072.db2.gz UXGZVNHJNOJPQB-OCCSQVGLSA-N 0 1 384.299 3.482 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000508252282 567740526 /nfs/dbraw/zinc/74/05/26/567740526.db2.gz AEZSFDSXVONGRZ-AWEZNQCLSA-N 0 1 389.308 3.477 10 0 GGAEMN Cn1nccc1[C@H]1CCCCN1C[C@@H](O)COc1ccc(Br)cc1 ZINC000532888128 567741363 /nfs/dbraw/zinc/74/13/63/567741363.db2.gz SNCKTWIHMNWGJZ-CRAIPNDOSA-N 0 1 394.313 3.150 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2ccsc2Br)[nH]n1 ZINC000554692765 567741624 /nfs/dbraw/zinc/74/16/24/567741624.db2.gz OXSFMONDKVGKGE-UHFFFAOYSA-N 0 1 381.299 3.007 10 0 GGAEMN COC(=O)[C@@H]1CCN(C(=O)c2cccc(Br)c2O)[C@H]2CCCC[C@@H]12 ZINC000598180867 567743219 /nfs/dbraw/zinc/74/32/19/567743219.db2.gz MFNDVNVEMFLZQR-ZOWXZIJZSA-N 0 1 396.281 3.349 10 0 GGAEMN COC(=O)[C@@H]1CCN(C(=O)c2cccc(Br)c2O)[C@H]2CCCC[C@H]12 ZINC000598180864 567743294 /nfs/dbraw/zinc/74/32/94/567743294.db2.gz MFNDVNVEMFLZQR-JMSVASOKSA-N 0 1 396.281 3.349 10 0 GGAEMN O=C(Cc1cc(C2CC2)no1)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000667425672 567746564 /nfs/dbraw/zinc/74/65/64/567746564.db2.gz KPNBLMYOURNSBK-UHFFFAOYSA-N 0 1 388.225 3.281 10 0 GGAEMN C[C@@H](CC(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCCO1 ZINC000667425821 567746803 /nfs/dbraw/zinc/74/68/03/567746803.db2.gz OJGQOJAUMNVGOF-GWCFXTLKSA-N 0 1 379.258 3.378 10 0 GGAEMN O=S(=O)(NCCCc1nccs1)c1cc(F)c(Br)cc1F ZINC000574004584 567749598 /nfs/dbraw/zinc/74/95/98/567749598.db2.gz MVLQPKWYPWGFJD-UHFFFAOYSA-N 0 1 397.266 3.095 10 0 GGAEMN Brc1ccc(N2CCN(C[C@@H]3CCC4(CCCC4)O3)CC2)nc1 ZINC000554809049 567750306 /nfs/dbraw/zinc/75/03/06/567750306.db2.gz STKXXWYZGQNUFM-INIZCTEOSA-N 0 1 380.330 3.458 10 0 GGAEMN COc1ccc(Br)c(CNC[C@@H](O)COc2ccc(C)cc2)c1 ZINC000554836413 567751460 /nfs/dbraw/zinc/75/14/60/567751460.db2.gz NCOGVFUCDDZWRW-OAHLLOKOSA-N 0 1 380.282 3.296 10 0 GGAEMN CCNC(=O)c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000574101386 567756186 /nfs/dbraw/zinc/75/61/86/567756186.db2.gz PIYLJAFTTZZKNQ-UHFFFAOYSA-N 0 1 387.237 3.327 10 0 GGAEMN C[C@@H]1CN(C[C@@H]2CCCN2Cc2c(F)cncc2Br)C[C@@H](C)O1 ZINC000667558889 567756422 /nfs/dbraw/zinc/75/64/22/567756422.db2.gz VHXJAEOATUAMFW-MCIONIFRSA-N 0 1 386.309 3.057 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2csc(Br)c2)[nH]n1 ZINC000533212675 567759346 /nfs/dbraw/zinc/75/93/46/567759346.db2.gz OUJYCUPTFHJIGM-UHFFFAOYSA-N 0 1 381.299 3.007 10 0 GGAEMN CCN(CC)Cc1ccc(C(=O)N[C@H](C)c2ncc(Br)cn2)o1 ZINC000647118532 567759977 /nfs/dbraw/zinc/75/99/77/567759977.db2.gz YIHKQOJGRCMTAQ-LLVKDONJSA-N 0 1 381.274 3.165 10 0 GGAEMN O=C(N[C@@H]1CCOC2(CCSCC2)C1)c1cccc(Br)c1O ZINC000533235495 567761050 /nfs/dbraw/zinc/76/10/50/567761050.db2.gz ORKIHTLUCMKNBC-LLVKDONJSA-N 0 1 386.311 3.329 10 0 GGAEMN CN(C)Cc1cc(-c2noc(-c3csc(S(C)(=O)=O)c3)n2)ccc1F ZINC000574167011 567761734 /nfs/dbraw/zinc/76/17/34/567761734.db2.gz DLMMFCSIMQTYEE-UHFFFAOYSA-N 0 1 381.454 3.069 10 0 GGAEMN COc1ncc(Br)cc1CN[C@H](C)CC(=O)N1CCCCCC1 ZINC000624133229 567762083 /nfs/dbraw/zinc/76/20/83/567762083.db2.gz JGUIULZWKZOMIZ-CYBMUJFWSA-N 0 1 384.318 3.124 10 0 GGAEMN Clc1cc(Cl)cc([C@H](c2nc([C@@H]3CCCN3)no2)N2CCOCC2)c1 ZINC000647145630 567764457 /nfs/dbraw/zinc/76/44/57/567764457.db2.gz ABGULJDTHAMLNL-LSDHHAIUSA-N 0 1 383.279 3.223 10 0 GGAEMN O=C(CC[C@H]1CCCCO1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598424866 567764785 /nfs/dbraw/zinc/76/47/85/567764785.db2.gz RKVFGFVOAVUPNZ-LLVKDONJSA-N 0 1 399.232 3.455 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1cnc(-c2ccc(Cl)s2)nc1)C(C)C ZINC000647137341 567764983 /nfs/dbraw/zinc/76/49/83/567764983.db2.gz WWNDRBNSTHRAFH-LLVKDONJSA-N 0 1 375.903 3.271 10 0 GGAEMN O=C(CC[C@H]1CCCO1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598422579 567764852 /nfs/dbraw/zinc/76/48/52/567764852.db2.gz FTFPPIMKIAMBHV-SNVBAGLBSA-N 0 1 385.205 3.065 10 0 GGAEMN Clc1cc(Cl)cc([C@@H](c2nc([C@H]3CCCN3)no2)N2CCOCC2)c1 ZINC000647145627 567765073 /nfs/dbraw/zinc/76/50/73/567765073.db2.gz ABGULJDTHAMLNL-CABCVRRESA-N 0 1 383.279 3.223 10 0 GGAEMN CC[C@H]1CC[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598424839 567765071 /nfs/dbraw/zinc/76/50/71/567765071.db2.gz RAVURUFHVGRQQC-JOYOIKCWSA-N 0 1 385.205 3.064 10 0 GGAEMN O=C(Nc1nc2ccc(I)cc2[nH]1)C1CCSCC1 ZINC000598424207 567765309 /nfs/dbraw/zinc/76/53/09/567765309.db2.gz OGPPSJMKAYUUOD-UHFFFAOYSA-N 0 1 387.246 3.249 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)Nc2ccc(-c3ccc(Cl)s3)nn2)n[nH]1 ZINC000667679952 567765696 /nfs/dbraw/zinc/76/56/96/567765696.db2.gz SYUFEEXUWLHACP-QMMMGPOBSA-N 0 1 377.861 3.422 10 0 GGAEMN CC[C@@H]1C[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCO1 ZINC000598428045 567765978 /nfs/dbraw/zinc/76/59/78/567765978.db2.gz LBOSJUBCMCKUJX-MWLCHTKSSA-N 0 1 399.232 3.311 10 0 GGAEMN CC[C@H]1C[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCO1 ZINC000598428047 567766117 /nfs/dbraw/zinc/76/61/17/567766117.db2.gz LBOSJUBCMCKUJX-ONGXEEELSA-N 0 1 399.232 3.311 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC(CN3CCOCC3)CC2)c1 ZINC000624194178 567766148 /nfs/dbraw/zinc/76/61/48/567766148.db2.gz AWDTZGFUOVMTNH-UHFFFAOYSA-N 0 1 399.304 3.081 10 0 GGAEMN CC[C@H]1C[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCO1 ZINC000598428043 567766192 /nfs/dbraw/zinc/76/61/92/567766192.db2.gz LBOSJUBCMCKUJX-KOLCDFICSA-N 0 1 399.232 3.311 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1ccc(OC(F)(F)F)c(Cl)c1 ZINC000624176520 567766381 /nfs/dbraw/zinc/76/63/81/567766381.db2.gz NFUMKOMVRUJQFI-UHFFFAOYSA-N 0 1 380.794 3.081 10 0 GGAEMN C[C@H]1CC[C@H](CCC(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598426157 567766385 /nfs/dbraw/zinc/76/63/85/567766385.db2.gz YGDHHTUPZXSIDL-GXSJLCMTSA-N 0 1 399.232 3.454 10 0 GGAEMN C[C@H]1CC[C@@H](CCC(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598426160 567766425 /nfs/dbraw/zinc/76/64/25/567766425.db2.gz YGDHHTUPZXSIDL-ONGXEEELSA-N 0 1 399.232 3.454 10 0 GGAEMN NS(=O)(=O)c1ccc(CN[C@H]2CCc3c2cccc3Br)c(F)c1 ZINC000647180686 567767670 /nfs/dbraw/zinc/76/76/70/567767670.db2.gz PEYAAYBOLGSKPS-INIZCTEOSA-N 0 1 399.285 3.013 10 0 GGAEMN COCCC[C@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428351 567767808 /nfs/dbraw/zinc/76/78/08/567767808.db2.gz NXPPJWDXQIFIPM-VIFPVBQESA-N 0 1 387.221 3.169 10 0 GGAEMN COc1ccccc1[C@H](N)CNS(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000647187145 567768349 /nfs/dbraw/zinc/76/83/49/567768349.db2.gz DYDHEAJWUFICQP-OAHLLOKOSA-N 0 1 389.304 3.121 10 0 GGAEMN CCCOC[C@@H](Cc1cccc(Br)c1)NCc1cncnc1OC ZINC000647202978 567769592 /nfs/dbraw/zinc/76/95/92/567769592.db2.gz BMTLWVDJRXJLEI-QGZVFWFLSA-N 0 1 394.313 3.375 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1cccc(-c2cn[nH]n2)c1 ZINC000443675336 567769726 /nfs/dbraw/zinc/76/97/26/567769726.db2.gz MZBDAUOTTGICRU-UHFFFAOYSA-N 0 1 387.237 3.424 10 0 GGAEMN CCN1CC[C@H](NCC(=O)Nc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555125790 567770467 /nfs/dbraw/zinc/77/04/67/567770467.db2.gz LUXGAOSVJBNPGM-GOEBONIOSA-N 0 1 382.892 3.299 10 0 GGAEMN Fc1cncc(Br)c1CN1CCC[C@@H](c2nc(C3CC3)n[nH]2)C1 ZINC000667712250 567770499 /nfs/dbraw/zinc/77/04/99/567770499.db2.gz AMXUCJXMONDVRC-LLVKDONJSA-N 0 1 380.265 3.358 10 0 GGAEMN Fc1cncc(Br)c1CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000667712250 567770503 /nfs/dbraw/zinc/77/05/03/567770503.db2.gz AMXUCJXMONDVRC-LLVKDONJSA-N 0 1 380.265 3.358 10 0 GGAEMN C[C@@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1ccccc1Br ZINC000624266365 567770660 /nfs/dbraw/zinc/77/06/60/567770660.db2.gz MGIZRGDOSDROIZ-WBVHZDCISA-N 0 1 390.325 3.396 10 0 GGAEMN CC1(C)CC(NC(=O)c2c[nH]c3ccc(I)cc3c2=O)C1 ZINC000598504726 567770906 /nfs/dbraw/zinc/77/09/06/567770906.db2.gz NYYBWVVYZLGWJS-UHFFFAOYSA-N 0 1 396.228 3.051 10 0 GGAEMN C[C@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1ccccc1Br ZINC000624266364 567771076 /nfs/dbraw/zinc/77/10/76/567771076.db2.gz MGIZRGDOSDROIZ-RDJZCZTQSA-N 0 1 390.325 3.396 10 0 GGAEMN O=C(Nc1cc(Cl)ccc1N1CCSCC1)[C@@H]1CCc2[nH]cnc2C1 ZINC000667738493 567771822 /nfs/dbraw/zinc/77/18/22/567771822.db2.gz PPDBXRRNVNOJSO-GFCCVEGCSA-N 0 1 376.913 3.360 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2cc(C)c(Cl)s2)c(Cl)c1 ZINC000555191070 567772968 /nfs/dbraw/zinc/77/29/68/567772968.db2.gz BGKHPTCVEJLYPS-UHFFFAOYSA-N 0 1 381.262 3.346 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccc(Br)cc3)o2)C1 ZINC000574407393 567776652 /nfs/dbraw/zinc/77/66/52/567776652.db2.gz NQBPYRWWOGMLJN-KGLIPLIRSA-N 0 1 395.253 3.168 10 0 GGAEMN C[C@H](NC[C@@H](O)COc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647295095 567777970 /nfs/dbraw/zinc/77/79/70/567777970.db2.gz ZRJGIBVPYBCRNR-DZGCQCFKSA-N 0 1 394.313 3.072 10 0 GGAEMN O=S1(=O)CC[C@@H](NC[C@H]2CSc3ccccc3O2)c2cc(F)ccc21 ZINC000647314284 567779535 /nfs/dbraw/zinc/77/95/35/567779535.db2.gz BLMIYCOHFMGQLE-DZGCQCFKSA-N 0 1 379.478 3.187 10 0 GGAEMN COc1ccccc1C1(N[C@H](C)Cn2cc(Br)ccc2=O)CC1 ZINC000647329876 567779579 /nfs/dbraw/zinc/77/95/79/567779579.db2.gz YGQJXIJKKCJPLU-CYBMUJFWSA-N 0 1 377.282 3.287 10 0 GGAEMN COC(=O)c1ccc(F)cc1S(=O)(=O)N[C@@H](C(F)F)C1CCCCC1 ZINC000598628447 567780072 /nfs/dbraw/zinc/78/00/72/567780072.db2.gz NKVJDYDQLFLXQV-CQSZACIVSA-N 0 1 379.400 3.105 10 0 GGAEMN O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1n[nH]c2ccc(Br)cc21 ZINC000533656350 567780645 /nfs/dbraw/zinc/78/06/45/567780645.db2.gz PXRGFIRVYLERAP-LYRGGWFBSA-N 0 1 390.281 3.403 10 0 GGAEMN C[C@@H]1c2cccn2CCN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000443951175 567780998 /nfs/dbraw/zinc/78/09/98/567780998.db2.gz IZJMUESHAXKQTL-LLVKDONJSA-N 0 1 386.249 3.309 10 0 GGAEMN C[C@H](Cc1cc(Br)ccc1F)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000533716311 567784542 /nfs/dbraw/zinc/78/45/42/567784542.db2.gz JVMSICJMAOCYLF-MFKMUULPSA-N 0 1 380.261 3.479 10 0 GGAEMN OC[C@@H](CNCc1cn(-c2ccc(Cl)cc2Cl)nn1)c1ccccc1 ZINC000533756313 567785025 /nfs/dbraw/zinc/78/50/25/567785025.db2.gz LKSPDKDSIDTEIU-CQSZACIVSA-N 0 1 377.275 3.440 10 0 GGAEMN OC[C@H](CNCc1cn(-c2ccc(Cl)cc2Cl)nn1)c1ccccc1 ZINC000533756306 567785318 /nfs/dbraw/zinc/78/53/18/567785318.db2.gz LKSPDKDSIDTEIU-AWEZNQCLSA-N 0 1 377.275 3.440 10 0 GGAEMN CNC(=O)c1ccc(=N[C@@H]2CCCSc3ccc(Br)cc32)[nH]n1 ZINC000624555560 567787595 /nfs/dbraw/zinc/78/75/95/567787595.db2.gz MPDONFWJUFAVLX-GFCCVEGCSA-N 0 1 393.310 3.060 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCc2ccc(Br)cc2Cl)cn1 ZINC000555550469 567788104 /nfs/dbraw/zinc/78/81/04/567788104.db2.gz RJILZTHBSMJLJK-UHFFFAOYSA-N 0 1 382.689 3.489 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)cn1 ZINC000555579368 567790004 /nfs/dbraw/zinc/79/00/04/567790004.db2.gz FZOWINBORBYJFF-UHFFFAOYSA-N 0 1 382.291 3.085 10 0 GGAEMN CC(C)(O)CN1CCN(c2nnc(-c3cc(Cl)cc(Cl)c3)s2)CC1 ZINC000444085938 567792269 /nfs/dbraw/zinc/79/22/69/567792269.db2.gz NMHQNCPPTIYCAB-UHFFFAOYSA-N 0 1 387.336 3.405 10 0 GGAEMN CN(Cc1nnc[nH]1)C(=O)N[C@H]1CCCSc2ccc(Br)cc21 ZINC000624638812 567793472 /nfs/dbraw/zinc/79/34/72/567793472.db2.gz QDMKKVMPTCCQKL-LBPRGKRZSA-N 0 1 396.314 3.336 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ncccc1Cl ZINC000555738976 567796693 /nfs/dbraw/zinc/79/66/93/567796693.db2.gz PRFDEHGKRHDLDE-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ncccc1Cl ZINC000555738976 567796694 /nfs/dbraw/zinc/79/66/94/567796694.db2.gz PRFDEHGKRHDLDE-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN CCS(=O)(=O)NC1CCN(Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000668157821 567799424 /nfs/dbraw/zinc/79/94/24/567799424.db2.gz CAVWQSRSSMZRBM-UHFFFAOYSA-N 0 1 379.551 3.022 10 0 GGAEMN Cc1cccc(CN(C)C(=O)c2c[nH]c3ccc(Br)cc3c2=O)n1 ZINC000444256713 567799493 /nfs/dbraw/zinc/79/94/93/567799493.db2.gz NGPWNKRRFQNQMN-UHFFFAOYSA-N 0 1 386.249 3.266 10 0 GGAEMN CCOC(=O)c1[nH]c(C)c(CN[C@@H](CO)c2cccc(Br)c2)c1C ZINC000598968290 567801127 /nfs/dbraw/zinc/80/11/27/567801127.db2.gz WYBFGJCIVKZBPC-INIZCTEOSA-N 0 1 395.297 3.394 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)N(CCN(C)C)Cc1ccccc1 ZINC000624812715 567801795 /nfs/dbraw/zinc/80/17/95/567801795.db2.gz ZIYBQCOOHPMRKZ-UHFFFAOYSA-N 0 1 376.513 3.452 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1n[nH]c2cc(O)ccc21 ZINC000647799816 567801998 /nfs/dbraw/zinc/80/19/98/567801998.db2.gz JTVOUKDILLIICR-UHFFFAOYSA-N 0 1 376.210 3.221 10 0 GGAEMN CC1(C)CCC[C@@](CO)(NCc2ncc(I)s2)C1 ZINC000598994894 567802235 /nfs/dbraw/zinc/80/22/35/567802235.db2.gz JDQAUNAWAHNZQX-CYBMUJFWSA-N 0 1 380.295 3.169 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000534257735 567804909 /nfs/dbraw/zinc/80/49/09/567804909.db2.gz XANAFPZAGAGFRO-QWRGUYRKSA-N 0 1 380.290 3.121 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CC[C@@H](C2CC2)C1 ZINC000534270593 567805697 /nfs/dbraw/zinc/80/56/97/567805697.db2.gz HEPTYILMKFLLEX-CYBMUJFWSA-N 0 1 390.285 3.176 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CC[C@@H](C2CC2)C1 ZINC000534270593 567805701 /nfs/dbraw/zinc/80/57/01/567805701.db2.gz HEPTYILMKFLLEX-CYBMUJFWSA-N 0 1 390.285 3.176 10 0 GGAEMN C[C@@H]1CN(C(=O)CCOc2cccc(Cl)c2Cl)CCN1CC(C)(C)O ZINC000444551268 567807652 /nfs/dbraw/zinc/80/76/52/567807652.db2.gz MYROJXQAHUBSAP-CYBMUJFWSA-N 0 1 389.323 3.066 10 0 GGAEMN C[C@H]1CN(C(=O)CCOc2cccc(Cl)c2Cl)CCN1CC(C)(C)O ZINC000444551270 567808285 /nfs/dbraw/zinc/80/82/85/567808285.db2.gz MYROJXQAHUBSAP-ZDUSSCGKSA-N 0 1 389.323 3.066 10 0 GGAEMN CCOCC[C@@H](O)CN1CCC[C@@H]1c1ccc(I)cc1 ZINC000444647859 567810218 /nfs/dbraw/zinc/81/02/18/567810218.db2.gz GAFYVQGBTFMUBG-HZPDHXFCSA-N 0 1 389.277 3.216 10 0 GGAEMN C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C[C@H]1C(=O)[O-] ZINC000575045809 567810327 /nfs/dbraw/zinc/81/03/27/567810327.db2.gz SDYBMHSRGHVBJP-MWLCHTKSSA-N 0 1 378.778 3.340 10 0 GGAEMN CN(CCOc1ccc(Cl)cc1)C(=O)CN1CC[C@@H](CC(F)(F)F)C1 ZINC000444695361 567811002 /nfs/dbraw/zinc/81/10/02/567811002.db2.gz MGMQWBPYEQSZMK-ZDUSSCGKSA-N 0 1 378.822 3.452 10 0 GGAEMN O=C(Nc1nc(-c2ccco2)cs1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000668474948 567811521 /nfs/dbraw/zinc/81/15/21/567811521.db2.gz IYBIULLQARUSHO-VHSXEESVSA-N 0 1 376.356 3.326 10 0 GGAEMN O[C@@H]([C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000444723605 567811708 /nfs/dbraw/zinc/81/17/08/567811708.db2.gz WNZODXROKUECNX-XPTSAGLGSA-N 0 1 392.219 3.461 10 0 GGAEMN Cc1ccc(Cl)c(OC[C@H](O)CN2CCC[C@H]([C@@H](O)C(F)(F)F)C2)c1 ZINC000444727065 567811793 /nfs/dbraw/zinc/81/17/93/567811793.db2.gz PHNOFYWROKMVEN-WOSRLPQWSA-N 0 1 381.822 3.023 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@@H]1CCCN(c2ccn(C)n2)C1=O ZINC000444710113 567811949 /nfs/dbraw/zinc/81/19/49/567811949.db2.gz TVJKMHVGAWOASK-MRXNPFEDSA-N 0 1 391.313 3.118 10 0 GGAEMN O=C(Nc1nc(-c2ccco2)cs1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000668474947 567812044 /nfs/dbraw/zinc/81/20/44/567812044.db2.gz IYBIULLQARUSHO-UWVGGRQHSA-N 0 1 376.356 3.326 10 0 GGAEMN O[C@H]([C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000444723603 567812172 /nfs/dbraw/zinc/81/21/72/567812172.db2.gz WNZODXROKUECNX-LKFCYVNXSA-N 0 1 392.219 3.461 10 0 GGAEMN CCCN1CCC[C@H]1C(=O)Nc1cnn(-c2ccccc2Br)c1 ZINC000534467012 567812974 /nfs/dbraw/zinc/81/29/74/567812974.db2.gz QEAGEVOHKMXNAM-INIZCTEOSA-N 0 1 377.286 3.448 10 0 GGAEMN O=C([C@@H]1Cc2ccccc2CN1)N1CCc2c(F)cc(Br)cc2C1 ZINC000648101825 567813043 /nfs/dbraw/zinc/81/30/43/567813043.db2.gz FXKLZXLJERBZSN-SFHVURJKSA-N 0 1 389.268 3.187 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2cnc(-c3cccs3)s2)C1 ZINC000648073404 567813368 /nfs/dbraw/zinc/81/33/68/567813368.db2.gz LJERDFROPSFZRU-AWEZNQCLSA-N 0 1 375.441 3.372 10 0 GGAEMN CCOc1cc(CNCc2c(C3CC3)cnn2C)cc(Br)c1O ZINC000668584080 567814047 /nfs/dbraw/zinc/81/40/47/567814047.db2.gz AOZSDVSNQKKOFU-UHFFFAOYSA-N 0 1 380.286 3.454 10 0 GGAEMN C[C@]12COC[C@@H]1C[N@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597584 567814177 /nfs/dbraw/zinc/81/41/77/567814177.db2.gz UPVSUAYCWXSKEI-HZMBPMFUSA-N 0 1 391.103 3.386 10 0 GGAEMN C[C@]12COC[C@@H]1C[N@@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597584 567814180 /nfs/dbraw/zinc/81/41/80/567814180.db2.gz UPVSUAYCWXSKEI-HZMBPMFUSA-N 0 1 391.103 3.386 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1C[C@H]2COC[C@]2(C)C1 ZINC000668594845 567814348 /nfs/dbraw/zinc/81/43/48/567814348.db2.gz HRHVLDUXCFVOAU-YJBOKZPZSA-N 0 1 384.314 3.333 10 0 GGAEMN C[C@@]12COC[C@@H]1C[N@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597586 567814388 /nfs/dbraw/zinc/81/43/88/567814388.db2.gz UPVSUAYCWXSKEI-IINYFYTJSA-N 0 1 391.103 3.386 10 0 GGAEMN C[C@@]12COC[C@@H]1C[N@@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597586 567814389 /nfs/dbraw/zinc/81/43/89/567814389.db2.gz UPVSUAYCWXSKEI-IINYFYTJSA-N 0 1 391.103 3.386 10 0 GGAEMN CN(C(=O)c1c(F)c(F)c(Br)c(F)c1F)[C@H]1CCN(C2CC2)C1 ZINC000668599385 567814482 /nfs/dbraw/zinc/81/44/82/567814482.db2.gz WEFGYVJIXXYXIT-QMMMGPOBSA-N 0 1 395.194 3.314 10 0 GGAEMN Cn1cnnc1-c1ccccc1NS(=O)(=O)c1cccc(OC(F)(F)F)c1 ZINC000047992052 570216909 /nfs/dbraw/zinc/21/69/09/570216909.db2.gz GGYMIZMZZHQNJT-UHFFFAOYSA-N 0 1 398.366 3.182 10 0 GGAEMN O=C(Cc1ccc(OC(F)(F)F)cc1)NCCN1CCc2ccccc2C1 ZINC000048180121 570220062 /nfs/dbraw/zinc/22/00/62/570220062.db2.gz LZICRKNDACESCA-UHFFFAOYSA-N 0 1 378.394 3.302 10 0 GGAEMN CN1CCC[C@H]1CNC(=O)c1cc(-c2ccccc2)c(N2CCOCC2)s1 ZINC000048286304 570231626 /nfs/dbraw/zinc/23/16/26/570231626.db2.gz QRFVIWMKIYMTIK-KRWDZBQOSA-N 0 1 385.533 3.076 10 0 GGAEMN CN(c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(C(N)=O)cc1 ZINC000048356589 570242817 /nfs/dbraw/zinc/24/28/17/570242817.db2.gz FUEOVXWBAWQJLN-UHFFFAOYSA-N 0 1 381.457 3.354 10 0 GGAEMN Cc1c2c(nn1-c1cccc(Cl)c1)c(=O)n(CCN1CCCCC1)nc2C ZINC000000642656 570279338 /nfs/dbraw/zinc/27/93/38/570279338.db2.gz XBFPRFKNGIVFGG-UHFFFAOYSA-N 0 1 385.899 3.338 10 0 GGAEMN Cc1ccc(-c2cc(C(=O)N3CCC(c4nnc5ccccn54)CC3)n[nH]2)cc1 ZINC000022306472 570312754 /nfs/dbraw/zinc/31/27/54/570312754.db2.gz RBHFLIPBSHYWIW-UHFFFAOYSA-N 0 1 386.459 3.448 10 0 GGAEMN CC(C)N1CCN(C(=O)c2nnc(N3CCC(C)CC3)c3ccccc32)CC1 ZINC000034837997 570335917 /nfs/dbraw/zinc/33/59/17/570335917.db2.gz LSAAJWOQCGWUEB-UHFFFAOYSA-N 0 1 381.524 3.032 10 0 GGAEMN CCCc1nc(SCC(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)n[nH]1 ZINC000023007881 570340319 /nfs/dbraw/zinc/34/03/19/570340319.db2.gz ORKFZWNEXSQIGE-OAHLLOKOSA-N 0 1 390.509 3.230 10 0 GGAEMN CCCc1n[nH]c(SCC(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)n1 ZINC000023007881 570340321 /nfs/dbraw/zinc/34/03/21/570340321.db2.gz ORKFZWNEXSQIGE-OAHLLOKOSA-N 0 1 390.509 3.230 10 0 GGAEMN Cc1ccc(-n2nc(C(=O)NCCN3CCCCC3)nc2-c2ccco2)cc1 ZINC000034911393 570340790 /nfs/dbraw/zinc/34/07/90/570340790.db2.gz XLJATVQWBRLXIS-UHFFFAOYSA-N 0 1 379.464 3.051 10 0 GGAEMN Cc1cccc(-n2nc(C(=O)NCCN3CCCCC3)nc2-c2ccco2)c1 ZINC000034911494 570341087 /nfs/dbraw/zinc/34/10/87/570341087.db2.gz GJXLFTBKLZOPLI-UHFFFAOYSA-N 0 1 379.464 3.051 10 0 GGAEMN CC(C)[C@@H](NC(=O)C1CCCCC1)C(=O)NC[C@@H](c1ccsc1)N(C)C ZINC000023133355 570346033 /nfs/dbraw/zinc/34/60/33/570346033.db2.gz MYEOOYVRRJEWQP-ZWKOTPCHSA-N 0 1 379.570 3.188 10 0 GGAEMN CN(C)[C@H](CNC(=O)[C@@H]1CCCN(C(=O)c2cccs2)C1)c1ccsc1 ZINC000023133434 570346206 /nfs/dbraw/zinc/34/62/06/570346206.db2.gz RUEHVLCYIGWBHF-GDBMZVCRSA-N 0 1 391.562 3.081 10 0 GGAEMN O=C(NCCc1cnc[nH]1)c1nc2ccccc2c(Nc2ccc(F)cc2)n1 ZINC000035430134 570358138 /nfs/dbraw/zinc/35/81/38/570358138.db2.gz IABKGKAHNNPEIO-UHFFFAOYSA-N 0 1 376.395 3.208 10 0 GGAEMN CC1CCC(NC(=O)[C@@H]2CCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)CC1 ZINC000035508232 570379502 /nfs/dbraw/zinc/37/95/02/570379502.db2.gz ALIFSZZOGRCNET-IIIMJFFVSA-N 0 1 395.507 3.019 10 0 GGAEMN Cc1ccc(Cc2nc(CCNS(=O)(=O)c3cc(C)c(C)cc3C)n[nH]2)cc1 ZINC000035509287 570379926 /nfs/dbraw/zinc/37/99/26/570379926.db2.gz JQENHPYIZDLRHZ-UHFFFAOYSA-N 0 1 398.532 3.150 10 0 GGAEMN CC[C@H](C)NC(=O)CCCn1c(=O)c2[nH]c3ccc(OC)cc3c2[nH]c1=S ZINC000004951006 570380732 /nfs/dbraw/zinc/38/07/32/570380732.db2.gz QPXVJJJJSZKTPO-NSHDSACASA-N 0 1 388.493 3.244 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cc(-c3noc(C)n3)sc2C)cc(OC)c1 ZINC000035539064 570391125 /nfs/dbraw/zinc/39/11/25/570391125.db2.gz PVWDZZHSRRBGJX-UHFFFAOYSA-N 0 1 395.462 3.233 10 0 GGAEMN CC(C)[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H](c1cccs1)N(C)C ZINC000025385315 570412899 /nfs/dbraw/zinc/41/28/99/570412899.db2.gz CCDOXKXCXJCSRY-WMZOPIPTSA-N 0 1 391.512 3.061 10 0 GGAEMN CC(=O)N1CCc2cc(NC(=O)CN3CCC[C@@H]3Cc3ccccc3)ccc21 ZINC000025440870 570413747 /nfs/dbraw/zinc/41/37/47/570413747.db2.gz ACKOPODLEWKYPX-OAQYLSRUSA-N 0 1 377.488 3.241 10 0 GGAEMN CC(=O)N1CCc2cc(NC(=O)CN3CCC[C@H]3Cc3ccccc3)ccc21 ZINC000025440872 570413757 /nfs/dbraw/zinc/41/37/57/570413757.db2.gz ACKOPODLEWKYPX-NRFANRHFSA-N 0 1 377.488 3.241 10 0 GGAEMN O=C([O-])C1(c2ccccc2)CCN(C(=O)[C@H]2CCC[N@H+]2Cc2ccccc2)CC1 ZINC000238066707 570422894 /nfs/dbraw/zinc/42/28/94/570422894.db2.gz YHSXUBIRYXUJAN-OAQYLSRUSA-N 0 1 392.499 3.296 10 0 GGAEMN O=C([C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)N1CCN2CCCC[C@H]2C1 ZINC000248002568 570434856 /nfs/dbraw/zinc/43/48/56/570434856.db2.gz RKFPLJBINYJPPP-GJZGRUSLSA-N 0 1 396.318 3.043 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)C(C)(C)Cc2cccc(Cl)c2)CC1 ZINC000192143016 570448849 /nfs/dbraw/zinc/44/88/49/570448849.db2.gz VICDEUUNFGNYNN-UHFFFAOYSA-N 0 1 380.916 3.306 10 0 GGAEMN C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NC[C@H]2C[C@H](O)CN2Cc2ccccc2)o1 ZINC000252477476 570474080 /nfs/dbraw/zinc/47/40/80/570474080.db2.gz OOIAGFVFXYNQEW-RBAQFSTRSA-N 0 1 382.504 3.087 10 0 GGAEMN COc1cccc(N2CC[C@H](CNc3nc(C(F)(F)F)nc4[nH]cnc43)C2)c1 ZINC000252482120 570474591 /nfs/dbraw/zinc/47/45/91/570474591.db2.gz CYXVVJVDSCDXFZ-LLVKDONJSA-N 0 1 392.385 3.319 10 0 GGAEMN Cc1ccc(NC(=O)C[N@H+]2CCC[C@@H](Cc3nnc4ccccn43)C2)c(C)c1 ZINC000252570985 570477688 /nfs/dbraw/zinc/47/76/88/570477688.db2.gz XMROSJQWWUIUIJ-SFHVURJKSA-N 0 1 377.492 3.239 10 0 GGAEMN Cc1ccc(NC(=O)CN2CCC[C@@H](Cc3nnc4ccccn43)C2)c(C)c1 ZINC000252570985 570477690 /nfs/dbraw/zinc/47/76/90/570477690.db2.gz XMROSJQWWUIUIJ-SFHVURJKSA-N 0 1 377.492 3.239 10 0 GGAEMN COc1ccc(CCN(C)C(=O)CN(C)[C@H]2CCc3ccccc32)cc1OC ZINC000029810828 570480726 /nfs/dbraw/zinc/48/07/26/570480726.db2.gz PPJFJYKVYNZGIQ-FQEVSTJZSA-N 0 1 382.504 3.324 10 0 GGAEMN COc1ccc(-c2n[nH]c(SCC(=O)N3CCC(c4ccccc4)=N3)n2)cc1 ZINC000006579893 570481059 /nfs/dbraw/zinc/48/10/59/570481059.db2.gz QURNKGJSSHUMFC-UHFFFAOYSA-N 0 1 393.472 3.209 10 0 GGAEMN O=C(NCCCN1CCOCC1)c1ccc(-c2cc(-c3ccccc3)[nH]n2)cc1 ZINC000022666865 570492889 /nfs/dbraw/zinc/49/28/89/570492889.db2.gz JATPMGCJJBUSFA-UHFFFAOYSA-N 0 1 390.487 3.196 10 0 GGAEMN CCc1ccc(-c2n[nH]c(SCC(=O)Nc3ccc4c(c3)OCO4)n2)cc1 ZINC000005180369 570494978 /nfs/dbraw/zinc/49/49/78/570494978.db2.gz LJPGLZYHJGDIIJ-UHFFFAOYSA-N 0 1 382.445 3.494 10 0 GGAEMN C[C@@H](c1ccc2c(c1)OCCO2)N(C)C(=O)Nc1nc(-c2ccccc2)n[nH]1 ZINC000032561835 570511371 /nfs/dbraw/zinc/51/13/71/570511371.db2.gz JMHJYYLMUUFRNE-ZDUSSCGKSA-N 0 1 379.420 3.468 10 0 GGAEMN C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CSc1nc(-c2ccccc2)n[nH]1 ZINC000005216700 570513247 /nfs/dbraw/zinc/51/32/47/570513247.db2.gz NYAWRKVUMLSGHA-CYBMUJFWSA-N 0 1 393.472 3.328 10 0 GGAEMN CCOC(=O)C1CCN([C@H](c2ccccc2)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022696810 570529160 /nfs/dbraw/zinc/52/91/60/570529160.db2.gz XNUPSLAXPLNHOZ-OAQYLSRUSA-N 0 1 398.503 3.247 10 0 GGAEMN CCOC(=O)C1CCN([C@@H](c2ccccc2)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022696807 570529200 /nfs/dbraw/zinc/52/92/00/570529200.db2.gz XNUPSLAXPLNHOZ-NRFANRHFSA-N 0 1 398.503 3.247 10 0 GGAEMN COCCN(Cc1ccccc1OC)C[C@@H](O)COc1ccc(Cl)cc1 ZINC000036096198 570533883 /nfs/dbraw/zinc/53/38/83/570533883.db2.gz VTECOYVCBQDRGS-GOSISDBHSA-N 0 1 379.884 3.237 10 0 GGAEMN Cc1ccc(C)c(Cc2c(C)nc(C)nc2N2CCN(C[C@@H](O)C(C)C)CC2)c1 ZINC000036340291 570563497 /nfs/dbraw/zinc/56/34/97/570563497.db2.gz UYYAVJUWSNVTRF-HSZRJFAPSA-N 0 1 396.579 3.440 10 0 GGAEMN CCOC(=O)c1c(C)c(S(=O)(=O)Nc2c(C)cccc2CC)c(C)n1C ZINC000064863266 570571992 /nfs/dbraw/zinc/57/19/92/570571992.db2.gz LPSPYVXYCWTDQT-UHFFFAOYSA-N 0 1 378.494 3.490 10 0 GGAEMN CCOC(=O)C1C(CN2C[C@H](C)C[C@H](C)C2)=NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000034145578 570584288 /nfs/dbraw/zinc/58/42/88/570584288.db2.gz JOAZBEZPXLZMIT-YRNRMSPPSA-N 0 1 385.508 3.144 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2cc(Cl)ccc2C)cc(C(=O)N2CCCC2)n1C ZINC000064922052 570593516 /nfs/dbraw/zinc/59/35/16/570593516.db2.gz GJJYWNUUUYBYKT-UHFFFAOYSA-N 0 1 395.912 3.332 10 0 GGAEMN COc1ccc([C@H](CNC(=O)c2ccc3ncsc3c2)N(C)C)cc1OC ZINC000006788241 570594026 /nfs/dbraw/zinc/59/40/26/570594026.db2.gz RSHSDDNFMGZPNC-INIZCTEOSA-N 0 1 385.489 3.346 10 0 GGAEMN CCNC(=O)[C@@H]1Cc2ccccc2N2CC[N@@H+](Cc3ccc(Cl)cc3)C[C@@H]12 ZINC000169679224 570600777 /nfs/dbraw/zinc/60/07/77/570600777.db2.gz YDLDNZVHLUKFFQ-CTNGQTDRSA-N 0 1 383.923 3.339 10 0 GGAEMN CCNC(=O)[C@@H]1Cc2ccccc2N2CCN(Cc3ccc(Cl)cc3)C[C@@H]12 ZINC000169679224 570600780 /nfs/dbraw/zinc/60/07/80/570600780.db2.gz YDLDNZVHLUKFFQ-CTNGQTDRSA-N 0 1 383.923 3.339 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)cc1)c1ccc(NCCCN2CCCC2)nn1 ZINC000064942925 570601897 /nfs/dbraw/zinc/60/18/97/570601897.db2.gz PLGHIJXKPVGMLI-UHFFFAOYSA-N 0 1 394.928 3.002 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(-c3ccno3)cc2OC)cc1OC ZINC000064979506 570624151 /nfs/dbraw/zinc/62/41/51/570624151.db2.gz UZLHHWKBHUFZFB-UHFFFAOYSA-N 0 1 390.417 3.168 10 0 GGAEMN CCc1nc(C)nc(N2CCN(C[C@@H](C)O)CC2)c1Cc1ccc(Cl)cc1 ZINC000036340747 570624996 /nfs/dbraw/zinc/62/49/96/570624996.db2.gz GPXZYGDZMGJVHB-OAHLLOKOSA-N 0 1 388.943 3.094 10 0 GGAEMN CCc1nc(C)nc(N2CCN(C[C@H](O)CC)CC2)c1Cc1ccc(C)cc1 ZINC000036340636 570625309 /nfs/dbraw/zinc/62/53/09/570625309.db2.gz GMRFJFZDTYCZLW-HXUWFJFHSA-N 0 1 382.552 3.140 10 0 GGAEMN O=C(CN1CCCC1)N1N=C(c2ccccc2)C[C@@H]1c1ccc2c(c1)OCO2 ZINC000036344396 570626536 /nfs/dbraw/zinc/62/65/36/570626536.db2.gz GKWJPQSIUQHQRB-LJQANCHMSA-N 0 1 377.444 3.189 10 0 GGAEMN Cc1cccc(CN(CCC(=O)N2CCNCC2)C(=O)c2ccc(Cl)cc2)c1 ZINC000045966965 570649834 /nfs/dbraw/zinc/64/98/34/570649834.db2.gz VWLVCMFDHYFNLN-UHFFFAOYSA-N 0 1 399.922 3.113 10 0 GGAEMN CCCCCN(CCC(=O)N1CCNCC1)C(=O)c1ccc(C(F)(F)F)cc1 ZINC000045966680 570649925 /nfs/dbraw/zinc/64/99/25/570649925.db2.gz YBDJWNWNDIDXTN-UHFFFAOYSA-N 0 1 399.457 3.160 10 0 GGAEMN Cc1cc(C)cc(C(=O)N(CCC(=O)N2CCNCC2)C2CCCCCC2)c1 ZINC000045966569 570649976 /nfs/dbraw/zinc/64/99/76/570649976.db2.gz NERMEUJVOXPFDO-UHFFFAOYSA-N 0 1 385.552 3.290 10 0 GGAEMN Cc1nc([C@H](NC(=O)Nc2cccc(Cl)c2N2CCOCC2)C(C)C)n[nH]1 ZINC000072314096 570653233 /nfs/dbraw/zinc/65/32/33/570653233.db2.gz KFWLGAODFPJNOS-OAHLLOKOSA-N 0 1 392.891 3.122 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2c(c1)C[C@H](C)N2C(=O)C1CC1 ZINC000006866807 570655004 /nfs/dbraw/zinc/65/50/04/570655004.db2.gz MKFWEMVZAOZRBF-ZDUSSCGKSA-N 0 1 386.473 3.184 10 0 GGAEMN Cc1cccnc1NC(=O)[C@@H]1CCCN(C[C@@H](O)c2ccc(F)c(F)c2)C1 ZINC000229750264 570666110 /nfs/dbraw/zinc/66/61/10/570666110.db2.gz BEIQDRWUQSYACO-CRAIPNDOSA-N 0 1 375.419 3.052 10 0 GGAEMN CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)Nc1ccc(OCC)cc1 ZINC000006887599 570682099 /nfs/dbraw/zinc/68/20/99/570682099.db2.gz KSRILBZXWKJVEV-UHFFFAOYSA-N 0 1 380.466 3.018 10 0 GGAEMN CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)Nc1cccc(-c2ccno2)c1 ZINC000006887516 570682106 /nfs/dbraw/zinc/68/21/06/570682106.db2.gz CHEGISZAQXSOLJ-UHFFFAOYSA-N 0 1 389.433 3.264 10 0 GGAEMN CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)Nc1c(C)cccc1CC ZINC000006887609 570682117 /nfs/dbraw/zinc/68/21/17/570682117.db2.gz RMRXKJXVDPWIPX-UHFFFAOYSA-N 0 1 378.494 3.490 10 0 GGAEMN Cc1cc(NC(=O)c2cc(-c3ccncc3)on2)cc(N2CCN(C)CC2)c1 ZINC000240407459 570685110 /nfs/dbraw/zinc/68/51/10/570685110.db2.gz FMKSYCDNVXIDGH-UHFFFAOYSA-N 0 1 377.448 3.049 10 0 GGAEMN CCn1nc(-c2csc(S(=O)(=O)Nc3cc(F)ccc3F)c2)ccc1=O ZINC000065128983 570704628 /nfs/dbraw/zinc/70/46/28/570704628.db2.gz UZZAAJWBDCKSPW-UHFFFAOYSA-N 0 1 397.428 3.071 10 0 GGAEMN CCCN1CCN(C(=O)c2cc(NC(=O)C3CCC3)cc3nc(C)ccc32)CC1 ZINC000065136094 570707322 /nfs/dbraw/zinc/70/73/22/570707322.db2.gz QKRUVBNXVFAEAF-UHFFFAOYSA-N 0 1 394.519 3.450 10 0 GGAEMN CCOC(=O)[C@@H]1C[C@H]2CCCN2[C@@]12c1ccccc1N(Cc1ccccc1)C2=O ZINC000058090325 570708731 /nfs/dbraw/zinc/70/87/31/570708731.db2.gz JSPQCGNBGKHZMJ-WWEVIYMKSA-N 0 1 390.483 3.476 10 0 GGAEMN CCCCN1CCN(C(=O)c2ccc(-c3ccnc(N4CCCC4)n3)cc2)CC1 ZINC000065171662 570721560 /nfs/dbraw/zinc/72/15/60/570721560.db2.gz WFIDQCQHHKPBBD-UHFFFAOYSA-N 0 1 393.535 3.302 10 0 GGAEMN O=C(CN1CCC[C@@H]1Cc1cccc(F)c1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000052035646 570724278 /nfs/dbraw/zinc/72/42/78/570724278.db2.gz COYOGQYZBOFXBL-NFBKMPQASA-N 0 1 395.522 3.475 10 0 GGAEMN Cc1nnc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2ccc(F)c(F)c2)o1 ZINC000065194109 570725822 /nfs/dbraw/zinc/72/58/22/570725822.db2.gz LAWUTCCKGMWXEY-UHFFFAOYSA-N 0 1 382.392 3.079 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000249073614 570732469 /nfs/dbraw/zinc/73/24/69/570732469.db2.gz ALUGUOZMQRMSNM-IKGGRYGDSA-N 0 1 398.425 3.206 10 0 GGAEMN O=C(CCN(Cc1ccccn1)C[C@H]1CCCO1)N1CCc2ccccc2C1 ZINC000065386963 570763962 /nfs/dbraw/zinc/76/39/62/570763962.db2.gz JGHYYDUUYBSKIY-JOCHJYFZSA-N 0 1 379.504 3.038 10 0 GGAEMN CCCN(Cc1ccc(OC)c(OC)c1)Cc1cc(=O)n2cc(C)sc2n1 ZINC000033068967 570774406 /nfs/dbraw/zinc/77/44/06/570774406.db2.gz KNQAWKAETXLKBC-UHFFFAOYSA-N 0 1 387.505 3.494 10 0 GGAEMN Cc1ccc(-c2nccn3cc(C(=O)N4CCN(CC(C)C)CC4)nc23)cc1 ZINC000065274546 570776953 /nfs/dbraw/zinc/77/69/53/570776953.db2.gz BEROIMZRHOYKSL-UHFFFAOYSA-N 0 1 377.492 3.119 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccc2oc(=O)ccc2c1 ZINC000032754910 570797645 /nfs/dbraw/zinc/79/76/45/570797645.db2.gz OTSWFHCKZFESBL-UHFFFAOYSA-N 0 1 393.804 3.034 10 0 GGAEMN CCNC(=O)NC(=O)[C@H](Sc1nc(-c2ccc(C)cc2)n[nH]1)c1ccccc1 ZINC000005868827 570799484 /nfs/dbraw/zinc/79/94/84/570799484.db2.gz RLLCKOLXLZLYEH-MRXNPFEDSA-N 0 1 395.488 3.459 10 0 GGAEMN CCOC1(c2nc([C@H]3CCCO3)no2)CCN(Cc2ccc3c(c2)CCO3)CC1 ZINC000583615938 570800782 /nfs/dbraw/zinc/80/07/82/570800782.db2.gz SPTTVYXUJPBTNW-LJQANCHMSA-N 0 1 399.491 3.384 10 0 GGAEMN COc1ccc2c(CN[C@@H](C)c3ccc(S(C)(=O)=O)cc3)cc(=O)oc2c1 ZINC000032797370 570819805 /nfs/dbraw/zinc/81/98/05/570819805.db2.gz HXAZLMRIVPJEMM-ZDUSSCGKSA-N 0 1 387.457 3.056 10 0 GGAEMN Cc1c(O)ccc2c(CN[C@H](C)c3ccc(S(C)(=O)=O)cc3)cc(=O)oc12 ZINC000032797382 570819824 /nfs/dbraw/zinc/81/98/24/570819824.db2.gz UWMWVSJNOAYXAD-CYBMUJFWSA-N 0 1 387.457 3.061 10 0 GGAEMN CCN(C(=O)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1 ZINC000065575890 570836057 /nfs/dbraw/zinc/83/60/57/570836057.db2.gz XSOAJEZDKWCIBE-UHFFFAOYSA-N 0 1 399.922 3.474 10 0 GGAEMN O=C(CCNC(=O)c1ccccc1Cl)NC[C@@H](c1ccco1)N1CCCC1 ZINC000005704803 570836296 /nfs/dbraw/zinc/83/62/96/570836296.db2.gz XJAMBQPEJFYNAQ-KRWDZBQOSA-N 0 1 389.883 3.006 10 0 GGAEMN CCOC(=O)C1CCN(C[C@H](O)COc2ccc(C(C)(C)CC)cc2)CC1 ZINC000003237235 570840277 /nfs/dbraw/zinc/84/02/77/570840277.db2.gz CLVBZZPHOLPDKS-IBGZPJMESA-N 0 1 377.525 3.389 10 0 GGAEMN Cc1occc1-c1nnc(NC(=O)CCn2c(=O)c3ccccc3[nH]c2=S)o1 ZINC000012545186 570845835 /nfs/dbraw/zinc/84/58/35/570845835.db2.gz JNNGKFINNQLAJY-UHFFFAOYSA-N 0 1 397.416 3.039 10 0 GGAEMN CCn1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3ccccc3C)ccc21 ZINC000022936108 570857729 /nfs/dbraw/zinc/85/77/29/570857729.db2.gz SMZFKPDVNUZDQK-UHFFFAOYSA-N 0 1 391.519 3.364 10 0 GGAEMN Cc1nc(COc2ccccc2C(=O)NCCN2CC=C(C(C)(C)C)CC2)no1 ZINC000170600625 570858591 /nfs/dbraw/zinc/85/85/91/570858591.db2.gz DMKZODYADOXCIH-UHFFFAOYSA-N 0 1 398.507 3.365 10 0 GGAEMN O=C(NC[C@H](c1c(F)cccc1Cl)N1CCCC1)[C@H]1CCCN1C1CC1 ZINC000170615869 570873444 /nfs/dbraw/zinc/87/34/44/570873444.db2.gz ICACSGIKIKKWSI-QZTJIDSGSA-N 0 1 379.907 3.359 10 0 GGAEMN O=C(c1cc(-c2ccccc2)[nH]n1)N1CCc2c(=O)[nH]c(-c3ccccc3)nc2C1 ZINC000097112219 570896840 /nfs/dbraw/zinc/89/68/40/570896840.db2.gz FLEZGSVVYUCBJP-UHFFFAOYSA-N 0 1 397.438 3.026 10 0 GGAEMN CCOC[C@@H](O)C[N@H+](Cc1cccc(F)c1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982519 570911017 /nfs/dbraw/zinc/91/10/17/570911017.db2.gz KEHZNWMPRRYIFK-LEWJYISDSA-N 0 1 386.467 3.218 10 0 GGAEMN CCOC[C@@H](O)CN(Cc1cccc(F)c1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982519 570911020 /nfs/dbraw/zinc/91/10/20/570911020.db2.gz KEHZNWMPRRYIFK-LEWJYISDSA-N 0 1 386.467 3.218 10 0 GGAEMN CCOC[C@@H](O)C[N@H+](Cc1ccc(F)cc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982492 570911089 /nfs/dbraw/zinc/91/10/89/570911089.db2.gz MOWJCXHJKHMGKH-LEWJYISDSA-N 0 1 386.467 3.218 10 0 GGAEMN CCOC[C@@H](O)CN(Cc1ccc(F)cc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982492 570911092 /nfs/dbraw/zinc/91/10/92/570911092.db2.gz MOWJCXHJKHMGKH-LEWJYISDSA-N 0 1 386.467 3.218 10 0 GGAEMN CCOC[C@H](O)C[N@H+](Cc1ccc(F)cc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982488 570911187 /nfs/dbraw/zinc/91/11/87/570911187.db2.gz MOWJCXHJKHMGKH-NHCUHLMSSA-N 0 1 386.467 3.218 10 0 GGAEMN CCOC[C@H](O)CN(Cc1ccc(F)cc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982488 570911190 /nfs/dbraw/zinc/91/11/90/570911190.db2.gz MOWJCXHJKHMGKH-NHCUHLMSSA-N 0 1 386.467 3.218 10 0 GGAEMN CC(C)OC[C@H](O)C[N@H+](Cc1ccccc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104983772 570911248 /nfs/dbraw/zinc/91/12/48/570911248.db2.gz ZQETZVZWMILIOS-FGZHOGPDSA-N 0 1 382.504 3.468 10 0 GGAEMN CC(C)OC[C@H](O)CN(Cc1ccccc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104983772 570911250 /nfs/dbraw/zinc/91/12/50/570911250.db2.gz ZQETZVZWMILIOS-FGZHOGPDSA-N 0 1 382.504 3.468 10 0 GGAEMN CC(C)(C)C(=O)Nc1cccc(NC(=O)c2ccccc2NS(C)(=O)=O)c1 ZINC000032909843 570912391 /nfs/dbraw/zinc/91/23/91/570912391.db2.gz WCJYRQNZAHWZIA-UHFFFAOYSA-N 0 1 389.477 3.295 10 0 GGAEMN O=C(NCCNC(=O)c1ccc(O)c(Cl)c1)c1ccc(C(F)(F)F)cc1 ZINC000032909882 570912471 /nfs/dbraw/zinc/91/24/71/570912471.db2.gz YADSPNPSUFVQHZ-UHFFFAOYSA-N 0 1 386.757 3.224 10 0 GGAEMN COc1cn(CC(=O)Nc2ccc(C)cc2C)c(CN2CCC(C)CC2)cc1=O ZINC000017025916 570924583 /nfs/dbraw/zinc/92/45/83/570924583.db2.gz WTDCGLKQHKDLGZ-UHFFFAOYSA-N 0 1 397.519 3.344 10 0 GGAEMN CCOC(=O)C1=C(CN2CCCC[C@H]2C)N(C)C(=O)N[C@@H]1c1cccc(C)c1 ZINC000106005655 570933900 /nfs/dbraw/zinc/93/39/00/570933900.db2.gz VGZPKLYCEBZRLV-OXQOHEQNSA-N 0 1 385.508 3.383 10 0 GGAEMN O=C(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1n[nH]c2ccccc21 ZINC000032930183 570942087 /nfs/dbraw/zinc/94/20/87/570942087.db2.gz IHAZWDDJAQFDGI-UHFFFAOYSA-N 0 1 389.381 3.376 10 0 GGAEMN CCc1nc(SCc2noc(CCC(=O)Nc3ccc(C)c(C)c3)n2)n[nH]1 ZINC000033270992 570947022 /nfs/dbraw/zinc/94/70/22/570947022.db2.gz QXPPZUGJWCCVGL-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN CCc1n[nH]c(SCc2noc(CCC(=O)Nc3ccc(C)c(C)c3)n2)n1 ZINC000033270992 570947027 /nfs/dbraw/zinc/94/70/27/570947027.db2.gz QXPPZUGJWCCVGL-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1 ZINC000106141247 570948915 /nfs/dbraw/zinc/94/89/15/570948915.db2.gz UPJGJCFDZFADIK-JFIYKMOQSA-N 0 1 377.504 3.020 10 0 GGAEMN Cc1[nH]c2ccccc2c1CC(=O)NCc1ccccc1CN1CCN(C)CC1 ZINC000052873237 570953553 /nfs/dbraw/zinc/95/35/53/570953553.db2.gz LINVWQGMFUJQQX-UHFFFAOYSA-N 0 1 390.531 3.083 10 0 GGAEMN COC(=O)c1cccn1C1CCN([C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)CC1 ZINC000106866737 570967651 /nfs/dbraw/zinc/96/76/51/570967651.db2.gz SREHHTMXZGWCTC-IMBTUZDBSA-N 0 1 389.540 3.241 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CC(NC(=O)OCC2c3ccccc3-c3ccccc32)C1 ZINC000725240426 570974303 /nfs/dbraw/zinc/97/43/03/570974303.db2.gz FBGKTTQPPFLPPV-UHFFFAOYSA-N 0 1 394.471 3.463 10 0 GGAEMN CC(C)(C)CNC(=O)c1[nH]cnc1C(=O)NCc1cccc(C(F)(F)F)c1 ZINC000033327513 570983026 /nfs/dbraw/zinc/98/30/26/570983026.db2.gz KRUGFWRVRCQDBQ-UHFFFAOYSA-N 0 1 382.386 3.134 10 0 GGAEMN COc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)=O)cc2)CC1 ZINC000170649076 570984925 /nfs/dbraw/zinc/98/49/25/570984925.db2.gz NTZXWLWBVBLIBU-UHFFFAOYSA-N 0 1 396.487 3.057 10 0 GGAEMN CN(C)c1ccc(N[C@@H]2CCCN(C(=O)c3cccc4[nH]cnc43)CC2)cn1 ZINC000252532842 570989221 /nfs/dbraw/zinc/98/92/21/570989221.db2.gz FIBOESKENFTUCJ-OAHLLOKOSA-N 0 1 378.480 3.131 10 0 GGAEMN Cc1cc(C)n(-c2ccc(N3CCC[C@H]3c3n[nH]c(-c4ccccc4)n3)nn2)n1 ZINC000252537526 570992161 /nfs/dbraw/zinc/99/21/61/570992161.db2.gz LNDDPKMNYRPXKK-KRWDZBQOSA-N 0 1 386.463 3.406 10 0 GGAEMN Cc1cc(C)n(-c2ccc(N3CCC[C@H]3c3nc(-c4ccccc4)n[nH]3)nn2)n1 ZINC000252537526 570992167 /nfs/dbraw/zinc/99/21/67/570992167.db2.gz LNDDPKMNYRPXKK-KRWDZBQOSA-N 0 1 386.463 3.406 10 0 GGAEMN COc1cccc([C@@H](CNC(=O)c2cnn(CC(F)(F)F)c2)N2CCCC2)c1 ZINC000252539479 570992646 /nfs/dbraw/zinc/99/26/46/570992646.db2.gz OCAYEXZTTYCIKY-QGZVFWFLSA-N 0 1 396.413 3.021 10 0 GGAEMN CC(C)OCC[C@@H]1CCCCN1C(=O)c1ccc2c(c1)[nH]c(=S)[nH]c2=O ZINC000170653613 570998929 /nfs/dbraw/zinc/99/89/29/570998929.db2.gz HPCMXEXXVSSRSN-AWEZNQCLSA-N 0 1 375.494 3.022 10 0 GGAEMN CC(C)OCC[C@H]1CCCCN1C(=O)c1ccc2c(c1)[nH]c(=S)[nH]c2=O ZINC000170653615 570998998 /nfs/dbraw/zinc/99/89/98/570998998.db2.gz HPCMXEXXVSSRSN-CQSZACIVSA-N 0 1 375.494 3.022 10 0 GGAEMN O=C(NCc1ccc(N2CCCCCC2)nc1)Nc1cnn(-c2ccncc2)c1 ZINC000084425578 571017787 /nfs/dbraw/zinc/01/77/87/571017787.db2.gz LIOHAQLZKBGERU-UHFFFAOYSA-N 0 1 391.479 3.364 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2)n[nH]1)NCCc1c[nH]c2ccccc12 ZINC000007733589 571027204 /nfs/dbraw/zinc/02/72/04/571027204.db2.gz XFHBFAXOPQSMEZ-UHFFFAOYSA-N 0 1 377.473 3.404 10 0 GGAEMN O=C(CN[C@H](c1cccs1)c1ccccc1)N1CCN(c2ccccn2)CC1 ZINC000007750243 571030887 /nfs/dbraw/zinc/03/08/87/571030887.db2.gz HRXJNAOGUPLDEY-QFIPXVFZSA-N 0 1 392.528 3.171 10 0 GGAEMN Fc1cc2ncnc(NCCCCN3CCOCC3)c2cc1Br ZINC000543398204 650910209 /nfs/dbraw/zinc/91/02/09/650910209.db2.gz PENLYEQNBCQKFI-UHFFFAOYSA-N 0 1 383.265 3.056 10 0 GGAEMN Cc1cc2oc(=O)cc(CN3CCC(N4CCNC4=O)CC3)c2cc1C(C)C ZINC000053282258 1406355066 /nfs/dbraw/zinc/35/50/66/1406355066.db2.gz HNQFPIYONUOEIQ-UHFFFAOYSA-N 0 1 383.492 3.214 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1CNCc1ccc(N2CCO[C@@H](C)C2)nc1 ZINC000054467326 1406743593 /nfs/dbraw/zinc/74/35/93/1406743593.db2.gz ICBOVMZTYPXCNM-KRWDZBQOSA-N 0 1 391.519 3.399 10 0 GGAEMN COc1ccc(OC)c([C@@H](C)NC(=O)CN2CCC(c3ccc(O)cc3)CC2)c1 ZINC000055103101 1406885806 /nfs/dbraw/zinc/88/58/06/1406885806.db2.gz DXSWCHCYNHYOPZ-MRXNPFEDSA-N 0 1 398.503 3.466 10 0 GGAEMN CN(C(=O)C(=O)c1c(-c2ccccc2)cc2ccccn21)C1CCN(C)CC1 ZINC000003235922 1398329082 /nfs/dbraw/zinc/32/90/82/1398329082.db2.gz SBTPIRHGMMCXLB-UHFFFAOYSA-N 0 1 375.472 3.342 10 0 GGAEMN Cc1cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)CC3CCCC3)cc2)n1 ZINC000003313159 1398334693 /nfs/dbraw/zinc/33/46/93/1398334693.db2.gz OSCKYCHDAWPJBP-UHFFFAOYSA-N 0 1 388.493 3.413 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc(NC(=O)c2ccccn2)cc1 ZINC000003425698 1398345486 /nfs/dbraw/zinc/34/54/86/1398345486.db2.gz ZWZPZTZKRRHCMM-UHFFFAOYSA-N 0 1 383.429 3.143 10 0 GGAEMN CN1CCN(c2ccc(Cl)cc2NC(=O)COc2cccc(F)c2)CC1 ZINC000003553082 1398367577 /nfs/dbraw/zinc/36/75/77/1398367577.db2.gz XTYXFUVWIOSPNK-UHFFFAOYSA-N 0 1 377.847 3.248 10 0 GGAEMN COc1ccc2nc(SCC(=O)NCC(=O)Nc3c(C)cccc3C)[nH]c2c1 ZINC000004274612 1398388158 /nfs/dbraw/zinc/38/81/58/1398388158.db2.gz HYTFATQFFYPQFL-UHFFFAOYSA-N 0 1 398.488 3.035 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2 ZINC000004270495 1398388219 /nfs/dbraw/zinc/38/82/19/1398388219.db2.gz LOWVYMMHQHKECS-UHFFFAOYSA-N 0 1 386.473 3.030 10 0 GGAEMN O=S(=O)(Nc1cccc(CO)c1)c1ccc(Br)cc1Cl ZINC000007422062 1398672195 /nfs/dbraw/zinc/67/21/95/1398672195.db2.gz LBQQPYOXYVBDLN-UHFFFAOYSA-N 0 1 376.659 3.396 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1cccc(NC(=O)c2cc(C)on2)c1 ZINC000007814357 1398750111 /nfs/dbraw/zinc/75/01/11/1398750111.db2.gz DLHZYEIOUFGDHU-UHFFFAOYSA-N 0 1 387.417 3.045 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ccc(-n3cccn3)cc2)CC1 ZINC000007987843 1398786908 /nfs/dbraw/zinc/78/69/08/1398786908.db2.gz OTRUALVIZQLOTF-UHFFFAOYSA-N 0 1 375.476 3.267 10 0 GGAEMN CC(C)[C@H](NCC(=O)Nc1ccccc1S(C)(=O)=O)c1ccc(F)cc1 ZINC000008004115 1398789444 /nfs/dbraw/zinc/78/94/44/1398789444.db2.gz OPGGLVCVAFKNSY-IBGZPJMESA-N 0 1 378.469 3.155 10 0 GGAEMN CCn1cc(C(=O)c2cc(F)ccc2O)cc1-c1nc2ccccc2c(=O)[nH]1 ZINC000008217134 1398814380 /nfs/dbraw/zinc/81/43/80/1398814380.db2.gz ZGBVXHIGIAWXCB-UHFFFAOYSA-N 0 1 377.375 3.487 10 0 GGAEMN O=C(CSc1nc(-c2cccs2)n[nH]1)Nc1ccccc1C(=O)NC1CC1 ZINC000008231141 1398814857 /nfs/dbraw/zinc/81/48/57/1398814857.db2.gz FTGGLNFQXDWXNY-UHFFFAOYSA-N 0 1 399.501 3.156 10 0 GGAEMN COc1ccc2nc(SCC(=O)c3c[nH]c(C(=O)N4CCCC4)c3)[nH]c2c1 ZINC000008461626 1398832640 /nfs/dbraw/zinc/83/26/40/1398832640.db2.gz KUMHFIPTQBOIHL-UHFFFAOYSA-N 0 1 384.461 3.111 10 0 GGAEMN O=C(C[C@H]1Sc2ccccc2NC1=O)NC[C@@H](c1ccco1)N1CCCC1 ZINC000008777799 1398846675 /nfs/dbraw/zinc/84/66/75/1398846675.db2.gz HKTDSCAIXANXNJ-MAUKXSAKSA-N 0 1 385.489 3.036 10 0 GGAEMN Cn1cccc1[C@@H]1CCCN1CC(=O)N1CCN(c2ccccc2Cl)CC1 ZINC000008780377 1398846760 /nfs/dbraw/zinc/84/67/60/1398846760.db2.gz SESLSZMJOLGXIQ-FQEVSTJZSA-N 0 1 386.927 3.164 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ccc3c(c2)NC(=O)CS3)CC1 ZINC000009221426 1398855282 /nfs/dbraw/zinc/85/52/82/1398855282.db2.gz SIOUNRKGMXSYFY-UHFFFAOYSA-N 0 1 396.516 3.125 10 0 GGAEMN COc1cn(CC(=O)Nc2cc(C)cc(C)c2)c(CN2CCC(C)CC2)cc1=O ZINC000009621973 1398861446 /nfs/dbraw/zinc/86/14/46/1398861446.db2.gz PQHOVIZHDSILOX-UHFFFAOYSA-N 0 1 397.519 3.344 10 0 GGAEMN COc1cn(CC(=O)Nc2ccc(F)cc2)c(CN2CCCCCC2)cc1=O ZINC000009622060 1398861543 /nfs/dbraw/zinc/86/15/43/1398861543.db2.gz MQYVNWHGFNEHDG-UHFFFAOYSA-N 0 1 387.455 3.011 10 0 GGAEMN Cc1c(C(=O)N2CCCCC2)c(S(=O)(=O)Nc2cccc(C)c2)c(C)n1C ZINC000009685149 1398863370 /nfs/dbraw/zinc/86/33/70/1398863370.db2.gz CFTFTPQQMCVQCR-UHFFFAOYSA-N 0 1 389.521 3.377 10 0 GGAEMN CCc1ccccc1NS(=O)(=O)c1c(C)[nH]c(C)c1C(=O)N1CCCC1 ZINC000009684081 1398863398 /nfs/dbraw/zinc/86/33/98/1398863398.db2.gz MDSYBCZVARFUQA-UHFFFAOYSA-N 0 1 375.494 3.231 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2c(C)cccc2C)c(C)n1C ZINC000009684695 1398863536 /nfs/dbraw/zinc/86/35/36/1398863536.db2.gz YJNQGOPXKIQRLB-UHFFFAOYSA-N 0 1 389.521 3.296 10 0 GGAEMN COc1cccc([C@@H]2CCCN2CC(=O)N2CCN(c3ccccc3)CC2)c1 ZINC000010227856 1398881766 /nfs/dbraw/zinc/88/17/66/1398881766.db2.gz ZKOBAMJEYSMKEL-QFIPXVFZSA-N 0 1 379.504 3.181 10 0 GGAEMN COc1ccc(NC(=O)CSc2nc(C=Cc3ccco3)n[nH]2)c(OC)c1 ZINC000010624502 1398904765 /nfs/dbraw/zinc/90/47/65/1398904765.db2.gz WFQZLLKVEQTUDK-SOFGYWHQSA-N 0 1 386.433 3.316 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(COc3cccc(C(F)(F)F)c3)n[nH]2)C[C@H](C)O1 ZINC000011933483 1399018120 /nfs/dbraw/zinc/01/81/20/1399018120.db2.gz PCWIQSNELAGXSL-TXEJJXNPSA-N 0 1 383.370 3.257 10 0 GGAEMN CC(=O)N1CCc2ccc(NS(=O)(=O)c3ccccc3Br)cc21 ZINC000013697026 1399081202 /nfs/dbraw/zinc/08/12/02/1399081202.db2.gz PLQVAYLJWVQHON-UHFFFAOYSA-N 0 1 395.278 3.159 10 0 GGAEMN O=C([C@@H]1CCCO1)N1CCOc2ccc(CN3CCc4ccccc4C3)cc2C1 ZINC000014954136 1399128656 /nfs/dbraw/zinc/12/86/56/1399128656.db2.gz VZORXUZMNDYTMZ-QHCPKHFHSA-N 0 1 392.499 3.145 10 0 GGAEMN O=C([C@H]1CCCO1)N1CCOc2ccc(CN3CCc4ccccc4C3)cc2C1 ZINC000014954140 1399128861 /nfs/dbraw/zinc/12/88/61/1399128861.db2.gz VZORXUZMNDYTMZ-HSZRJFAPSA-N 0 1 392.499 3.145 10 0 GGAEMN C[C@@H](NC(=O)COc1ccc(-c2ncccn2)cc1CN(C)C)c1ccco1 ZINC000015005209 1399130995 /nfs/dbraw/zinc/13/09/95/1399130995.db2.gz CPSBNYHOQSXEID-OAHLLOKOSA-N 0 1 380.448 3.054 10 0 GGAEMN O[C@@H](COCc1ccccc1)CN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000026780693 1399933504 /nfs/dbraw/zinc/93/35/04/1399933504.db2.gz KBWKNPZMLATSGG-HXUWFJFHSA-N 0 1 394.437 3.405 10 0 GGAEMN CCOc1cc(CN[C@@H](C)C(=O)NCc2ccccc2)ccc1OC(F)F ZINC000056187775 1407246179 /nfs/dbraw/zinc/24/61/79/1407246179.db2.gz DPNVPKUJWDHLRO-AWEZNQCLSA-N 0 1 378.419 3.481 10 0 GGAEMN C[C@H]([NH2+][C@@H](C)c1ccc(Br)cc1Br)c1nnn[n-]1 ZINC000044925885 1424667270 /nfs/dbraw/zinc/66/72/70/1424667270.db2.gz NTXNFWYACVKYJC-BQBZGAKWSA-N 0 1 375.068 3.137 10 0 GGAEMN COCC(=O)Nc1cccc(CNCc2ccc(F)c(Br)c2)c1 ZINC000045822758 1404215598 /nfs/dbraw/zinc/21/55/98/1404215598.db2.gz GZTLVCWNKYHGJD-UHFFFAOYSA-N 0 1 381.245 3.463 10 0 GGAEMN CNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2SC(F)(F)F)cc1 ZINC000047251346 1404768123 /nfs/dbraw/zinc/76/81/23/1404768123.db2.gz ZIBHSZZLMCDHNN-UHFFFAOYSA-N 0 1 390.408 3.459 10 0 GGAEMN CCOC(=O)c1cccc(NC(=O)NC2CCN(Cc3ccncc3)CC2)c1 ZINC000047524425 1404857872 /nfs/dbraw/zinc/85/78/72/1404857872.db2.gz GWOSNBIZSPYQCV-UHFFFAOYSA-N 0 1 382.464 3.044 10 0 GGAEMN COc1ccc([C@H](CNC(=O)NCc2cccnc2OC)N2CCCCC2)cc1 ZINC000047793520 1404946902 /nfs/dbraw/zinc/94/69/02/1404946902.db2.gz ARJBNSHISGZFDJ-FQEVSTJZSA-N 0 1 398.507 3.125 10 0 GGAEMN COC(=O)Nc1ccc(CNC(=O)NC[C@H](c2cccs2)N(C)C)cc1 ZINC000047833126 1404967505 /nfs/dbraw/zinc/96/75/05/1404967505.db2.gz FAKQPUIZMIJLOH-OAHLLOKOSA-N 0 1 376.482 3.029 10 0 GGAEMN CCNC(=O)COc1ccc(CNCc2cc(Cl)ccc2OC)cc1OC ZINC000048714443 1405266272 /nfs/dbraw/zinc/26/62/72/1405266272.db2.gz GYWIKSLULMUVGK-UHFFFAOYSA-N 0 1 392.883 3.162 10 0 GGAEMN C[C@@H](NCc1cnc(N2CCCC2)nc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000048714415 1405266360 /nfs/dbraw/zinc/26/63/60/1405266360.db2.gz FMYCRDLVIXFXBZ-OAHLLOKOSA-N 0 1 380.496 3.212 10 0 GGAEMN C[C@@H](NCc1cnn(-c2ccccc2)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000048744909 1405278518 /nfs/dbraw/zinc/27/85/18/1405278518.db2.gz HHZXDRCFWWTGNN-QGZVFWFLSA-N 0 1 390.487 3.381 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC[C@H](C(=O)NC2CC2)C1 ZINC000051044998 1405707807 /nfs/dbraw/zinc/70/78/07/1405707807.db2.gz DKDHGMOKGWCKGR-SCTDSRPQSA-N 0 1 393.531 3.396 10 0 GGAEMN C[C@@H](NCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 ZINC000057876885 1407743992 /nfs/dbraw/zinc/74/39/92/1407743992.db2.gz CEQWBVZGJKQXMH-OAHLLOKOSA-N 0 1 375.875 3.479 10 0 GGAEMN COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1 ZINC000060082628 1407937308 /nfs/dbraw/zinc/93/73/08/1407937308.db2.gz IENKDIPQUJVSIL-ROUUACIJSA-N 0 1 395.931 3.364 10 0 GGAEMN COc1ccccc1CN(CCO)C(=O)c1cc(-c2cccc(Cl)c2)[nH]n1 ZINC000063779831 1408409653 /nfs/dbraw/zinc/40/96/53/1408409653.db2.gz BLQSDOPHBYATNC-UHFFFAOYSA-N 0 1 385.851 3.373 10 0 GGAEMN CCN(C(=O)CCc1nc2cccc(C)c2[nH]1)[C@H]1CCN(c2ccccc2)C1=O ZINC000176424613 1428315876 /nfs/dbraw/zinc/31/58/76/1428315876.db2.gz KEDZMCFOQDXRFM-IBGZPJMESA-N 0 1 390.487 3.458 10 0 GGAEMN CCOC(=O)CCN(CC(=O)Nc1c(C)nn(-c2ccccc2)c1C)CC1CC1 ZINC000064343894 1408537815 /nfs/dbraw/zinc/53/78/15/1408537815.db2.gz CJRLCRVOJHMRQK-UHFFFAOYSA-N 0 1 398.507 3.093 10 0 GGAEMN CCN(CC)[C@H](CNC(=O)N1CCN(Cc2ccccc2)CC1)c1ccco1 ZINC000065481328 1408676448 /nfs/dbraw/zinc/67/64/48/1408676448.db2.gz AFMMWKIZJPRXHE-HXUWFJFHSA-N 0 1 384.524 3.190 10 0 GGAEMN CC(=O)N1CCc2cc(S(=O)(=O)Nc3cc(F)ccc3OC(C)C)ccc21 ZINC000066586223 1408861381 /nfs/dbraw/zinc/86/13/81/1408861381.db2.gz RJBNVDMYISISKE-UHFFFAOYSA-N 0 1 392.452 3.323 10 0 GGAEMN C[C@H](NC(=O)NCc1cccnc1N1CCN(C)CC1)c1ccc(Cl)s1 ZINC000066891876 1408943837 /nfs/dbraw/zinc/94/38/37/1408943837.db2.gz FWFNPDPYNQXCJE-ZDUSSCGKSA-N 0 1 393.944 3.109 10 0 GGAEMN CC1CCN(c2ccc(CNCc3ccccc3N3CCOCC3)cn2)CC1 ZINC000066973160 1408969761 /nfs/dbraw/zinc/96/97/61/1408969761.db2.gz AJWZHURHLGMZNI-UHFFFAOYSA-N 0 1 380.536 3.444 10 0 GGAEMN COc1cc(CNC(=O)CN[C@H](C)c2ccc(Cl)cc2)cc(OC)c1OC ZINC000067131985 1409016428 /nfs/dbraw/zinc/01/64/28/1409016428.db2.gz HTMFTOOLFCYXMG-CYBMUJFWSA-N 0 1 392.883 3.333 10 0 GGAEMN CC[C@@H](C)NC(=O)c1cccc(CNCc2cn(C)nc2-c2cccnc2)c1 ZINC000067212773 1409044473 /nfs/dbraw/zinc/04/44/73/1409044473.db2.gz GTCIYMRRUIQURJ-MRXNPFEDSA-N 0 1 377.492 3.300 10 0 GGAEMN COc1cccc(CNC[C@H](O)COc2ccc(C(F)(F)F)cc2)c1OC ZINC000067255202 1409054810 /nfs/dbraw/zinc/05/48/10/1409054810.db2.gz HMXSBEHRUJXVNL-HNNXBMFYSA-N 0 1 385.382 3.252 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N(C)[C@@H]3CCCN(c4ccccc4)C3=O)[nH]c21 ZINC000176597799 1428375398 /nfs/dbraw/zinc/37/53/98/1428375398.db2.gz BRNYCIPDCJLTOG-LJQANCHMSA-N 0 1 390.487 3.458 10 0 GGAEMN C[C@H]1CN(c2ccc(CNCc3csc(Br)c3)cn2)CCO1 ZINC000067669214 1409202951 /nfs/dbraw/zinc/20/29/51/1409202951.db2.gz GKGOHGZIRMGQPI-LBPRGKRZSA-N 0 1 382.327 3.421 10 0 GGAEMN C[C@H](NCc1cc2c(c(Br)c1)OCO2)C(=O)Nc1ccccc1 ZINC000067987210 1409270204 /nfs/dbraw/zinc/27/02/04/1409270204.db2.gz BRDACNGILQAJIA-NSHDSACASA-N 0 1 377.238 3.295 10 0 GGAEMN C[C@H](NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)C1(N2CCOCC2)CCCC1 ZINC000176656654 1428393234 /nfs/dbraw/zinc/39/32/34/1428393234.db2.gz BTLRZLCPWTXDGI-HRCADAONSA-N 0 1 378.463 3.218 10 0 GGAEMN CC[C@@H](C)NC(=O)[C@H](C)NCc1cc(Br)c2c(c1)OCCCO2 ZINC000068366639 1409381353 /nfs/dbraw/zinc/38/13/53/1409381353.db2.gz FHVSUQJOVIAHAY-NEPJUHHUSA-N 0 1 385.302 3.003 10 0 GGAEMN CCOc1c(Br)cc(CN[C@@H](C)C(=O)N[C@H](C)CC)cc1OC ZINC000068366991 1409381583 /nfs/dbraw/zinc/38/15/83/1409381583.db2.gz HKKDXRPZDCWETQ-NEPJUHHUSA-N 0 1 387.318 3.249 10 0 GGAEMN C[C@H](Cc1ccccc1F)NC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000069286290 1409605043 /nfs/dbraw/zinc/60/50/43/1409605043.db2.gz DKCQQHOGFSSSGO-GCJKJVERSA-N 0 1 398.526 3.045 10 0 GGAEMN CN1CCN(C[C@@H](NC(=O)N[C@@H]2CCCc3ccccc32)c2ccccc2)CC1 ZINC000069725725 1409683863 /nfs/dbraw/zinc/68/38/63/1409683863.db2.gz CWEHFBWAXOAYAR-DHIUTWEWSA-N 0 1 392.547 3.352 10 0 GGAEMN COc1ccnc(N2CCN(C(=O)NCc3ccccc3OC(C)(C)C)CC2)c1 ZINC000078947045 1409946030 /nfs/dbraw/zinc/94/60/30/1409946030.db2.gz OTHCHJOMFBXUIL-UHFFFAOYSA-N 0 1 398.507 3.299 10 0 GGAEMN CN1CCN(c2ccccc2NC(=O)NCc2ncoc2-c2ccccc2)CC1 ZINC000079100306 1409958141 /nfs/dbraw/zinc/95/81/41/1409958141.db2.gz PZSWRCAVDGFHAE-UHFFFAOYSA-N 0 1 391.475 3.415 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)N2CCCC2)cc1F ZINC000086234466 1410044301 /nfs/dbraw/zinc/04/43/01/1410044301.db2.gz GUEJJLVMJYQMID-QZTJIDSGSA-N 0 1 375.488 3.255 10 0 GGAEMN CC[C@H](C)NC(=O)[C@H](C)NCc1ccc(OC(F)F)c(Br)c1 ZINC000092564394 1410173704 /nfs/dbraw/zinc/17/37/04/1410173704.db2.gz CTSPRALOYMFPOE-UWVGGRQHSA-N 0 1 379.245 3.443 10 0 GGAEMN O=c1oc2cccnc2n1CCN1CCC[C@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000095993099 1410318443 /nfs/dbraw/zinc/31/84/43/1410318443.db2.gz ZUCIVNQAMULGHT-INIZCTEOSA-N 0 1 396.495 3.035 10 0 GGAEMN COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CN[C@H](C)c1ccc(Cl)cc1 ZINC000096955249 1410340456 /nfs/dbraw/zinc/34/04/56/1410340456.db2.gz AAKXJQNPYGAJLO-AUUYWEPGSA-N 0 1 386.879 3.117 10 0 GGAEMN COc1c(C)cc(CN(C)C(=O)c2cc(-c3c(C)nn(C)c3C)[nH]n2)cc1C ZINC000101529698 1410449587 /nfs/dbraw/zinc/44/95/87/1410449587.db2.gz XYFVFIFLHZRSDG-UHFFFAOYSA-N 0 1 381.480 3.325 10 0 GGAEMN CCN1CCN([C@H]2CCN(C(=O)c3ccc(-c4ccc(F)cc4)s3)C2)CC1 ZINC000106805340 1411304693 /nfs/dbraw/zinc/30/46/93/1411304693.db2.gz PDHDVGDQXLFYRA-SFHVURJKSA-N 0 1 387.524 3.406 10 0 GGAEMN CC(C)C[C@H](C)Oc1cc(CNCc2cnc(N3CCOCC3)s2)ccn1 ZINC000111387719 1411937984 /nfs/dbraw/zinc/93/79/84/1411937984.db2.gz GXWNXODEWDXHLZ-INIZCTEOSA-N 0 1 390.553 3.478 10 0 GGAEMN COc1ccc(-c2n[nH]c(CNC(=O)N[C@@H](C)Cc3ccccc3F)n2)cc1 ZINC000111837519 1412035770 /nfs/dbraw/zinc/03/57/70/1412035770.db2.gz CRTWQTMCCALGJQ-ZDUSSCGKSA-N 0 1 383.427 3.050 10 0 GGAEMN COc1ccc(-c2nc(CNC(=O)N[C@@H](C)Cc3ccccc3F)n[nH]2)cc1 ZINC000111837519 1412035779 /nfs/dbraw/zinc/03/57/79/1412035779.db2.gz CRTWQTMCCALGJQ-ZDUSSCGKSA-N 0 1 383.427 3.050 10 0 GGAEMN O=C1[C@H](NCc2ccc(OC[C@@H]3CCCO3)cc2)CCN1c1ccccc1F ZINC000112366738 1412135888 /nfs/dbraw/zinc/13/58/88/1412135888.db2.gz HJMJFTOLGIXIMF-AZUAARDMSA-N 0 1 384.451 3.279 10 0 GGAEMN O=C(NC[C@@H]1CCCO1)c1cccc(CNCc2cc3ccccc3[nH]c2=O)c1 ZINC000112668573 1412188794 /nfs/dbraw/zinc/18/87/94/1412188794.db2.gz FORAXVZTHLIAHZ-FQEVSTJZSA-N 0 1 391.471 3.139 10 0 GGAEMN O=C(NC[C@H]1CCCO1)c1cccc(CNCc2cc3ccccc3[nH]c2=O)c1 ZINC000112668576 1412189210 /nfs/dbraw/zinc/18/92/10/1412189210.db2.gz FORAXVZTHLIAHZ-HXUWFJFHSA-N 0 1 391.471 3.139 10 0 GGAEMN Cc1cc(F)ccc1S(=O)(=O)N(C)C1CCN(Cc2ccccc2)CC1 ZINC000113302788 1412288730 /nfs/dbraw/zinc/28/87/30/1412288730.db2.gz VCWRYGBHKUUTKG-UHFFFAOYSA-N 0 1 376.497 3.419 10 0 GGAEMN COc1ccccc1-c1cc(-c2nc(-c3ccc(S(C)(=O)=O)cc3)no2)[nH]n1 ZINC000113727175 1412338298 /nfs/dbraw/zinc/33/82/98/1412338298.db2.gz VQNLLLGXRVGRGI-UHFFFAOYSA-N 0 1 396.428 3.206 10 0 GGAEMN CNC(=O)c1cccc(CN2CCC(c3nc(-c4ccccc4)no3)CC2)c1 ZINC000113932301 1412354094 /nfs/dbraw/zinc/35/40/94/1412354094.db2.gz HGVBQGIXYWCZGR-UHFFFAOYSA-N 0 1 376.460 3.476 10 0 GGAEMN CCCCn1nc(C)c(CNC[C@H](O)c2cc(OC)cc(OC)c2)c1Cl ZINC000118450783 1413161865 /nfs/dbraw/zinc/16/18/65/1413161865.db2.gz DZRQPCBJBYXGJC-SFHVURJKSA-N 0 1 381.904 3.485 10 0 GGAEMN Cc1ccc(CNCc2cccnc2N2CCN(C)CC2)c(Br)c1 ZINC000118952073 1413271429 /nfs/dbraw/zinc/27/14/29/1413271429.db2.gz COBSDFMHQMLEJE-UHFFFAOYSA-N 0 1 389.341 3.194 10 0 GGAEMN O=C(C1CCN(Cc2ccc(OCC(F)(F)F)nc2)CC1)N1CCCCC1 ZINC000119800234 1413574144 /nfs/dbraw/zinc/57/41/44/1413574144.db2.gz XKJJAOSVAHPREH-UHFFFAOYSA-N 0 1 385.430 3.247 10 0 GGAEMN CC(=O)N(C)C1CCN([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)CC1 ZINC000119843940 1413590495 /nfs/dbraw/zinc/59/04/95/1413590495.db2.gz HKYYRXOLPRFDNB-IRXDYDNUSA-N 0 1 381.520 3.348 10 0 GGAEMN NC(=O)[C@H]1CCCN1Cc1cccc(NCc2ccc(OC(F)F)cc2)c1 ZINC000120055999 1413669719 /nfs/dbraw/zinc/66/97/19/1413669719.db2.gz FDPNQZKQJAPBAZ-GOSISDBHSA-N 0 1 375.419 3.350 10 0 GGAEMN COCCOc1ccc([C@H](C)N[C@@H](C)C(=O)NC2CCCCC2)cc1OC ZINC000120350536 1413799074 /nfs/dbraw/zinc/79/90/74/1413799074.db2.gz HSCZYTJQZBGZDM-HOTGVXAUSA-N 0 1 378.513 3.208 10 0 GGAEMN CC(C)c1ccc(CCN2CCN(CC(=O)NCc3ccccc3)CC2)cc1 ZINC000121314167 1414080808 /nfs/dbraw/zinc/08/08/08/1414080808.db2.gz IAOLEXIYUQHPSS-UHFFFAOYSA-N 0 1 379.548 3.287 10 0 GGAEMN CN1CCN(c2ncccc2CNCc2cc(F)ccc2Br)CC1 ZINC000121467303 1414138001 /nfs/dbraw/zinc/13/80/01/1414138001.db2.gz BAGSOMSFWTUHOG-UHFFFAOYSA-N 0 1 393.304 3.025 10 0 GGAEMN CCCOc1ccc(CN[C@H](C)CS(=O)(=O)c2ccccc2)cc1OC ZINC000122086552 1414359274 /nfs/dbraw/zinc/35/92/74/1414359274.db2.gz ACDZWEVQKXJAHG-MRXNPFEDSA-N 0 1 377.506 3.436 10 0 GGAEMN Cc1nc(S(=O)(=O)Nc2cc(Cl)c(C)cc2Br)cn1C ZINC000123045056 1414626412 /nfs/dbraw/zinc/62/64/12/1414626412.db2.gz TVWSHTPPQLIDQX-UHFFFAOYSA-N 0 1 378.679 3.254 10 0 GGAEMN CN1CCN(c2ccc(NCc3ccc(OCc4ccncc4)cc3)nc2)CC1 ZINC000123252853 1414679158 /nfs/dbraw/zinc/67/91/58/1414679158.db2.gz BRVNLKQFUXQHDN-UHFFFAOYSA-N 0 1 389.503 3.420 10 0 GGAEMN C[C@@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC(CC(=O)N2CCCC2)CC1 ZINC000124181074 1414901531 /nfs/dbraw/zinc/90/15/31/1414901531.db2.gz FXYMRRDDWRONST-MOPGFXCFSA-N 0 1 397.563 3.467 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC(CC(=O)N2CCCC2)CC1 ZINC000124180619 1414901917 /nfs/dbraw/zinc/90/19/17/1414901917.db2.gz FXYMRRDDWRONST-RTBURBONSA-N 0 1 397.563 3.467 10 0 GGAEMN CC[C@H](C)NC(=O)[C@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000124545964 1414991085 /nfs/dbraw/zinc/99/10/85/1414991085.db2.gz HQPWUMNIUGOJAX-JSGCOSHPSA-N 0 1 393.329 3.336 10 0 GGAEMN C[C@@H](NC(=O)NCc1ccc(N2CCN(C)CC2)nc1)c1ccc(Cl)cc1 ZINC000126916051 1415607633 /nfs/dbraw/zinc/60/76/33/1415607633.db2.gz GTXSVYGXVKNUOC-OAHLLOKOSA-N 0 1 387.915 3.047 10 0 GGAEMN COc1ccc(Br)c(CNC[C@@H](O)c2cc(OC)cc(OC)c2)c1 ZINC000128183911 1415933459 /nfs/dbraw/zinc/93/34/59/1415933459.db2.gz BYMXOTQDEGCAQI-GOSISDBHSA-N 0 1 396.281 3.298 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@H](C)[C@@H](n3ccnc3)C2)C2CC2)cc1 ZINC000129387530 1416201138 /nfs/dbraw/zinc/20/11/38/1416201138.db2.gz CIMFADQUIBKWON-XUEUYAKLSA-N 0 1 382.508 3.042 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)[nH]c21 ZINC000129887630 1416280507 /nfs/dbraw/zinc/28/05/07/1416280507.db2.gz SYJGEWGELRNGBF-IBGZPJMESA-N 0 1 390.487 3.111 10 0 GGAEMN COCCN1[C@H](C)CN([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C[C@@H]1C ZINC000130123143 1416322677 /nfs/dbraw/zinc/32/26/77/1416322677.db2.gz DLFKPBPTHCWINS-YRPNKDGESA-N 0 1 397.563 3.447 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)[N@@H+](C)CCCn1cc[nH+]c1C ZINC000130771494 1416446578 /nfs/dbraw/zinc/44/65/78/1416446578.db2.gz HJTNAZRFPAPZGO-GOSISDBHSA-N 0 1 394.523 3.343 10 0 GGAEMN COc1ccc(OC(F)F)c(CNc2ccc(N3CCN(C)CC3)cn2)c1 ZINC000131567120 1416577251 /nfs/dbraw/zinc/57/72/51/1416577251.db2.gz AXWYUFAUMQALJE-UHFFFAOYSA-N 0 1 378.423 3.056 10 0 GGAEMN COCCOc1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1 ZINC000132923766 1416831594 /nfs/dbraw/zinc/83/15/94/1416831594.db2.gz RAIYVWHELVFELJ-UHFFFAOYSA-N 0 1 377.249 3.214 10 0 GGAEMN COC(=O)c1ccc(CN2CCC(C(=O)N3CCCCCC3)CC2)c(F)c1 ZINC000134899151 1417141954 /nfs/dbraw/zinc/14/19/54/1417141954.db2.gz RJPRUGKTCNRAEW-UHFFFAOYSA-N 0 1 376.472 3.227 10 0 GGAEMN O[C@H]1Cc2ccccc2[C@H]1NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000139545956 1417463168 /nfs/dbraw/zinc/46/31/68/1417463168.db2.gz FVGGVUGCFSHPSO-RBUKOAKNSA-N 0 1 384.277 3.383 10 0 GGAEMN CCCNCc1nc(-c2ncc(Br)cc2Br)no1 ZINC000139924635 1417481147 /nfs/dbraw/zinc/48/11/47/1417481147.db2.gz NVPOEYMPHWNEAB-UHFFFAOYSA-N 0 1 376.052 3.156 10 0 GGAEMN CC[C@](C)(N)c1nc(-c2ncc(Br)cc2Br)no1 ZINC000139933378 1417481266 /nfs/dbraw/zinc/48/12/66/1417481266.db2.gz KVQFLTCKIACEGF-NSHDSACASA-N 0 1 376.052 3.241 10 0 GGAEMN CNC(C)(C)c1nc(-c2ncc(Br)cc2Br)no1 ZINC000139957290 1417483159 /nfs/dbraw/zinc/48/31/59/1417483159.db2.gz JIOFPKRZUZMJJD-UHFFFAOYSA-N 0 1 376.052 3.111 10 0 GGAEMN CCc1ccc(C[N@H+](C)[C@@H]2CC(=O)N(c3ccc(C(=O)[O-])cc3C)C2=O)cc1 ZINC000141572080 1417545581 /nfs/dbraw/zinc/54/55/81/1417545581.db2.gz GKZRPFCYFHEWCD-LJQANCHMSA-N 0 1 380.444 3.020 10 0 GGAEMN CCc1ccc(C[N@@H+](C)[C@@H]2CC(=O)N(c3ccc(C(=O)[O-])cc3C)C2=O)cc1 ZINC000141572080 1417545589 /nfs/dbraw/zinc/54/55/89/1417545589.db2.gz GKZRPFCYFHEWCD-LJQANCHMSA-N 0 1 380.444 3.020 10 0 GGAEMN COc1ccc(CN[C@@H]2CCN(c3ccccc3OC)C2=O)cc1OC(F)F ZINC000151538059 1418018084 /nfs/dbraw/zinc/01/80/84/1418018084.db2.gz FAHHCIPJMLQGQJ-CQSZACIVSA-N 0 1 392.402 3.200 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2cc(Cl)c(OC)c(OC)c2)C1=O ZINC000151581808 1418031418 /nfs/dbraw/zinc/03/14/18/1418031418.db2.gz FHORAITXUTWDLC-OAHLLOKOSA-N 0 1 390.867 3.261 10 0 GGAEMN Cc1nn(C)c(OCC(F)(F)F)c1CNc1cccc(N2CCC[NH+]=C2[O-])c1 ZINC000152155014 1418160055 /nfs/dbraw/zinc/16/00/55/1418160055.db2.gz HTCFELKVNHJQML-UHFFFAOYSA-N 0 1 397.401 3.201 10 0 GGAEMN CN1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@@H]3c3cccc(F)c3F)c2)CC1 ZINC000152277281 1418191909 /nfs/dbraw/zinc/19/19/09/1418191909.db2.gz GZBZHRJDLKEGHR-RTBURBONSA-N 0 1 385.458 3.454 10 0 GGAEMN CCc1nc(NC(=O)CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)sc1C ZINC000179752511 1429538769 /nfs/dbraw/zinc/53/87/69/1429538769.db2.gz BEFGKNHMZXHZSV-IBGZPJMESA-N 0 1 387.505 3.465 10 0 GGAEMN COc1ccccc1[C@@H](CNC(=O)N[C@H](CCO)c1ccccc1)N1CCCC1 ZINC000152927409 1422298549 /nfs/dbraw/zinc/29/85/49/1422298549.db2.gz DZHAAVUGTMWOMP-NHCUHLMSSA-N 0 1 397.519 3.255 10 0 GGAEMN COc1ccc(CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c(OC)c1OC ZINC000153996321 1422823009 /nfs/dbraw/zinc/82/30/09/1422823009.db2.gz ICFUDRUZFAUVHR-LJQANCHMSA-N 0 1 398.503 3.036 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000154437877 1422888716 /nfs/dbraw/zinc/88/87/16/1422888716.db2.gz AKANPJFJBFJMFY-INIZCTEOSA-N 0 1 376.403 3.234 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2cn(-c3ccccc3)nc2C)C1=O ZINC000154453389 1422890752 /nfs/dbraw/zinc/89/07/52/1422890752.db2.gz FSKXERPLCUVJOL-IBGZPJMESA-N 0 1 376.460 3.084 10 0 GGAEMN CN1CCC[C@H]1C(=O)NC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 ZINC000154958024 1423091701 /nfs/dbraw/zinc/09/17/01/1423091701.db2.gz AZEOXGKZACTUES-QFIPXVFZSA-N 0 1 394.515 3.482 10 0 GGAEMN COc1ccc([C@H]2CCN([C@H](C)C(=O)Nc3cccc(NC(C)=O)c3)C2)cc1 ZINC000155237083 1423264262 /nfs/dbraw/zinc/26/42/62/1423264262.db2.gz FYJUHFTZEVYYNP-QAPCUYQASA-N 0 1 381.476 3.470 10 0 GGAEMN C[C@@H](NC(=O)[C@@H](C)N1CCC(Cn2ccnn2)CC1)c1cccc2ccccc21 ZINC000155617359 1423448358 /nfs/dbraw/zinc/44/83/58/1423448358.db2.gz BRKUNUZPPVHLNQ-QZTJIDSGSA-N 0 1 391.519 3.409 10 0 GGAEMN CNS(=O)(=O)c1cccc(CNCc2cc(Cl)cc3cccnc32)c1 ZINC000156188967 1423714931 /nfs/dbraw/zinc/71/49/31/1423714931.db2.gz HEPVKVONBPHZDO-UHFFFAOYSA-N 0 1 375.881 3.086 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@@H](C)[C@@H](n3ccnc3)C2)C(C)C)cc1 ZINC000156432153 1423810040 /nfs/dbraw/zinc/81/00/40/1423810040.db2.gz BSDURJYCWWXUGE-PIPMEXSNSA-N 0 1 384.524 3.288 10 0 GGAEMN C[C@@H]1CCN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1n1ccnc1 ZINC000156511444 1423821267 /nfs/dbraw/zinc/82/12/67/1423821267.db2.gz BOQYGGIQNOBAEJ-KNQAVFIVSA-N 0 1 380.536 3.247 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@@H](O)c2ccc(Br)cc2)C1 ZINC000157080348 1423919643 /nfs/dbraw/zinc/91/96/43/1423919643.db2.gz GXVURWXRVCMCLW-HUUCEWRRSA-N 0 1 385.302 3.082 10 0 GGAEMN COc1ccccc1CN(CCO)CCc1nc(-c2ccc(Cl)cc2)no1 ZINC000157877899 1424110452 /nfs/dbraw/zinc/11/04/52/1424110452.db2.gz BFOZWAHANBNJJX-UHFFFAOYSA-N 0 1 387.867 3.436 10 0 GGAEMN COc1ccccc1[C@@H](CNC(=O)N(C)CC1CCOCC1)N1CCCCC1 ZINC000159229627 1424452096 /nfs/dbraw/zinc/45/20/96/1424452096.db2.gz FFSSQLXZBYCRKI-HXUWFJFHSA-N 0 1 389.540 3.290 10 0 GGAEMN COc1ccccc1[C@H](CNC(=O)N(C)CC1CCOCC1)N1CCCCC1 ZINC000159229490 1424452770 /nfs/dbraw/zinc/45/27/70/1424452770.db2.gz FFSSQLXZBYCRKI-FQEVSTJZSA-N 0 1 389.540 3.290 10 0 GGAEMN COc1cc(CNCc2ccc(C)cc2Br)ccc1OCCO ZINC000160058606 1424568312 /nfs/dbraw/zinc/56/83/12/1424568312.db2.gz BJRODKAFDWJPBY-UHFFFAOYSA-N 0 1 380.282 3.427 10 0 GGAEMN Cc1nc2cc(F)ccc2cc1C(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000162859556 1424897100 /nfs/dbraw/zinc/89/71/00/1424897100.db2.gz OUILWGBRKNWXBR-UHFFFAOYSA-N 0 1 375.407 3.440 10 0 GGAEMN Cc1ccc(C)c(C(=O)CCC(=O)NCCc2nnc(-c3ccccc3)[nH]2)c1 ZINC000162870441 1424898268 /nfs/dbraw/zinc/89/82/68/1424898268.db2.gz XBDLOILYDHUCKL-UHFFFAOYSA-N 0 1 376.460 3.410 10 0 GGAEMN O=C(CCc1ncc(-c2ccccc2)o1)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000162968753 1424914971 /nfs/dbraw/zinc/91/49/71/1424914971.db2.gz YBOVAUYLUOBSHF-UHFFFAOYSA-N 0 1 387.443 3.418 10 0 GGAEMN O=C(Cn1ccc2ccc(Cl)cc21)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000162973576 1424915997 /nfs/dbraw/zinc/91/59/97/1424915997.db2.gz MVHLDWBZDLZBAB-UHFFFAOYSA-N 0 1 379.851 3.439 10 0 GGAEMN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccc(F)cc1F ZINC000163489550 1425007526 /nfs/dbraw/zinc/00/75/26/1425007526.db2.gz HCMBYYSCGXVJDO-RYUDHWBXSA-N 0 1 382.432 3.046 10 0 GGAEMN COc1cccc(CN2CCC[C@@H](COc3ccccc3C(=O)NC3CC3)C2)n1 ZINC000169765292 1425249906 /nfs/dbraw/zinc/24/99/06/1425249906.db2.gz LFNVYNKVGIHCFR-QGZVFWFLSA-N 0 1 395.503 3.273 10 0 GGAEMN COC[C@@H]1CN(C(C)=O)CC12CCN(Cc1cccc(Br)c1)CC2 ZINC000169782735 1425255624 /nfs/dbraw/zinc/25/56/24/1425255624.db2.gz FDFYUBBVASSFMJ-KRWDZBQOSA-N 0 1 395.341 3.156 10 0 GGAEMN COC[C@@H]1CN(C(C)=O)CC12CCN(Cc1cccc(C(F)(F)F)c1)CC2 ZINC000169782739 1425256012 /nfs/dbraw/zinc/25/60/12/1425256012.db2.gz SMMUKGJQMNPOPU-SFHVURJKSA-N 0 1 384.442 3.412 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC(C2OCCO2)CC1 ZINC000171238288 1425560606 /nfs/dbraw/zinc/56/06/06/1425560606.db2.gz IBCLFQCOGZAMKO-DLBZAZTESA-N 0 1 382.504 3.490 10 0 GGAEMN C[C@@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCCCc1nnn[n-]1 ZINC000708195121 1425642165 /nfs/dbraw/zinc/64/21/65/1425642165.db2.gz KLMAPPIWOORKKS-HOTGVXAUSA-N 0 1 380.537 3.070 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000171620390 1425760673 /nfs/dbraw/zinc/76/06/73/1425760673.db2.gz ANEXWMYGJPMREL-LMMKCTJWSA-N 0 1 393.535 3.160 10 0 GGAEMN COC(=O)CCc1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1 ZINC000172561210 1426088394 /nfs/dbraw/zinc/08/83/94/1426088394.db2.gz TVQZPKXWJJTWER-UHFFFAOYSA-N 0 1 389.260 3.295 10 0 GGAEMN CC(C)(C)OC(=O)N1CC[C@H](CN2CCN(c3nc4ccccc4o3)CC2)C1 ZINC000172790659 1426189935 /nfs/dbraw/zinc/18/99/35/1426189935.db2.gz RGQJDWRAPIKCCX-MRXNPFEDSA-N 0 1 386.496 3.207 10 0 GGAEMN COc1ccc(-c2ccc(C(=O)N3CCO[C@@H](c4n[nH]c(C)n4)C3)c(F)c2)cc1 ZINC000173086726 1426336783 /nfs/dbraw/zinc/33/67/83/1426336783.db2.gz GLEGAUWMLLFHQF-LJQANCHMSA-N 0 1 396.422 3.142 10 0 GGAEMN CCCn1c(C)c(C(=O)N2CCO[C@@H](c3n[nH]c(C)n3)C2)c2cc(OC)ccc21 ZINC000173089210 1426337866 /nfs/dbraw/zinc/33/78/66/1426337866.db2.gz JEXMUGPGIZFTDX-GOSISDBHSA-N 0 1 397.479 3.009 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2ccnc(OC3CCCCC3)c2)[nH]1 ZINC000174444237 1427159352 /nfs/dbraw/zinc/15/93/52/1427159352.db2.gz BXYMMWNIKLZGIC-UHFFFAOYSA-N 0 1 375.498 3.018 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)CCCc2cc(-c3ccccc3)no2)[nH]1 ZINC000174686555 1427309677 /nfs/dbraw/zinc/30/96/77/1427309677.db2.gz DDZXLKGMOWLULA-UHFFFAOYSA-N 0 1 385.493 3.342 10 0 GGAEMN COC(=O)c1cc(F)ccc1CN(C)C1CCN(C(=O)OC(C)(C)C)CC1 ZINC000174824875 1427388364 /nfs/dbraw/zinc/38/83/64/1427388364.db2.gz CZMGFNDHEAIYKS-UHFFFAOYSA-N 0 1 380.460 3.444 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H](C)c2noc(-c3ccc(Cl)cc3)n2)[nH]1 ZINC000175101044 1427546327 /nfs/dbraw/zinc/54/63/27/1427546327.db2.gz ABTOBXCUEFHLFM-SECBINFHSA-N 0 1 392.872 3.176 10 0 GGAEMN Cc1cc(NC(=O)C2CCN([C@H]3CCCN(c4ccc(C)cc4)C3=O)CC2)no1 ZINC000175523122 1427802872 /nfs/dbraw/zinc/80/28/72/1427802872.db2.gz WUGBCZNKTBZUMB-IBGZPJMESA-N 0 1 396.491 3.138 10 0 GGAEMN C[C@@H](NCc1cc(=O)n2cc(Cl)ccc2n1)c1ccc(-n2cccn2)cc1 ZINC000180822956 1430058584 /nfs/dbraw/zinc/05/85/84/1430058584.db2.gz HMAXJBPQNXCEAX-CQSZACIVSA-N 0 1 379.851 3.384 10 0 GGAEMN CCOC(=O)c1ccc(NC(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)cc1 ZINC000180854314 1430071729 /nfs/dbraw/zinc/07/17/29/1430071729.db2.gz FBNYAVLDAUVWGK-INIZCTEOSA-N 0 1 392.459 3.338 10 0 GGAEMN CC(C)c1noc(CCC(=O)N2CCC[C@@H](c3nnc(-c4ccccc4)[nH]3)C2)n1 ZINC000181350596 1430279928 /nfs/dbraw/zinc/27/99/28/1430279928.db2.gz BFOPQUXDMYEODZ-MRXNPFEDSA-N 0 1 394.479 3.317 10 0 GGAEMN Cc1cccc(Cc2cnc(NC(=O)CN3CCCC[C@@H]3c3nnc[nH]3)s2)c1 ZINC000182690734 1430518066 /nfs/dbraw/zinc/51/80/66/1430518066.db2.gz YAINORQHEIESAP-QGZVFWFLSA-N 0 1 396.520 3.326 10 0 GGAEMN O=S(=O)(c1ccccc1)N1CCCN(Cc2cccc3cnccc32)CC1 ZINC000183164671 1430635469 /nfs/dbraw/zinc/63/54/69/1430635469.db2.gz ZUINHZATWVDTEZ-UHFFFAOYSA-N 0 1 381.501 3.131 10 0 GGAEMN CCO[C@H](C)c1noc(CN2CCN([C@@H](C)CCc3cccc(F)c3)CC2)n1 ZINC000183365145 1430690636 /nfs/dbraw/zinc/69/06/36/1430690636.db2.gz FJPHAHGNGDSWKO-DLBZAZTESA-N 0 1 390.503 3.445 10 0 GGAEMN Cc1cccc(N2CCN(Cc3ccc(NC(=O)C4CC(=O)C4)cc3)CC2)c1 ZINC000183503469 1430729847 /nfs/dbraw/zinc/72/98/47/1430729847.db2.gz ADNGZSRLYGFQPN-UHFFFAOYSA-N 0 1 377.488 3.235 10 0 GGAEMN CN(C)c1ccncc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1 ZINC000183772078 1430790246 /nfs/dbraw/zinc/79/02/46/1430790246.db2.gz PTFUMPXDBIFCAK-KRWDZBQOSA-N 0 1 384.480 3.143 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(Cc3cc(F)cc4c3OCOC4)C[C@H]12 ZINC000186036534 1431316348 /nfs/dbraw/zinc/31/63/48/1431316348.db2.gz XIUCCFXQUGJIDR-JEBQAFNWSA-N 0 1 392.471 3.427 10 0 GGAEMN N#Cc1ccc(Cl)c(S(=O)(=O)Nc2ccnn2-c2cccc(F)c2)c1 ZINC000186615415 1431469756 /nfs/dbraw/zinc/46/97/56/1431469756.db2.gz TULHIUQCZXCCFW-UHFFFAOYSA-N 0 1 376.800 3.337 10 0 GGAEMN CN(C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2)[C@@H]1CCc2ccccc21 ZINC000189711133 1432211594 /nfs/dbraw/zinc/21/15/94/1432211594.db2.gz KRVBGYFRENQTFO-GOSISDBHSA-N 0 1 396.491 3.462 10 0 GGAEMN CN(C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2)[C@H]1CCc2ccccc21 ZINC000189711153 1432211652 /nfs/dbraw/zinc/21/16/52/1432211652.db2.gz KRVBGYFRENQTFO-SFHVURJKSA-N 0 1 396.491 3.462 10 0 GGAEMN CCc1ccc(C(=O)CCC(=O)NCCc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000189793003 1432236422 /nfs/dbraw/zinc/23/64/22/1432236422.db2.gz YOCFJGMBXPUQRS-UHFFFAOYSA-N 0 1 376.460 3.356 10 0 GGAEMN CN(C)c1noc(C2CCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)n1 ZINC000191907853 1432752776 /nfs/dbraw/zinc/75/27/76/1432752776.db2.gz BGKJRIOYYPVYSD-IBGZPJMESA-N 0 1 386.496 3.073 10 0 GGAEMN COc1ccc(OC[C@H](O)CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1 ZINC000192462323 1432847526 /nfs/dbraw/zinc/84/75/26/1432847526.db2.gz SBZXYCBOLIBVDM-LJQANCHMSA-N 0 1 387.451 3.169 10 0 GGAEMN CCCNC(=O)C1CCN([C@@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)CC1 ZINC000192839364 1432897312 /nfs/dbraw/zinc/89/73/12/1432897312.db2.gz FXJGHKHWSNRRFO-AWEZNQCLSA-N 0 1 397.922 3.064 10 0 GGAEMN O=C(CN1CCC(c2ccn[nH]2)CC1)Nc1ncc(Cc2ccc(F)cc2)s1 ZINC000195507205 1433337701 /nfs/dbraw/zinc/33/77/01/1433337701.db2.gz NAGSEUWUEGQCDP-UHFFFAOYSA-N 0 1 399.495 3.414 10 0 GGAEMN O=S(=O)(NCC1CCSCC1)c1c(F)cc(F)cc1Br ZINC000229368614 1433371607 /nfs/dbraw/zinc/37/16/07/1433371607.db2.gz DRFGAGWKDUJVMR-UHFFFAOYSA-N 0 1 386.283 3.149 10 0 GGAEMN Cc1ccnc(-c2noc(-c3cc(I)ccc3O)n2)c1 ZINC000236009248 1433374016 /nfs/dbraw/zinc/37/40/16/1433374016.db2.gz IAKIAGFZKMVONQ-UHFFFAOYSA-N 0 1 379.157 3.417 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2ccc(F)c(Br)c2)C1=O ZINC000237096912 1433388948 /nfs/dbraw/zinc/38/89/48/1433388948.db2.gz HSGOIWKSWQASJE-OAHLLOKOSA-N 0 1 393.256 3.492 10 0 GGAEMN COc1ccc(Br)c(CNC[C@H](O)COc2ccc(F)cc2)c1 ZINC000237327554 1433397351 /nfs/dbraw/zinc/39/73/51/1433397351.db2.gz HOKFGCQVAOEWKQ-AWEZNQCLSA-N 0 1 384.245 3.126 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N(C)C[C@H]1CCCC[C@H]1O ZINC000245527008 1433481332 /nfs/dbraw/zinc/48/13/32/1433481332.db2.gz AWAUOGSYBUJFIE-NLWGTHIKSA-N 0 1 384.524 3.299 10 0 GGAEMN C[C@H]1CC[N@@H+](CC(=O)NCc2ccc(F)cc2C(F)(F)F)C[C@H]1n1ccnc1 ZINC000245558276 1433485159 /nfs/dbraw/zinc/48/51/59/1433485159.db2.gz BDOHURDCXPATKE-SUMWQHHRSA-N 0 1 398.404 3.240 10 0 GGAEMN CCN(C[C@H](O)c1ccc(C)cc1)[C@H](C)C(=O)Nc1cc(C(=O)OC)ccc1C ZINC000245743267 1433509902 /nfs/dbraw/zinc/50/99/02/1433509902.db2.gz FKSJMMHXLWXAPQ-UTKZUKDTSA-N 0 1 398.503 3.473 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000245990105 1433554288 /nfs/dbraw/zinc/55/42/88/1433554288.db2.gz CYOLKWNCQFEPPH-IJEWVQPXSA-N 0 1 398.450 3.129 10 0 GGAEMN COC(=O)c1cc(F)ccc1CN1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]2C1 ZINC000248553808 1433808146 /nfs/dbraw/zinc/80/81/46/1433808146.db2.gz AQXIMSMUKALYNC-BMGDILEWSA-N 0 1 392.471 3.347 10 0 GGAEMN COC(=O)c1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(F)c1 ZINC000248581628 1433809674 /nfs/dbraw/zinc/80/96/74/1433809674.db2.gz ISZIKJPFWALHQK-LESCRADOSA-N 0 1 392.471 3.347 10 0 GGAEMN CC(C)(C)OC(=O)N[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1 ZINC000249750829 1433850936 /nfs/dbraw/zinc/85/09/36/1433850936.db2.gz HGCIZEUALCLVFX-JKSUJKDBSA-N 0 1 384.904 3.069 10 0 GGAEMN CCOC(=O)C1=C(CN2CCCC[C@H]2C)N(C)C(=O)N[C@H]1c1cccc(C)c1 ZINC000253389051 1433867052 /nfs/dbraw/zinc/86/70/52/1433867052.db2.gz VGZPKLYCEBZRLV-UZLBHIALSA-N 0 1 385.508 3.383 10 0 GGAEMN COc1cccc(-c2cc(C(=O)N3CCC[C@@H]3c3nncn3C(C)C)n[nH]2)c1 ZINC000253412264 1433867150 /nfs/dbraw/zinc/86/71/50/1433867150.db2.gz QKTZGCCHXOJZRZ-GOSISDBHSA-N 0 1 380.452 3.235 10 0 GGAEMN CC(C)(C)OC(=O)N1CCN(C2CCC(NC(=O)CC3CCC3)CC2)CC1 ZINC000253430276 1433867538 /nfs/dbraw/zinc/86/75/38/1433867538.db2.gz XNRWIELYXHJOKI-UHFFFAOYSA-N 0 1 379.545 3.157 10 0 GGAEMN COCCN1CC2(CCN(C(=O)c3ccccc3OC)CC2)[C@H]1c1ccncc1 ZINC000257174640 1433893179 /nfs/dbraw/zinc/89/31/79/1433893179.db2.gz JAZKLRLJHKUTKP-OAQYLSRUSA-N 0 1 395.503 3.016 10 0 GGAEMN Cc1cnc(CO[C@H]2CCCN(C(=O)c3cc(-c4ccc(F)cc4)[nH]n3)C2)n1C ZINC000257176052 1433893421 /nfs/dbraw/zinc/89/34/21/1433893421.db2.gz RPMNUVLNSHRVSX-KRWDZBQOSA-N 0 1 397.454 3.079 10 0 GGAEMN COCCN1CC2(CCN(C(=O)c3ccccc3C)CC2)[C@@H]1c1ccncc1 ZINC000257178229 1433893513 /nfs/dbraw/zinc/89/35/13/1433893513.db2.gz ZMXBWLVKUIWONE-NRFANRHFSA-N 0 1 379.504 3.316 10 0 GGAEMN O=c1[n-]c(-c2cnccn2)nc2c1CC[N@H+](Cc1cc(Cl)ccc1F)CC2 ZINC000257177354 1433893620 /nfs/dbraw/zinc/89/36/20/1433893620.db2.gz WPXATKZOHFTPAS-UHFFFAOYSA-N 0 1 385.830 3.033 10 0 GGAEMN O=c1[n-]c(-c2cnccn2)nc2c1CC[N@@H+](Cc1cc(Cl)ccc1F)CC2 ZINC000257177354 1433893621 /nfs/dbraw/zinc/89/36/21/1433893621.db2.gz WPXATKZOHFTPAS-UHFFFAOYSA-N 0 1 385.830 3.033 10 0 GGAEMN O=C(c1cccs1)N1CCC(N2C[C@@H](OCC3CC3)C23CCOCC3)CC1 ZINC000257179304 1433893871 /nfs/dbraw/zinc/89/38/71/1433893871.db2.gz IJIJLHPPUQDHNR-LJQANCHMSA-N 0 1 390.549 3.013 10 0 GGAEMN Cc1ccc(C[N@H+]2CCC[C@@H](C(=O)NCc3ccccc3)CCNC(=O)CC2)o1 ZINC000257184872 1433894151 /nfs/dbraw/zinc/89/41/51/1433894151.db2.gz VMSZNKBOXSHUMB-HXUWFJFHSA-N 0 1 397.519 3.013 10 0 GGAEMN Cc1ccc(NC(=O)N2CCC[C@H]2c2nnc3n2CCN(C)CC3)c(Cl)c1 ZINC000257188054 1433894298 /nfs/dbraw/zinc/89/42/98/1433894298.db2.gz DFRSRTBUAWKNGY-INIZCTEOSA-N 0 1 388.903 3.097 10 0 GGAEMN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@@H]1c1nnc2n1CCN(C)CC2 ZINC000257190460 1433894518 /nfs/dbraw/zinc/89/45/18/1433894518.db2.gz MRXJMBXRSLEONU-MRXNPFEDSA-N 0 1 388.903 3.097 10 0 GGAEMN Cn1cccc1CN1CCC(N2C(=O)[C@@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257190374 1433894591 /nfs/dbraw/zinc/89/45/91/1433894591.db2.gz MGOZPRGMJTWNBQ-OAQYLSRUSA-N 0 1 385.552 3.330 10 0 GGAEMN CCCCS(=O)(=O)N1CCC(CCn2c(C)cnc2C2CCOCC2)CC1 ZINC000257196199 1433894927 /nfs/dbraw/zinc/89/49/27/1433894927.db2.gz XUBRMJIPGNRLJC-UHFFFAOYSA-N 0 1 397.585 3.318 10 0 GGAEMN C[C@@H](O)CN(Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)C1CCCCC1 ZINC000264141415 1434075425 /nfs/dbraw/zinc/07/54/25/1434075425.db2.gz BGNMNDNIUZQGRM-OAHLLOKOSA-N 0 1 381.480 3.037 10 0 GGAEMN CCC(=O)N[C@H](CCSC)C(=O)Nc1ccc2nc(-c3ccccn3)[nH]c2c1 ZINC000265047531 1434178557 /nfs/dbraw/zinc/17/85/57/1434178557.db2.gz ATQKLYZLRZYRFR-MRXNPFEDSA-N 0 1 397.504 3.211 10 0 GGAEMN CN1CCN(CCOc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)cc2)CC1 ZINC000266297142 1434317442 /nfs/dbraw/zinc/31/74/42/1434317442.db2.gz HROKCSHQNOSNSP-FGZHOGPDSA-N 0 1 397.494 3.194 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)[nH]1 ZINC000266785496 1434375236 /nfs/dbraw/zinc/37/52/36/1434375236.db2.gz AOEOQCQAHIUJJD-CQSZACIVSA-N 0 1 382.436 3.391 10 0 GGAEMN C[C@@H](C(=O)Nc1ccccc1Cc1ccccc1)N1CCC2(CNC(=O)C2)CC1 ZINC000267736631 1434459768 /nfs/dbraw/zinc/45/97/68/1434459768.db2.gz BVYFWLDBSQQONE-SFHVURJKSA-N 0 1 391.515 3.207 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N1CCC[C@@H](c2nc(C)n[nH]2)C1 ZINC000268433451 1434522309 /nfs/dbraw/zinc/52/23/09/1434522309.db2.gz FSMORDYXTDQGLJ-SWLSCSKDSA-N 0 1 395.463 3.269 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N1CCC[C@@H](c2nnc(C)[nH]2)C1 ZINC000268433451 1434522312 /nfs/dbraw/zinc/52/23/12/1434522312.db2.gz FSMORDYXTDQGLJ-SWLSCSKDSA-N 0 1 395.463 3.269 10 0 GGAEMN CC[NH+]1CCN(c2ccc(NC(=O)c3cc(NC(C)=O)ccc3[O-])c(C)c2)CC1 ZINC000270027143 1434694375 /nfs/dbraw/zinc/69/43/75/1434694375.db2.gz GCIARCZSSAHNSN-UHFFFAOYSA-N 0 1 396.491 3.053 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@H]1CS(=O)(=O)c2ccccc21)CC3 ZINC000272814079 1434933136 /nfs/dbraw/zinc/93/31/36/1434933136.db2.gz CEERUSPWTMNIPJ-XCLFUZPHSA-N 0 1 382.485 3.152 10 0 GGAEMN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000272890322 1434939048 /nfs/dbraw/zinc/93/90/48/1434939048.db2.gz DRECLGZHLWJJRS-MDNHHPLHSA-N 0 1 387.505 3.060 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@H]1CCCN(C(=O)/C=C/c2ccc(SC(F)F)cc2)CC1 ZINC000275589802 1435150864 /nfs/dbraw/zinc/15/08/64/1435150864.db2.gz HGYAITQZSXWMTK-PPYMECGQSA-N 0 1 398.475 3.412 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)NCc2cnn(Cc3ccccc3)c2)n[nH]1 ZINC000277095871 1435261495 /nfs/dbraw/zinc/26/14/95/1435261495.db2.gz DRADIQNWYXAWGC-LSDHHAIUSA-N 0 1 381.484 3.123 10 0 GGAEMN Cc1cc([C@H]2CCCN(C(=O)[C@H](NC(=O)c3cccc(C)c3)C(C)C)C2)n[nH]1 ZINC000282380214 1435845133 /nfs/dbraw/zinc/84/51/33/1435845133.db2.gz CUBUXIVKRVZBCX-AZUAARDMSA-N 0 1 382.508 3.187 10 0 GGAEMN CC(C)Oc1ccc(CNC(=O)[C@@H]2CCc3[nH]nnc3C2)c(C(F)(F)F)c1 ZINC000283230961 1435880372 /nfs/dbraw/zinc/88/03/72/1435880372.db2.gz YWPDYMXXTUFJHC-LLVKDONJSA-N 0 1 382.386 3.032 10 0 GGAEMN CC(C)Oc1ccc(CNC(=O)[C@@H]2CCc3nn[nH]c3C2)c(C(F)(F)F)c1 ZINC000283230961 1435880374 /nfs/dbraw/zinc/88/03/74/1435880374.db2.gz YWPDYMXXTUFJHC-LLVKDONJSA-N 0 1 382.386 3.032 10 0 GGAEMN Cc1cc([C@@H]2CCCN(C(=O)C=Cc3ccc(N4CCCC4=O)cc3)C2)n[nH]1 ZINC000283442117 1435890064 /nfs/dbraw/zinc/89/00/64/1435890064.db2.gz GZOUUWNAESSDOU-VEGGFIAOSA-N 0 1 378.476 3.264 10 0 GGAEMN O=C([O-])[C@H](NC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)c1cccs1 ZINC000379638525 939131353 /nfs/dbraw/zinc/13/13/53/939131353.db2.gz ULEPIHMNWDRJAI-FUHWJXTLSA-N 0 1 387.505 3.228 10 0 GGAEMN C[C@@]1(CNC(=O)N[C@H](C(=O)[O-])c2cccs2)CCC[N@H+]1Cc1ccccc1 ZINC000397908495 939138419 /nfs/dbraw/zinc/13/84/19/939138419.db2.gz XSASRCZFBKWJMG-PXNSSMCTSA-N 0 1 387.505 3.228 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@H](C(=O)[O-])C2CCCCC2)[C@@H]1c1cccs1 ZINC000780584488 939138921 /nfs/dbraw/zinc/13/89/21/939138921.db2.gz ABVIEBPVJUUUPQ-BPQIPLTHSA-N 0 1 393.553 3.464 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2)[C@@H]1c1cccs1 ZINC000780584833 939139448 /nfs/dbraw/zinc/13/94/48/939139448.db2.gz HMIVPYJRLMZZNH-KBAYOESNSA-N 0 1 387.505 3.256 10 0 GGAEMN C[N@@H+](CCOc1ccccc1)Cc1ccc(NC(=O)[C@@H](C(=O)[O-])C2CC2)cc1 ZINC000902730127 939287441 /nfs/dbraw/zinc/28/74/41/939287441.db2.gz PGGNIPNAELNRHE-FQEVSTJZSA-N 0 1 382.460 3.247 10 0 GGAEMN C[N@@H+](CCCNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)Cc1ccccc1 ZINC000908759646 939314863 /nfs/dbraw/zinc/31/48/63/939314863.db2.gz DEQBVMSNFGKBQA-OAQYLSRUSA-N 0 1 375.513 3.231 10 0 GGAEMN C[C@@H](CNC(=O)N[C@H](C(=O)[O-])c1ccc2ccccc2c1)[N@H+]1CCC[C@@H](C)C1 ZINC000908811657 939325535 /nfs/dbraw/zinc/32/55/35/939325535.db2.gz AAWACHKUEXGHPB-GUXCAODWSA-N 0 1 383.492 3.385 10 0 GGAEMN CC1(C)CCC[C@@](NC(=O)NCCC[N@H+]2CCc3ccccc3C2)(C(=O)[O-])C1 ZINC000908821419 939329524 /nfs/dbraw/zinc/32/95/24/939329524.db2.gz KUBMDXTYYNDABW-QFIPXVFZSA-N 0 1 387.524 3.158 10 0 GGAEMN C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N[C@@]2(C(=O)[O-])CCCC(C)(C)C2)C1 ZINC000908829808 939332109 /nfs/dbraw/zinc/33/21/09/939332109.db2.gz NSJSITKHTJFNIK-FVJLSDCUSA-N 0 1 381.561 3.467 10 0 GGAEMN CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@@H](C(=O)[O-])C2CCCCCC2)c1 ZINC000908882846 939344518 /nfs/dbraw/zinc/34/45/18/939344518.db2.gz MFZQFFOVPCTXOP-LJQANCHMSA-N 0 1 375.513 3.361 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@H](C(=O)[O-])c1ccc(Br)cc1 ZINC000908909865 939349345 /nfs/dbraw/zinc/34/93/45/939349345.db2.gz BTSTUWOVRAAGSR-ZBEGNZNMSA-N 0 1 394.269 3.101 10 0 GGAEMN C[C@@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2ccccc2C1 ZINC000908914666 939351822 /nfs/dbraw/zinc/35/18/22/939351822.db2.gz ZXUAZDWXXSSCNA-KSFYIVLOSA-N 0 1 387.524 3.156 10 0 GGAEMN O=C([O-])[C@H](NC(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC000908924873 939354105 /nfs/dbraw/zinc/35/41/05/939354105.db2.gz NCCSJKOPJANZPQ-AZUAARDMSA-N 0 1 387.524 3.231 10 0 GGAEMN C[C@@](NC(=O)NC[C@@]1(C)CCC[N@H+]1Cc1ccccc1)(C(=O)[O-])c1ccccc1 ZINC000908960004 939361889 /nfs/dbraw/zinc/36/18/89/939361889.db2.gz OOAQVZUHJJNMLN-PKTZIBPZSA-N 0 1 395.503 3.340 10 0 GGAEMN CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N[C@H](C(=O)[O-])c2cccc(OC)c2)C1 ZINC000908960865 939362412 /nfs/dbraw/zinc/36/24/12/939362412.db2.gz HOGNUFGDWJWIBO-YJBOKZPZSA-N 0 1 391.512 3.021 10 0 GGAEMN CC[C@](NC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)(C(=O)[O-])c1ccc(Cl)cc1 ZINC000909051736 939374351 /nfs/dbraw/zinc/37/43/51/939374351.db2.gz GHIRQFPRDOVCGY-KVMCETHSSA-N 0 1 393.915 3.344 10 0 GGAEMN C[C@@H]1C[C@H](NC(=O)N[C@@]2(C(=O)[O-])CCCC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000909094218 939380401 /nfs/dbraw/zinc/38/04/01/939380401.db2.gz HPYKRYRRWHQYFY-NRJQMVOHSA-N 0 1 387.524 3.372 10 0 GGAEMN CCCC[N@@H+](CC)Cc1cccc(CNC(=O)N[C@@]2(C(=O)[O-])CCSC2)c1 ZINC000909123650 939383222 /nfs/dbraw/zinc/38/32/22/939383222.db2.gz ZJAYJBAFUYJFDI-FQEVSTJZSA-N 0 1 393.553 3.068 10 0 GGAEMN COc1cccc([C@H](NC(=O)NCC[C@H](C)[N@@H+](C)Cc2ccccc2)C(=O)[O-])c1 ZINC000909136307 939384434 /nfs/dbraw/zinc/38/44/34/939384434.db2.gz GLQCQYFADCELEO-JXFKEZNVSA-N 0 1 399.491 3.031 10 0 GGAEMN C[N@@H+]1CCc2[nH]c3ccc(C(=O)N[C@@]4(C(=O)[O-])CCCC(C)(C)C4)cc3c2C1 ZINC000910217777 939753770 /nfs/dbraw/zinc/75/37/70/939753770.db2.gz GJLZYPKJIGXFCZ-QFIPXVFZSA-N 0 1 383.492 3.309 10 0 GGAEMN C[N@H+]1CCc2[nH]c3ccc(C(=O)N[C@@]4(C(=O)[O-])CCCC(C)(C)C4)cc3c2C1 ZINC000910217777 939753771 /nfs/dbraw/zinc/75/37/71/939753771.db2.gz GJLZYPKJIGXFCZ-QFIPXVFZSA-N 0 1 383.492 3.309 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@H](C(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000910379496 939755111 /nfs/dbraw/zinc/75/51/11/939755111.db2.gz IPQUSSNPEJSJOG-BZNIZROVSA-N 0 1 383.370 3.358 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)[C@@H]1CCC[N@@H+](CCc2ccccc2)C1)C1CCCCCC1 ZINC000911780712 939781765 /nfs/dbraw/zinc/78/17/65/939781765.db2.gz CUFOTPXIERCXTF-RTWAWAEBSA-N 0 1 386.536 3.481 10 0 GGAEMN C[C@H](NC(=O)N[C@@H](C(=O)[O-])C1CCCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041377 939798836 /nfs/dbraw/zinc/79/88/36/939798836.db2.gz NNLDBZKNRLKRJI-VDZJLULYSA-N 0 1 379.545 3.362 10 0 GGAEMN Cc1cccc(C(=O)N[C@@]2(C(=O)[O-])CCC[N@@H+](Cc3ccccc3)C2)c1Cl ZINC001123269806 939818430 /nfs/dbraw/zinc/81/84/30/939818430.db2.gz AXIPVEYXEGURQE-NRFANRHFSA-N 0 1 386.879 3.498 10 0 GGAEMN O=C([O-])[C@@]1(NC(=O)c2cccc3scnc32)CCC[N@@H+](Cc2ccccc2)C1 ZINC001123278297 939820313 /nfs/dbraw/zinc/82/03/13/939820313.db2.gz VNRSHSBLUPQLNR-OAQYLSRUSA-N 0 1 395.484 3.146 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000663045486 939850893 /nfs/dbraw/zinc/85/08/93/939850893.db2.gz IFXUQOKAVPCZLP-YESZJQIVSA-N 0 1 382.863 3.230 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000663045486 939850894 /nfs/dbraw/zinc/85/08/94/939850894.db2.gz IFXUQOKAVPCZLP-YESZJQIVSA-N 0 1 382.863 3.230 10 0 GGAEMN CC(C)(C)OC(=O)N=c1[nH]cc(CNC2(CO)Cc3ccccc3C2)s1 ZINC000367238074 1126079900 /nfs/dbraw/zinc/07/99/00/1126079900.db2.gz NZMRTUQQMDGJNF-UHFFFAOYSA-N 0 1 375.494 3.110 10 0 GGAEMN COc1ccc(-c2nc(CNC3(CO)Cc4ccccc4C3)cs2)c(OC)c1 ZINC000369329642 1126080085 /nfs/dbraw/zinc/08/00/85/1126080085.db2.gz NHUXXMRKEQEAPC-UHFFFAOYSA-N 0 1 396.512 3.447 10 0 GGAEMN O=C([O-])[C@@H](Cc1c[nH]c2cc(F)ccc12)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000426835222 1126093054 /nfs/dbraw/zinc/09/30/54/1126093054.db2.gz QMLKQQMZIXXQOV-LJQANCHMSA-N 0 1 378.407 3.483 10 0 GGAEMN Cn1nc(C(F)(F)F)cc1CN[C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000657362541 1126104485 /nfs/dbraw/zinc/10/44/85/1126104485.db2.gz CQDKXWIKDREKOA-TZMCWYRMSA-N 0 1 381.320 3.063 10 0 GGAEMN O[C@H]([C@@H](Cc1ccccc1)NCc1cc(-c2cccnc2)n[nH]1)C(F)(F)F ZINC000675100096 1126105146 /nfs/dbraw/zinc/10/51/46/1126105146.db2.gz WBGDKODMJSQAKT-QZTJIDSGSA-N 0 1 376.382 3.096 10 0 GGAEMN Cc1cc(C)cc(-n2ncc(CN[C@@H](CO)Cc3c[nH]c4ccccc34)n2)c1 ZINC000781416825 1126109354 /nfs/dbraw/zinc/10/93/54/1126109354.db2.gz WWOIGEFJBFBROR-GOSISDBHSA-N 0 1 375.476 3.059 10 0 GGAEMN Cc1ccc(C[C@H](CO)NCc2cnc(NC(=O)OC(C)(C)C)cn2)cc1C ZINC000865599325 1126114473 /nfs/dbraw/zinc/11/44/73/1126114473.db2.gz XPOOXDSKQOUKBX-QGZVFWFLSA-N 0 1 386.496 3.134 10 0 GGAEMN CC(C)(C)OC(=O)Nc1cnc(CN[C@@](C)(CO)Cc2ccccc2F)cn1 ZINC000865716559 1126115920 /nfs/dbraw/zinc/11/59/20/1126115920.db2.gz VXPXBPXWLXNWBN-HXUWFJFHSA-N 0 1 390.459 3.046 10 0 GGAEMN Cn1ccc(-c2nc(CN[C@](C)(CO)Cc3ccc(Cl)cc3)cs2)n1 ZINC000922318350 1126134600 /nfs/dbraw/zinc/13/46/00/1126134600.db2.gz QRMIBKIIOPHUQM-SFHVURJKSA-N 0 1 376.913 3.280 10 0 GGAEMN COc1cc(CN[C@@](C)(CO)Cc2ccc(F)cc2)c(Br)cn1 ZINC001198230826 1126155907 /nfs/dbraw/zinc/15/59/07/1126155907.db2.gz RZQMTKRFOCKIBD-QGZVFWFLSA-N 0 1 383.261 3.075 10 0 GGAEMN COc1cc(CN[C@](C)(CO)Cc2ccc(F)cc2)c(Br)cn1 ZINC001198230819 1126155909 /nfs/dbraw/zinc/15/59/09/1126155909.db2.gz RZQMTKRFOCKIBD-KRWDZBQOSA-N 0 1 383.261 3.075 10 0 GGAEMN O[C@H]([C@H](Cc1ccccc1)NCc1cccc(Br)n1)C(F)(F)F ZINC001648158308 1126250202 /nfs/dbraw/zinc/25/02/02/1126250202.db2.gz KPSMWYNDZFCRHX-DZGCQCFKSA-N 0 1 389.215 3.468 10 0 GGAEMN C[C@@](CO)(Cc1ccc(F)cc1)NCc1ccn(-c2ccc(F)cc2F)n1 ZINC001656293683 1126257200 /nfs/dbraw/zinc/25/72/00/1126257200.db2.gz PVSUOXYDRYMBGZ-FQEVSTJZSA-N 0 1 375.394 3.373 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@H]1CCCN(C(=O)c2ccc(COc3ccccc3)cc2)CC1 ZINC000186653364 212176637 /nfs/dbraw/zinc/17/66/37/212176637.db2.gz ZLBWBGVAJMAOFR-FQEVSTJZSA-N 0 1 396.487 3.277 10 0 GGAEMN COc1ccc2nc(SCC(=O)N[C@@H](C)c3ccc4c(c3)OCCO4)[nH]c2c1 ZINC000007901423 221015534 /nfs/dbraw/zinc/01/55/34/221015534.db2.gz SCESKCDGWQSSGF-LBPRGKRZSA-N 0 1 399.472 3.312 10 0 GGAEMN O=C(COc1ccc(Br)cc1)Nc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000008116697 221027382 /nfs/dbraw/zinc/02/73/82/221027382.db2.gz UOABMLIXXYDRCG-UHFFFAOYSA-N 0 1 391.200 3.391 10 0 GGAEMN CN(C)S(=O)(=O)c1cccc(CSc2nc(-c3cccs3)n[nH]2)c1 ZINC000008485160 221042568 /nfs/dbraw/zinc/04/25/68/221042568.db2.gz SJHPYWJRGHTVKZ-UHFFFAOYSA-N 0 1 380.520 3.076 10 0 GGAEMN CC(C)(C)OC(=O)N1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C[C@H]1C(=O)[O-] ZINC000008698786 221049897 /nfs/dbraw/zinc/04/98/97/221049897.db2.gz WHTXSKUHVZKEIF-AWEZNQCLSA-N 0 1 388.386 3.211 10 0 GGAEMN CC(C)(C)OC(=O)N1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C[C@H]1C(=O)[O-] ZINC000008698786 221049900 /nfs/dbraw/zinc/04/99/00/221049900.db2.gz WHTXSKUHVZKEIF-AWEZNQCLSA-N 0 1 388.386 3.211 10 0 GGAEMN COc1ccc(NC(=O)c2cncc(NS(=O)(=O)c3ccccc3)c2)cc1 ZINC000009151970 221071962 /nfs/dbraw/zinc/07/19/62/221071962.db2.gz WIHOUGIBYJNAME-UHFFFAOYSA-N 0 1 383.429 3.143 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cncc(C(=O)N3CCc4ccccc43)c2)cc1 ZINC000009151962 221072370 /nfs/dbraw/zinc/07/23/70/221072370.db2.gz HJQPBUNOVCNALD-UHFFFAOYSA-N 0 1 393.468 3.394 10 0 GGAEMN COc1cn(CC(=O)Nc2ccccc2C)c(CN2CCCCCC2)cc1=O ZINC000009622020 221087402 /nfs/dbraw/zinc/08/74/02/221087402.db2.gz JQRFHKZOGHSAJA-UHFFFAOYSA-N 0 1 383.492 3.180 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2ccc(C)cc2C)c(C)n1C ZINC000009684753 221088416 /nfs/dbraw/zinc/08/84/16/221088416.db2.gz GQMDDAXPTNYYFI-UHFFFAOYSA-N 0 1 389.521 3.296 10 0 GGAEMN CCc1cccc(NS(=O)(=O)c2c(C)n(C)c(C)c2C(=O)N2CCCC2)c1 ZINC000009684796 221088562 /nfs/dbraw/zinc/08/85/62/221088562.db2.gz VFWNSAVSXQYMBV-UHFFFAOYSA-N 0 1 389.521 3.241 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(F)c(Cl)c2)c1C(=O)N1CCCC1 ZINC000009684254 221088760 /nfs/dbraw/zinc/08/87/60/221088760.db2.gz FFWGDQFIWFYTHH-UHFFFAOYSA-N 0 1 399.875 3.461 10 0 GGAEMN CCc1cccc(NS(=O)(=O)c2c(C)[nH]c(C)c2C(=O)N2CCCC2)c1 ZINC000009684229 221088776 /nfs/dbraw/zinc/08/87/76/221088776.db2.gz AMDNFQXVHIMRAT-UHFFFAOYSA-N 0 1 375.494 3.231 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2C(=O)N2CCCCC2)cc1 ZINC000009684358 221089013 /nfs/dbraw/zinc/08/90/13/221089013.db2.gz UMZKNFWVARHYCY-UHFFFAOYSA-N 0 1 391.493 3.067 10 0 GGAEMN CCc1ccc(NS(=O)(=O)c2c(C)n(C)c(C)c2C(=O)N2CCCC2)cc1 ZINC000009684700 221089028 /nfs/dbraw/zinc/08/90/28/221089028.db2.gz KQQFWMCVTQUFCR-UHFFFAOYSA-N 0 1 389.521 3.241 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2ccc(Cl)cc2)c(C)n1C ZINC000009684660 221089113 /nfs/dbraw/zinc/08/91/13/221089113.db2.gz CLDJEUAKNRBJRX-UHFFFAOYSA-N 0 1 395.912 3.332 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2cc(C)cc(C)c2)c1C(=O)N1CCCC1 ZINC000009684201 221089157 /nfs/dbraw/zinc/08/91/57/221089157.db2.gz VUCCFZYJVNUDEK-UHFFFAOYSA-N 0 1 375.494 3.285 10 0 GGAEMN COc1cccc(NS(=O)(=O)c2c(C)[nH]c(C)c2C(=O)N2CCCCC2)c1 ZINC000009684356 221089206 /nfs/dbraw/zinc/08/92/06/221089206.db2.gz OQUORCLPEMHTJK-UHFFFAOYSA-N 0 1 391.493 3.067 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2cccc(C)c2C)c(C)n1C ZINC000009684694 221089256 /nfs/dbraw/zinc/08/92/56/221089256.db2.gz CEYCEWZSDBWSFR-UHFFFAOYSA-N 0 1 389.521 3.296 10 0 GGAEMN CCc1ccccc1NS(=O)(=O)c1c(C)n(C)c(C)c1C(=O)N1CCCC1 ZINC000009684698 221089340 /nfs/dbraw/zinc/08/93/40/221089340.db2.gz UTEUQAUHTGLJJQ-UHFFFAOYSA-N 0 1 389.521 3.241 10 0 GGAEMN O=C(CSc1nc(-c2cccs2)n[nH]1)c1c[nH]c(C(=O)N2CCCC2)c1 ZINC000009952106 221095485 /nfs/dbraw/zinc/09/54/85/221095485.db2.gz UTQIRATYOSBWKC-UHFFFAOYSA-N 0 1 387.490 3.072 10 0 GGAEMN Cc1ccc2n1CCN(C(=O)c1cc(COc3ccc4c(c3)OCO4)n[nH]1)[C@H]2C ZINC000011820055 221129807 /nfs/dbraw/zinc/12/98/07/221129807.db2.gz ZYINPMGPOBHDCK-AWEZNQCLSA-N 0 1 394.431 3.044 10 0 GGAEMN CCNC(=O)NC(=O)[C@@H](Sc1nc(CC2CCCC2)n[nH]1)c1ccccc1 ZINC000011885668 221134526 /nfs/dbraw/zinc/13/45/26/221134526.db2.gz OXKKBFGCDAXUJY-INIZCTEOSA-N 0 1 387.509 3.217 10 0 GGAEMN CCNC(=O)NC(=O)[C@@H](Sc1n[nH]c(CC2CCCC2)n1)c1ccccc1 ZINC000011885668 221134527 /nfs/dbraw/zinc/13/45/27/221134527.db2.gz OXKKBFGCDAXUJY-INIZCTEOSA-N 0 1 387.509 3.217 10 0 GGAEMN CCCn1c(=O)[nH]nc1SCCS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000011388210 221115218 /nfs/dbraw/zinc/11/52/18/221115218.db2.gz DKKWZPLCBFBSTI-UHFFFAOYSA-N 0 1 396.321 3.267 10 0 GGAEMN CCc1ccc(S(=O)(=O)N2CCC[C@@H](N(CC)Cc3ccncc3)C2)cc1 ZINC000012306546 221179288 /nfs/dbraw/zinc/17/92/88/221179288.db2.gz NSDGATVCNOGXPW-HXUWFJFHSA-N 0 1 387.549 3.319 10 0 GGAEMN O=C(NCC(F)(F)F)c1cccc(NS(=O)(=O)c2cc(F)cc(F)c2)c1 ZINC000012507932 221199775 /nfs/dbraw/zinc/19/97/75/221199775.db2.gz WWRVLRFOADSTMW-UHFFFAOYSA-N 0 1 394.321 3.058 10 0 GGAEMN Cc1ccc(-c2nn(-c3cccc(F)c3)cc2CN(C)C[C@@H]2COCCO2)o1 ZINC000012372812 221186663 /nfs/dbraw/zinc/18/66/63/221186663.db2.gz NVFYXKMAVPFAMQ-LJQANCHMSA-N 0 1 385.439 3.427 10 0 GGAEMN CC(=O)Nc1cccc(NC(=O)CCc2c(C)[nH]n(-c3ccc(F)cc3)c2=O)c1 ZINC000012799643 221234095 /nfs/dbraw/zinc/23/40/95/221234095.db2.gz JNIOJHPIVJEDCA-UHFFFAOYSA-N 0 1 396.422 3.143 10 0 GGAEMN Cc1ccc(NC(=O)CN(C)C(=O)[C@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000012755367 221225356 /nfs/dbraw/zinc/22/53/56/221225356.db2.gz WPISHCYFKVOVJQ-GJZGRUSLSA-N 0 1 389.446 3.409 10 0 GGAEMN C[C@@H](Sc1nc(C=Cc2cccs2)n[nH]1)C(=O)NC(=O)NC(C)(C)C ZINC000012753492 221225766 /nfs/dbraw/zinc/22/57/66/221225766.db2.gz WDFHBCCBARDEFO-QROSGCPLSA-N 0 1 379.511 3.142 10 0 GGAEMN Cc1ccc(NC(=O)CN(C)C(=O)[C@@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000012755361 221225913 /nfs/dbraw/zinc/22/59/13/221225913.db2.gz WPISHCYFKVOVJQ-LSDHHAIUSA-N 0 1 389.446 3.409 10 0 GGAEMN C[C@@H](C(=O)N1CCc2ccccc21)N1CCC(C(=O)N2CCCCCC2)CC1 ZINC000012903655 221244210 /nfs/dbraw/zinc/24/42/10/221244210.db2.gz DUXNVSWAUVANQD-SFHVURJKSA-N 0 1 383.536 3.079 10 0 GGAEMN COC(=O)c1ccc(CN2CCC(C(=O)c3ccc4c(c3)OCCO4)CC2)cc1 ZINC000012805925 221235207 /nfs/dbraw/zinc/23/52/07/221235207.db2.gz RSZPEEKOPOPOPL-UHFFFAOYSA-N 0 1 395.455 3.339 10 0 GGAEMN O=C(CN1CCC[C@@H](C(=O)Nc2ccccc2)C1)NCc1ccccc1Cl ZINC000012882788 221241707 /nfs/dbraw/zinc/24/17/07/221241707.db2.gz DWVZSBHBCXSGGR-QGZVFWFLSA-N 0 1 385.895 3.307 10 0 GGAEMN COc1ccc([C@@H](C)NCC(=O)Nc2ccccc2C(=O)NC2CC2)cc1F ZINC000012895206 221242352 /nfs/dbraw/zinc/24/23/52/221242352.db2.gz JPBUVMRDOQZTNM-CYBMUJFWSA-N 0 1 385.439 3.016 10 0 GGAEMN Cc1nc(-c2ccc(CN[C@@H](C)C(=O)Nc3ccc(C(N)=O)cc3)cc2)cs1 ZINC000012945549 221249427 /nfs/dbraw/zinc/24/94/27/221249427.db2.gz KKRVIOINPDYOEQ-ZDUSSCGKSA-N 0 1 394.500 3.334 10 0 GGAEMN CC[C@H](C)NC(=O)c1ccc2c(c1)n1c(=S)[nH]nc1n(CCC(C)C)c2=O ZINC000013363176 221266892 /nfs/dbraw/zinc/26/68/92/221266892.db2.gz PZKUPTNMKSDINX-LBPRGKRZSA-N 0 1 387.509 3.281 10 0 GGAEMN CCOC(=O)C1=C(NS(=O)(=O)c2ccccc2)Nc2ccccc2N=C1CC ZINC000013095622 221260343 /nfs/dbraw/zinc/26/03/43/221260343.db2.gz SSJSPVTYUGKKLX-UHFFFAOYSA-N 0 1 399.472 3.348 10 0 GGAEMN CC1(C)Cc2nc(N3CCC(O)CC3)ncc2[C@@H](NCc2cccc(F)c2)C1 ZINC000014967227 221321526 /nfs/dbraw/zinc/32/15/26/221321526.db2.gz WQUIVCNKMFYZMB-IBGZPJMESA-N 0 1 384.499 3.380 10 0 GGAEMN CN(C[C@@H]1COc2ccccc2O1)C(=O)C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000015291770 221334304 /nfs/dbraw/zinc/33/43/04/221334304.db2.gz PCXQMOCMSIGFOQ-UYAOXDASSA-N 0 1 380.488 3.294 10 0 GGAEMN CN(C[C@@H]1COc2ccccc2O1)C(=O)CN(C)[C@@H]1CCCc2ccccc21 ZINC000015291770 221334306 /nfs/dbraw/zinc/33/43/06/221334306.db2.gz PCXQMOCMSIGFOQ-UYAOXDASSA-N 0 1 380.488 3.294 10 0 GGAEMN O=C(NCc1ccccc1)[C@@H]1Cc2nc[nH]c2CN1Cc1ccc(Cl)cc1 ZINC000015676220 221340554 /nfs/dbraw/zinc/34/05/54/221340554.db2.gz DPFWLKXCLDWLLM-FQEVSTJZSA-N 0 1 380.879 3.306 10 0 biogenic GGAEMN CCOC(=O)c1c(C)oc2nc(C)nc(N3CCN(Cc4ccccc4)CC3)c21 ZINC000015727387 221341136 /nfs/dbraw/zinc/34/11/36/221341136.db2.gz WURKZPCFGOCCTN-UHFFFAOYSA-N 0 1 394.475 3.339 10 0 GGAEMN CC(C)Cc1nn2c(nc(CSc3nc(-c4ccccc4)n[nH]3)cc2=O)s1 ZINC000015731851 221342069 /nfs/dbraw/zinc/34/20/69/221342069.db2.gz XOITZGJBEYRQCB-UHFFFAOYSA-N 0 1 398.517 3.427 10 0 GGAEMN CCc1nn2c(nc(CSc3nc(-c4ccccc4C)n[nH]3)cc2=O)s1 ZINC000015731840 221342095 /nfs/dbraw/zinc/34/20/95/221342095.db2.gz BMCUYLSBHCBLST-UHFFFAOYSA-N 0 1 384.490 3.099 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)C[C@@H](C)S2 ZINC000015730550 221342232 /nfs/dbraw/zinc/34/22/32/221342232.db2.gz IFZBJJFYYBVDCO-LLVKDONJSA-N 0 1 378.475 3.319 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@H](C)CS2 ZINC000015730809 221342637 /nfs/dbraw/zinc/34/26/37/221342637.db2.gz UKFHYXOGGCSZIS-GFCCVEGCSA-N 0 1 392.502 3.485 10 0 GGAEMN CCCN1CCN(c2ncc3c(n2)CCN(Cc2ccc(Cl)cc2)C3)CC1 ZINC000015779549 221344836 /nfs/dbraw/zinc/34/48/36/221344836.db2.gz IHDJPQPRBSFNLW-UHFFFAOYSA-N 0 1 385.943 3.220 10 0 GGAEMN C[C@H](CC(=O)NCCC1=CCCCC1)CC1=Nc2ccccc2S(=O)(=O)N1 ZINC000015826815 221346741 /nfs/dbraw/zinc/34/67/41/221346741.db2.gz YUUBMEHDHCHPNO-HNNXBMFYSA-N 0 1 389.521 3.432 10 0 GGAEMN COc1cn(CC(=O)Nc2ccc(Cl)cc2)c(CN2CCCCC2)cc1=O ZINC000016974387 221374652 /nfs/dbraw/zinc/37/46/52/221374652.db2.gz VQASVENIXZVEOA-UHFFFAOYSA-N 0 1 389.883 3.135 10 0 GGAEMN Clc1ccc2nc(N3CCN(Cc4ccccc4)CC3)c3nncn3c2c1 ZINC000058070727 136154326 /nfs/dbraw/zinc/15/43/26/136154326.db2.gz XSCKIRLIBXKGTR-UHFFFAOYSA-N 0 1 378.867 3.253 10 0 GGAEMN CCCCN1CCN(Cc2nc(-c3ccc(N4CCCCC4)nc3)no2)CC1 ZINC000065216004 136160125 /nfs/dbraw/zinc/16/01/25/136160125.db2.gz FRAMQEUDWNMYHO-UHFFFAOYSA-N 0 1 384.528 3.040 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)c3ncoc3-c3ccccc3Cl)nc2)CC1 ZINC000095961509 136182819 /nfs/dbraw/zinc/18/28/19/136182819.db2.gz XIONOPQSBCIQPR-UHFFFAOYSA-N 0 1 397.866 3.394 10 0 GGAEMN CN(CCN1C(=O)COc2ccc(Br)cc21)Cc1ccsc1 ZINC000095995295 136183053 /nfs/dbraw/zinc/18/30/53/136183053.db2.gz DNVVMTKCFNYZFJ-UHFFFAOYSA-N 0 1 381.295 3.368 10 0 GGAEMN Oc1cccc(N2CCN(C[C@@H](O)COc3cccc4ccccc43)CC2)c1 ZINC000153773514 136192462 /nfs/dbraw/zinc/19/24/62/136192462.db2.gz LLXIHMMXHLPBCW-OAQYLSRUSA-N 0 1 378.472 3.107 10 0 GGAEMN CC(C)OC[C@@H](O)CN(Cc1ccccc1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036146441 221845577 /nfs/dbraw/zinc/84/55/77/221845577.db2.gz ZQETZVZWMILIOS-VXKWHMMOSA-N 0 1 382.504 3.468 10 0 GGAEMN O=C(c1ccc(NS(=O)(=O)c2cccc3cnccc32)cc1)N1CCCC1 ZINC000055581152 222023490 /nfs/dbraw/zinc/02/34/90/222023490.db2.gz CYEQOTAWKPHYBO-UHFFFAOYSA-N 0 1 381.457 3.272 10 0 GGAEMN Cc1cccc(C(=O)N(CCC(=O)N2CCNCC2)Cc2cccc(Cl)c2)c1 ZINC000045966943 221967435 /nfs/dbraw/zinc/96/74/35/221967435.db2.gz MVYLSFGYABBXBC-UHFFFAOYSA-N 0 1 399.922 3.113 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc2cc(Br)ccc2o1 ZINC000053450235 222010970 /nfs/dbraw/zinc/01/09/70/222010970.db2.gz DMHKFYVAIJCFKC-UHFFFAOYSA-N 0 1 381.270 3.038 10 0 GGAEMN CCc1noc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2cccc(OC)c2)n1 ZINC000065194553 222108087 /nfs/dbraw/zinc/10/80/87/222108087.db2.gz LEOMIGBHSLUUDP-UHFFFAOYSA-N 0 1 390.465 3.064 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2c(C)n(C)c(C)c2-c2nnc(C)o2)cc1 ZINC000065194073 222108268 /nfs/dbraw/zinc/10/82/68/222108268.db2.gz DEFXSXHNSKLPNP-UHFFFAOYSA-N 0 1 390.465 3.200 10 0 GGAEMN CC(=O)c1cccc(NS(=O)(=O)c2c(C)n(C)c(C)c2-c2nnc(C)o2)c1 ZINC000065194091 222108446 /nfs/dbraw/zinc/10/84/46/222108446.db2.gz WWCAIOGMDXGEDL-UHFFFAOYSA-N 0 1 388.449 3.004 10 0 GGAEMN CCc1nnc(-c2c(C)c(S(=O)(=O)Nc3ccc(F)c(F)c3)c(C)n2C)o1 ZINC000065186521 222108972 /nfs/dbraw/zinc/10/89/72/222108972.db2.gz PTXRZLRIXNZHQL-UHFFFAOYSA-N 0 1 396.419 3.333 10 0 GGAEMN CC(C)CN1CCN(Cc2nc(-c3ccc(N4CCCCCC4)nc3)no2)CC1 ZINC000065216278 222111399 /nfs/dbraw/zinc/11/13/99/222111399.db2.gz YPBGDZRTVXEOIA-UHFFFAOYSA-N 0 1 398.555 3.286 10 0 GGAEMN O=C(Nc1ccc(-c2nccs2)cc1)N1CCC(CN2CCOCC2)CC1 ZINC000058112638 222039800 /nfs/dbraw/zinc/03/98/00/222039800.db2.gz KCVYZILOAIPLQR-UHFFFAOYSA-N 0 1 386.521 3.386 10 0 GGAEMN O=C(CN1CCC[C@@H]1CN1CCc2ccccc21)N[C@@H]1CCOc2ccccc21 ZINC000058324531 222049385 /nfs/dbraw/zinc/04/93/85/222049385.db2.gz KILZVJZPCBVPPH-TZIWHRDSSA-N 0 1 391.515 3.154 10 0 GGAEMN Cc1c[nH]c(=O)n1-c1cccc(NC(=O)c2ccc3c(=O)[nH]c(=S)[nH]c3c2)c1 ZINC000064054138 222068912 /nfs/dbraw/zinc/06/89/12/222068912.db2.gz NLIPWBNRKJYBQZ-UHFFFAOYSA-N 0 1 393.428 3.038 10 0 GGAEMN CC(C)Cc1ccc(S(=O)(=O)NCCc2nnc(-c3ccccc3)[nH]2)cc1 ZINC000064969471 222090634 /nfs/dbraw/zinc/09/06/34/222090634.db2.gz ZOSFBDGCXQYNET-UHFFFAOYSA-N 0 1 384.505 3.191 10 0 GGAEMN Cc1cccc(Cc2nc(CCNS(=O)(=O)c3c(C)cc(C)cc3C)n[nH]2)c1 ZINC000064969812 222090804 /nfs/dbraw/zinc/09/08/04/222090804.db2.gz GXOJAYADOBQXLN-UHFFFAOYSA-N 0 1 398.532 3.150 10 0 GGAEMN COc1ccc(-c2cc(C(=O)NCCc3nnc(-c4ccccc4)[nH]3)no2)cc1 ZINC000064969247 222091320 /nfs/dbraw/zinc/09/13/20/222091320.db2.gz ZJTUMTZXOIUADG-UHFFFAOYSA-N 0 1 389.415 3.108 10 0 GGAEMN COc1cc(-c2ccno2)ccc1S(=O)(=O)Nc1ccc(NC(C)=O)cc1 ZINC000064979594 222092432 /nfs/dbraw/zinc/09/24/32/222092432.db2.gz SRJWVEBMCWQOSM-UHFFFAOYSA-N 0 1 387.417 3.109 10 0 GGAEMN CCCn1cc(S(=O)(=O)Nc2cc(OC)cc(OC)c2)c2cccnc21 ZINC000065242240 222114484 /nfs/dbraw/zinc/11/44/84/222114484.db2.gz DAQQGIJHCWWWSK-UHFFFAOYSA-N 0 1 375.450 3.264 10 0 GGAEMN Cc1ccc2[nH]c(=O)c(CCC(=O)NCCN3CCc4ccccc4C3)cc2c1 ZINC000065245494 222114751 /nfs/dbraw/zinc/11/47/51/222114751.db2.gz XICMNBBERAINBY-UHFFFAOYSA-N 0 1 389.499 3.356 10 0 GGAEMN COc1cccc(CNC(=O)c2cc(C)cc(Br)c2O)c1OC ZINC000065622621 222134831 /nfs/dbraw/zinc/13/48/31/222134831.db2.gz HGSRCVPUEUVHEE-UHFFFAOYSA-N 0 1 380.238 3.410 10 0 GGAEMN COc1ccc(-c2n[nH]c(SCc3nnc(SC)s3)n2)c(OC)c1 ZINC000065694222 222135838 /nfs/dbraw/zinc/13/58/38/222135838.db2.gz YMOKNAWBTOVRQW-UHFFFAOYSA-N 0 1 381.508 3.355 10 0 GGAEMN CCC(CC)NC(=O)[C@H]1C[C@@](CC)(C(=O)[O-])[N@@H+](C)[C@H]1c1ccc(OC)cc1 ZINC000067648860 222151651 /nfs/dbraw/zinc/15/16/51/222151651.db2.gz FDZPCEOKWMPJNP-WFXMLNOXSA-N 0 1 376.497 3.226 10 0 GGAEMN CC[C@@]1(C(=O)[O-])C[C@H](C(=O)N2CCCCCC2)[C@H](c2ccc(OC)cc2)[N@H+]1C ZINC000067955457 222168545 /nfs/dbraw/zinc/16/85/45/222168545.db2.gz BGPYIEZFSZXZCM-IPJJNNNSSA-N 0 1 388.508 3.324 10 0 GGAEMN CCCC1(NC(=O)[C@H]2C[C@@](CC)(C(=O)[O-])[N@@H+](C)[C@H]2c2ccc(OC)cc2)CC1 ZINC000067967340 222169876 /nfs/dbraw/zinc/16/98/76/222169876.db2.gz VVKHKFDWBRHOPO-SPEDKVCISA-N 0 1 388.508 3.370 10 0 GGAEMN CC(C)(NC(=O)NC[C@@H](c1ccco1)N1CCCC1)c1ccc2c(c1)OCCO2 ZINC000069384386 222172743 /nfs/dbraw/zinc/17/27/43/222172743.db2.gz JZUGGMSOKINEII-KRWDZBQOSA-N 0 1 399.491 3.422 10 0 GGAEMN CCCC(=O)Nc1cccc(CNC(=O)c2c[n-]c3[nH+]c(C)ccc3c2=O)c1 ZINC000071960981 222200799 /nfs/dbraw/zinc/20/07/99/222200799.db2.gz BCILXJXGBFTOED-UHFFFAOYSA-N 0 1 378.432 3.312 10 0 GGAEMN O=S(=O)(NCc1ccco1)c1ccc(-c2cc(C(F)(F)F)n[nH]2)s1 ZINC000085664645 222325836 /nfs/dbraw/zinc/32/58/36/222325836.db2.gz LJVDSIVETNKWEI-UHFFFAOYSA-N 0 1 377.369 3.229 10 0 GGAEMN O[C@@H](Cc1ccccc1)CN1CCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000088613734 222326662 /nfs/dbraw/zinc/32/66/62/222326662.db2.gz SMNIMGQUBCGGSD-FQEVSTJZSA-N 0 1 378.438 3.427 10 0 GGAEMN O[C@H](Cc1ccccc1)CN1CCN(Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000088613735 222326726 /nfs/dbraw/zinc/32/67/26/222326726.db2.gz SMNIMGQUBCGGSD-HXUWFJFHSA-N 0 1 378.438 3.427 10 0 GGAEMN O=C(NC[C@@H](c1ccco1)N1CCCC1)[C@@H]1CCCN1C(=O)C1CCCCC1 ZINC000084429541 222316253 /nfs/dbraw/zinc/31/62/53/222316253.db2.gz QQYXVBUNTMCGOP-OALUTQOASA-N 0 1 387.524 3.104 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1cc(F)ccc1I ZINC000095940280 222361433 /nfs/dbraw/zinc/36/14/33/222361433.db2.gz WBTPBBQFYONWOW-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1cc(F)ccc1I ZINC000095940280 222361437 /nfs/dbraw/zinc/36/14/37/222361437.db2.gz WBTPBBQFYONWOW-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN COc1ccc(CN2c3ccccc3O[C@H]3C[C@@H](C2=O)N(CC2CC2)C3)cc1 ZINC000096111880 222381509 /nfs/dbraw/zinc/38/15/09/222381509.db2.gz WIXREULYZRMGJR-FPOVZHCZSA-N 0 1 378.472 3.474 10 0 biogenic GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2cccc(C(C)=O)c2)n1 ZINC000096379795 222416692 /nfs/dbraw/zinc/41/66/92/222416692.db2.gz FZFAYYPJQWPZDT-UHFFFAOYSA-N 0 1 388.449 3.247 10 0 GGAEMN CN1CCN(Cc2nc3ccccc3n2Cc2nc3cc(Cl)ccc3[nH]2)CC1 ZINC000073636127 523913488 /nfs/dbraw/zinc/91/34/88/523913488.db2.gz RKFJPMOFFVTOAM-UHFFFAOYSA-N 0 1 394.910 3.362 10 0 GGAEMN Cc1cc(-n2nnc(C[N@H+]3CCC[C@@H](C(=O)[O-])C3)c2-c2ccncc2)ccc1F ZINC000057345524 526081349 /nfs/dbraw/zinc/08/13/49/526081349.db2.gz VCPLNLIMCRBMGH-MRXNPFEDSA-N 0 1 395.438 3.073 10 0 GGAEMN C[C@@H](NC[C@H]1CN(C)CCO1)c1ccc(Br)cc1Br ZINC000097996897 564911725 /nfs/dbraw/zinc/91/17/25/564911725.db2.gz MCLNXQFCCWIQIU-PWSUYJOCSA-N 0 1 392.135 3.193 10 0 GGAEMN C[C@H](Cn1cccn1)NCc1cc(Cl)ccc1I ZINC000405195459 565585736 /nfs/dbraw/zinc/58/57/36/565585736.db2.gz BIDWXELELVZMJQ-SNVBAGLBSA-N 0 1 375.641 3.319 10 0 GGAEMN C[C@@H]1CN(C2CCN(C(=O)/C=C/c3csc(Br)c3)CC2)CCO1 ZINC000116196157 564205450 /nfs/dbraw/zinc/20/54/50/564205450.db2.gz OYCKIDAKDFTYPL-YWVDXFKGSA-N 0 1 399.354 3.236 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccc(Br)o1 ZINC000116246962 564206179 /nfs/dbraw/zinc/20/61/79/564206179.db2.gz XNWJQHPRVQUCQH-OCCSQVGLSA-N 0 1 378.270 3.078 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccc(Br)cc1 ZINC000116248235 564206271 /nfs/dbraw/zinc/20/62/71/564206271.db2.gz NRHDLDSVOUUIAY-KDOFPFPSSA-N 0 1 388.309 3.485 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1nc(Cl)ccc1Cl ZINC000116248964 564206463 /nfs/dbraw/zinc/20/64/63/564206463.db2.gz HOHKIEURMVTEJJ-WFASDCNBSA-N 0 1 379.291 3.424 10 0 GGAEMN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN1CC[C@@H](c2cnn(C)c2)C1 ZINC000116319370 564207112 /nfs/dbraw/zinc/20/71/12/564207112.db2.gz LAJUAZFIAPMNKG-CQSZACIVSA-N 0 1 381.307 3.175 10 0 GGAEMN CC[C@H](Cc1cccc(Br)c1)C(=O)NCCCCN1CCOCC1 ZINC000117238669 564224663 /nfs/dbraw/zinc/22/46/63/564224663.db2.gz OOEBPDHGACUNAG-QGZVFWFLSA-N 0 1 397.357 3.246 10 0 GGAEMN CCOc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2 ZINC000006779309 564226909 /nfs/dbraw/zinc/22/69/09/564226909.db2.gz VNMHYGMPOJTQQF-LLVKDONJSA-N 0 1 378.475 3.319 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2ccc(F)cc2Br)CCN1CCOC ZINC000117444662 564227591 /nfs/dbraw/zinc/22/75/91/564227591.db2.gz BPEGQCKOLJVVEO-ZDUSSCGKSA-N 0 1 388.281 3.163 10 0 GGAEMN Cc1csc2nc(C)c(S(=O)(=O)Nc3ccc(C)cc3Cl)c(=O)n12 ZINC000006823576 564228354 /nfs/dbraw/zinc/22/83/54/564228354.db2.gz JKXZXCCINIJMDZ-UHFFFAOYSA-N 0 1 383.882 3.135 10 0 GGAEMN CC1CCN(C(=S)SCC(=O)Nc2cccc(-c3nnc[nH]3)c2)CC1 ZINC000117669665 564230324 /nfs/dbraw/zinc/23/03/24/564230324.db2.gz NNDJVOPWEFPWBB-UHFFFAOYSA-N 0 1 375.523 3.160 10 0 GGAEMN O=S(=O)(Nc1cccc(-c2nc[nH]n2)c1)c1ccc(F)cc1Br ZINC000117739687 564231176 /nfs/dbraw/zinc/23/11/76/564231176.db2.gz MPIVCZPNCKNPFG-UHFFFAOYSA-N 0 1 397.229 3.174 10 0 GGAEMN CCCS(=O)(=O)NC[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000117932120 564234539 /nfs/dbraw/zinc/23/45/39/564234539.db2.gz NNVCZMCAOGFAJB-GOEBONIOSA-N 0 1 378.460 3.418 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2ccc(Br)cc2Cl)[nH]n1 ZINC000119315270 564265135 /nfs/dbraw/zinc/26/51/35/564265135.db2.gz CWHLTKXZMYKOGD-UHFFFAOYSA-N 0 1 380.633 3.478 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)C2(c3cccc(Br)c3)CC2)[nH]n1 ZINC000119324809 564266342 /nfs/dbraw/zinc/26/63/42/564266342.db2.gz HJUXWLQYODVANP-UHFFFAOYSA-N 0 1 386.253 3.243 10 0 GGAEMN O=C(NCCSc1ccc(Br)cc1)c1ccc2[nH]nnc2c1 ZINC000012548028 564268215 /nfs/dbraw/zinc/26/82/15/564268215.db2.gz QSPNAPUZUDWADL-UHFFFAOYSA-N 0 1 377.267 3.243 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cc(Br)ccc2Cl)[nH]n1 ZINC000119426195 564270250 /nfs/dbraw/zinc/27/02/50/564270250.db2.gz XLEHSOJYNUIBOU-UHFFFAOYSA-N 0 1 380.633 3.478 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)C(C)(C)c2ccc(Br)cc2)[nH]n1 ZINC000119433560 564271071 /nfs/dbraw/zinc/27/10/71/564271071.db2.gz UENPMYXNQGDOLV-UHFFFAOYSA-N 0 1 388.269 3.489 10 0 GGAEMN Cc1cc(C(=O)N2CCC(N3CCO[C@H](C)C3)CC2)ccc1Br ZINC000119636461 564280282 /nfs/dbraw/zinc/28/02/82/564280282.db2.gz AUEWBSXICCAYBF-CQSZACIVSA-N 0 1 381.314 3.083 10 0 GGAEMN Cc1cc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)ccn1 ZINC000119625192 564280304 /nfs/dbraw/zinc/28/03/04/564280304.db2.gz PMCRMPJFHPJWRR-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1cc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)ccn1 ZINC000119625192 564280305 /nfs/dbraw/zinc/28/03/05/564280305.db2.gz PMCRMPJFHPJWRR-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNCc3cccc4c3OCO4)n2)cc1 ZINC000119739763 564285833 /nfs/dbraw/zinc/28/58/33/564285833.db2.gz USOJJBXHCUHMCA-UHFFFAOYSA-N 0 1 387.237 3.253 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000119763447 564287111 /nfs/dbraw/zinc/28/71/11/564287111.db2.gz UIZSZGWMTWWZEM-LLVKDONJSA-N 0 1 386.279 3.318 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@H](O)COc1cccc(Cl)c1Cl ZINC000119763297 564287341 /nfs/dbraw/zinc/28/73/41/564287341.db2.gz UIZSZGWMTWWZEM-NSHDSACASA-N 0 1 386.279 3.318 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)Cc2c[nH]c3cc(Br)ccc23)[nH]n1 ZINC000119778531 564288149 /nfs/dbraw/zinc/28/81/49/564288149.db2.gz ZMGCECPQSZTDOO-UHFFFAOYSA-N 0 1 399.252 3.235 10 0 GGAEMN Cc1cc(NC(=O)N2CCC(CN3CCOCC3)CC2)ccc1Br ZINC000020532074 564306909 /nfs/dbraw/zinc/30/69/09/564306909.db2.gz JIGJVPNLSHGQRH-UHFFFAOYSA-N 0 1 396.329 3.334 10 0 GGAEMN CC(C)Cc1nc(SCc2cc(=O)n3c4c(sc3n2)CCCC4)n[nH]1 ZINC000020982822 564307848 /nfs/dbraw/zinc/30/78/48/564307848.db2.gz BLXKYWZDYWFCDW-UHFFFAOYSA-N 0 1 375.523 3.244 10 0 GGAEMN CC(C)Cc1n[nH]c(SCc2cc(=O)n3c4c(sc3n2)CCCC4)n1 ZINC000020982822 564307849 /nfs/dbraw/zinc/30/78/49/564307849.db2.gz BLXKYWZDYWFCDW-UHFFFAOYSA-N 0 1 375.523 3.244 10 0 GGAEMN COC(=O)c1cc(-c2ccc(S(=O)(=O)Nc3ccccc3F)s2)on1 ZINC000021540616 564310908 /nfs/dbraw/zinc/31/09/08/564310908.db2.gz UKYQIHOTBZEOGP-UHFFFAOYSA-N 0 1 382.394 3.130 10 0 GGAEMN C[C@H](NC(=O)NCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccc(Br)c1 ZINC000120484555 564322068 /nfs/dbraw/zinc/32/20/68/564322068.db2.gz OIUDCXTYNLGYMK-ZNMIVQPWSA-N 0 1 398.345 3.309 10 0 GGAEMN C[C@H]1CCCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000120521450 564324080 /nfs/dbraw/zinc/32/40/80/564324080.db2.gz REFBMFREWYAQBS-NSHDSACASA-N 0 1 378.274 3.176 10 0 GGAEMN C[C@H]1CCCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000120521450 564324083 /nfs/dbraw/zinc/32/40/83/564324083.db2.gz REFBMFREWYAQBS-NSHDSACASA-N 0 1 378.274 3.176 10 0 GGAEMN CC[C@@H](C)CN(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120523084 564324211 /nfs/dbraw/zinc/32/42/11/564324211.db2.gz WIAOOLDELRZNNK-LLVKDONJSA-N 0 1 380.290 3.422 10 0 GGAEMN CC[C@@H](C)CN(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120523084 564324213 /nfs/dbraw/zinc/32/42/13/564324213.db2.gz WIAOOLDELRZNNK-LLVKDONJSA-N 0 1 380.290 3.422 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H](C)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000023763979 564327719 /nfs/dbraw/zinc/32/77/19/564327719.db2.gz DPEQBZUUTJIFKC-SNVBAGLBSA-N 0 1 386.880 3.325 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NC3CC3)cc2)c(Cl)cc1F ZINC000120695557 564333001 /nfs/dbraw/zinc/33/30/01/564333001.db2.gz MQYVBMBMGKGHDT-UHFFFAOYSA-N 0 1 382.844 3.481 10 0 GGAEMN CSCCCCC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120741114 564334396 /nfs/dbraw/zinc/33/43/96/564334396.db2.gz OOIJTAQEITZFLR-UHFFFAOYSA-N 0 1 383.315 3.384 10 0 GGAEMN CSCCCCC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120741114 564334399 /nfs/dbraw/zinc/33/43/99/564334399.db2.gz OOIJTAQEITZFLR-UHFFFAOYSA-N 0 1 383.315 3.384 10 0 GGAEMN COC(=O)[C@@H](c1cccc(Br)c1)N1CCC(c2ccn[nH]2)CC1 ZINC000120772276 564336994 /nfs/dbraw/zinc/33/69/94/564336994.db2.gz WEYDHZBKGBIDBW-MRXNPFEDSA-N 0 1 378.270 3.266 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(-c3nnnn3C3CC3)cc2)c(C)s1 ZINC000026538381 564347383 /nfs/dbraw/zinc/34/73/83/564347383.db2.gz CMYVFWZYRWMZPN-UHFFFAOYSA-N 0 1 375.479 3.154 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC[C@H](C)Oc2ccccc2Br)n[nH]1 ZINC000121162611 564357019 /nfs/dbraw/zinc/35/70/19/564357019.db2.gz NZJRYJZICXUBBN-AAEUAGOBSA-N 0 1 395.301 3.178 10 0 GGAEMN COc1cc(NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc(OC)c1Br ZINC000121212190 564360189 /nfs/dbraw/zinc/36/01/89/564360189.db2.gz LZGDMDFNEGALGU-SECBINFHSA-N 0 1 397.273 3.251 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)cc2C)c(Cl)cc1F ZINC000121585311 564375902 /nfs/dbraw/zinc/37/59/02/564375902.db2.gz GVEUPJDIRHOGGZ-UHFFFAOYSA-N 0 1 391.873 3.300 10 0 GGAEMN Brc1ccc(N2CCN(Cc3ccc(-n4cccn4)cc3)CC2)nc1 ZINC000030201637 564377094 /nfs/dbraw/zinc/37/70/94/564377094.db2.gz YSMJDNUBANIVKT-UHFFFAOYSA-N 0 1 398.308 3.352 10 0 GGAEMN Brc1ccccc1-c1nnc(CN2CCCC[C@@H]2c2nnc[nH]2)o1 ZINC000121636423 564379062 /nfs/dbraw/zinc/37/90/62/564379062.db2.gz UCNKUULAOUCLHR-CYBMUJFWSA-N 0 1 389.257 3.344 10 0 GGAEMN CCn1cc(CN2CCCN(Cc3cc(O)ccc3Br)CC2)cn1 ZINC000121642034 564379951 /nfs/dbraw/zinc/37/99/51/564379951.db2.gz NAWFVFOFWXOWCA-UHFFFAOYSA-N 0 1 393.329 3.079 10 0 GGAEMN COc1ccc(CN2CCCC[C@@H]2c2nnc[nH]2)c(Br)c1OC ZINC000121740929 564384598 /nfs/dbraw/zinc/38/45/98/564384598.db2.gz HRACTYURZBWMHZ-GFCCVEGCSA-N 0 1 381.274 3.312 10 0 GGAEMN COC(=O)c1coc(C(=O)Nc2nnc(SCc3ccccc3)s2)c1 ZINC000544692106 564394484 /nfs/dbraw/zinc/39/44/84/564394484.db2.gz JCWLZANKPRERIC-UHFFFAOYSA-N 0 1 375.431 3.462 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)COc2ccccc2Br)ccc1F ZINC000122089281 564399285 /nfs/dbraw/zinc/39/92/85/564399285.db2.gz ZPMWDENCAMONJC-UHFFFAOYSA-N 0 1 395.272 3.345 10 0 GGAEMN CC[C@@H](CO)N1CCN(CCSc2ccnc3cc(Cl)ccc32)CC1 ZINC000122107316 564400614 /nfs/dbraw/zinc/40/06/14/564400614.db2.gz IHNYRYDCYKNQDM-INIZCTEOSA-N 0 1 379.957 3.369 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)Cc2ccc(F)c(Br)c2)n[nH]1 ZINC000122160674 564402012 /nfs/dbraw/zinc/40/20/12/564402012.db2.gz YJYQFEWKRWVSEL-QWRGUYRKSA-N 0 1 397.292 3.481 10 0 GGAEMN C[C@@H](CC(=O)N1CC[C@H](CN2CCOCC2)C1)c1ccc(Br)cc1 ZINC000122294857 564407632 /nfs/dbraw/zinc/40/76/32/564407632.db2.gz WEALHKUQYJNIMU-JKSUJKDBSA-N 0 1 395.341 3.123 10 0 GGAEMN C[C@@H](CC(=O)N1CC[C@@H](CN2CCOCC2)C1)c1ccc(Br)cc1 ZINC000122295289 564408065 /nfs/dbraw/zinc/40/80/65/564408065.db2.gz WEALHKUQYJNIMU-HOTGVXAUSA-N 0 1 395.341 3.123 10 0 GGAEMN CCn1c2ccc(NS(=O)(=O)c3cc(Cl)ccc3OC)cc2oc1=O ZINC000033048741 564409926 /nfs/dbraw/zinc/40/99/26/564409926.db2.gz BDUUUJSCUAQEFL-UHFFFAOYSA-N 0 1 382.825 3.077 10 0 GGAEMN Cc1sc(Br)cc1S(=O)(=O)Nc1ccc(N(C)C)nc1 ZINC000122379571 564412249 /nfs/dbraw/zinc/41/22/49/564412249.db2.gz WAQJQDKVXGWJPL-UHFFFAOYSA-N 0 1 376.301 3.081 10 0 GGAEMN C[C@H](NCCC(=O)N(C)C)c1ccc(Br)cc1Br ZINC000041653403 564435753 /nfs/dbraw/zinc/43/57/53/564435753.db2.gz SHISTSDHPRFHSI-VIFPVBQESA-N 0 1 378.108 3.341 10 0 GGAEMN C[C@H](NCc1csc(Br)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000036954938 564419657 /nfs/dbraw/zinc/41/96/57/564419657.db2.gz FPRLLQWIMDKLOL-VIFPVBQESA-N 0 1 375.313 3.009 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)CCc2cc(Br)ccc2F)[nH]n1 ZINC000123297369 564444086 /nfs/dbraw/zinc/44/40/86/564444086.db2.gz COQHBHRMUGGTQK-UHFFFAOYSA-N 0 1 392.232 3.283 10 0 GGAEMN C[C@@H]1C[C@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)CCN1C ZINC000123440181 564449061 /nfs/dbraw/zinc/44/90/61/564449061.db2.gz OPHMSWANQMJLNS-TZMCWYRMSA-N 0 1 379.353 3.182 10 0 GGAEMN O=C(NCc1ccc(Cl)cc1Cl)N1CCC(CN2CCOCC2)CC1 ZINC000042997044 564451598 /nfs/dbraw/zinc/45/15/98/564451598.db2.gz VHFQSBQFFFKYCC-UHFFFAOYSA-N 0 1 386.323 3.247 10 0 GGAEMN CCSc1cc(Cl)ccc1C(=O)N1CCO[C@@H](c2n[nH]c(CC)n2)C1 ZINC000123692978 564458305 /nfs/dbraw/zinc/45/83/05/564458305.db2.gz YWBXANMDDAPWIZ-CYBMUJFWSA-N 0 1 380.901 3.346 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(Br)cc3)cc21 ZINC000123973412 564467314 /nfs/dbraw/zinc/46/73/14/564467314.db2.gz WFUNVDCHIIBBGZ-QWHCGFSZSA-N 0 1 399.248 3.167 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(Br)cc3)cc21 ZINC000123973201 564467375 /nfs/dbraw/zinc/46/73/75/564467375.db2.gz WFUNVDCHIIBBGZ-OLZOCXBDSA-N 0 1 399.248 3.167 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(Br)c3)cc21 ZINC000124078874 564471526 /nfs/dbraw/zinc/47/15/26/564471526.db2.gz QFZIILLGNZYRCW-QWHCGFSZSA-N 0 1 399.248 3.167 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C[C@@H](C)O ZINC000124135249 564472218 /nfs/dbraw/zinc/47/22/18/564472218.db2.gz QMCKFNLPWJURME-DGCLKSJQSA-N 0 1 378.822 3.276 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C[C@@H](C)O ZINC000124135436 564472382 /nfs/dbraw/zinc/47/23/82/564472382.db2.gz QMCKFNLPWJURME-YPMHNXCESA-N 0 1 378.822 3.276 10 0 GGAEMN CC[N@H+]1CCC[C@H]1CN(C)C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000124194323 564474522 /nfs/dbraw/zinc/47/45/22/564474522.db2.gz NBSLGYYMXMASMW-HNNXBMFYSA-N 0 1 378.314 3.416 10 0 GGAEMN Cc1nc2ccc(Br)cn2c1C(=O)Nc1cc(C(F)(F)F)n[nH]1 ZINC000480501838 564475880 /nfs/dbraw/zinc/47/58/80/564475880.db2.gz OWHZZUWZIXXLRU-UHFFFAOYSA-N 0 1 388.147 3.399 10 0 GGAEMN Cc1cc(NC(=O)N2CCC(N3CCO[C@H](C)C3)CC2)ccc1Br ZINC000124267659 564476825 /nfs/dbraw/zinc/47/68/25/564476825.db2.gz HVWDKGQLMYGCTL-CQSZACIVSA-N 0 1 396.329 3.475 10 0 GGAEMN CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccc(O)c(Br)c1 ZINC000124331646 564478850 /nfs/dbraw/zinc/47/88/50/564478850.db2.gz KMELVXXVQBIRGO-CQSZACIVSA-N 0 1 384.318 3.074 10 0 GGAEMN C[C@@H](NCc1cc(Cl)ccc1OC(F)F)c1ccc(S(N)(=O)=O)cc1 ZINC000124423541 564481794 /nfs/dbraw/zinc/48/17/94/564481794.db2.gz TUUFJNVPUXBGKJ-SNVBAGLBSA-N 0 1 390.839 3.440 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3ccc(Br)c(Cl)c3)cc21 ZINC000124518741 564484935 /nfs/dbraw/zinc/48/49/35/564484935.db2.gz VMMVYGUULVYUGU-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N(C)CCc2ccc(Br)cc2)n[nH]1 ZINC000124660803 564489748 /nfs/dbraw/zinc/48/97/48/564489748.db2.gz JQOLZGAGFOITCP-LBPRGKRZSA-N 0 1 379.302 3.296 10 0 GGAEMN CN(Cc1ccc2c(c1)OCCO2)[C@H](CO)c1cccc(Br)c1 ZINC000125758363 564525670 /nfs/dbraw/zinc/52/56/70/564525670.db2.gz MXXNZVFDYCGVRN-MRXNPFEDSA-N 0 1 378.266 3.386 10 0 GGAEMN COCC(=O)Nc1ccc(NC(=O)c2cc(C)cc(Br)c2O)cc1 ZINC000047827882 564526791 /nfs/dbraw/zinc/52/67/91/564526791.db2.gz LLOSINIVKFHDBF-UHFFFAOYSA-N 0 1 393.237 3.300 10 0 GGAEMN Cc1cc(Br)c(O)c(C(=O)Nc2cccc(NS(C)(=O)=O)c2)c1 ZINC000047827870 564527367 /nfs/dbraw/zinc/52/73/67/564527367.db2.gz PAWLZSZYDGIHMP-UHFFFAOYSA-N 0 1 399.266 3.087 10 0 GGAEMN CCOC(=O)[C@@H]1CC[C@H](NCc2cc(OC)c(OC)cc2Br)C1 ZINC000125826998 564527786 /nfs/dbraw/zinc/52/77/86/564527786.db2.gz QHHYCQHKCMRRDS-YPMHNXCESA-N 0 1 386.286 3.288 10 0 GGAEMN C[C@H](NCc1cccnc1-n1cncn1)c1ccc(Br)cc1F ZINC000125909327 564530772 /nfs/dbraw/zinc/53/07/72/564530772.db2.gz WPQQMVDWWWIPAF-NSHDSACASA-N 0 1 376.233 3.415 10 0 GGAEMN O=C(CCc1nc[nH]n1)Nc1nc(-c2sccc2Br)cs1 ZINC000125912266 564531322 /nfs/dbraw/zinc/53/13/22/564531322.db2.gz WHHZHRZQMLASFW-UHFFFAOYSA-N 0 1 384.284 3.324 10 0 GGAEMN CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(N3CCCC3)nc2)c1 ZINC000126170818 564538889 /nfs/dbraw/zinc/53/88/89/564538889.db2.gz RHSLIMCKUFIEAT-UHFFFAOYSA-N 0 1 379.869 3.339 10 0 GGAEMN C[C@@H](N[C@H](C)c1cccc(Cl)c1)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000126215248 564541182 /nfs/dbraw/zinc/54/11/82/564541182.db2.gz YCGIMYRVGIUOJP-CHWSQXEVSA-N 0 1 380.897 3.421 10 0 GGAEMN CN(C)C[C@H](NC(=O)C(=O)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000049379160 564551082 /nfs/dbraw/zinc/55/10/82/564551082.db2.gz NINKUNSKWXJCJN-INIZCTEOSA-N 0 1 380.275 3.351 10 0 GGAEMN CN1CCC[C@@H](NC(=O)CSCc2ccc(Br)cc2F)C1 ZINC000051377038 564563454 /nfs/dbraw/zinc/56/34/54/564563454.db2.gz JWTXMEAJHGVUGO-CYBMUJFWSA-N 0 1 375.307 3.032 10 0 GGAEMN Cc1csc(N2CCN(CCCc3nc(-c4cccs4)no3)CC2)n1 ZINC000051879872 564567070 /nfs/dbraw/zinc/56/70/70/564567070.db2.gz VUKXYNLJKUHSLP-UHFFFAOYSA-N 0 1 375.523 3.318 10 0 GGAEMN CC[C@@H]1CN(C(=O)C[C@@H](C)c2ccc(Br)cc2)CCN1C[C@@H](C)O ZINC000126953331 564568807 /nfs/dbraw/zinc/56/88/07/564568807.db2.gz LVVYDSMNKZIQEA-IIDMSEBBSA-N 0 1 397.357 3.246 10 0 GGAEMN Cc1cc(C(=O)N2[C@H](C)CN(C)C[C@H]2C)c2cc(Br)ccc2n1 ZINC000127235591 564578127 /nfs/dbraw/zinc/57/81/27/564578127.db2.gz XZLDNAIVYLJBQN-CHWSQXEVSA-N 0 1 376.298 3.470 10 0 GGAEMN Cc1noc([C@@H]2CCCN(C[C@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000052862385 564578561 /nfs/dbraw/zinc/57/85/61/564578561.db2.gz LZACBSRJCGZLES-OLZOCXBDSA-N 0 1 386.279 3.304 10 0 GGAEMN O[C@H](COC1CCOCC1)CN1CCC[C@@H]1c1ccc(Br)cc1 ZINC000127404582 564582674 /nfs/dbraw/zinc/58/26/74/564582674.db2.gz DLOWSNSHVQZJBL-FUHWJXTLSA-N 0 1 384.314 3.143 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2F)n[nH]1)Nc1nc2c(s1)CCC2 ZINC000053264902 564583890 /nfs/dbraw/zinc/58/38/90/564583890.db2.gz FEOSQVJFBKUWFD-UHFFFAOYSA-N 0 1 375.454 3.287 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@H]2CCC[C@@H]21 ZINC000053376285 564587156 /nfs/dbraw/zinc/58/71/56/564587156.db2.gz BTTLOZUAEJJCID-HOTGVXAUSA-N 0 1 376.254 3.233 10 0 GGAEMN Cc1noc(C2CCN(C[C@@H](O)COc3c(Cl)cccc3Cl)CC2)n1 ZINC000053640405 564592054 /nfs/dbraw/zinc/59/20/54/564592054.db2.gz YTFJAZCZMWAFCG-CYBMUJFWSA-N 0 1 386.279 3.304 10 0 GGAEMN O=C(N[C@@H]1CCOc2ccc(Br)cc21)N1CCN(CC2CC2)CC1 ZINC000054815308 564610310 /nfs/dbraw/zinc/61/03/10/564610310.db2.gz HRGJSAUSJCNDJL-MRXNPFEDSA-N 0 1 394.313 3.010 10 0 GGAEMN Cc1cc(C)c(Br)c(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c1 ZINC000128205893 564610367 /nfs/dbraw/zinc/61/03/67/564610367.db2.gz MWIOTHKYKGCVHQ-UHFFFAOYSA-N 0 1 387.237 3.293 10 0 GGAEMN CCCn1cc(CNCc2ccc(Br)cc2N2CCOCC2)cn1 ZINC000128338937 564615090 /nfs/dbraw/zinc/61/50/90/564615090.db2.gz OPRJJZFPGZGTMF-UHFFFAOYSA-N 0 1 393.329 3.182 10 0 GGAEMN Cn1cc([C@@H]2CCN(Cc3cc(Br)c4c(c3)OCCCO4)C2)cn1 ZINC000128359562 564616399 /nfs/dbraw/zinc/61/63/99/564616399.db2.gz FEUGKWHITBFXFC-CQSZACIVSA-N 0 1 392.297 3.333 10 0 GGAEMN O[C@]12CCCC[C@@H]1CN(Cc1cc3c(cc1Br)OCCO3)CC2 ZINC000128444492 564619397 /nfs/dbraw/zinc/61/93/97/564619397.db2.gz ZKEHRKSXEAXPPJ-KDOFPFPSSA-N 0 1 382.298 3.347 10 0 GGAEMN O[C@@]12CCCC[C@@H]1CN(Cc1cc3c(cc1Br)OCCO3)CC2 ZINC000128444245 564619440 /nfs/dbraw/zinc/61/94/40/564619440.db2.gz ZKEHRKSXEAXPPJ-RDTXWAMCSA-N 0 1 382.298 3.347 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)c(F)c2)cc1 ZINC000055619606 564626534 /nfs/dbraw/zinc/62/65/34/564626534.db2.gz XLYHSEMNSUJZOW-UHFFFAOYSA-N 0 1 377.846 3.074 10 0 GGAEMN C[C@@H](c1cccc(Br)c1)N1CCCN(Cc2cnn(C)c2)CC1 ZINC000128848312 564632217 /nfs/dbraw/zinc/63/22/17/564632217.db2.gz OVHRDKCZFGLQBT-HNNXBMFYSA-N 0 1 377.330 3.452 10 0 GGAEMN C[C@H](c1cccc(Br)c1)N1CCCN(Cc2cnn(C)c2)CC1 ZINC000128848564 564632432 /nfs/dbraw/zinc/63/24/32/564632432.db2.gz OVHRDKCZFGLQBT-OAHLLOKOSA-N 0 1 377.330 3.452 10 0 GGAEMN C[C@@H](C(=O)Nc1cccc(I)c1)N1CCCSCC1 ZINC000129352531 564646063 /nfs/dbraw/zinc/64/60/63/564646063.db2.gz YGEKICUAMTUQCR-NSHDSACASA-N 0 1 390.290 3.057 10 0 GGAEMN Cc1cc(CC(=O)NCc2ccc(Br)cc2C(F)(F)F)[nH]n1 ZINC000129435351 564648292 /nfs/dbraw/zinc/64/82/92/564648292.db2.gz QWWRPOGZBSQCTM-UHFFFAOYSA-N 0 1 376.176 3.358 10 0 GGAEMN Cc1nc([C@H](NC(=O)c2ccc(C)nc2Br)c2ccccc2)n[nH]1 ZINC000129524181 564651156 /nfs/dbraw/zinc/65/11/56/564651156.db2.gz VDDFQYVCYBRSDP-CQSZACIVSA-N 0 1 386.253 3.098 10 0 GGAEMN O=C(CSCc1ccc(Cl)cc1Cl)NCCCCN1CCOCC1 ZINC000056982208 564655401 /nfs/dbraw/zinc/65/54/01/564655401.db2.gz UBCSPDBVKCVRQG-UHFFFAOYSA-N 0 1 391.364 3.455 10 0 GGAEMN CC(C)Oc1cc(Br)ccc1C(=O)NCCCCN1CCOCC1 ZINC000057044847 564659019 /nfs/dbraw/zinc/65/90/19/564659019.db2.gz TUKKCBJTLHSNFU-UHFFFAOYSA-N 0 1 399.329 3.079 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1ccccc1N(C)C ZINC000129923937 564665201 /nfs/dbraw/zinc/66/52/01/564665201.db2.gz VVOMDACTIKYVJW-UHFFFAOYSA-N 0 1 385.283 3.325 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(F)cc3Br)[nH]c21 ZINC000130008555 564666734 /nfs/dbraw/zinc/66/67/34/564666734.db2.gz LYTCODPABIWWGJ-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3sccc3Br)[nH]c21 ZINC000130026864 564667767 /nfs/dbraw/zinc/66/77/67/564667767.db2.gz XHOBRIUCRPOQIB-UHFFFAOYSA-N 0 1 386.296 3.174 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3cc(C)ccc3Br)CCO2)n[nH]1 ZINC000130133953 564670475 /nfs/dbraw/zinc/67/04/75/564670475.db2.gz VMAXILSRCLPEER-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN O=S(=O)(NCc1cc(F)cc(Br)c1)c1c(F)cc(F)cc1F ZINC000060507320 564699245 /nfs/dbraw/zinc/69/92/45/564699245.db2.gz RRFFFKSHRPIHNP-UHFFFAOYSA-N 0 1 398.175 3.484 10 0 GGAEMN Cc1ccn2c(c1)nnc2NC(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000131123296 564701286 /nfs/dbraw/zinc/70/12/86/564701286.db2.gz WDTYWZSXAKLPJX-UHFFFAOYSA-N 0 1 397.236 3.443 10 0 GGAEMN C[C@@H](c1ccccc1Br)N(C)C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000131206554 564704086 /nfs/dbraw/zinc/70/40/86/564704086.db2.gz LQGHYEBBIYFFOS-KBPBESRZSA-N 0 1 389.359 3.114 10 0 GGAEMN C[C@H](c1ccccc1Br)N(C)C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000131206729 564704290 /nfs/dbraw/zinc/70/42/90/564704290.db2.gz LQGHYEBBIYFFOS-KGLIPLIRSA-N 0 1 389.359 3.114 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cc(O)cc(F)c2)ccc1Br ZINC000131412341 564711428 /nfs/dbraw/zinc/71/14/28/564711428.db2.gz HRIJJKYTRWUPOW-UHFFFAOYSA-N 0 1 376.203 3.103 10 0 GGAEMN COc1cc(Br)c(CNC[C@@H](O)Cc2ccccc2)c(OC)c1 ZINC000132272566 564738263 /nfs/dbraw/zinc/73/82/63/564738263.db2.gz AZQUIYVNRVUJNO-AWEZNQCLSA-N 0 1 380.282 3.160 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000065297650 564741875 /nfs/dbraw/zinc/74/18/75/564741875.db2.gz UWRRZQNQZFVPFP-GOEBONIOSA-N 0 1 389.323 3.066 10 0 GGAEMN CCN1CCCn2cc(S(=O)(=O)Nc3ccc(Cl)cc3C)cc2C1=O ZINC000065258766 564742077 /nfs/dbraw/zinc/74/20/77/564742077.db2.gz APBSUMVFDQOEFW-UHFFFAOYSA-N 0 1 381.885 3.117 10 0 GGAEMN Cc1noc([C@H]2CCCN(Cc3nc4ccc(Br)cc4[nH]3)C2)n1 ZINC000132625994 564749067 /nfs/dbraw/zinc/74/90/67/564749067.db2.gz DTJAIILGZPIJGR-NSHDSACASA-N 0 1 376.258 3.396 10 0 GGAEMN O=C(c1csc(-c2ccc(Cl)s2)n1)N1CCC[C@@H](c2nn[nH]n2)C1 ZINC000132706695 564750888 /nfs/dbraw/zinc/75/08/88/564750888.db2.gz GCHXCOSTOICGBS-MRVPVSSYSA-N 0 1 380.886 3.058 10 0 GGAEMN O=C(Cc1c[nH]c2cccc(Br)c12)N1CCN2CCCC[C@H]2C1 ZINC000133438594 564773704 /nfs/dbraw/zinc/77/37/04/564773704.db2.gz UAQJBTLYCGYWRE-AWEZNQCLSA-N 0 1 376.298 3.170 10 0 GGAEMN Cc1nn(C)c(Cl)c1C(=O)N1CCC(c2ncc(C(F)(F)F)[nH]2)CC1 ZINC000133890933 564787639 /nfs/dbraw/zinc/78/76/39/564787639.db2.gz IXCIILLKRBJNSW-UHFFFAOYSA-N 0 1 375.782 3.144 10 0 GGAEMN Cn1ccnc1[C@@H](O)[C@H]1CCCN(C(=O)c2c(O)cc(Cl)cc2Cl)C1 ZINC000134331827 564799981 /nfs/dbraw/zinc/79/99/81/564799981.db2.gz IMENGQZHRFESPZ-BONVTDFDSA-N 0 1 384.263 3.018 10 0 GGAEMN OCCn1nccc1C1CCN(C[C@H](O)c2ccc(Cl)cc2Cl)CC1 ZINC000134314290 564800260 /nfs/dbraw/zinc/80/02/60/564800260.db2.gz MHWHRQBEKRNGDJ-SFHVURJKSA-N 0 1 384.307 3.095 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3c[nH]c4cccc(Br)c34)cc21 ZINC000134363139 564801513 /nfs/dbraw/zinc/80/15/13/564801513.db2.gz CNRCKCHVHDAEMW-UHFFFAOYSA-N 0 1 398.220 3.158 10 0 GGAEMN OCC[C@@]1(CNCc2csc(COc3ccc(Cl)cc3)n2)CCOC1 ZINC000134426363 564802088 /nfs/dbraw/zinc/80/20/88/564802088.db2.gz IKRYUECCWUETIL-SFHVURJKSA-N 0 1 382.913 3.254 10 0 GGAEMN C[C@H](CNC(=O)[C@H]1CCCc2[nH]ncc21)Oc1ccccc1Br ZINC000134468035 564804324 /nfs/dbraw/zinc/80/43/24/564804324.db2.gz ICSANHWQQAOALP-NEPJUHHUSA-N 0 1 378.270 3.176 10 0 GGAEMN Cc1cc(NC(=O)N[C@@H](C)c2nnc[nH]2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000493985411 564815082 /nfs/dbraw/zinc/81/50/82/564815082.db2.gz YZGQNRFLQMAOFJ-VIFPVBQESA-N 0 1 380.239 3.488 10 0 GGAEMN CCN(CC)CC(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000068466023 564819786 /nfs/dbraw/zinc/81/97/86/564819786.db2.gz LPJCRHLXJVBEPG-UHFFFAOYSA-N 0 1 382.291 3.484 10 0 GGAEMN O=C(Nc1ccccc1CN1CCC(O)CC1)c1coc(Br)c1 ZINC000135627387 564837153 /nfs/dbraw/zinc/83/71/53/564837153.db2.gz HSSKEUKMPCQBHG-UHFFFAOYSA-N 0 1 379.254 3.251 10 0 GGAEMN COc1cc(CNC(C)(C)C(=O)NCC2CCCC2)cc(Br)c1O ZINC000136036683 564844638 /nfs/dbraw/zinc/84/46/38/564844638.db2.gz LWIJLNFLUCVCMV-UHFFFAOYSA-N 0 1 399.329 3.338 10 0 GGAEMN Cc1nc(S(=O)(=O)Nc2ccc(Br)cc2Br)c[nH]1 ZINC000070069429 564849648 /nfs/dbraw/zinc/84/96/48/564849648.db2.gz NLPAAYXWWHHDGB-UHFFFAOYSA-N 0 1 395.076 3.044 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1Br ZINC000136889496 564856830 /nfs/dbraw/zinc/85/68/30/564856830.db2.gz KLCJHIXLHWOUIM-PWSUYJOCSA-N 0 1 395.301 3.481 10 0 GGAEMN C[C@H]1CN(C2CCN(C(=O)c3cc(F)c(Cl)cc3Cl)CC2)CCO1 ZINC000072013549 564859884 /nfs/dbraw/zinc/85/98/84/564859884.db2.gz VLRZEBYDMRFLDN-NSHDSACASA-N 0 1 375.271 3.458 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1ccc(I)cc1 ZINC000079306847 564866706 /nfs/dbraw/zinc/86/67/06/564866706.db2.gz WLMOCOIPFVTNCS-UHFFFAOYSA-N 0 1 390.184 3.329 10 0 GGAEMN CC(C)CN1CCN(C(=O)CSCc2cc(-c3cccs3)on2)CC1 ZINC000139668912 564869998 /nfs/dbraw/zinc/86/99/98/564869998.db2.gz IQJNANNUHRIYMB-UHFFFAOYSA-N 0 1 379.551 3.437 10 0 GGAEMN CN1C(=O)C[C@H](NC(=O)c2ccc(O)c(Cl)c2)[C@H]1c1ccc(Cl)cc1 ZINC000091770775 564872374 /nfs/dbraw/zinc/87/23/74/564872374.db2.gz CNWCZXHKOKOBIL-WMLDXEAASA-N 0 1 379.243 3.401 10 0 GGAEMN O=C(Nc1ccc(Br)cn1)C1CCN(Cc2cncs2)CC1 ZINC000091842967 564872443 /nfs/dbraw/zinc/87/24/43/564872443.db2.gz NANFSUCVAOJJIZ-UHFFFAOYSA-N 0 1 381.299 3.151 10 0 GGAEMN O=C(Nc1ccc(Br)cn1)[C@@H]1CCCN(Cc2cncs2)C1 ZINC000091841660 564872920 /nfs/dbraw/zinc/87/29/20/564872920.db2.gz TUUOJMSYPJRFNK-LLVKDONJSA-N 0 1 381.299 3.151 10 0 GGAEMN COCCNC(=O)[C@@H]1CC[C@H](C)N(CCOc2c(Cl)cccc2Cl)C1 ZINC000144338776 564877339 /nfs/dbraw/zinc/87/73/39/564877339.db2.gz XXPRJCNMOLEDIU-UONOGXRCSA-N 0 1 389.323 3.235 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1Cc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000092588794 564879724 /nfs/dbraw/zinc/87/97/24/564879724.db2.gz SGNUXJFIFOLQSK-AWEZNQCLSA-N 0 1 377.286 3.069 10 0 GGAEMN COCCOC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)sc2C)c1 ZINC000146218946 564880392 /nfs/dbraw/zinc/88/03/92/564880392.db2.gz UOMRHRAPBZDGQK-UHFFFAOYSA-N 0 1 384.479 3.361 10 0 GGAEMN CCOC(=O)c1nnc(NC(=O)c2ncoc2-c2ccccc2Cl)s1 ZINC000150734203 564888667 /nfs/dbraw/zinc/88/86/67/564888667.db2.gz QBCASLPNQGVGLU-UHFFFAOYSA-N 0 1 378.797 3.276 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc3c(C)[nH]nc3c2)cc1Br ZINC000093909425 564892615 /nfs/dbraw/zinc/89/26/15/564892615.db2.gz JGNQXWDAEOYPMV-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN COc1ccccc1CN(CCO)Cc1nc2ccc(Br)cc2[nH]1 ZINC000097141145 564906604 /nfs/dbraw/zinc/90/66/04/564906604.db2.gz WOJOAFASYUDNMF-UHFFFAOYSA-N 0 1 390.281 3.329 10 0 GGAEMN CC[C@@](O)(CNC(=O)[C@H]1CCCc2[nH]ncc21)c1ccc(Br)cc1 ZINC000151161677 564908073 /nfs/dbraw/zinc/90/80/73/564908073.db2.gz CYDYGHFAGVXHTM-KBXCAEBGSA-N 0 1 392.297 3.006 10 0 GGAEMN C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000151191329 564909188 /nfs/dbraw/zinc/90/91/88/564909188.db2.gz FFYFYKIWYKILCF-GHMZBOCLSA-N 0 1 382.835 3.216 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000101563197 564917092 /nfs/dbraw/zinc/91/70/92/564917092.db2.gz CGQHNXFEXQSOLV-GJZGRUSLSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000101563196 564917460 /nfs/dbraw/zinc/91/74/60/564917460.db2.gz CGQHNXFEXQSOLV-CABCVRRESA-N 0 1 389.323 3.114 10 0 GGAEMN C[C@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1cccc(Br)c1 ZINC000102675213 564932118 /nfs/dbraw/zinc/93/21/18/564932118.db2.gz VELBMWUJHMQYID-GFCCVEGCSA-N 0 1 383.311 3.290 10 0 GGAEMN CCOC(=O)C1CCN(C(=O)CN[C@@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000102686957 564932669 /nfs/dbraw/zinc/93/26/69/564932669.db2.gz CRRBIOQIDMHTQI-LBPRGKRZSA-N 0 1 387.307 3.446 10 0 GGAEMN C[C@@H]1CC[C@H](C)N1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000151928927 564940723 /nfs/dbraw/zinc/94/07/23/564940723.db2.gz RYZOCHDYZNQYRT-PHIMTYICSA-N 0 1 378.274 3.317 10 0 GGAEMN C[C@@H]1CC[C@H](C)N1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000151928927 564940728 /nfs/dbraw/zinc/94/07/28/564940728.db2.gz RYZOCHDYZNQYRT-PHIMTYICSA-N 0 1 378.274 3.317 10 0 GGAEMN C[C@H]1CC[C@H](C)N1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000151929006 564940900 /nfs/dbraw/zinc/94/09/00/564940900.db2.gz RYZOCHDYZNQYRT-QWRGUYRKSA-N 0 1 378.274 3.317 10 0 GGAEMN C[C@H]1CC[C@H](C)N1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000151929006 564940903 /nfs/dbraw/zinc/94/09/03/564940903.db2.gz RYZOCHDYZNQYRT-QWRGUYRKSA-N 0 1 378.274 3.317 10 0 GGAEMN CC1(C)CCCN1C(=O)c1c[nH]c2ccc(I)cc2c1=O ZINC000151997891 564943440 /nfs/dbraw/zinc/94/34/40/564943440.db2.gz UQORTNJLGFINRR-UHFFFAOYSA-N 0 1 396.228 3.147 10 0 GGAEMN C[C@@H]1CC[C@@H](C(N)=O)CN1CCOc1ccc(Cl)cc1Br ZINC000103286244 564945337 /nfs/dbraw/zinc/94/53/37/564945337.db2.gz ARJNBEPWVQJIHE-GHMZBOCLSA-N 0 1 375.694 3.067 10 0 GGAEMN Cc1ccccc1CS(=O)(=O)c1nc2cc(Br)c(C)[nH]c-2n1 ZINC000152065624 564946017 /nfs/dbraw/zinc/94/60/17/564946017.db2.gz XSUUUAPNYJWIHR-UHFFFAOYSA-N 0 1 380.267 3.311 10 0 GGAEMN CC[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1cccs1 ZINC000152143350 564948774 /nfs/dbraw/zinc/94/87/74/564948774.db2.gz FOWYTCMSMUSUER-AWEZNQCLSA-N 0 1 386.564 3.071 10 0 GGAEMN Cn1nccc1CN[C@@H]1CCCOc2ccc(I)cc21 ZINC000152195955 564950227 /nfs/dbraw/zinc/95/02/27/564950227.db2.gz VCMYYZDWMANMME-CQSZACIVSA-N 0 1 383.233 3.028 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3ccc(C)cc3Br)CCO2)n[nH]1 ZINC000152264404 564952546 /nfs/dbraw/zinc/95/25/46/564952546.db2.gz VRZZRHZLOMFSFR-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3ccc(C)cc3Br)CCO2)n[nH]1 ZINC000152264300 564952806 /nfs/dbraw/zinc/95/28/06/564952806.db2.gz VRZZRHZLOMFSFR-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN O[C@H](COc1ccc(Cl)cc1Cl)CN1CC[C@@H](Oc2cccnc2)C1 ZINC000152288112 564953368 /nfs/dbraw/zinc/95/33/68/564953368.db2.gz PZXBMLBEAPFEHP-GOEBONIOSA-N 0 1 383.275 3.281 10 0 GGAEMN Cc1cccc(S(=O)(=O)Nc2cccc(-c3nc[nH]n3)c2)c1Br ZINC000152463302 564960069 /nfs/dbraw/zinc/96/00/69/564960069.db2.gz SQJWAHLVZXGLLU-UHFFFAOYSA-N 0 1 393.266 3.343 10 0 GGAEMN NC(=O)[C@H](NC1CCN(c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000105401700 564966960 /nfs/dbraw/zinc/96/69/60/564966960.db2.gz KOLZOEJFIFIOBB-GOSISDBHSA-N 0 1 388.309 3.234 10 0 GGAEMN C[C@@H]1CCC[C@@H]1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000105570338 564968413 /nfs/dbraw/zinc/96/84/13/564968413.db2.gz CCBQTNMTGVJDSB-MFKMUULPSA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@@H]1CCC[C@@H]1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000105570338 564968416 /nfs/dbraw/zinc/96/84/16/564968416.db2.gz CCBQTNMTGVJDSB-MFKMUULPSA-N 0 1 378.274 3.222 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NC[C@H]1CC=CCC1 ZINC000105570307 564968677 /nfs/dbraw/zinc/96/86/77/564968677.db2.gz IEEMKTCZZBSCTO-LBPRGKRZSA-N 0 1 390.285 3.390 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NC[C@H]1CC=CCC1 ZINC000105570307 564968680 /nfs/dbraw/zinc/96/86/80/564968680.db2.gz IEEMKTCZZBSCTO-LBPRGKRZSA-N 0 1 390.285 3.390 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)C(=O)Nc2cc(Cl)ccc2SC(C)C)C1 ZINC000105534232 564968983 /nfs/dbraw/zinc/96/89/83/564968983.db2.gz HBFJSQROMOKXTO-CQSZACIVSA-N 0 1 383.945 3.380 10 0 GGAEMN Cc1nc(C[C@@H]2CCC[N@@H+](C[C@H](O)c3ccccc3Br)C2)no1 ZINC000152890397 564975479 /nfs/dbraw/zinc/97/54/79/564975479.db2.gz JRQWWGKZHPYPDG-BBRMVZONSA-N 0 1 380.286 3.129 10 0 GGAEMN Cc1nc(C[C@@H]2CCCN(C[C@H](O)c3ccccc3Br)C2)no1 ZINC000152890397 564975483 /nfs/dbraw/zinc/97/54/83/564975483.db2.gz JRQWWGKZHPYPDG-BBRMVZONSA-N 0 1 380.286 3.129 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2ccc(Cl)cc2Cl)C[C@@H]1CC ZINC000106119091 564977802 /nfs/dbraw/zinc/97/78/02/564977802.db2.gz LYVKDVHFKDHJAJ-HNNXBMFYSA-N 0 1 388.339 3.365 10 0 GGAEMN O=C(CN(C[C@H]1CCCO1)C1CCCC1)Nc1ccc(Br)cn1 ZINC000152969159 564978862 /nfs/dbraw/zinc/97/88/62/564978862.db2.gz VZIRRBNISQPINR-OAHLLOKOSA-N 0 1 382.302 3.206 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@H](Cn2cncn2)C1 ZINC000106173461 564979136 /nfs/dbraw/zinc/97/91/36/564979136.db2.gz RFHRQSYBPCNODX-STQMWFEESA-N 0 1 382.295 3.324 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3ccc(Br)cc3F)CC2)cn1 ZINC000106157787 564979210 /nfs/dbraw/zinc/97/92/10/564979210.db2.gz MSRLGRFGAGCJSU-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3cc(Br)ccc3F)CC2)cn1 ZINC000106154600 564979271 /nfs/dbraw/zinc/97/92/71/564979271.db2.gz MOUDBZVUPIVBRZ-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN COc1cc(C)c(Br)cc1C(=O)Nc1cc(-c2nccn2C)n[nH]1 ZINC000501785432 564985700 /nfs/dbraw/zinc/98/57/00/564985700.db2.gz DAYRWWNGJDNQRJ-UHFFFAOYSA-N 0 1 390.241 3.142 10 0 GGAEMN Cc1ccc(NC(=O)c2ccc(Br)cc2O)cc1S(C)(=O)=O ZINC000153147779 564985997 /nfs/dbraw/zinc/98/59/97/564985997.db2.gz XRDQZCARNMBEBU-UHFFFAOYSA-N 0 1 384.251 3.119 10 0 GGAEMN CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2c[nH]nc2-c2ccccn2)c1 ZINC000153318384 564991271 /nfs/dbraw/zinc/99/12/71/564991271.db2.gz XZRATUKDOWGFRN-UHFFFAOYSA-N 0 1 376.825 3.129 10 0 GGAEMN CN(C)[C@@H](Cc1ccccc1)C(=O)NCc1cc(F)cc(Br)c1 ZINC000106909720 564991407 /nfs/dbraw/zinc/99/14/07/564991407.db2.gz WYYUSORQZJKHJO-KRWDZBQOSA-N 0 1 379.273 3.377 10 0 GGAEMN CN(C)[C@H](Cc1ccccc1)C(=O)NCc1cc(F)cc(Br)c1 ZINC000106909722 564991626 /nfs/dbraw/zinc/99/16/26/564991626.db2.gz WYYUSORQZJKHJO-QGZVFWFLSA-N 0 1 379.273 3.377 10 0 GGAEMN Cc1cc(S(=O)(=O)[N-]c2ccc(NC(=O)CC[NH+](C)C)cc2)c(C)s1 ZINC000107061958 564993993 /nfs/dbraw/zinc/99/39/93/564993993.db2.gz WMIJOJJQPGBKBK-UHFFFAOYSA-N 0 1 381.523 3.056 10 0 GGAEMN COCCN1CCN(Cc2coc(-c3ccc(Br)cc3)n2)C[C@@H]1C ZINC000108867425 565018141 /nfs/dbraw/zinc/01/81/41/565018141.db2.gz ACMWBFVHTKAVNV-AWEZNQCLSA-N 0 1 394.313 3.257 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3ccc(Br)cc3C)CCO2)n[nH]1 ZINC000154035873 565022859 /nfs/dbraw/zinc/02/28/59/565022859.db2.gz ZGKBEHZKNBAILM-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000110529862 565041841 /nfs/dbraw/zinc/04/18/41/565041841.db2.gz OCUTZWOLWIFXKU-NSHDSACASA-N 0 1 377.794 3.027 10 0 GGAEMN O=C(CC[C@H]1CCCCO1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000110688886 565044225 /nfs/dbraw/zinc/04/42/25/565044225.db2.gz ARIHWSDAZOEKPK-CQSZACIVSA-N 0 1 393.285 3.200 10 0 GGAEMN O=C(CC[C@H]1CCCCO1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000110688886 565044229 /nfs/dbraw/zinc/04/42/29/565044229.db2.gz ARIHWSDAZOEKPK-CQSZACIVSA-N 0 1 393.285 3.200 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Br)c(Cl)c2)CCN1C ZINC000154697003 565049591 /nfs/dbraw/zinc/04/95/91/565049591.db2.gz MUABOXVIZRWDLW-QWRGUYRKSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C ZINC000154698078 565049865 /nfs/dbraw/zinc/04/98/65/565049865.db2.gz ODDTWDNRIZBJDX-CMPLNLGQSA-N 0 1 384.851 3.462 10 0 GGAEMN CNS(=O)(=O)c1ccc2c(c1)nc(-c1cc(Cl)c(O)cc1Cl)n2C ZINC000154899139 565056158 /nfs/dbraw/zinc/05/61/58/565056158.db2.gz UXEUDLUJLLZLQN-UHFFFAOYSA-N 0 1 386.260 3.161 10 0 GGAEMN COc1cccc(Br)c1OC[C@H](O)CN1CCc2ccccc2C1 ZINC000154954206 565058024 /nfs/dbraw/zinc/05/80/24/565058024.db2.gz XUJNBVDLEBYASV-MRXNPFEDSA-N 0 1 392.293 3.256 10 0 GGAEMN O=C(Nc1cnn(-c2ccccc2Br)c1)[C@@H]1CCCc2[nH]ncc21 ZINC000154963921 565058374 /nfs/dbraw/zinc/05/83/74/565058374.db2.gz CKGJFXLGBYMMJW-GFCCVEGCSA-N 0 1 386.253 3.417 10 0 GGAEMN C[C@@H](CSc1nc(-c2ccccc2Br)n[nH]1)CS(C)(=O)=O ZINC000154968761 565058493 /nfs/dbraw/zinc/05/84/93/565058493.db2.gz ARXGPOJRIKQFTK-VIFPVBQESA-N 0 1 390.328 3.007 10 0 GGAEMN O=C(Nc1cnn(-c2ccccc2Br)c1)[C@H]1CCCc2[nH]ncc21 ZINC000154964030 565058569 /nfs/dbraw/zinc/05/85/69/565058569.db2.gz CKGJFXLGBYMMJW-LBPRGKRZSA-N 0 1 386.253 3.417 10 0 GGAEMN C[C@H](c1ccc(Br)cc1)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000112337941 565062644 /nfs/dbraw/zinc/06/26/44/565062644.db2.gz JYSAAVGLXWGPJP-ZBFHGGJFSA-N 0 1 381.314 3.081 10 0 GGAEMN C[C@H](c1ccc(Br)cc1)N1CCCN(Cc2cnn(C)c2)CC1 ZINC000112345513 565062740 /nfs/dbraw/zinc/06/27/40/565062740.db2.gz ITWMVGUHMDQHNB-OAHLLOKOSA-N 0 1 377.330 3.452 10 0 GGAEMN Cc1cccc2nc(CNC(=O)[C@@H]3COc4ccc(Br)cc43)[nH]c21 ZINC000155201059 565064208 /nfs/dbraw/zinc/06/42/08/565064208.db2.gz FKJCGQBVXVTNJW-CYBMUJFWSA-N 0 1 386.249 3.426 10 0 GGAEMN O=C(CNCc1cc(Br)cc(C(F)(F)F)c1)NCc1ccco1 ZINC000155562909 565069107 /nfs/dbraw/zinc/06/91/07/565069107.db2.gz CJZWLZCXTAFWNJ-UHFFFAOYSA-N 0 1 391.187 3.467 10 0 GGAEMN CCCOc1c(Br)cc(C(=O)N2[C@H](C)CN(C)C[C@H]2C)cc1OC ZINC000155772615 565071507 /nfs/dbraw/zinc/07/15/07/565071507.db2.gz QIFQVDLVRFTSIP-CHWSQXEVSA-N 0 1 399.329 3.411 10 0 GGAEMN CN(C)[C@@H](CNC(=O)C(=O)c1ccc(Br)cc1)c1ccccc1 ZINC000114222176 565073026 /nfs/dbraw/zinc/07/30/26/565073026.db2.gz YTNQBQBHQVUTNA-INIZCTEOSA-N 0 1 375.266 3.051 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NC1CCN(Cc2ccccn2)CC1 ZINC000114318684 565073897 /nfs/dbraw/zinc/07/38/97/565073897.db2.gz FLDGIBOWFQFVLU-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Cc2ccc(Br)s2)c2ccccc2)n[nH]1 ZINC000114327432 565073979 /nfs/dbraw/zinc/07/39/79/565073979.db2.gz DRGUNNLASHXUCI-HNNXBMFYSA-N 0 1 391.294 3.385 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)CN1CCCC[C@@H]1c1cn[nH]c1 ZINC000114483190 565074747 /nfs/dbraw/zinc/07/47/47/565074747.db2.gz WJIYOWPRNHXPGG-NVXWUHKLSA-N 0 1 380.286 3.139 10 0 GGAEMN CC[C@H]1C[C@@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCO1 ZINC000183597546 565080882 /nfs/dbraw/zinc/08/08/82/565080882.db2.gz JZOMQWWDBSHHSR-JSGCOSHPSA-N 0 1 393.285 3.056 10 0 GGAEMN CC[C@H]1C[C@@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCO1 ZINC000183597546 565080885 /nfs/dbraw/zinc/08/08/85/565080885.db2.gz JZOMQWWDBSHHSR-JSGCOSHPSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@H](CNC(=O)c1cnccc1N(C)C)Oc1ccccc1Br ZINC000183599719 565081033 /nfs/dbraw/zinc/08/10/33/565081033.db2.gz FIUVBXDLIGIXEY-GFCCVEGCSA-N 0 1 378.270 3.107 10 0 GGAEMN CC[C@@H]1C[C@@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCO1 ZINC000183597528 565081171 /nfs/dbraw/zinc/08/11/71/565081171.db2.gz JZOMQWWDBSHHSR-GXTWGEPZSA-N 0 1 393.285 3.056 10 0 GGAEMN CC[C@@H]1C[C@@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCO1 ZINC000183597528 565081173 /nfs/dbraw/zinc/08/11/73/565081173.db2.gz JZOMQWWDBSHHSR-GXTWGEPZSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@@H](N[C@@H](CO)c1ccccc1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000183635411 565084500 /nfs/dbraw/zinc/08/45/00/565084500.db2.gz FMUOBUPTXDBVBC-KDOFPFPSSA-N 0 1 391.309 3.119 10 0 GGAEMN C[C@@H](N[C@H](CO)c1ccccc1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000183635451 565085109 /nfs/dbraw/zinc/08/51/09/565085109.db2.gz FMUOBUPTXDBVBC-RDTXWAMCSA-N 0 1 391.309 3.119 10 0 GGAEMN C[C@H](N[C@H](CO)c1ccccc1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000183635432 565085208 /nfs/dbraw/zinc/08/52/08/565085208.db2.gz FMUOBUPTXDBVBC-KBXCAEBGSA-N 0 1 391.309 3.119 10 0 GGAEMN C[C@H](CN[C@@H](c1ccco1)c1ccc(Br)cc1)N1CCOCC1 ZINC000183692490 565088572 /nfs/dbraw/zinc/08/85/72/565088572.db2.gz UIIILEDAMJWQAZ-RDTXWAMCSA-N 0 1 379.298 3.442 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CCC(c2ncc[nH]2)CC1 ZINC000266762836 565089846 /nfs/dbraw/zinc/08/98/46/565089846.db2.gz QNRLLBWCHUKZST-UHFFFAOYSA-N 0 1 391.313 3.010 10 0 GGAEMN O[C@H](CNCc1cn(-c2ccc(Cl)c(Cl)c2)nn1)Cc1ccccc1 ZINC000183736403 565092967 /nfs/dbraw/zinc/09/29/67/565092967.db2.gz UGHDZJQWSZQYLD-INIZCTEOSA-N 0 1 377.275 3.267 10 0 GGAEMN CC1(C)CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@]2(CCOC2)O1 ZINC000369537576 565096664 /nfs/dbraw/zinc/09/66/64/565096664.db2.gz RZPNDAQSEYJFNX-KRWDZBQOSA-N 0 1 380.286 3.095 10 0 GGAEMN C[C@H]1CN(c2ccccc2NC(=O)CSc2n[nH]c(=S)s2)C[C@H](C)O1 ZINC000266970191 565097797 /nfs/dbraw/zinc/09/77/97/565097797.db2.gz BHEFJBXTRQRYOO-QWRGUYRKSA-N 0 1 396.563 3.171 10 0 GGAEMN C[C@@H]1CN(c2ccccc2NC(=O)CSc2n[nH]c(=S)s2)C[C@H](C)O1 ZINC000266970190 565098783 /nfs/dbraw/zinc/09/87/83/565098783.db2.gz BHEFJBXTRQRYOO-PHIMTYICSA-N 0 1 396.563 3.171 10 0 GGAEMN O=C(N=c1nc(-c2ccsc2)[n-]s1)N1CCC[N@H+](C2CCCC2)CC1 ZINC000369616228 565101335 /nfs/dbraw/zinc/10/13/35/565101335.db2.gz QCFXMZCAPUBDEL-UHFFFAOYSA-N 0 1 377.539 3.171 10 0 GGAEMN O=C1O[C@@H](CN[C@@H](CO)c2cccc(Br)c2)CN1c1ccccc1 ZINC000183918475 565104250 /nfs/dbraw/zinc/10/42/50/565104250.db2.gz VWCQBPMXULXCPT-IRXDYDNUSA-N 0 1 391.265 3.098 10 0 GGAEMN Cc1cnc(C(C)(C)NC[C@H](O)COc2cccc(Br)c2)s1 ZINC000183943197 565106028 /nfs/dbraw/zinc/10/60/28/565106028.db2.gz UTAGEPXBZSUMOI-ZDUSSCGKSA-N 0 1 385.327 3.479 10 0 GGAEMN O=C(NCCCCN1CCOCC1)C1(Cc2ccccc2Br)CC1 ZINC000292288852 565109276 /nfs/dbraw/zinc/10/92/76/565109276.db2.gz PDMWSFHEPHBXQB-UHFFFAOYSA-N 0 1 395.341 3.000 10 0 GGAEMN CC(=Cc1c(Cl)cccc1Cl)C(=O)N1CCO[C@H](c2n[nH]c(C)n2)C1 ZINC000184247547 565122849 /nfs/dbraw/zinc/12/28/49/565122849.db2.gz OEBIQUBLEJMUNV-HQPKTYMTSA-N 0 1 381.263 3.423 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)[nH]1 ZINC000184326086 565129336 /nfs/dbraw/zinc/12/93/36/565129336.db2.gz TWRXKHLFNFBXEH-GFCCVEGCSA-N 0 1 380.342 3.293 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)N[C@@H](c1nccs1)C(F)(F)F ZINC000292744555 565131695 /nfs/dbraw/zinc/13/16/95/565131695.db2.gz HQIFXHWBKFRGHX-JTQLQIEISA-N 0 1 386.804 3.387 10 0 GGAEMN O=C1CCCN1C[C@@H](O)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000157628230 565138860 /nfs/dbraw/zinc/13/88/60/565138860.db2.gz PYWOHCHTOJCKKY-KRWDZBQOSA-N 0 1 383.319 3.456 10 0 GGAEMN O=C(Nc1ccc(F)cc1I)[C@@H]1CCCc2[nH]ncc21 ZINC000268142820 565141974 /nfs/dbraw/zinc/14/19/74/565141974.db2.gz JKDJGZDVMRNJJV-SECBINFHSA-N 0 1 385.180 3.212 10 0 GGAEMN O=C(N[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCCc2[nH]ncc21 ZINC000268191645 565143375 /nfs/dbraw/zinc/14/33/75/565143375.db2.gz ZWDLOXNATRFHAP-FZMZJTMJSA-N 0 1 376.254 3.232 10 0 GGAEMN O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184589702 565146604 /nfs/dbraw/zinc/14/66/04/565146604.db2.gz NEXNGAKIUXKADS-LBPRGKRZSA-N 0 1 377.857 3.167 10 0 GGAEMN O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184589702 565146610 /nfs/dbraw/zinc/14/66/10/565146610.db2.gz NEXNGAKIUXKADS-LBPRGKRZSA-N 0 1 377.857 3.167 10 0 GGAEMN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184594837 565146787 /nfs/dbraw/zinc/14/67/87/565146787.db2.gz HLDYUQCYWULKTA-QMMMGPOBSA-N 0 1 382.251 3.136 10 0 GGAEMN C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184594837 565146792 /nfs/dbraw/zinc/14/67/92/565146792.db2.gz HLDYUQCYWULKTA-QMMMGPOBSA-N 0 1 382.251 3.136 10 0 GGAEMN O=C(NCc1cc(F)cc(Br)c1)c1ccc(-c2nnc[nH]2)cc1 ZINC000184835362 565158977 /nfs/dbraw/zinc/15/89/77/565158977.db2.gz MVWNGTWYOKEJAY-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1cccc(Br)c1 ZINC000158265900 565162518 /nfs/dbraw/zinc/16/25/18/565162518.db2.gz NDJWNVQKWUCJOF-LBPRGKRZSA-N 0 1 383.311 3.290 10 0 GGAEMN O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCN(C2CCOCC2)CC1 ZINC000293338661 565163309 /nfs/dbraw/zinc/16/33/09/565163309.db2.gz JHVRLQSNETVGBQ-OAHLLOKOSA-N 0 1 383.945 3.285 10 0 GGAEMN CCc1onc(C)c1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000184883820 565163647 /nfs/dbraw/zinc/16/36/47/565163647.db2.gz RLXRIHZIQKOKCX-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN CCc1onc(C)c1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000184883820 565163651 /nfs/dbraw/zinc/16/36/51/565163651.db2.gz RLXRIHZIQKOKCX-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN O=S(=O)(C=Cc1ccc(Br)cc1)N[C@@H]1CCCc2cn[nH]c21 ZINC000268816084 565168892 /nfs/dbraw/zinc/16/88/92/565168892.db2.gz VTTBQYLREXDZFG-MYSGNRETSA-N 0 1 382.283 3.140 10 0 GGAEMN COC(=O)c1cccc2nc(NC(=O)Cc3ccc(Br)s3)[nH]c21 ZINC000158407941 565168996 /nfs/dbraw/zinc/16/89/96/565168996.db2.gz IOGCHZFQXVSDJM-UHFFFAOYSA-N 0 1 394.250 3.355 10 0 GGAEMN O[C@@H](CN1CCC(Cn2cccn2)CC1)c1ccc(F)c(Br)c1 ZINC000185004327 565170001 /nfs/dbraw/zinc/17/00/01/565170001.db2.gz YKAMUIACZSKWRZ-KRWDZBQOSA-N 0 1 382.277 3.230 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Nc2cccc(I)c2)n[nH]1 ZINC000158425044 565170296 /nfs/dbraw/zinc/17/02/96/565170296.db2.gz SRGAFOHLHKLRON-SECBINFHSA-N 0 1 384.221 3.075 10 0 GGAEMN COc1ccc(Br)cc1CN(C)C(=O)N[C@@H](C)Cc1cc(C)[nH]n1 ZINC000268955796 565173219 /nfs/dbraw/zinc/17/32/19/565173219.db2.gz ADBKVLBLRWQSMC-NSHDSACASA-N 0 1 395.301 3.262 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3ccc(C)c(Br)c3)CCO2)n[nH]1 ZINC000158607948 565174915 /nfs/dbraw/zinc/17/49/15/565174915.db2.gz KAKKFKROXNOFIZ-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN Fc1cc(CNCc2ccc(Br)cc2)cnc1N1CCOCC1 ZINC000185076086 565176099 /nfs/dbraw/zinc/17/60/99/565176099.db2.gz XBQOJSAJTSZYMH-UHFFFAOYSA-N 0 1 380.261 3.110 10 0 GGAEMN O=C(c1cc(F)ccc1I)N1CCC(c2cnc[nH]2)CC1 ZINC000371169261 565181059 /nfs/dbraw/zinc/18/10/59/565181059.db2.gz GJGSZWRMXZEAQV-UHFFFAOYSA-N 0 1 399.207 3.173 10 0 GGAEMN O=C(c1cccc(I)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000371172696 565180972 /nfs/dbraw/zinc/18/09/72/565180972.db2.gz CCTGDMFTZDYUSG-UHFFFAOYSA-N 0 1 381.217 3.034 10 0 GGAEMN Cc1ccsc1[C@@H](NCCN1C(=O)CNC1=O)c1ccc(Cl)cc1F ZINC000185202365 565187138 /nfs/dbraw/zinc/18/71/38/565187138.db2.gz RWEXXXIVGBWBMP-HNNXBMFYSA-N 0 1 381.860 3.080 10 0 GGAEMN O=C(CCCCOc1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000371350121 565188307 /nfs/dbraw/zinc/18/83/07/565188307.db2.gz PTBJXEJGGPEMAY-AWEZNQCLSA-N 0 1 392.297 3.395 10 0 GGAEMN O=C(CCCCOc1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371350122 565188942 /nfs/dbraw/zinc/18/89/42/565188942.db2.gz PTBJXEJGGPEMAY-CQSZACIVSA-N 0 1 392.297 3.395 10 0 GGAEMN COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1ccc(SC(F)F)nc1 ZINC000269392232 565189302 /nfs/dbraw/zinc/18/93/02/565189302.db2.gz XQKIHZDHQXZCEX-UHFFFAOYSA-N 0 1 392.405 3.194 10 0 GGAEMN O=C(CCNC(=O)[C@H]1CCCc2[nH]ncc21)Nc1cc(Cl)cc(Cl)c1 ZINC000293963817 565191824 /nfs/dbraw/zinc/19/18/24/565191824.db2.gz FHBVGXDNXHZUPI-ZDUSSCGKSA-N 0 1 381.263 3.281 10 0 GGAEMN CCN(CC)C(=O)C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000159024308 565191888 /nfs/dbraw/zinc/19/18/88/565191888.db2.gz UWQRHMUSZLCXOL-UHFFFAOYSA-N 0 1 393.329 3.406 10 0 GGAEMN CCCCNC(=O)[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159051102 565193322 /nfs/dbraw/zinc/19/33/22/565193322.db2.gz DFRVHFFDEVYSLB-CYBMUJFWSA-N 0 1 393.329 3.454 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@H]1CCOC2(CCSCC2)C1)c1ccsc1 ZINC000269555899 565194367 /nfs/dbraw/zinc/19/43/67/565194367.db2.gz ZEPWOGPJBHVFOM-HOTGVXAUSA-N 0 1 383.583 3.095 10 0 GGAEMN O=C(NC[C@H](O)CN1CCc2ccccc2C1)c1ccc(Cl)c(Cl)c1 ZINC000159167557 565196532 /nfs/dbraw/zinc/19/65/32/565196532.db2.gz YRRSTYVANMRIME-INIZCTEOSA-N 0 1 379.287 3.142 10 0 GGAEMN CC(C)C[C@@H](CO)N(C)CC(=O)Nc1c(F)cc(F)cc1Br ZINC000185349402 565197007 /nfs/dbraw/zinc/19/70/07/565197007.db2.gz RWWKJTZZNXUVIE-NSHDSACASA-N 0 1 379.245 3.005 10 0 GGAEMN CC(C)C[C@H](CO)N(C)CC(=O)Nc1c(F)cc(F)cc1Br ZINC000185349423 565197108 /nfs/dbraw/zinc/19/71/08/565197108.db2.gz RWWKJTZZNXUVIE-LLVKDONJSA-N 0 1 379.245 3.005 10 0 GGAEMN O=C(NC[C@H](O)CN1CCc2ccccc2C1)c1cc(Cl)ccc1Cl ZINC000159296461 565200871 /nfs/dbraw/zinc/20/08/71/565200871.db2.gz GPKXFOUSADCMMA-INIZCTEOSA-N 0 1 379.287 3.142 10 0 GGAEMN Brc1ccc2nc(CN3CCC(Nc4cccnn4)CC3)[nH]c2c1 ZINC000159312842 565201866 /nfs/dbraw/zinc/20/18/66/565201866.db2.gz OIOVVHIMUROJRU-UHFFFAOYSA-N 0 1 387.285 3.192 10 0 GGAEMN CCCCn1c(=O)[nH]nc1SCc1nc2ccc(Br)cc2[nH]1 ZINC000185456490 565203401 /nfs/dbraw/zinc/20/34/01/565203401.db2.gz CZAXQBOHXVOEMN-UHFFFAOYSA-N 0 1 382.287 3.303 10 0 GGAEMN O[C@H](COC1CCOCC1)CN1CCC[C@H]1c1ccc(Br)s1 ZINC000371715967 565207162 /nfs/dbraw/zinc/20/71/62/565207162.db2.gz MFJZYUHRZNVZDZ-JSGCOSHPSA-N 0 1 390.343 3.204 10 0 GGAEMN O=C(Cc1sccc1Br)NC1CCN(Cc2ccccn2)CC1 ZINC000294310511 565207426 /nfs/dbraw/zinc/20/74/26/565207426.db2.gz DFQSQSZPNKMOGT-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN CN(Cc1cnc(-c2ccccc2)[nH]1)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000185577946 565209877 /nfs/dbraw/zinc/20/98/77/565209877.db2.gz GHDQIRNTEJXVED-KRWDZBQOSA-N 0 1 399.292 3.498 10 0 GGAEMN Cc1ccc(NC(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)c(Br)n1 ZINC000372049231 565220640 /nfs/dbraw/zinc/22/06/40/565220640.db2.gz QNOKBZWJRLJKCO-CYBMUJFWSA-N 0 1 387.241 3.182 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)NCc2cc(F)cc(Br)c2)n[nH]1 ZINC000270666830 565224511 /nfs/dbraw/zinc/22/45/11/565224511.db2.gz KYWWSTFGOULCDC-VIFPVBQESA-N 0 1 384.253 3.390 10 0 GGAEMN CN1CC[C@@H](NC(=O)c2[nH]nc(C3CC3)c2Br)[C@H]1c1ccccc1 ZINC000270638786 565225417 /nfs/dbraw/zinc/22/54/17/565225417.db2.gz KLUBREIDXBBACM-CXAGYDPISA-N 0 1 389.297 3.225 10 0 GGAEMN Cc1c(Br)scc1C(=O)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000372236352 565227295 /nfs/dbraw/zinc/22/72/95/565227295.db2.gz MXDWMVWRQUKZIL-GFCCVEGCSA-N 0 1 377.267 3.457 10 0 GGAEMN Cn1c(NC(=O)c2cc(-c3ccc(Br)cc3)n[nH]2)nnc1C1CC1 ZINC000617291298 565231228 /nfs/dbraw/zinc/23/12/28/565231228.db2.gz ALCIOGYFRKDTAI-UHFFFAOYSA-N 0 1 387.241 3.097 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N(C)Cc1cc(Br)cn1C)C2 ZINC000372444874 565238979 /nfs/dbraw/zinc/23/89/79/565238979.db2.gz CHZMVWUUQYZCIJ-GFCCVEGCSA-N 0 1 393.329 3.398 10 0 GGAEMN COc1cc(CN[C@@H](CO)c2ccc(Br)cc2)cc2c1OCCO2 ZINC000271295384 565247386 /nfs/dbraw/zinc/24/73/86/565247386.db2.gz NNSBBEHDXSRKDS-HNNXBMFYSA-N 0 1 394.265 3.052 10 0 GGAEMN CSC[C@H](CCO)N[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186210032 565247514 /nfs/dbraw/zinc/24/75/14/565247514.db2.gz XJYSDIWRUXZNLW-JKSUJKDBSA-N 0 1 382.327 3.032 10 0 GGAEMN O=C(NCc1sccc1Br)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000372613169 565247749 /nfs/dbraw/zinc/24/77/49/565247749.db2.gz XQTUSSJHFGUKCJ-CYBMUJFWSA-N 0 1 392.282 3.218 10 0 GGAEMN CCn1cc(S(=O)(=O)Nc2ncc(C3CCC3)cc2Br)cn1 ZINC000295193559 565250541 /nfs/dbraw/zinc/25/05/41/565250541.db2.gz LOHCFPUFHBAORS-UHFFFAOYSA-N 0 1 385.287 3.129 10 0 GGAEMN O=S(=O)(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cccc(Cl)c1Cl ZINC000372876395 565259287 /nfs/dbraw/zinc/25/92/87/565259287.db2.gz ICSBRVDPOVVAPA-CQSZACIVSA-N 0 1 383.260 3.179 10 0 GGAEMN FC(F)(F)CN1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000186443074 565260711 /nfs/dbraw/zinc/26/07/11/565260711.db2.gz QCDLJZLUJCJQKH-UHFFFAOYSA-N 0 1 377.208 3.005 10 0 GGAEMN O=C(CCCC(=O)N1CCN2CCC1CC2)c1ccc(Br)cc1 ZINC000373167504 565272723 /nfs/dbraw/zinc/27/27/23/565272723.db2.gz YJZQAAKYSSOPEU-UHFFFAOYSA-N 0 1 379.298 3.109 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)CC1 ZINC000186622208 565273893 /nfs/dbraw/zinc/27/38/93/565273893.db2.gz UKBZBBYRWGGZDH-CABCVRRESA-N 0 1 385.291 3.104 10 0 GGAEMN COC[C@H](C)OC[C@@H](O)CN1CCC[C@@H]1c1ccc(Br)s1 ZINC000373181503 565274127 /nfs/dbraw/zinc/27/41/27/565274127.db2.gz UFXLQBXWZNRRBD-RWMBFGLXSA-N 0 1 378.332 3.060 10 0 GGAEMN COC[C@H](C)OC[C@H](O)CN1CCC[C@H]1c1ccc(Br)s1 ZINC000373181504 565274222 /nfs/dbraw/zinc/27/42/22/565274222.db2.gz UFXLQBXWZNRRBD-XQQFMLRXSA-N 0 1 378.332 3.060 10 0 GGAEMN O=C(N[C@H]1CCCN(CCCO)C1)c1sc2ccccc2c1Br ZINC000295588844 565275058 /nfs/dbraw/zinc/27/50/58/565275058.db2.gz WIXKMUDIOXLZRY-LBPRGKRZSA-N 0 1 397.338 3.240 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)CCCOc2ccccc2Br)n[nH]1 ZINC000161638124 565288619 /nfs/dbraw/zinc/28/86/19/565288619.db2.gz QQNAIWWMEAKXKA-GFCCVEGCSA-N 0 1 380.286 3.387 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)CCCOc2ccccc2Br)n[nH]1 ZINC000161638255 565288706 /nfs/dbraw/zinc/28/87/06/565288706.db2.gz QQNAIWWMEAKXKA-LBPRGKRZSA-N 0 1 380.286 3.387 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)[C@@H](C)CC(=O)c2cccc(Br)c2)n[nH]1 ZINC000161698299 565291490 /nfs/dbraw/zinc/29/14/90/565291490.db2.gz RARQMBYENZKXAX-RYUDHWBXSA-N 0 1 392.297 3.437 10 0 GGAEMN Cn1ccnc1[C@@H]1N(C(=O)c2[nH]nc3ccc(Br)cc32)CC1(C)C ZINC000295901896 565293063 /nfs/dbraw/zinc/29/30/63/565293063.db2.gz NKNPXIBZTKDZNW-AWEZNQCLSA-N 0 1 388.269 3.282 10 0 GGAEMN COc1ccc(CCC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1Br ZINC000161765263 565293293 /nfs/dbraw/zinc/29/32/93/565293293.db2.gz QHTDUJMQVNZPQP-NSHDSACASA-N 0 1 380.286 3.169 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2cc3c(cc(Br)cc3F)[nH]2)n[nH]1 ZINC000161783405 565293341 /nfs/dbraw/zinc/29/33/41/565293341.db2.gz LUCCHKPDCFJLJW-MRVPVSSYSA-N 0 1 379.233 3.462 10 0 GGAEMN CC[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@]2(CCOC2)O1 ZINC000373802988 565304087 /nfs/dbraw/zinc/30/40/87/565304087.db2.gz BYGGAEMWVCIAOZ-DYVFJYSZSA-N 0 1 380.286 3.095 10 0 GGAEMN Cc1nnc(SCCC(=O)N2C[C@H](c3cccc(Cl)c3)OC[C@@H]2C)[nH]1 ZINC000187049356 565304687 /nfs/dbraw/zinc/30/46/87/565304687.db2.gz FMYWRPAAYKREOG-XHDPSFHLSA-N 0 1 380.901 3.237 10 0 GGAEMN CC(C)(CC(=O)N[C@@H](c1nn[nH]n1)c1ccc(Cl)c(F)c1)C(F)(F)F ZINC000373819132 565304902 /nfs/dbraw/zinc/30/49/02/565304902.db2.gz JQPPOOZNSKPFKU-LLVKDONJSA-N 0 1 379.745 3.176 10 0 GGAEMN Cc1nc([C@@H]2CN(Cc3nc(-c4ccccc4Cl)cs3)CCO2)n[nH]1 ZINC000187090157 565308356 /nfs/dbraw/zinc/30/83/56/565308356.db2.gz UXRHUJWILQUGTA-HNNXBMFYSA-N 0 1 375.885 3.464 10 0 GGAEMN Cn1cc(CNC(=O)c2cn[nH]c2-c2ccc(Cl)s2)c(C(F)(F)F)n1 ZINC000187110979 565309985 /nfs/dbraw/zinc/30/99/85/565309985.db2.gz AIANMJDNCSRHKS-UHFFFAOYSA-N 0 1 389.790 3.474 10 0 GGAEMN COc1ccc(CCN[C@H](C(N)=O)c2cccc(Br)c2)c(Cl)c1 ZINC000162267522 565311410 /nfs/dbraw/zinc/31/14/10/565311410.db2.gz HQNYFJKNDNIGDK-INIZCTEOSA-N 0 1 397.700 3.470 10 0 GGAEMN Cc1cccnc1CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000296339349 565313845 /nfs/dbraw/zinc/31/38/45/565313845.db2.gz HTVVIRUWVABYHR-NSHDSACASA-N 0 1 388.320 3.238 10 0 GGAEMN Brc1cnn(C2CCN(Cc3ccc4c(c3)OCCO4)CC2)c1 ZINC000374011461 565314698 /nfs/dbraw/zinc/31/46/98/565314698.db2.gz YBVUUYRJFCLPBQ-UHFFFAOYSA-N 0 1 378.270 3.254 10 0 GGAEMN CCS(=O)(=O)c1c(Cl)cccc1CNCCCc1nc(C(C)C)no1 ZINC000187193384 565315794 /nfs/dbraw/zinc/31/57/94/565315794.db2.gz MHKFPRXJOZHCDE-UHFFFAOYSA-N 0 1 385.917 3.362 10 0 GGAEMN CCS(=O)(=O)c1c(Cl)cccc1CNCCCNC(=O)OC(C)(C)C ZINC000187202845 565315936 /nfs/dbraw/zinc/31/59/36/565315936.db2.gz JIJDSPVACCRHHK-UHFFFAOYSA-N 0 1 390.933 3.138 10 0 GGAEMN CS(=O)(=O)CCCCSc1nc(-c2ccccc2Br)n[nH]1 ZINC000162439299 565317390 /nfs/dbraw/zinc/31/73/90/565317390.db2.gz PCOHEBRFHSZCFA-UHFFFAOYSA-N 0 1 390.328 3.151 10 0 GGAEMN COCCN1CCN(Cc2cc(Br)cc3cccnc32)C[C@@H]1C ZINC000162559960 565320955 /nfs/dbraw/zinc/32/09/55/565320955.db2.gz SFFUOZVIBCEZFL-AWEZNQCLSA-N 0 1 378.314 3.150 10 0 GGAEMN CC(C)c1nc2n(n1)C[C@H](N[C@@H](C)c1ncc(Br)cc1F)CC2 ZINC000187328964 565324538 /nfs/dbraw/zinc/32/45/38/565324538.db2.gz DDTYCTJBYZDUAQ-CMPLNLGQSA-N 0 1 382.281 3.364 10 0 GGAEMN CC(C)c1nc2n(n1)C[C@@H](N[C@H](C)c1ncc(Br)cc1F)CC2 ZINC000187329021 565324563 /nfs/dbraw/zinc/32/45/63/565324563.db2.gz DDTYCTJBYZDUAQ-PWSUYJOCSA-N 0 1 382.281 3.364 10 0 GGAEMN C[C@H](N[C@H]1CCCN(c2cccnn2)C1)c1ncc(Br)cc1F ZINC000187344586 565324981 /nfs/dbraw/zinc/32/49/81/565324981.db2.gz JOYVKTBAXQXIJP-AAEUAGOBSA-N 0 1 380.265 3.093 10 0 GGAEMN C[C@@H](N[C@H]1CCCN(c2cccnn2)C1)c1ncc(Br)cc1F ZINC000187344603 565325044 /nfs/dbraw/zinc/32/50/44/565325044.db2.gz JOYVKTBAXQXIJP-YPMHNXCESA-N 0 1 380.265 3.093 10 0 GGAEMN COc1c(Br)cccc1CN[C@H]1CCCN(c2cccnc2)C1=O ZINC000187358251 565326973 /nfs/dbraw/zinc/32/69/73/565326973.db2.gz ZHTSTWMEIXMUHB-INIZCTEOSA-N 0 1 390.281 3.138 10 0 GGAEMN CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(Cl)c(Cl)c1[O-] ZINC000162875334 565330333 /nfs/dbraw/zinc/33/03/33/565330333.db2.gz JLSKIFLTEVZXMO-UHFFFAOYSA-N 0 1 375.296 3.129 10 0 GGAEMN Cn1cnc(-c2cccc(NC(=O)c3cc(Br)cc4nc[nH]c43)c2)n1 ZINC000374315371 565330944 /nfs/dbraw/zinc/33/09/44/565330944.db2.gz LPAJEPBXXWIRNW-UHFFFAOYSA-N 0 1 397.236 3.373 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3cc(Br)ccc3C)CCO2)n[nH]1 ZINC000162966305 565332209 /nfs/dbraw/zinc/33/22/09/565332209.db2.gz WNZYVHYVDDIWTL-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H](c1nccs1)C(F)(F)F)c1cccs1 ZINC000296723864 565332441 /nfs/dbraw/zinc/33/24/41/565332441.db2.gz BUILROWWTFSXNI-KOLCDFICSA-N 0 1 378.445 3.410 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)N[C@@H](c2nccs2)C(F)(F)F)n[nH]1 ZINC000296721047 565332532 /nfs/dbraw/zinc/33/25/32/565332532.db2.gz BPIOPIMLCTUOQA-CIUDSAMLSA-N 0 1 376.408 3.439 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H](c1nccs1)C(F)(F)F)c1cccs1 ZINC000296723869 565332590 /nfs/dbraw/zinc/33/25/90/565332590.db2.gz BUILROWWTFSXNI-MWLCHTKSSA-N 0 1 378.445 3.410 10 0 GGAEMN COc1cc(Br)ccc1CN[C@H](Cc1ccc(Cl)cc1)C(N)=O ZINC000187438806 565332697 /nfs/dbraw/zinc/33/26/97/565332697.db2.gz CMLGOJTWGPKMMV-OAHLLOKOSA-N 0 1 397.700 3.297 10 0 GGAEMN Cc1cc(Br)cc(NC(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c1 ZINC000187479495 565334655 /nfs/dbraw/zinc/33/46/55/565334655.db2.gz YHZJBFCVGGCGBM-CQSZACIVSA-N 0 1 396.329 3.475 10 0 GGAEMN Cc1cc(S(=O)(=O)NCCNCc2cnc(CC(C)C)s2)c(C)s1 ZINC000163113556 565336305 /nfs/dbraw/zinc/33/63/05/565336305.db2.gz XBRULPVZVQCHDC-UHFFFAOYSA-N 0 1 387.596 3.088 10 0 GGAEMN Cc1cc(Cl)ccc1NC(=O)CN[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000163157003 565338052 /nfs/dbraw/zinc/33/80/52/565338052.db2.gz NDSUPUDTPINPCN-CYBMUJFWSA-N 0 1 380.897 3.341 10 0 GGAEMN CC(C)n1cc(Br)cc1-c1nc([C@H]2CN3CCC[C@H]3CO2)no1 ZINC000273853021 565340068 /nfs/dbraw/zinc/34/00/68/565340068.db2.gz CISFHVHUJOHYJF-GXTWGEPZSA-N 0 1 381.274 3.417 10 0 GGAEMN CC(C)n1cc(Br)cc1-c1nc([C@H]2CN3CCC[C@@H]3CO2)no1 ZINC000273853030 565340445 /nfs/dbraw/zinc/34/04/45/565340445.db2.gz CISFHVHUJOHYJF-TZMCWYRMSA-N 0 1 381.274 3.417 10 0 GGAEMN C[C@@H](N[C@@H](C)C(=O)Nc1ccc(Cl)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000163248626 565341556 /nfs/dbraw/zinc/34/15/56/565341556.db2.gz FIFCUKVJNKGVOS-OLZOCXBDSA-N 0 1 380.897 3.421 10 0 GGAEMN C[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccc(Cl)cc1 ZINC000163248900 565341718 /nfs/dbraw/zinc/34/17/18/565341718.db2.gz FIFCUKVJNKGVOS-CHWSQXEVSA-N 0 1 380.897 3.421 10 0 GGAEMN O=S(=O)(c1cc(Cl)cc(C(F)(F)F)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000187594917 565344273 /nfs/dbraw/zinc/34/42/73/565344273.db2.gz QLFBIMGOSMESRY-LBPRGKRZSA-N 0 1 394.806 3.393 10 0 GGAEMN O=C(Nc1cccc(Br)c1)C1CCN(C[C@H](O)C(F)(F)F)CC1 ZINC000273909208 565344738 /nfs/dbraw/zinc/34/47/38/565344738.db2.gz GWGSOPKAHPXEQS-ZDUSSCGKSA-N 0 1 395.219 3.023 10 0 GGAEMN C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1Cl)c1ccc(S(C)(=O)=O)cc1 ZINC000163470601 565346144 /nfs/dbraw/zinc/34/61/44/565346144.db2.gz DWVGHZGCYILNNE-OLZOCXBDSA-N 0 1 380.897 3.421 10 0 GGAEMN CC(C)c1nc(CNC(=O)N[C@@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000296957249 565347570 /nfs/dbraw/zinc/34/75/70/565347570.db2.gz AUVPJPVQBSKUFL-NSHDSACASA-N 0 1 380.290 3.121 10 0 GGAEMN C[C@@H]1CN(Cc2csc(-c3cccc(Br)c3)n2)CCN1CCO ZINC000187664610 565348147 /nfs/dbraw/zinc/34/81/47/565348147.db2.gz KOYVVHKTDZEMDO-CYBMUJFWSA-N 0 1 396.354 3.071 10 0 GGAEMN C[C@H]1CN(Cc2csc(-c3cccc(Br)c3)n2)CCN1CCO ZINC000187664628 565348178 /nfs/dbraw/zinc/34/81/78/565348178.db2.gz KOYVVHKTDZEMDO-ZDUSSCGKSA-N 0 1 396.354 3.071 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cnn([C@@H](C)C3CC3)c2)c(Cl)c1 ZINC000187721583 565351322 /nfs/dbraw/zinc/35/13/22/565351322.db2.gz QRINOYHUHHITGE-JTQLQIEISA-N 0 1 383.857 3.095 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cnn([C@H](C)C3CC3)c2)c(Cl)c1 ZINC000187721604 565351573 /nfs/dbraw/zinc/35/15/73/565351573.db2.gz QRINOYHUHHITGE-SNVBAGLBSA-N 0 1 383.857 3.095 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)cc1Br ZINC000187830766 565358494 /nfs/dbraw/zinc/35/84/94/565358494.db2.gz ZZLDGAVYJXRJAH-HNNXBMFYSA-N 0 1 395.341 3.012 10 0 GGAEMN O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894632 565359564 /nfs/dbraw/zinc/35/95/64/565359564.db2.gz LTBXZSHDMYBWET-RHSMWYFYSA-N 0 1 388.309 3.488 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000375013107 565364587 /nfs/dbraw/zinc/36/45/87/565364587.db2.gz OUDXIAHROWNYSZ-UHFFFAOYSA-N 0 1 384.939 3.283 10 0 GGAEMN Cn1c(CNC(=O)c2cn[nH]c2-c2ccc(Cl)s2)nnc1C1CCC1 ZINC000187959161 565366858 /nfs/dbraw/zinc/36/68/58/565366858.db2.gz RPHWDDWMEAXYCD-UHFFFAOYSA-N 0 1 376.873 3.118 10 0 GGAEMN CC(C)(NCc1cn2cccnc2n1)[C@H](O)c1ccc(Br)cc1 ZINC000297312800 565367694 /nfs/dbraw/zinc/36/76/94/565367694.db2.gz BTXAXGJFRNRTPY-OAHLLOKOSA-N 0 1 375.270 3.094 10 0 GGAEMN NCc1cc(C(=O)N2CCC[C@@H]2c2ccccc2I)co1 ZINC000375252730 565378322 /nfs/dbraw/zinc/37/83/22/565378322.db2.gz LZPCMSQDAGMDPU-OAHLLOKOSA-N 0 1 396.228 3.320 10 0 GGAEMN Cc1cc(Br)ccc1CNCc1cccc(N2CCOCC2)n1 ZINC000274761194 565380924 /nfs/dbraw/zinc/38/09/24/565380924.db2.gz GXLFEKJEEHKLDF-UHFFFAOYSA-N 0 1 376.298 3.279 10 0 GGAEMN Ic1cccc(CN[C@@H](c2nnc[nH]2)c2ccccc2)c1 ZINC000375311911 565381106 /nfs/dbraw/zinc/38/11/06/565381106.db2.gz XNHOEPFFYPGBBG-OAHLLOKOSA-N 0 1 390.228 3.289 10 0 GGAEMN O=C(Nc1nc(-c2ccccn2)n[nH]1)C1(c2ccccc2Br)CC1 ZINC000188133253 565381730 /nfs/dbraw/zinc/38/17/30/565381730.db2.gz HFBCWBIODSYEEP-UHFFFAOYSA-N 0 1 384.237 3.300 10 0 GGAEMN Cc1cc(CNCc2cccc(N3CCOCC3)n2)ccc1Br ZINC000274798404 565382145 /nfs/dbraw/zinc/38/21/45/565382145.db2.gz NYHICKJCBZAIPC-UHFFFAOYSA-N 0 1 376.298 3.279 10 0 GGAEMN Brc1ccc2c(c1)CC[C@H]2NCc1cccc(N2CCOCC2)n1 ZINC000274824247 565382990 /nfs/dbraw/zinc/38/29/90/565382990.db2.gz YXWAZMZITOLCQU-GOSISDBHSA-N 0 1 388.309 3.458 10 0 GGAEMN Cc1c(Br)cccc1CC(=O)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000375458671 565389220 /nfs/dbraw/zinc/38/92/20/565389220.db2.gz QFUGBNOJVVYZFJ-QGZVFWFLSA-N 0 1 385.265 3.324 10 0 GGAEMN CCOc1cc(CN2CCC[C@@H](C3OCCO3)C2)cc(Br)c1O ZINC000297895826 565391975 /nfs/dbraw/zinc/39/19/75/565391975.db2.gz RHOLUCDQSVZEBZ-CYBMUJFWSA-N 0 1 386.286 3.138 10 0 GGAEMN CO[C@@H](C)c1noc(CN(C)C(=O)c2cn[nH]c2-c2ccc(Cl)s2)n1 ZINC000275130989 565393947 /nfs/dbraw/zinc/39/39/47/565393947.db2.gz JQVZZFVEAWMBEL-QMMMGPOBSA-N 0 1 381.845 3.154 10 0 GGAEMN O=C(CN[C@@H](c1nnc[nH]1)c1ccccc1)Nc1cc(Cl)ccc1Cl ZINC000375553517 565394090 /nfs/dbraw/zinc/39/40/90/565394090.db2.gz VNQOUKYXMPRVEW-MRXNPFEDSA-N 0 1 376.247 3.429 10 0 GGAEMN O=C(CN[C@H](c1nnc[nH]1)c1ccccc1)Nc1ccc(Cl)cc1Cl ZINC000375544231 565394869 /nfs/dbraw/zinc/39/48/69/565394869.db2.gz DGBDLRVGARUHHZ-INIZCTEOSA-N 0 1 376.247 3.429 10 0 GGAEMN COc1cc(C)c(S(=O)(=O)Nc2cccc3c2OCC[C@H]3O)cc1Cl ZINC000375648547 565399114 /nfs/dbraw/zinc/39/91/14/565399114.db2.gz XOGZYBHTZFEFMP-CQSZACIVSA-N 0 1 383.853 3.274 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1ccc(-c2nnc[nH]2)cc1 ZINC000188439240 565401094 /nfs/dbraw/zinc/40/10/94/565401094.db2.gz SSKJBGPIGRSFKT-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2scc(C)c2I)n[nH]1 ZINC000188441681 565401113 /nfs/dbraw/zinc/40/11/13/565401113.db2.gz KDVHFOHCOPXYGO-QMMMGPOBSA-N 0 1 389.262 3.054 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2scc(C)c2I)n[nH]1 ZINC000188441659 565401150 /nfs/dbraw/zinc/40/11/50/565401150.db2.gz KDVHFOHCOPXYGO-MRVPVSSYSA-N 0 1 389.262 3.054 10 0 GGAEMN CN(CC(=O)N1CCc2sccc2[C@@H]1c1cccs1)[C@@H]1CCC[C@H]1O ZINC000375750353 565404011 /nfs/dbraw/zinc/40/40/11/565404011.db2.gz LEQMUIRVRMKQPQ-SPYBWZPUSA-N 0 1 376.547 3.129 10 0 GGAEMN Cc1cc(C)n([C@H](C)C(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000171099527 565408699 /nfs/dbraw/zinc/40/86/99/565408699.db2.gz XZMBJLUCVFXZMO-LLVKDONJSA-N 0 1 389.257 3.247 10 0 GGAEMN CN(Cc1cc(-c2cnn(C)c2)no1)C[C@@H](O)c1cccc(Br)c1 ZINC000298355280 565410390 /nfs/dbraw/zinc/41/03/90/565410390.db2.gz MRHVVJDBRBIGIM-QGZVFWFLSA-N 0 1 391.269 3.003 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000188883367 565429787 /nfs/dbraw/zinc/42/97/87/565429787.db2.gz PDXTWBBVEQAPSC-ZWNOBZJWSA-N 0 1 378.270 3.478 10 0 GGAEMN Cc1nc(C[C@@H]2CCCN(C[C@H](O)c3cccc(Br)c3)C2)no1 ZINC000171407071 565430351 /nfs/dbraw/zinc/43/03/51/565430351.db2.gz CPSGIXYQQLFILT-BBRMVZONSA-N 0 1 380.286 3.129 10 0 GGAEMN CN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@H]1CC[C@H](O)CC1 ZINC000275909590 565431725 /nfs/dbraw/zinc/43/17/25/565431725.db2.gz LEWZXQLDFWKJKA-HDJSIYSDSA-N 0 1 378.270 3.215 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1ncc(Br)s1 ZINC000188929282 565433111 /nfs/dbraw/zinc/43/31/11/565433111.db2.gz DMTSZMKAPVZSSA-UHFFFAOYSA-N 0 1 395.326 3.218 10 0 GGAEMN CCOC(=O)c1csc(CCNCc2nc3ccc(Cl)cc3n2C)n1 ZINC000276090706 565435030 /nfs/dbraw/zinc/43/50/30/565435030.db2.gz HRCICXVNYBEHTP-UHFFFAOYSA-N 0 1 378.885 3.192 10 0 GGAEMN CCCn1nccc1NS(=O)(=O)c1cc(Cl)ccc1O[C@H](C)COC ZINC000188990957 565436088 /nfs/dbraw/zinc/43/60/88/565436088.db2.gz XIFHLSLPUMYMDB-GFCCVEGCSA-N 0 1 387.889 3.161 10 0 GGAEMN COc1ccc(O)cc1C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000189016276 565437876 /nfs/dbraw/zinc/43/78/76/565437876.db2.gz VPDUQUJZSRPBBW-UHFFFAOYSA-N 0 1 389.209 3.201 10 0 GGAEMN CN(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccc(Br)s1 ZINC000171606740 565439372 /nfs/dbraw/zinc/43/93/72/565439372.db2.gz APHZQGUXGPSHJH-HNNXBMFYSA-N 0 1 381.339 3.342 10 0 GGAEMN CCN(Cc1cccc(Br)c1)C(=O)NCCCCN1CCOCC1 ZINC000299408400 565449459 /nfs/dbraw/zinc/44/94/59/565449459.db2.gz AQBDUHFOMIKAFK-UHFFFAOYSA-N 0 1 398.345 3.093 10 0 GGAEMN O=S(=O)(NCCc1nnc(-c2ccccc2)[nH]1)c1c(Cl)cccc1Cl ZINC000189162734 565449606 /nfs/dbraw/zinc/44/96/06/565449606.db2.gz QEVNCAHBNBKUOJ-UHFFFAOYSA-N 0 1 397.287 3.300 10 0 GGAEMN Cc1noc([C@H]2CCCN(C(=O)c3[nH]nc4ccc(Br)cc43)C2)n1 ZINC000171773058 565450328 /nfs/dbraw/zinc/45/03/28/565450328.db2.gz URZKXPMZTLSCTB-JTQLQIEISA-N 0 1 390.241 3.037 10 0 GGAEMN CCOC(=O)[C@H](CC)N(C(=O)c1[nH]nc2ccc(Br)cc21)C1CC1 ZINC000189199944 565451544 /nfs/dbraw/zinc/45/15/44/565451544.db2.gz NUJQANJKVFGUEP-AWEZNQCLSA-N 0 1 394.269 3.272 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1ccc2c(c1)CC(=O)N2 ZINC000171962023 565460245 /nfs/dbraw/zinc/46/02/45/565460245.db2.gz YXIPEJRGRGTBKY-SECBINFHSA-N 0 1 399.248 3.311 10 0 GGAEMN COc1cc(Br)c(CN2CC[C@@H](c3cnn(C)c3)C2)cc1OC ZINC000172057408 565463638 /nfs/dbraw/zinc/46/36/38/565463638.db2.gz ONXIQDBOCXBZAW-GFCCVEGCSA-N 0 1 380.286 3.189 10 0 GGAEMN C[C@H](NC(=O)N1CCC(c2cnc[nH]2)CC1)c1ccc(Br)cn1 ZINC000377075255 565465144 /nfs/dbraw/zinc/46/51/44/565465144.db2.gz YCFWOMSOWDSVGZ-NSHDSACASA-N 0 1 378.274 3.217 10 0 GGAEMN COc1cc(CCNC(=O)c2n[nH]c3ccc(Br)cc32)ccc1O ZINC000172207389 565471376 /nfs/dbraw/zinc/47/13/76/565471376.db2.gz LZVJSCVXNGQVJT-UHFFFAOYSA-N 0 1 390.237 3.012 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(c3cnc[nH]3)CC2)cc1I ZINC000377274049 565472577 /nfs/dbraw/zinc/47/25/77/565472577.db2.gz VDQMMSBGRRTMIO-UHFFFAOYSA-N 0 1 395.244 3.343 10 0 GGAEMN CCn1cc(Br)cc1C(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000172230594 565473625 /nfs/dbraw/zinc/47/36/25/565473625.db2.gz NBUPDIJZMBTYFH-UHFFFAOYSA-N 0 1 382.277 3.401 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)CN1CCCC[C@@H]1c1cn[nH]c1 ZINC000172271860 565476199 /nfs/dbraw/zinc/47/61/99/565476199.db2.gz BTWUTYRHWTZJTR-NVXWUHKLSA-N 0 1 380.286 3.139 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)CN1CCCC[C@@H]1c1cn[nH]c1 ZINC000172271863 565476249 /nfs/dbraw/zinc/47/62/49/565476249.db2.gz BTWUTYRHWTZJTR-DOTOQJQBSA-N 0 1 380.286 3.139 10 0 GGAEMN Brc1c(CN[C@H](c2nnc[nH]2)c2ccccc2)nc2ccccn12 ZINC000377614684 565488083 /nfs/dbraw/zinc/48/80/83/565488083.db2.gz JQPOLZOPRBBFQV-HNNXBMFYSA-N 0 1 383.253 3.094 10 0 GGAEMN C[C@@H](NC[C@H](O)CC(F)(F)F)c1cc2c(cc1Br)OCCO2 ZINC000189833698 565490982 /nfs/dbraw/zinc/49/09/82/565490982.db2.gz KCLPKZBIJFBLNL-RKDXNWHRSA-N 0 1 384.192 3.184 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(Cl)cc(Br)c1F ZINC000277455898 565497754 /nfs/dbraw/zinc/49/77/54/565497754.db2.gz ARBGZXWWJSZZGW-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN CCOc1cc(Br)ccc1NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000377810792 565499425 /nfs/dbraw/zinc/49/94/25/565499425.db2.gz FGEYKQHBWVNURK-NSHDSACASA-N 0 1 379.258 3.250 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H](C)Cc1cc(C)[nH]n1 ZINC000189965742 565499721 /nfs/dbraw/zinc/49/97/21/565499721.db2.gz DWNHZNNIMWJYNR-JQWIXIFHSA-N 0 1 395.301 3.481 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000377845167 565503226 /nfs/dbraw/zinc/50/32/26/565503226.db2.gz OXJCRKFKAAOYQA-CJNGLKHVSA-N 0 1 376.444 3.170 10 0 GGAEMN CN1CCN(c2ccc(Cl)cc2NC(=O)c2cn3ccnc3s2)CC1 ZINC000190045585 565504106 /nfs/dbraw/zinc/50/41/06/565504106.db2.gz BHVMHRFXCHZWBK-UHFFFAOYSA-N 0 1 375.885 3.053 10 0 GGAEMN O=C(CN1CCN2CCCC[C@@H]2C1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000172805407 565505300 /nfs/dbraw/zinc/50/53/00/565505300.db2.gz ITSUIMQTKCFNNN-CYBMUJFWSA-N 0 1 375.822 3.467 10 0 GGAEMN O=C(N[C@H]1CCc2c1cccc2Br)N[C@H]1CCc2nc[nH]c2C1 ZINC000378051237 565510614 /nfs/dbraw/zinc/51/06/14/565510614.db2.gz HJDXFQKBAHAHPT-HZMBPMFUSA-N 0 1 375.270 3.016 10 0 GGAEMN Cc1c(Cl)cccc1NC(=O)CN[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000172892240 565510880 /nfs/dbraw/zinc/51/08/80/565510880.db2.gz YIBLDZOAPKFJBO-CYBMUJFWSA-N 0 1 380.897 3.341 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)NC1(c2cccc(Br)c2)CCC1 ZINC000378121238 565512968 /nfs/dbraw/zinc/51/29/68/565512968.db2.gz WDGKEOJFVKJEFI-AWEZNQCLSA-N 0 1 389.297 3.408 10 0 GGAEMN O=C(NCC1(c2cccc(Br)c2)CC1)N[C@H]1CCc2nc[nH]c2C1 ZINC000378125035 565513216 /nfs/dbraw/zinc/51/32/16/565513216.db2.gz BMOBVLKFYUBSSQ-AWEZNQCLSA-N 0 1 389.297 3.061 10 0 GGAEMN Cc1cc(Br)ccc1SCC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378198825 565515503 /nfs/dbraw/zinc/51/55/03/565515503.db2.gz HJMZKAFNNJJLPY-LBPRGKRZSA-N 0 1 380.311 3.246 10 0 GGAEMN O=C(CCC(F)(F)F)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000172996933 565518120 /nfs/dbraw/zinc/51/81/20/565518120.db2.gz UJNPGRWZDRLUIT-UHFFFAOYSA-N 0 1 377.164 3.193 10 0 GGAEMN O=C(CCC(F)(F)F)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000172996933 565518124 /nfs/dbraw/zinc/51/81/24/565518124.db2.gz UJNPGRWZDRLUIT-UHFFFAOYSA-N 0 1 377.164 3.193 10 0 GGAEMN O=C1COc2cc(NS(=O)(=O)c3ccc(Cl)c(F)c3Cl)ccc2N1 ZINC000190248860 565519151 /nfs/dbraw/zinc/51/91/51/565519151.db2.gz ZJYRFVZWDZQYEH-UHFFFAOYSA-N 0 1 391.207 3.264 10 0 GGAEMN CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cn[nH]c1-c1ccc(Cl)s1 ZINC000190269498 565519530 /nfs/dbraw/zinc/51/95/30/565519530.db2.gz NPZZANISEBXGDW-JTQLQIEISA-N 0 1 376.873 3.210 10 0 GGAEMN Cc1cc(C(=O)N[C@H]2CCc3nc[nH]c3C2)c2ccc(Br)cc2n1 ZINC000378304093 565520126 /nfs/dbraw/zinc/52/01/26/565520126.db2.gz GNEBUHCTJFKPOE-LBPRGKRZSA-N 0 1 385.265 3.316 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378310071 565521688 /nfs/dbraw/zinc/52/16/88/565521688.db2.gz NZDHCKOLPYZBGF-JSGCOSHPSA-N 0 1 376.298 3.415 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)c3[nH]c4ccc(Cl)cc4c3Cl)CCO2)n[nH]1 ZINC000173086455 565525375 /nfs/dbraw/zinc/52/53/75/565525375.db2.gz IZYWNJINSCYDJS-GFCCVEGCSA-N 0 1 380.235 3.115 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)CSc3cc(Cl)ccc3Cl)CCO2)n[nH]1 ZINC000173085395 565525684 /nfs/dbraw/zinc/52/56/84/565525684.db2.gz SEEKCWNTCMKVND-GFCCVEGCSA-N 0 1 387.292 3.112 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)c3csc(-c4ccc(Cl)s4)n3)CCO2)n[nH]1 ZINC000173091378 565526900 /nfs/dbraw/zinc/52/69/00/565526900.db2.gz AXSVCXGAJXZVAE-JTQLQIEISA-N 0 1 395.897 3.165 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)CCSc3ccccc3Cl)CCO2)n[nH]1 ZINC000173095544 565527019 /nfs/dbraw/zinc/52/70/19/565527019.db2.gz DSVZLDGSYJFROP-ZDUSSCGKSA-N 0 1 380.901 3.103 10 0 GGAEMN Clc1ccccc1-c1nnc(N2CCC(CN3CCOCC3)CC2)s1 ZINC000302107067 565530459 /nfs/dbraw/zinc/53/04/59/565530459.db2.gz NZFSZFGLPWZMKT-UHFFFAOYSA-N 0 1 378.929 3.407 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NCC(=O)N(C)CC(F)(F)F ZINC000190429354 565532101 /nfs/dbraw/zinc/53/21/01/565532101.db2.gz MBEJKQRXGWSQMW-SECBINFHSA-N 0 1 383.208 3.129 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NCCCS(=O)(=O)C(C)C ZINC000190429553 565532210 /nfs/dbraw/zinc/53/22/10/565532210.db2.gz IGAPIFNNBYLYMA-GFCCVEGCSA-N 0 1 378.332 3.322 10 0 GGAEMN COc1ccc(Br)c(CN(C)C2CCN(c3cnccn3)CC2)c1 ZINC000378556498 565534324 /nfs/dbraw/zinc/53/43/24/565534324.db2.gz ALXLCPQVQNPXJT-UHFFFAOYSA-N 0 1 391.313 3.349 10 0 GGAEMN Cn1ncc(Br)c1CNC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000379632505 565538326 /nfs/dbraw/zinc/53/83/26/565538326.db2.gz NTFVCLDUFOMLOW-INIZCTEOSA-N 0 1 377.330 3.327 10 0 GGAEMN Cc1ncsc1C[N@H+](C)C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000190529345 565540390 /nfs/dbraw/zinc/54/03/90/565540390.db2.gz KCTGINHWMIZFPO-ZDUSSCGKSA-N 0 1 379.913 3.405 10 0 GGAEMN Cc1ncsc1C[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(Cl)ccc2[O-])C1 ZINC000190529345 565540392 /nfs/dbraw/zinc/54/03/92/565540392.db2.gz KCTGINHWMIZFPO-ZDUSSCGKSA-N 0 1 379.913 3.405 10 0 GGAEMN CC(C)n1cc(Br)cc1C(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000173252447 565540829 /nfs/dbraw/zinc/54/08/29/565540829.db2.gz UPCSGUQONXVQMH-CQSZACIVSA-N 0 1 398.345 3.157 10 0 GGAEMN CC[C@@H]1CN(c2nnc(Cc3ccc(Cl)cc3)s2)CCN1C[C@H](C)O ZINC000302402658 565540857 /nfs/dbraw/zinc/54/08/57/565540857.db2.gz FXYNGQKLXOAURD-XJKSGUPXSA-N 0 1 380.945 3.064 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Br)cc2Cl)CCN1C ZINC000173269803 565542281 /nfs/dbraw/zinc/54/22/81/565542281.db2.gz PUBOOBQSTJJYGJ-ZYHUDNBSSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C ZINC000173278845 565543021 /nfs/dbraw/zinc/54/30/21/565543021.db2.gz XVZJLDHDASLCKC-MNOVXSKESA-N 0 1 384.851 3.462 10 0 GGAEMN Cc1cc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(C)cc1Br ZINC000173280359 565543050 /nfs/dbraw/zinc/54/30/50/565543050.db2.gz JQQGGNMIDLDMAU-ZIAGYGMSSA-N 0 1 389.359 3.169 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)CCN1C ZINC000173276642 565543413 /nfs/dbraw/zinc/54/34/13/565543413.db2.gz MFAFDTTVRNEBDF-WDEREUQCSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C ZINC000173278833 565543437 /nfs/dbraw/zinc/54/34/37/565543437.db2.gz XVZJLDHDASLCKC-WDEREUQCSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)CCN1C ZINC000173273620 565543647 /nfs/dbraw/zinc/54/36/47/565543647.db2.gz PSFAQNGMALQESI-WDEREUQCSA-N 0 1 382.860 3.045 10 0 GGAEMN CN(C)[C@H](CNc1nnc(Cc2ccc(Cl)cc2)s1)c1cnn(C)c1 ZINC000302553446 565545989 /nfs/dbraw/zinc/54/59/89/565545989.db2.gz XAAOYAHXTOCQJQ-OAHLLOKOSA-N 0 1 376.917 3.231 10 0 GGAEMN COc1ccc(S(=O)(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)cc1 ZINC000173323615 565547969 /nfs/dbraw/zinc/54/79/69/565547969.db2.gz DCHVOPQXYLWAPM-RDTXWAMCSA-N 0 1 380.535 3.118 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2ccccc2F)[C@@H]1c1cccs1 ZINC000173323289 565548209 /nfs/dbraw/zinc/54/82/09/565548209.db2.gz NUZYQAJNQJEFER-RDTXWAMCSA-N 0 1 382.526 3.390 10 0 GGAEMN COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)cc1 ZINC000173323631 565548298 /nfs/dbraw/zinc/54/82/98/565548298.db2.gz DCHVOPQXYLWAPM-KBXCAEBGSA-N 0 1 380.535 3.118 10 0 GGAEMN CCc1n[nH]c(C2CCN(CC(=O)Nc3ccc(Cl)cc3Cl)CC2)n1 ZINC000190721294 565554072 /nfs/dbraw/zinc/55/40/72/565554072.db2.gz YNBXMPNFZXYFOS-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN CCc1nnc(C2CCN(CC(=O)Nc3ccc(Cl)cc3Cl)CC2)[nH]1 ZINC000190721294 565554077 /nfs/dbraw/zinc/55/40/77/565554077.db2.gz YNBXMPNFZXYFOS-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)Nc1cc(-n2cccn2)nc(N)n1 ZINC000302743539 565554067 /nfs/dbraw/zinc/55/40/67/565554067.db2.gz DOAGAVFWERITMM-JTQLQIEISA-N 0 1 389.257 3.189 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cc(Cl)ccc2-n2cccn2)ccc1F ZINC000190731136 565555256 /nfs/dbraw/zinc/55/52/56/565555256.db2.gz UVGIPXAFTQHZQB-UHFFFAOYSA-N 0 1 381.816 3.474 10 0 GGAEMN COC(=O)[C@@]1(C)CCCN1C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000190743690 565556089 /nfs/dbraw/zinc/55/60/89/565556089.db2.gz SFZPQMCSPATIIV-QGZVFWFLSA-N 0 1 392.253 3.007 10 0 GGAEMN Cc1ccc(-n2ncc(N3CCN4CCC3CC4)c(Cl)c2=O)cc1Cl ZINC000302790567 565556898 /nfs/dbraw/zinc/55/68/98/565556898.db2.gz YFTBQNSUVLEALL-UHFFFAOYSA-N 0 1 379.291 3.132 10 0 GGAEMN C[C@@H](CN(C)Cc1ccccc1)NS(=O)(=O)c1ccccc1Br ZINC000390733276 565557095 /nfs/dbraw/zinc/55/70/95/565557095.db2.gz ZITQVQUUIJMBCS-AWEZNQCLSA-N 0 1 397.338 3.248 10 0 GGAEMN Clc1sc(CNCc2cccnc2-n2cncn2)cc1Br ZINC000190766919 565557542 /nfs/dbraw/zinc/55/75/42/565557542.db2.gz VEFSMCBKDVPTLS-UHFFFAOYSA-N 0 1 384.690 3.430 10 0 GGAEMN COc1cc(Br)c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(=O)[O-])cc1OC ZINC000390991815 565560249 /nfs/dbraw/zinc/56/02/49/565560249.db2.gz GZTZLEZVKKBPCY-IETSOEAISA-N 0 1 384.270 3.151 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1nc(-c2ccco2)n[nH]1 ZINC000173487353 565560984 /nfs/dbraw/zinc/56/09/84/565560984.db2.gz KXHOVWXXUYGLHU-UHFFFAOYSA-N 0 1 377.198 3.017 10 0 GGAEMN CN(Cc1ccc(Cl)s1)C(=O)C[N@H+]1Cc2ccccc2[C@@H](C(=O)[O-])C1 ZINC000392621344 565565304 /nfs/dbraw/zinc/56/53/04/565565304.db2.gz NHQCYTUZJSTFGF-HNNXBMFYSA-N 0 1 378.881 3.044 10 0 GGAEMN CN(Cc1ccc(Cl)s1)C(=O)C[N@@H+]1Cc2ccccc2[C@@H](C(=O)[O-])C1 ZINC000392621344 565565309 /nfs/dbraw/zinc/56/53/09/565565309.db2.gz NHQCYTUZJSTFGF-HNNXBMFYSA-N 0 1 378.881 3.044 10 0 GGAEMN Cc1ccc(-c2nc(CCNCc3c(Br)cnn3C)co2)cc1 ZINC000278582412 565567203 /nfs/dbraw/zinc/56/72/03/565567203.db2.gz YPCMFTZWDZFEKQ-UHFFFAOYSA-N 0 1 375.270 3.478 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)c3sc4ccccc4c3Cl)CCO2)n[nH]1 ZINC000173559217 565567588 /nfs/dbraw/zinc/56/75/88/565567588.db2.gz SBOJQMZFLAENDU-NSHDSACASA-N 0 1 376.869 3.449 10 0 GGAEMN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173660681 565574929 /nfs/dbraw/zinc/57/49/29/565574929.db2.gz WACHWZHZXKQZSM-DGCLKSJQSA-N 0 1 378.270 3.190 10 0 GGAEMN Cc1nc([C@H](NC(=O)c2nc(Br)ccc2C)c2ccccc2)n[nH]1 ZINC000190993671 565576154 /nfs/dbraw/zinc/57/61/54/565576154.db2.gz IPMACLZLLVAIIC-OAHLLOKOSA-N 0 1 386.253 3.098 10 0 GGAEMN Cn1ncc(NC[C@]2(C)CCCN2Cc2ccccc2)c(Br)c1=O ZINC000397925718 565576331 /nfs/dbraw/zinc/57/63/31/565576331.db2.gz BMBRRYCVGPEQQL-SFHVURJKSA-N 0 1 391.313 3.009 10 0 GGAEMN Cn1ncc(NC[C@@]2(C)CCCN2Cc2ccccc2)c(Br)c1=O ZINC000397925716 565576459 /nfs/dbraw/zinc/57/64/59/565576459.db2.gz BMBRRYCVGPEQQL-GOSISDBHSA-N 0 1 391.313 3.009 10 0 GGAEMN Cc1nc([C@@H](NC(=O)c2nc(Br)ccc2C)c2ccccc2)n[nH]1 ZINC000190993656 565576517 /nfs/dbraw/zinc/57/65/17/565576517.db2.gz IPMACLZLLVAIIC-HNNXBMFYSA-N 0 1 386.253 3.098 10 0 GGAEMN COCC[C@@H](CO)N[C@@H](C)c1ccc(Br)cc1Br ZINC000305946051 565576707 /nfs/dbraw/zinc/57/67/07/565576707.db2.gz SPOUWJIWTMOLQA-ONGXEEELSA-N 0 1 381.108 3.260 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)CCSc2nnc(C)[nH]2)cc1Br ZINC000173706223 565576977 /nfs/dbraw/zinc/57/69/77/565576977.db2.gz DOBHBOGMPAOWNZ-VIFPVBQESA-N 0 1 399.314 3.244 10 0 GGAEMN C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[C@]2(CNC(=O)C2)C1 ZINC000278833850 565579408 /nfs/dbraw/zinc/57/94/08/565579408.db2.gz IPIQRURKKQRXFV-BTDLBPIBSA-N 0 1 381.263 3.316 10 0 GGAEMN Cn1ncc(Br)c1CNCCCc1nc(-c2ccc(F)cc2)no1 ZINC000278849775 565580503 /nfs/dbraw/zinc/58/05/03/565580503.db2.gz WURSQWFKKPDXFG-UHFFFAOYSA-N 0 1 394.248 3.094 10 0 GGAEMN Brc1cccnc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@H]21 ZINC000404170417 565582959 /nfs/dbraw/zinc/58/29/59/565582959.db2.gz XOTKQUYJINJMDN-QZTJIDSGSA-N 0 1 388.309 3.324 10 0 GGAEMN Brc1cccnc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@@H]21 ZINC000404170421 565583087 /nfs/dbraw/zinc/58/30/87/565583087.db2.gz XOTKQUYJINJMDN-ROUUACIJSA-N 0 1 388.309 3.324 10 0 GGAEMN O=C1C[C@@]2(CCN(Cc3csc(-c4cccc(Br)c4)n3)C2)CN1 ZINC000278973137 565587330 /nfs/dbraw/zinc/58/73/30/565587330.db2.gz YCELZQROBLGTPW-KRWDZBQOSA-N 0 1 392.322 3.285 10 0 GGAEMN O=C1C[C@]2(CCN(Cc3csc(-c4ccc(Br)cc4)n3)C2)CN1 ZINC000278971497 565587530 /nfs/dbraw/zinc/58/75/30/565587530.db2.gz XWGZDCYYFHKASS-QGZVFWFLSA-N 0 1 392.322 3.285 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2ccc(Cl)c(F)c2Cl)n[nH]1 ZINC000407974820 565588080 /nfs/dbraw/zinc/58/80/80/565588080.db2.gz DEBGZAHEXLSVLM-SNVBAGLBSA-N 0 1 393.271 3.475 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3cccc(Br)c3)C2)n[nH]1 ZINC000407975290 565588412 /nfs/dbraw/zinc/58/84/12/565588412.db2.gz FZONTFCGJWJDOF-LBPRGKRZSA-N 0 1 384.299 3.049 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2ccc(Br)c(C)c2)n[nH]1 ZINC000407971571 565588577 /nfs/dbraw/zinc/58/85/77/565588577.db2.gz BVRQOODGURUUEV-CQSZACIVSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2ccc(C)c(Br)c2)n[nH]1 ZINC000407976563 565588660 /nfs/dbraw/zinc/58/86/60/565588660.db2.gz LOIFVJTXIASHHC-CQSZACIVSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2cc(Cl)ccc2Cl)n[nH]1 ZINC000407977659 565589180 /nfs/dbraw/zinc/58/91/80/565589180.db2.gz YQWJKHRQQGTWON-LBPRGKRZSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1cc([C@@H]2CCCN(C(=O)[C@H]3COc4ccc(Br)cc43)C2)n[nH]1 ZINC000407981334 565589253 /nfs/dbraw/zinc/58/92/53/565589253.db2.gz SFJZPQZORPYEIJ-DOMZBBRYSA-N 0 1 390.281 3.363 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3cccc(Br)c3C)C2)n[nH]1 ZINC000407978016 565589379 /nfs/dbraw/zinc/58/93/79/565589379.db2.gz VDOXGKKSZCSPCE-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3ccc(Br)c(C)c3)C2)n[nH]1 ZINC000407977123 565589956 /nfs/dbraw/zinc/58/99/56/565589956.db2.gz PXHXSEDRHFHWFP-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)n[nH]1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000408023657 565591157 /nfs/dbraw/zinc/59/11/57/565591157.db2.gz UCPFCKFWWNBUGF-OAHLLOKOSA-N 0 1 389.297 3.150 10 0 GGAEMN COc1cc(Cl)c(Cl)cc1NC(=O)N1CCO[C@@H](c2n[nH]c(C)n2)C1 ZINC000191273255 565592102 /nfs/dbraw/zinc/59/21/02/565592102.db2.gz WTYBQVDOPYBQED-CYBMUJFWSA-N 0 1 386.239 3.034 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCC[C@@H]1[C@H]1CCCO1 ZINC000408091799 565594684 /nfs/dbraw/zinc/59/46/84/565594684.db2.gz XLTXUFRGNBXATC-HZPDHXFCSA-N 0 1 391.265 3.074 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)C[C@@H]1C ZINC000408209895 565599647 /nfs/dbraw/zinc/59/96/47/565599647.db2.gz WSPZDXSLCJDRFQ-MQIPJXDCSA-N 0 1 386.323 3.077 10 0 GGAEMN CC(C)(C)[C@@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@H]1O ZINC000408211918 565599794 /nfs/dbraw/zinc/59/97/94/565599794.db2.gz SAMPNHMTUJLFIZ-OCCSQVGLSA-N 0 1 380.286 3.195 10 0 GGAEMN C[C@H]1[C@H](C)N(C(=O)Nc2cnn(-c3ncc(Cl)cc3Cl)c2)CCN1C ZINC000408209361 565599840 /nfs/dbraw/zinc/59/98/40/565599840.db2.gz ZXYYGNVUBYELFC-QWRGUYRKSA-N 0 1 383.283 3.130 10 0 GGAEMN COc1ccc(-c2n[nH]c(SC[C@@H](O)C(F)(F)F)n2)cc1Br ZINC000191390939 565600140 /nfs/dbraw/zinc/60/01/40/565600140.db2.gz KPOMZQLBQPNARG-SECBINFHSA-N 0 1 398.204 3.258 10 0 GGAEMN Cc1nc([C@@H]2CN(Cc3cc(Br)c(Cl)s3)CCO2)n[nH]1 ZINC000191425765 565602592 /nfs/dbraw/zinc/60/25/92/565602592.db2.gz MTFPNVGIRNWBPB-JTQLQIEISA-N 0 1 377.695 3.164 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H](C)Cc2ccc(Br)cc2)[nH]1 ZINC000173977002 565604548 /nfs/dbraw/zinc/60/45/48/565604548.db2.gz PSFAYIAPKNUPPR-SNVBAGLBSA-N 0 1 383.315 3.105 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN(CC2CC2)CC1 ZINC000191437694 565604913 /nfs/dbraw/zinc/60/49/13/565604913.db2.gz RVPPLHBHDWBZDH-ZDUSSCGKSA-N 0 1 396.329 3.256 10 0 GGAEMN CCOC(=O)C1CCC(O)(C[N@@H+](C)Cc2csc(Br)c2)CC1 ZINC000191442705 565605128 /nfs/dbraw/zinc/60/51/28/565605128.db2.gz GNEOLVMZNUHFRN-UHFFFAOYSA-N 0 1 390.343 3.427 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN(CC2CC2)CC1 ZINC000191437711 565605173 /nfs/dbraw/zinc/60/51/73/565605173.db2.gz RVPPLHBHDWBZDH-CYBMUJFWSA-N 0 1 396.329 3.256 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000191441054 565605220 /nfs/dbraw/zinc/60/52/20/565605220.db2.gz LUTRQSMWGYUFJH-CFVMTHIKSA-N 0 1 396.329 3.397 10 0 GGAEMN C[C@@H]1CCSCCN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000408443012 565609401 /nfs/dbraw/zinc/60/94/01/565609401.db2.gz OAWRFEKIZJXHMK-SNVBAGLBSA-N 0 1 381.295 3.258 10 0 GGAEMN C[C@@H]1CCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CCS1 ZINC000408440513 565609944 /nfs/dbraw/zinc/60/99/44/565609944.db2.gz CPISLUGITJAEJE-SNVBAGLBSA-N 0 1 381.295 3.258 10 0 GGAEMN COC(=O)c1ccc(CNCc2cc(Br)cc3c2OCC3)cc1 ZINC000322689797 565610177 /nfs/dbraw/zinc/61/01/77/565610177.db2.gz OFCFYLGUFYYNSR-UHFFFAOYSA-N 0 1 376.250 3.460 10 0 GGAEMN CC[C@H](O)CN1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)CC1 ZINC000174083060 565611118 /nfs/dbraw/zinc/61/11/18/565611118.db2.gz SABVYIMIVPBGJV-SFHVURJKSA-N 0 1 379.957 3.276 10 0 GGAEMN COCCN(C)c1ccc(CNCc2ccc(Br)cc2OC)cn1 ZINC000191617304 565616968 /nfs/dbraw/zinc/61/69/68/565616968.db2.gz MKRWADBSZKIRLX-UHFFFAOYSA-N 0 1 394.313 3.225 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)CN1CCC(C(F)(F)F)CC1 ZINC000174191181 565620290 /nfs/dbraw/zinc/62/02/90/565620290.db2.gz CDLZNYQCVBSKNG-CYBMUJFWSA-N 0 1 382.220 3.463 10 0 GGAEMN O=C1[C@H](NCc2cccc(Br)c2)CCN1Cc1ccc(F)cc1 ZINC000191760703 565628923 /nfs/dbraw/zinc/62/89/23/565628923.db2.gz GOAPMZIYHYKCCQ-QGZVFWFLSA-N 0 1 377.257 3.479 10 0 GGAEMN COC(=O)c1nc(N[C@H]2CCOc3c(Br)cccc32)sc1C ZINC000409636931 565628918 /nfs/dbraw/zinc/62/89/18/565628918.db2.gz VVQMBCVBZDUEBY-NSHDSACASA-N 0 1 383.267 3.358 10 0 GGAEMN C[C@@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cccnc1 ZINC000174506022 565641126 /nfs/dbraw/zinc/64/11/26/565641126.db2.gz KSYHAUFLSZGRQF-LLVKDONJSA-N 0 1 386.253 3.049 10 0 GGAEMN C[C@@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccnc1 ZINC000174506022 565641132 /nfs/dbraw/zinc/64/11/32/565641132.db2.gz KSYHAUFLSZGRQF-LLVKDONJSA-N 0 1 386.253 3.049 10 0 GGAEMN NC(=O)[C@@H](Cc1ccc(F)cc1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409874565 565645432 /nfs/dbraw/zinc/64/54/32/565645432.db2.gz KIRWCLYWANHYIA-HZPDHXFCSA-N 0 1 393.256 3.098 10 0 GGAEMN NC(=O)[C@H](Cc1ccc(F)cc1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409874563 565645735 /nfs/dbraw/zinc/64/57/35/565645735.db2.gz KIRWCLYWANHYIA-CVEARBPZSA-N 0 1 393.256 3.098 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(C3SCCS3)cc2)CCN1C[C@@H](C)O ZINC000174597655 565646291 /nfs/dbraw/zinc/64/62/91/565646291.db2.gz NNMNWPMPYFSJNV-RHSMWYFYSA-N 0 1 380.579 3.082 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Br)ccc2Cl)CCN1C[C@@H](C)O ZINC000174604211 565646568 /nfs/dbraw/zinc/64/65/68/565646568.db2.gz WUJWUYYVABZAMX-DGCLKSJQSA-N 0 1 389.721 3.020 10 0 GGAEMN Cc1c(Br)ccc(C(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c1F ZINC000280044564 565648265 /nfs/dbraw/zinc/64/82/65/565648265.db2.gz GPYHKCWPSTYSKP-LBPRGKRZSA-N 0 1 399.304 3.222 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Cl)ccc2Br)CCN1C[C@@H](C)O ZINC000174622529 565648581 /nfs/dbraw/zinc/64/85/81/565648581.db2.gz HFOCZYMKYVWMFM-YPMHNXCESA-N 0 1 389.721 3.020 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Br)cc2Cl)CCN1C[C@@H](C)O ZINC000174636782 565648801 /nfs/dbraw/zinc/64/88/01/565648801.db2.gz GCJDMSWQEXRHCT-YPMHNXCESA-N 0 1 389.721 3.020 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Cl)ccc2Br)CCN1C[C@@H](C)O ZINC000174622517 565648841 /nfs/dbraw/zinc/64/88/41/565648841.db2.gz HFOCZYMKYVWMFM-DGCLKSJQSA-N 0 1 389.721 3.020 10 0 GGAEMN COCCN(Cc1ccc(F)cc1Cl)C(=O)CCSc1nnc(C)[nH]1 ZINC000174704695 565653202 /nfs/dbraw/zinc/65/32/02/565653202.db2.gz FBZNBRUPAFQZPM-UHFFFAOYSA-N 0 1 386.880 3.063 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)[C@H]1C ZINC000174922271 565667760 /nfs/dbraw/zinc/66/77/60/565667760.db2.gz XETPODSNAKRDTG-MNOVXSKESA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)[C@H]1C ZINC000174922271 565667763 /nfs/dbraw/zinc/66/77/63/565667763.db2.gz XETPODSNAKRDTG-MNOVXSKESA-N 0 1 378.274 3.174 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000329548886 565669664 /nfs/dbraw/zinc/66/96/64/565669664.db2.gz BJDVRCAUFJOUOZ-ZBFHGGJFSA-N 0 1 390.281 3.499 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000329548884 565670103 /nfs/dbraw/zinc/67/01/03/565670103.db2.gz BJDVRCAUFJOUOZ-GOEBONIOSA-N 0 1 390.281 3.499 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000329548883 565670233 /nfs/dbraw/zinc/67/02/33/565670233.db2.gz BJDVRCAUFJOUOZ-GDBMZVCRSA-N 0 1 390.281 3.499 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)c(Br)c2)CCN1C ZINC000192214513 565670505 /nfs/dbraw/zinc/67/05/05/565670505.db2.gz FNESZTSJZSOJIB-WDEREUQCSA-N 0 1 395.750 3.206 10 0 GGAEMN COc1cc(C(=O)N(C)C)ccc1NS(=O)(=O)c1cccc(Cl)c1C ZINC000174992125 565672797 /nfs/dbraw/zinc/67/27/97/565672797.db2.gz MPGMWLKWFUYQBJ-UHFFFAOYSA-N 0 1 382.869 3.160 10 0 GGAEMN CCN(CC(=O)OC(C)(C)C)C1CCN(c2cncc(Br)c2)CC1 ZINC000192240635 565673236 /nfs/dbraw/zinc/67/32/36/565673236.db2.gz MNQGPSNHMWIMNE-UHFFFAOYSA-N 0 1 398.345 3.477 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)[C@H]2CCO[C@H](C)C2)c2cccs2)CC1 ZINC000329629230 565674510 /nfs/dbraw/zinc/67/45/10/565674510.db2.gz VYRFOPGEJZATDB-IXDOHACOSA-N 0 1 386.583 3.008 10 0 GGAEMN C[C@H]1C[N@H+](C2CCN(C(=O)Nc3cc(Cl)c(N)c(Cl)c3)CC2)CCO1 ZINC000192295338 565677195 /nfs/dbraw/zinc/67/71/95/565677195.db2.gz FZAZPEUPORAGFP-NSHDSACASA-N 0 1 387.311 3.293 10 0 GGAEMN C[C@H]1CN(C2CCN(C(=O)Nc3cc(Cl)c(N)c(Cl)c3)CC2)CCO1 ZINC000192295338 565677199 /nfs/dbraw/zinc/67/71/99/565677199.db2.gz FZAZPEUPORAGFP-NSHDSACASA-N 0 1 387.311 3.293 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2n[nH]c3ccc(Br)cc32)[C@H]2CCCO[C@H]21 ZINC000329733485 565677778 /nfs/dbraw/zinc/67/77/78/565677778.db2.gz QUHIJJWMJMTNSD-VCTAVGKDSA-N 0 1 378.270 3.259 10 0 GGAEMN CC[C@@H]1CN(C)CCCN1S(=O)(=O)c1cccc(-c2nc(C)cs2)c1 ZINC000329838779 565681904 /nfs/dbraw/zinc/68/19/04/565681904.db2.gz MQVDIWAUAQCSLH-MRXNPFEDSA-N 0 1 379.551 3.223 10 0 GGAEMN Cc1cccc(S(=O)(=O)Nc2ccc(N3CCC3=O)cc2)c1Br ZINC000410416959 565684073 /nfs/dbraw/zinc/68/40/73/565684073.db2.gz IQWPSZJIAPMPDX-UHFFFAOYSA-N 0 1 395.278 3.295 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@@H]1CCCc2[nH]ncc21 ZINC000280628474 565685119 /nfs/dbraw/zinc/68/51/19/565685119.db2.gz QVYVIAVTTLPLPD-OHUAYANFSA-N 0 1 378.245 3.404 10 0 GGAEMN Cc1cc(C)n(C[C@@H]2CN(C(=O)c3c(O)cc(Cl)cc3Cl)CCO2)n1 ZINC000175227073 565686442 /nfs/dbraw/zinc/68/64/42/565686442.db2.gz MMQUAKXLNRSVDG-ZDUSSCGKSA-N 0 1 384.263 3.054 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3cc(Cl)c(F)c(Cl)c3)CCO2)n[nH]1 ZINC000192422255 565688850 /nfs/dbraw/zinc/68/88/50/565688850.db2.gz DUVPFWJUGKIJAB-NSHDSACASA-N 0 1 388.230 3.418 10 0 GGAEMN O=C1[C@H](N2CCC[C@@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000330023671 565689655 /nfs/dbraw/zinc/68/96/55/565689655.db2.gz JBDFIASMUHDYAK-IAQYHMDHSA-N 0 1 380.279 3.096 10 0 GGAEMN COC(=O)c1cccc(NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)c1Br ZINC000192424716 565689892 /nfs/dbraw/zinc/68/98/92/565689892.db2.gz YVZVVVLFSJIIRK-SECBINFHSA-N 0 1 395.257 3.020 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CCO2)n[nH]1 ZINC000175300373 565691583 /nfs/dbraw/zinc/69/15/83/565691583.db2.gz JQBZLGYYDMKZAT-OTYXRUKQSA-N 0 1 384.267 3.264 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)N[C@H](C)c3ccc(Cl)cc3Cl)CCO2)n[nH]1 ZINC000175300388 565691601 /nfs/dbraw/zinc/69/16/01/565691601.db2.gz JQBZLGYYDMKZAT-YMTOWFKASA-N 0 1 384.267 3.264 10 0 GGAEMN Cn1c2ccc(CNCc3cc(Cl)c4c(c3)OCCO4)cc2sc1=O ZINC000192455535 565692455 /nfs/dbraw/zinc/69/24/55/565692455.db2.gz QCLCDRCVAFQFBJ-UHFFFAOYSA-N 0 1 376.865 3.314 10 0 GGAEMN Cc1cccc(CN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1 ZINC000280741680 565692564 /nfs/dbraw/zinc/69/25/64/565692564.db2.gz PDMPRPFAWNIONT-LBPRGKRZSA-N 0 1 383.311 3.256 10 0 GGAEMN CCC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)[C@H]2CCN(CC)C[C@@H]2C)c1 ZINC000280769303 565694429 /nfs/dbraw/zinc/69/44/29/565694429.db2.gz RQCVHRXOVUGYFT-BBRMVZONSA-N 0 1 386.945 3.284 10 0 GGAEMN CCC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)[C@@H]2CCN(CC)C[C@@H]2C)c1 ZINC000280769315 565694497 /nfs/dbraw/zinc/69/44/97/565694497.db2.gz RQCVHRXOVUGYFT-XJKSGUPXSA-N 0 1 386.945 3.284 10 0 GGAEMN CC[C@@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccncc1 ZINC000280764577 565694875 /nfs/dbraw/zinc/69/48/75/565694875.db2.gz QYQOJJQYSWATJY-IAQYHMDHSA-N 0 1 398.326 3.293 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@H](CO)c3cccc(Br)c3)ccc21 ZINC000192618392 565701978 /nfs/dbraw/zinc/70/19/78/565701978.db2.gz ZTJBHNDHDUYEHF-CQSZACIVSA-N 0 1 393.306 3.186 10 0 GGAEMN C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ncsc2Br)C1 ZINC000411057145 565708329 /nfs/dbraw/zinc/70/83/29/565708329.db2.gz JQWLSRKFKIDQSY-CYBMUJFWSA-N 0 1 394.338 3.500 10 0 GGAEMN C[C@H](NC1(c2ccccc2)CC1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000281165344 565715639 /nfs/dbraw/zinc/71/56/39/565715639.db2.gz QEAJJGSXPPVTQD-LBPRGKRZSA-N 0 1 395.322 3.436 10 0 GGAEMN Cc1cc(S(=O)(=O)NC2(C(F)(F)F)CCOCC2)c(Cl)cc1F ZINC000330866505 565726336 /nfs/dbraw/zinc/72/63/36/565726336.db2.gz OGZQQHKSGYLIHL-UHFFFAOYSA-N 0 1 375.771 3.177 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2Br)CCN1C ZINC000281418639 565729162 /nfs/dbraw/zinc/72/91/62/565729162.db2.gz IREXLIXYZYVDIC-CMPLNLGQSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1CC[C@@H](CCC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)O1 ZINC000175911386 565733819 /nfs/dbraw/zinc/73/38/19/565733819.db2.gz WKBXOJOHOGFICA-FZMZJTMJSA-N 0 1 393.285 3.198 10 0 GGAEMN C[C@H]1CC[C@@H](CCC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)O1 ZINC000175911386 565733823 /nfs/dbraw/zinc/73/38/23/565733823.db2.gz WKBXOJOHOGFICA-FZMZJTMJSA-N 0 1 393.285 3.198 10 0 GGAEMN Cc1nn(C)c(C)c1[C@@H](NS(=O)(=O)c1c(C)cccc1F)C(F)(F)F ZINC000331047621 565736977 /nfs/dbraw/zinc/73/69/77/565736977.db2.gz GLZREPMCIIURGK-CQSZACIVSA-N 0 1 379.379 3.066 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCC(=O)Nc1ccccc1Br ZINC000411612789 565740120 /nfs/dbraw/zinc/74/01/20/565740120.db2.gz FAUOYHCXYDKTHV-IGCXYCKISA-N 0 1 395.297 3.051 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1occc1Br ZINC000176092294 565747522 /nfs/dbraw/zinc/74/75/22/565747522.db2.gz STJIKUMIIUFKJT-DOMZBBRYSA-N 0 1 378.270 3.078 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1occc1Br ZINC000176092311 565748156 /nfs/dbraw/zinc/74/81/56/565748156.db2.gz STJIKUMIIUFKJT-WFASDCNBSA-N 0 1 378.270 3.078 10 0 GGAEMN CCC1(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCC1 ZINC000176105183 565748751 /nfs/dbraw/zinc/74/87/51/565748751.db2.gz UUTNNNAGOYXMLH-UHFFFAOYSA-N 0 1 378.274 3.366 10 0 GGAEMN CCC1(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCC1 ZINC000176105183 565748754 /nfs/dbraw/zinc/74/87/54/565748754.db2.gz UUTNNNAGOYXMLH-UHFFFAOYSA-N 0 1 378.274 3.366 10 0 GGAEMN CCC1(CC)CN(C(=O)c2c(O)cc(Cl)cc2Cl)CCS1(=O)=O ZINC000331246849 565749055 /nfs/dbraw/zinc/74/90/55/565749055.db2.gz VHSBUZNFPWVLGZ-UHFFFAOYSA-N 0 1 380.293 3.128 10 0 GGAEMN O=C(NCc1cc(F)cc(Br)c1)c1c[nH]c2ccccc2c1=O ZINC000193409745 565750666 /nfs/dbraw/zinc/75/06/66/565750666.db2.gz HXFPOEPBZYNEQU-UHFFFAOYSA-N 0 1 375.197 3.360 10 0 GGAEMN NC(=O)CCN(Cc1ccc(Br)cn1)[C@@H]1CCOc2ccccc21 ZINC000411792250 565753632 /nfs/dbraw/zinc/75/36/32/565753632.db2.gz QXMLRUNZGJFAQT-MRXNPFEDSA-N 0 1 390.281 3.045 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)cc2Br)CCN1C ZINC000281939784 565756358 /nfs/dbraw/zinc/75/63/58/565756358.db2.gz QOCDFIZDTFYZKI-CMPLNLGQSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)cc2Br)CCN1C ZINC000281939795 565756653 /nfs/dbraw/zinc/75/66/53/565756653.db2.gz QOCDFIZDTFYZKI-PWSUYJOCSA-N 0 1 395.750 3.206 10 0 GGAEMN CC(C)c1n[nH]cc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000193527888 565758288 /nfs/dbraw/zinc/75/82/88/565758288.db2.gz UOAITGQWUSFOJG-UHFFFAOYSA-N 0 1 389.257 3.011 10 0 GGAEMN CC(C)c1n[nH]cc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000193527888 565758292 /nfs/dbraw/zinc/75/82/92/565758292.db2.gz UOAITGQWUSFOJG-UHFFFAOYSA-N 0 1 389.257 3.011 10 0 GGAEMN CC(C)N(CC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)C[C@@H]1CCC(=O)N1 ZINC000412095602 565770868 /nfs/dbraw/zinc/77/08/68/565770868.db2.gz YAJRBCOGUNDIIJ-OCCSQVGLSA-N 0 1 386.323 3.160 10 0 GGAEMN CC(C)N(CC[S@](=O)c1cc(Cl)ccc1Cl)C[C@H]1CCC(=O)N1 ZINC000412092261 565770994 /nfs/dbraw/zinc/77/09/94/565770994.db2.gz VSIPVSGEYWTHHW-ZLOXQWCVSA-N 0 1 377.337 3.090 10 0 GGAEMN C[C@@H]1CN(C(=O)CSc2n[nH]c(=S)s2)C[C@@H](c2ccc(F)cc2)O1 ZINC000176441723 565772815 /nfs/dbraw/zinc/77/28/15/565772815.db2.gz QYWGVDWBCGSJTJ-SKDRFNHKSA-N 0 1 385.511 3.420 10 0 GGAEMN CC(C)(C)n1ncnc1NS(=O)(=O)/C=C/c1ccc(Br)cc1 ZINC000282354522 565776271 /nfs/dbraw/zinc/77/62/71/565776271.db2.gz SUKSXRJDKZEYLR-CMDGGOBGSA-N 0 1 385.287 3.208 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)c2cc(Br)cc3[nH]cnc32)n[nH]1 ZINC000282585039 565787065 /nfs/dbraw/zinc/78/70/65/565787065.db2.gz VEVQVGUCQABZBJ-MRVPVSSYSA-N 0 1 377.246 3.058 10 0 GGAEMN C[C@@H]1CN([C@@H](CNC(=O)c2ccc(O)c(Cl)c2)c2cccs2)CCO1 ZINC000176588588 565787053 /nfs/dbraw/zinc/78/70/53/565787053.db2.gz OOERFVOFHYTQEQ-DOMZBBRYSA-N 0 1 380.897 3.299 10 0 GGAEMN C[C@H]1CN([C@@H](CNC(=O)c2ccc(O)c(Cl)c2)c2cccs2)CCO1 ZINC000176588605 565787538 /nfs/dbraw/zinc/78/75/38/565787538.db2.gz OOERFVOFHYTQEQ-WFASDCNBSA-N 0 1 380.897 3.299 10 0 GGAEMN Brc1cncc(Br)c1CN[C@@H]1CCCc2cn[nH]c21 ZINC000331848369 565787611 /nfs/dbraw/zinc/78/76/11/565787611.db2.gz VPQIMMZHSHTVLO-GFCCVEGCSA-N 0 1 386.091 3.497 10 0 GGAEMN CS(=O)(=O)N1CCC[C@@H](CN2CCc3sccc3[C@@H]2c2cccs2)C1 ZINC000176625617 565789956 /nfs/dbraw/zinc/78/99/56/565789956.db2.gz ZYVOSVSCMGSBOX-KBXCAEBGSA-N 0 1 396.603 3.429 10 0 GGAEMN CN1CCN([C@@H]2CCCCN(C(=O)c3cc(Cl)sc3Cl)C2)CC1 ZINC000176670445 565793180 /nfs/dbraw/zinc/79/31/80/565793180.db2.gz ZMIUXSCOXSMLTR-GFCCVEGCSA-N 0 1 376.353 3.297 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)[C@@H]1CCCc2[nH]ncc21 ZINC000282719364 565793757 /nfs/dbraw/zinc/79/37/57/565793757.db2.gz HDUUFISUNNLTGQ-YGRLFVJLSA-N 0 1 376.254 3.232 10 0 GGAEMN O[C@@H]1[C@H](CNCc2c(F)ccc(Br)c2F)CCC12CCOCC2 ZINC000282841805 565799662 /nfs/dbraw/zinc/79/96/62/565799662.db2.gz OVRIDBNWWHGLDO-MEDUHNTESA-N 0 1 390.268 3.385 10 0 GGAEMN COCCn1cc(CN[C@H]2CCCOc3ccc(Br)cc32)cn1 ZINC000282855215 565800260 /nfs/dbraw/zinc/80/02/60/565800260.db2.gz UHCFGEXQGHHSDY-INIZCTEOSA-N 0 1 380.286 3.296 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCO[C@@H](c2ccco2)C1 ZINC000176775997 565801471 /nfs/dbraw/zinc/80/14/71/565801471.db2.gz DOGLFBPNXRTYTI-CQSZACIVSA-N 0 1 376.210 3.132 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)N[C@@H]1CCOc2c(Br)cccc21 ZINC000282905756 565802845 /nfs/dbraw/zinc/80/28/45/565802845.db2.gz RPAUBOQJNNOYQL-ZIAGYGMSSA-N 0 1 391.269 3.373 10 0 GGAEMN O=C(NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)c1s[n-]c(=O)c1Cl ZINC000282933047 565804025 /nfs/dbraw/zinc/80/40/25/565804025.db2.gz GAQIXFJXZFRVLI-UHFFFAOYSA-N 0 1 387.839 3.175 10 0 GGAEMN C[C@H]1CN(c2ccc(S(=O)(=O)Nc3cc(F)cc(F)c3)cn2)CCS1 ZINC000176920204 565814566 /nfs/dbraw/zinc/81/45/66/565814566.db2.gz SDLNHRAJRLFFCM-NSHDSACASA-N 0 1 385.461 3.102 10 0 GGAEMN C[C@@H]1CN(c2ccc(S(=O)(=O)Nc3cc(F)cc(F)c3)cn2)CCS1 ZINC000176920194 565815293 /nfs/dbraw/zinc/81/52/93/565815293.db2.gz SDLNHRAJRLFFCM-LLVKDONJSA-N 0 1 385.461 3.102 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1 ZINC000412952164 565823777 /nfs/dbraw/zinc/82/37/77/565823777.db2.gz MGXFNTKHIPYAGE-NSHDSACASA-N 0 1 379.865 3.177 10 0 GGAEMN CN1CC[C@H](N[C@H](C(N)=O)c2cccc(Br)c2)[C@H]1c1ccccc1 ZINC000283885840 565833750 /nfs/dbraw/zinc/83/37/50/565833750.db2.gz DZQGPVYAYCWMPI-OKZBNKHCSA-N 0 1 388.309 3.011 10 0 GGAEMN CCS(=O)(=O)c1ccc([C@@H](C)NCc2cncc(Br)c2)cc1 ZINC000284022211 565838061 /nfs/dbraw/zinc/83/80/61/565838061.db2.gz NTJGRLOAACVGAV-GFCCVEGCSA-N 0 1 383.311 3.489 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)[C@@H]2CCCc3[nH]ncc32)cc1Br ZINC000177280378 565840792 /nfs/dbraw/zinc/84/07/92/565840792.db2.gz NDVGXUFTDAKEOJ-CMPLNLGQSA-N 0 1 378.270 3.478 10 0 GGAEMN C[C@@H](NC(=O)N1CCN(C2CCOCC2)CC1)c1ccccc1Br ZINC000177303244 565842135 /nfs/dbraw/zinc/84/21/35/565842135.db2.gz WBSBPTKBKNTKFN-CQSZACIVSA-N 0 1 396.329 3.016 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@H](CO)NCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000284127748 565843391 /nfs/dbraw/zinc/84/33/91/565843391.db2.gz UHRCVENFOFEYRE-GDBMZVCRSA-N 0 1 396.329 3.087 10 0 GGAEMN C[C@H](NC(=O)N1CCN(C2CCOCC2)CC1)c1cccc(Br)c1 ZINC000177349131 565844051 /nfs/dbraw/zinc/84/40/51/565844051.db2.gz BHPOWQVLRXADAX-AWEZNQCLSA-N 0 1 396.329 3.016 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000284160906 565844891 /nfs/dbraw/zinc/84/48/91/565844891.db2.gz WHXVKAPUIGBKEN-ZBFHGGJFSA-N 0 1 396.329 3.087 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCN(c2cccs2)CC1 ZINC000177420965 565850128 /nfs/dbraw/zinc/85/01/28/565850128.db2.gz PTIPGLLVYRQWOC-UHFFFAOYSA-N 0 1 391.294 3.349 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SCC(=O)Nc2ccncc2)n1 ZINC000177471310 565854187 /nfs/dbraw/zinc/85/41/87/565854187.db2.gz YATSUPQOKOTZND-UHFFFAOYSA-N 0 1 375.841 3.260 10 0 GGAEMN C[C@H](C(=O)NC[C@@H]1CCCN(C)[C@H]1c1ccnn1C)c1ccc(Cl)s1 ZINC000284526755 565857133 /nfs/dbraw/zinc/85/71/33/565857133.db2.gz GARDHTVNVCUELR-GDZNZVCISA-N 0 1 380.945 3.438 10 0 GGAEMN CCCCOC[C@@H](O)CN[C@H](C)c1cc2c(cc1Br)OCCO2 ZINC000195212570 565865833 /nfs/dbraw/zinc/86/58/33/565865833.db2.gz WVJQAFSYJSFRGV-OLZOCXBDSA-N 0 1 388.302 3.049 10 0 GGAEMN O=S(=O)([C@@H]1C[C@@H]2CC[C@H]1C2)N1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1 ZINC000333181209 565870261 /nfs/dbraw/zinc/87/02/61/565870261.db2.gz PVZDVGMOSJXXIU-MROQNXINSA-N 0 1 377.432 3.126 10 0 GGAEMN Cc1csc([C@@H]2CCCN(CC(=O)N3CCC[C@H](C(F)(F)F)C3)C2)n1 ZINC000195337735 565877015 /nfs/dbraw/zinc/87/70/15/565877015.db2.gz OIHAZIKBYVFLMN-KGLIPLIRSA-N 0 1 375.460 3.432 10 0 GGAEMN Cc1nc(CCNC(=O)c2n[nH]c3ccc(Br)cc32)sc1C ZINC000177879200 565878886 /nfs/dbraw/zinc/87/88/86/565878886.db2.gz OWYFXGKMAVYIQX-UHFFFAOYSA-N 0 1 379.283 3.371 10 0 GGAEMN CC1CCN(CC(=O)NC2(c3ccc(Br)cc3)CCOCC2)CC1 ZINC000177975866 565885621 /nfs/dbraw/zinc/88/56/21/565885621.db2.gz FRSBRDJBUDIBBY-UHFFFAOYSA-N 0 1 395.341 3.303 10 0 GGAEMN C[C@@H]1CNCCN1C(=O)N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000333514655 565886142 /nfs/dbraw/zinc/88/61/42/565886142.db2.gz FYSXXBHCGLZPOS-BZNIZROVSA-N 0 1 391.313 3.311 10 0 GGAEMN C[C@H]1CNCCN1C(=O)N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000333514662 565886287 /nfs/dbraw/zinc/88/62/87/565886287.db2.gz FYSXXBHCGLZPOS-ZBEGNZNMSA-N 0 1 391.313 3.311 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCc2cc(Cl)cc(Br)c2)cn1 ZINC000414016015 565888199 /nfs/dbraw/zinc/88/81/99/565888199.db2.gz YQAUQWSVJHAFAY-UHFFFAOYSA-N 0 1 382.689 3.489 10 0 GGAEMN C[C@@H](NCc1cccnc1-n1cncn1)c1cc(Br)ccc1F ZINC000178053898 565893399 /nfs/dbraw/zinc/89/33/99/565893399.db2.gz XWHDOGOKWJDIGM-LLVKDONJSA-N 0 1 376.233 3.415 10 0 GGAEMN O[C@@H](COc1ccc(Br)c(F)c1)CN1CCc2ccccc2C1 ZINC000200437683 565895014 /nfs/dbraw/zinc/89/50/14/565895014.db2.gz LXXJLRYGDXPPDB-OAHLLOKOSA-N 0 1 380.257 3.386 10 0 GGAEMN C[C@H](O)c1cc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)ccc1F ZINC000285240618 565896126 /nfs/dbraw/zinc/89/61/26/565896126.db2.gz YWVORESXCSVSEO-VIFPVBQESA-N 0 1 387.816 3.104 10 0 GGAEMN C[C@H](NC(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)c1cccs1 ZINC000285248158 565896912 /nfs/dbraw/zinc/89/69/12/565896912.db2.gz AILPTYNWWDYEIO-SJCJKPOMSA-N 0 1 397.338 3.185 10 0 GGAEMN C[C@H](NCCOCC[NH+](C)C)c1ccc(Br)cc1Br ZINC000219324685 565901954 /nfs/dbraw/zinc/90/19/54/565901954.db2.gz BXDQKTGBHKGRAE-NSHDSACASA-N 0 1 394.151 3.440 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H](c2cncc(Br)c2)C2CC2)n[nH]1 ZINC000285438714 565907290 /nfs/dbraw/zinc/90/72/90/565907290.db2.gz OGNWCXLLFOORIB-HWPZZCPQSA-N 0 1 392.301 3.257 10 0 GGAEMN CN(C)C[C@H](NCc1ncc(I)s1)c1ccccc1 ZINC000285474987 565909130 /nfs/dbraw/zinc/90/91/30/565909130.db2.gz OBXSPAWFPQKHGQ-LBPRGKRZSA-N 0 1 387.290 3.140 10 0 GGAEMN CCn1ccnc1NCc1cc(I)c(OC)c(OC)c1 ZINC000414305800 565909771 /nfs/dbraw/zinc/90/97/71/565909771.db2.gz SEMJKINDCRHHBB-UHFFFAOYSA-N 0 1 387.221 3.137 10 0 GGAEMN COC(C)(C)CS(=O)(=O)Nc1ccc(OC(F)F)cc1OC(F)F ZINC000414369577 565917436 /nfs/dbraw/zinc/91/74/36/565917436.db2.gz IWLCXBZZSITAIQ-UHFFFAOYSA-N 0 1 375.340 3.056 10 0 GGAEMN COC(=O)c1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)s1 ZINC000285634605 565917817 /nfs/dbraw/zinc/91/78/17/565917817.db2.gz AKCMXOCHHAQHQC-INIZCTEOSA-N 0 1 384.295 3.295 10 0 GGAEMN COC(C)(C)CS(=O)(=O)Nc1ccccc1NC(=O)Cc1cccs1 ZINC000414377781 565918346 /nfs/dbraw/zinc/91/83/46/565918346.db2.gz XHYGONOUSRNOCI-UHFFFAOYSA-N 0 1 382.507 3.096 10 0 GGAEMN CCc1nc(C)c(NS(=O)(=O)c2cc(C(=O)NC)cc(Cl)c2C)s1 ZINC000414379862 565919829 /nfs/dbraw/zinc/91/98/29/565919829.db2.gz HLIYIHCSGBPTLI-UHFFFAOYSA-N 0 1 387.914 3.136 10 0 GGAEMN Cc1cccc(Cl)c1S(=O)(=O)Nc1ccc(F)cc1N1CCOCC1 ZINC000414391919 565922243 /nfs/dbraw/zinc/92/22/43/565922243.db2.gz DINDFPLJEWOPDN-UHFFFAOYSA-N 0 1 384.860 3.425 10 0 GGAEMN O=S(=O)(Nc1ccc(F)cc1N1CCOCC1)c1ccc(F)cc1Cl ZINC000414396398 565922811 /nfs/dbraw/zinc/92/28/11/565922811.db2.gz OUBSTPWZJMGHHP-UHFFFAOYSA-N 0 1 388.823 3.256 10 0 GGAEMN O=S(=O)(Nc1ccc(F)cc1N1CCOCC1)c1cc(F)ccc1Cl ZINC000414402520 565924561 /nfs/dbraw/zinc/92/45/61/565924561.db2.gz ZWZARWOBPICEBH-UHFFFAOYSA-N 0 1 388.823 3.256 10 0 GGAEMN O=C(Cc1c[nH]c2cc(Br)ccc12)N1CCN2CCCC[C@@H]2C1 ZINC000178602410 565928075 /nfs/dbraw/zinc/92/80/75/565928075.db2.gz WRSYVAOUMROOSL-OAHLLOKOSA-N 0 1 376.298 3.170 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc3ccn(C)c3c2)cc1Cl ZINC000178601593 565928634 /nfs/dbraw/zinc/92/86/34/565928634.db2.gz MGTRVZBVZYSZAE-UHFFFAOYSA-N 0 1 378.837 3.419 10 0 GGAEMN Cc1cc(Br)c(C(=O)NCCCCN2CCOCC2)cc1Cl ZINC000285909724 565932673 /nfs/dbraw/zinc/93/26/73/565932673.db2.gz DCAWPDVIZXRCJG-UHFFFAOYSA-N 0 1 389.721 3.253 10 0 GGAEMN CC(C)Cc1ncc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)s1 ZINC000178783027 565937775 /nfs/dbraw/zinc/93/77/75/565937775.db2.gz GQPJXOFELWRTNM-CQSZACIVSA-N 0 1 381.567 3.443 10 0 GGAEMN COC[C@@H](O)CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C ZINC000178835002 565940366 /nfs/dbraw/zinc/94/03/66/565940366.db2.gz XKNDWIUVZAPHAW-LBPRGKRZSA-N 0 1 382.810 3.015 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)CCN1C ZINC000286097178 565942210 /nfs/dbraw/zinc/94/22/10/565942210.db2.gz UNYBOMMDCSWUSE-PWSUYJOCSA-N 0 1 384.851 3.462 10 0 GGAEMN Cc1noc(C)c1[C@@H](C)CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000178866690 565942422 /nfs/dbraw/zinc/94/24/22/565942422.db2.gz ASOZDNOCNXOQMY-QMMMGPOBSA-N 0 1 377.242 3.464 10 0 GGAEMN Cc1noc(C)c1[C@H](C)CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000178866700 565943210 /nfs/dbraw/zinc/94/32/10/565943210.db2.gz ASOZDNOCNXOQMY-MRVPVSSYSA-N 0 1 377.242 3.464 10 0 GGAEMN C[C@@H]1CN(C)C[C@H](C)N1C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000178936809 565947497 /nfs/dbraw/zinc/94/74/97/565947497.db2.gz NXLDRTVRMZFAKI-OKILXGFUSA-N 0 1 377.941 3.481 10 0 GGAEMN C[C@H]1CN(C)C[C@H](C)N1C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000178936824 565947538 /nfs/dbraw/zinc/94/75/38/565947538.db2.gz NXLDRTVRMZFAKI-KBPBESRZSA-N 0 1 377.941 3.481 10 0 GGAEMN COC(=O)[C@H]1CSCCN(Cc2cnc(CCc3ccccc3)s2)C1 ZINC000414598732 565950942 /nfs/dbraw/zinc/95/09/42/565950942.db2.gz YJTNVGJKPCAORX-MRXNPFEDSA-N 0 1 376.547 3.266 10 0 GGAEMN CN(C)Cc1cc(-c2noc(-c3ccc(S(C)(=O)=O)s3)n2)ccc1F ZINC000351322666 565951365 /nfs/dbraw/zinc/95/13/65/565951365.db2.gz HTEADWJLDJWJEL-UHFFFAOYSA-N 0 1 381.454 3.069 10 0 GGAEMN O=C([O-])C[N@@H+](CC1CC1)C1CC(NCc2cnc(-c3ccsc3)s2)C1 ZINC000414677239 565954364 /nfs/dbraw/zinc/95/43/64/565954364.db2.gz IDRDPSMEZVUFPE-UHFFFAOYSA-N 0 1 377.535 3.289 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H](C)c2ccc(Br)cc2F)[nH]1 ZINC000286410234 565958204 /nfs/dbraw/zinc/95/82/04/565958204.db2.gz FFJMHBPHZCKFDM-MRVPVSSYSA-N 0 1 387.278 3.374 10 0 GGAEMN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CCN[C@@H](C)C1 ZINC000414764813 565958809 /nfs/dbraw/zinc/95/88/09/565958809.db2.gz BAUQSPVNBCLHBI-VIFPVBQESA-N 0 1 376.682 3.327 10 0 GGAEMN CCN1C(=O)N=NC1C1CCN(C(=O)c2c(O)cc(Cl)cc2Cl)CC1 ZINC000361217006 565966027 /nfs/dbraw/zinc/96/60/27/565966027.db2.gz WELXXLKQAOSVRR-UHFFFAOYSA-N 0 1 385.251 3.036 10 0 GGAEMN CN(C)C(=O)c1cccc(CN[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000286566954 565968390 /nfs/dbraw/zinc/96/83/90/565968390.db2.gz PIQHWQMJPBAKEE-IBGZPJMESA-N 0 1 391.309 3.148 10 0 GGAEMN Cc1cnc(CCN(C)C(=O)c2[nH]nc3ccc(Br)cc32)s1 ZINC000179266120 565969117 /nfs/dbraw/zinc/96/91/17/565969117.db2.gz WDXBUWZWDVGOKN-UHFFFAOYSA-N 0 1 379.283 3.405 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)c2[nH]nc3ccc(Br)cc32)no1 ZINC000361466711 565969798 /nfs/dbraw/zinc/96/97/98/565969798.db2.gz WOVZNUHXCKUXMB-CYBMUJFWSA-N 0 1 390.241 3.384 10 0 GGAEMN O=S(=O)(NCCCc1ccccn1)c1cc(F)c(Br)cc1F ZINC000179299638 565971745 /nfs/dbraw/zinc/97/17/45/565971745.db2.gz NJMXWXVRQNYYHS-UHFFFAOYSA-N 0 1 391.237 3.033 10 0 GGAEMN COc1ccc(CCC(=O)N2CCCC[C@@H]2c2nnc[nH]2)cc1Br ZINC000179347635 565975283 /nfs/dbraw/zinc/97/52/83/565975283.db2.gz IBQDNIPNJVFRBH-CQSZACIVSA-N 0 1 393.285 3.262 10 0 GGAEMN COc1ccc(CCC(=O)N2CCCC[C@H]2c2nnc[nH]2)cc1Br ZINC000179347641 565975407 /nfs/dbraw/zinc/97/54/07/565975407.db2.gz IBQDNIPNJVFRBH-AWEZNQCLSA-N 0 1 393.285 3.262 10 0 GGAEMN Cc1c(I)cccc1C(=O)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000179359745 565976525 /nfs/dbraw/zinc/97/65/25/565976525.db2.gz UMRGVBKQYYGKAI-CYBMUJFWSA-N 0 1 396.232 3.085 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)CCCc2cc(Cl)sc2Cl)CC1 ZINC000179395189 565977153 /nfs/dbraw/zinc/97/71/53/565977153.db2.gz ZXIGJPRZOVNNJI-ZDUSSCGKSA-N 0 1 379.353 3.293 10 0 GGAEMN COc1ccc(-c2nc3c(s2)[C@H](N[C@H](C)CS(C)(=O)=O)CCC3)cc1 ZINC000362295349 565978734 /nfs/dbraw/zinc/97/87/34/565978734.db2.gz YNGSMPHMMATOHB-IUODEOHRSA-N 0 1 380.535 3.219 10 0 GGAEMN COCCN1CCCN(C(=O)Cc2csc(-c3ccc(Cl)s3)n2)CC1 ZINC000363063980 565989513 /nfs/dbraw/zinc/98/95/13/565989513.db2.gz QBPJFFYGEWWDOS-UHFFFAOYSA-N 0 1 399.969 3.248 10 0 GGAEMN Cc1nc([C@@H]2CN([C@@H]3CCCc4ccc(Br)cc43)CCO2)n[nH]1 ZINC000179614090 565992341 /nfs/dbraw/zinc/99/23/41/565992341.db2.gz FOQIGJBOHZANBX-CVEARBPZSA-N 0 1 377.286 3.327 10 0 GGAEMN CCCOc1c(Br)cc(CN2C[C@H](C(N)=O)CC[C@H]2C)cc1OC ZINC000245513917 565993085 /nfs/dbraw/zinc/99/30/85/565993085.db2.gz DRKJAFVDFHVMHW-TZMCWYRMSA-N 0 1 399.329 3.332 10 0 GGAEMN CN1CC[C@H](CNC(=O)[C@H]2CSCCS2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245755545 566006496 /nfs/dbraw/zinc/00/64/96/566006496.db2.gz YHURWUIYUBXBLC-DAXOMENPSA-N 0 1 388.961 3.437 10 0 GGAEMN CCC[C@@H](C(=O)Nc1nccn1Cc1ccc(Br)cc1)N(C)C ZINC000179784953 566007455 /nfs/dbraw/zinc/00/74/55/566007455.db2.gz AUBHTVDQRAFFAI-HNNXBMFYSA-N 0 1 379.302 3.363 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C[C@H](C)O ZINC000245838161 566008150 /nfs/dbraw/zinc/00/81/50/566008150.db2.gz BTJQZWQUZIWYEN-AAEUAGOBSA-N 0 1 378.822 3.276 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C[C@H](C)O ZINC000245838165 566008224 /nfs/dbraw/zinc/00/82/24/566008224.db2.gz BTJQZWQUZIWYEN-WCQYABFASA-N 0 1 378.822 3.276 10 0 GGAEMN O[C@@]12CCCC[C@@H]1CN(Cc1cc(Br)c3c(c1)OCCO3)CC2 ZINC000179839553 566011796 /nfs/dbraw/zinc/01/17/96/566011796.db2.gz IRVVNVSYQSBMRS-RDTXWAMCSA-N 0 1 382.298 3.347 10 0 GGAEMN COC(=O)[C@H]1CCCN(Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000179852224 566013199 /nfs/dbraw/zinc/01/31/99/566013199.db2.gz JPDMCBFLWUJEOG-AWEZNQCLSA-N 0 1 378.270 3.020 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1cccc(Br)c1 ZINC000245982198 566013308 /nfs/dbraw/zinc/01/33/08/566013308.db2.gz GWJUJLZYLAFGKL-IAOVAPTHSA-N 0 1 381.314 3.270 10 0 GGAEMN CC[C@@H]1CN(C(=O)C[C@H](C)c2ccc(Br)cc2)CCN1C[C@H](C)O ZINC000245990843 566013594 /nfs/dbraw/zinc/01/35/94/566013594.db2.gz LVVYDSMNKZIQEA-RLFYNMQTSA-N 0 1 397.357 3.246 10 0 GGAEMN FC(F)(F)c1nc(N2CC[C@H](CN3CCOCC3)C2)ccc1Br ZINC000287376555 566014541 /nfs/dbraw/zinc/01/45/41/566014541.db2.gz QUJMIAFSIPZOHA-LLVKDONJSA-N 0 1 394.235 3.021 10 0 GGAEMN FC(F)(F)c1nc(N2CC[C@@H](CN3CCOCC3)C2)ccc1Br ZINC000287376564 566014774 /nfs/dbraw/zinc/01/47/74/566014774.db2.gz QUJMIAFSIPZOHA-NSHDSACASA-N 0 1 394.235 3.021 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1ccc(Br)cc1 ZINC000246034346 566015200 /nfs/dbraw/zinc/01/52/00/566015200.db2.gz MNOSYDKOSNNVPQ-IAOVAPTHSA-N 0 1 381.314 3.270 10 0 GGAEMN C[N@H+]1CCC[C@H](C[N-]S(=O)(=O)c2c(F)cccc2F)[C@H]1c1cccs1 ZINC000246098582 566016151 /nfs/dbraw/zinc/01/61/51/566016151.db2.gz HGEYYVPZRDKFAH-WBMJQRKESA-N 0 1 386.489 3.388 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCC[C@H]2c2ccc(Br)s2)[nH]1 ZINC000363745518 566019333 /nfs/dbraw/zinc/01/93/33/566019333.db2.gz DPQSKYZXVWGRRV-VIFPVBQESA-N 0 1 387.328 3.393 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CCC[C@H]2c2ccc(Br)s2)n1 ZINC000363745518 566019335 /nfs/dbraw/zinc/01/93/35/566019335.db2.gz DPQSKYZXVWGRRV-VIFPVBQESA-N 0 1 387.328 3.393 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2ccc(F)c(F)c2)[C@H]1c1cccs1 ZINC000246191358 566020011 /nfs/dbraw/zinc/02/00/11/566020011.db2.gz OBHCTKGQCCQKCJ-SJCJKPOMSA-N 0 1 386.489 3.388 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2ccccc2F)[C@H]1c1cccs1 ZINC000246188126 566020454 /nfs/dbraw/zinc/02/04/54/566020454.db2.gz NUZYQAJNQJEFER-KSSFIOAISA-N 0 1 382.526 3.390 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2cccc(F)c2)[C@H]1c1cccs1 ZINC000246206224 566021640 /nfs/dbraw/zinc/02/16/40/566021640.db2.gz OZUJXFWOVSOZJW-QAPCUYQASA-N 0 1 382.526 3.390 10 0 GGAEMN O=C(CN1CCN2CCCC[C@H]2C1)Nc1ccc(Br)cc1Cl ZINC000246198223 566021887 /nfs/dbraw/zinc/02/18/87/566021887.db2.gz NDVYOZCKWBANPI-ZDUSSCGKSA-N 0 1 386.721 3.211 10 0 GGAEMN O=C(CC[N@H+]1CCN2CCCC[C@H]2C1)Nc1ccc(Br)cc1F ZINC000246263116 566023949 /nfs/dbraw/zinc/02/39/49/566023949.db2.gz YVLGCPFMAXEGQY-AWEZNQCLSA-N 0 1 384.293 3.087 10 0 GGAEMN CC1(CNC(=O)c2c[nH]c3ccc(I)cc3c2=O)CCC1 ZINC000179996823 566024345 /nfs/dbraw/zinc/02/43/45/566024345.db2.gz YPGMLPGSJOTIFC-UHFFFAOYSA-N 0 1 396.228 3.053 10 0 GGAEMN O=C(Cc1ccc(Br)s1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000363864114 566024638 /nfs/dbraw/zinc/02/46/38/566024638.db2.gz CHDUNCANLMGYHA-AWEZNQCLSA-N 0 1 377.267 3.077 10 0 GGAEMN C[C@H](c1ccccc1Br)N(C)C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000246302398 566025954 /nfs/dbraw/zinc/02/59/54/566025954.db2.gz LQGHYEBBIYFFOS-ZIAGYGMSSA-N 0 1 389.359 3.114 10 0 GGAEMN C[C@H](NCc1cc(F)cc(Br)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000180037495 566026832 /nfs/dbraw/zinc/02/68/32/566026832.db2.gz BUUMVZMVHIHYNV-JTQLQIEISA-N 0 1 387.274 3.086 10 0 GGAEMN CC(=O)c1ccc(Cl)c(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)c1 ZINC000246406735 566027849 /nfs/dbraw/zinc/02/78/49/566027849.db2.gz QKGMVALGPSJVOK-CVEARBPZSA-N 0 1 384.929 3.178 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)CN1CCCC[C@H]1c1cn[nH]c1 ZINC000246438929 566029841 /nfs/dbraw/zinc/02/98/41/566029841.db2.gz WJIYOWPRNHXPGG-WBVHZDCISA-N 0 1 380.286 3.139 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Nc2ccc3nccnc3c2Br)n[nH]1 ZINC000287629759 566030687 /nfs/dbraw/zinc/03/06/87/566030687.db2.gz IPYPFPSRAYLLLY-SECBINFHSA-N 0 1 389.257 3.177 10 0 GGAEMN Cc1nc([C@@H]2CN(CC3=Cc4cc(Cl)cc(Cl)c4OC3)CCO2)n[nH]1 ZINC000180106990 566032457 /nfs/dbraw/zinc/03/24/57/566032457.db2.gz PJJCKPKOUHMPPV-HNNXBMFYSA-N 0 1 381.263 3.269 10 0 GGAEMN CCCOc1ccc(Br)cc1CN1CCO[C@H](c2n[nH]c(C)n2)C1 ZINC000180106848 566032996 /nfs/dbraw/zinc/03/29/96/566032996.db2.gz GPPNSNZAIQOAKT-INIZCTEOSA-N 0 1 395.301 3.238 10 0 GGAEMN O[C@@H](COC[C@H]1CCCO1)CN(Cc1csc(Br)c1)C1CC1 ZINC000246728361 566038599 /nfs/dbraw/zinc/03/85/99/566038599.db2.gz OMUZSKNMLCCJLF-HUUCEWRRSA-N 0 1 390.343 3.032 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Br)cc2Cl)CCN1C[C@H](C)O ZINC000246739986 566039996 /nfs/dbraw/zinc/03/99/96/566039996.db2.gz GCJDMSWQEXRHCT-AAEUAGOBSA-N 0 1 389.721 3.020 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Br)cc2Cl)CCN1C[C@H](C)O ZINC000246739991 566040210 /nfs/dbraw/zinc/04/02/10/566040210.db2.gz GCJDMSWQEXRHCT-WCQYABFASA-N 0 1 389.721 3.020 10 0 GGAEMN C[C@@H](CNC(=O)c1ncsc1Br)N1CCc2ccccc2C1 ZINC000287823579 566042847 /nfs/dbraw/zinc/04/28/47/566042847.db2.gz AHZFGVAQRRFRRJ-NSHDSACASA-N 0 1 380.311 3.082 10 0 GGAEMN O[C@@H](COc1c(Cl)cccc1Cl)C[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000246897418 566045801 /nfs/dbraw/zinc/04/58/01/566045801.db2.gz VKVSTWYCGJAFPR-UKRRQHHQSA-N 0 1 383.275 3.281 10 0 GGAEMN O[C@@H](COc1c(Cl)cccc1Cl)CN1CC[C@@H](Oc2cccnc2)C1 ZINC000246897418 566045803 /nfs/dbraw/zinc/04/58/03/566045803.db2.gz VKVSTWYCGJAFPR-UKRRQHHQSA-N 0 1 383.275 3.281 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)C[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000246897403 566045951 /nfs/dbraw/zinc/04/59/51/566045951.db2.gz VKVSTWYCGJAFPR-DZGCQCFKSA-N 0 1 383.275 3.281 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)CN1CC[C@@H](Oc2cccnc2)C1 ZINC000246897403 566045953 /nfs/dbraw/zinc/04/59/53/566045953.db2.gz VKVSTWYCGJAFPR-DZGCQCFKSA-N 0 1 383.275 3.281 10 0 GGAEMN C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1Br ZINC000246930532 566046806 /nfs/dbraw/zinc/04/68/06/566046806.db2.gz IHVIXMBSAQMEJX-KBXCAEBGSA-N 0 1 388.309 3.485 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1Br ZINC000246930532 566046813 /nfs/dbraw/zinc/04/68/13/566046813.db2.gz IHVIXMBSAQMEJX-KBXCAEBGSA-N 0 1 388.309 3.485 10 0 GGAEMN C[C@@H]1CN(C(=O)CCCCc2ccc(Br)cc2)[C@H](C)CN1CCO ZINC000416294321 566051866 /nfs/dbraw/zinc/05/18/66/566051866.db2.gz KUOPJJHOAUDHJF-HZPDHXFCSA-N 0 1 397.357 3.075 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000364461521 566052499 /nfs/dbraw/zinc/05/24/99/566052499.db2.gz WEELRMOCUCOFRW-CQSZACIVSA-N 0 1 387.237 3.233 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(CCC(=O)Nc3cccc(Br)c3)[C@H]2C1 ZINC000247139608 566054023 /nfs/dbraw/zinc/05/40/23/566054023.db2.gz XDGHEFYRFBJDRY-IKGGRYGDSA-N 0 1 397.313 3.046 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CCN1CCOC ZINC000247163496 566054646 /nfs/dbraw/zinc/05/46/46/566054646.db2.gz QRQFXXQBTADGGS-FGTMMUONSA-N 0 1 395.341 3.122 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)CCN1CCOC ZINC000247163508 566054987 /nfs/dbraw/zinc/05/49/87/566054987.db2.gz QRQFXXQBTADGGS-KURKYZTESA-N 0 1 395.341 3.122 10 0 GGAEMN CCCN(C[C@H](O)CN1CCCC1=O)[C@H](C)c1ccccc1Br ZINC000247234802 566055984 /nfs/dbraw/zinc/05/59/84/566055984.db2.gz DEQVANPCKBZXJA-CABCVRRESA-N 0 1 383.330 3.205 10 0 GGAEMN Cc1csc2nc(CN3CCC[C@@H]3C[C@@H](O)c3cccs3)cc(=O)n12 ZINC000247260415 566056705 /nfs/dbraw/zinc/05/67/05/566056705.db2.gz VGLBIRFTGFCEKY-HUUCEWRRSA-N 0 1 375.519 3.214 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1coc(Br)c1 ZINC000247281576 566057358 /nfs/dbraw/zinc/05/73/58/566057358.db2.gz SFYYDWJYGGISPQ-IUODEOHRSA-N 0 1 378.270 3.078 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccc(Br)o1 ZINC000247323616 566058087 /nfs/dbraw/zinc/05/80/87/566058087.db2.gz XNWJQHPRVQUCQH-TZMCWYRMSA-N 0 1 378.270 3.078 10 0 GGAEMN CCOCCN1CC[N@H+](CCC(=O)Nc2c(Cl)cccc2Cl)C[C@H]1C ZINC000247536369 566063202 /nfs/dbraw/zinc/06/32/02/566063202.db2.gz COAXYPAEFXHFKT-CQSZACIVSA-N 0 1 388.339 3.365 10 0 GGAEMN CC[C@@H]1CN([C@H](C)C(=O)Nc2cccc(Cl)c2Cl)CCN1CCOC ZINC000247601746 566064326 /nfs/dbraw/zinc/06/43/26/566064326.db2.gz LCHOIPPPMNODNS-ZIAGYGMSSA-N 0 1 388.339 3.363 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)Nc3cc(F)ccc3Br)cn21 ZINC000416414105 566064909 /nfs/dbraw/zinc/06/49/09/566064909.db2.gz FKWWKLXICRWDCE-SECBINFHSA-N 0 1 388.262 3.483 10 0 GGAEMN CC[C@H]1CN([C@H](C)C(=O)Nc2cc(Cl)ccc2Cl)CCN1CCOC ZINC000247815054 566066166 /nfs/dbraw/zinc/06/61/66/566066166.db2.gz WAUZWBDTVRSMPT-HIFRSBDPSA-N 0 1 388.339 3.363 10 0 GGAEMN COC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cn3c(n2)CCC[C@H]3C)c1 ZINC000416417860 566066304 /nfs/dbraw/zinc/06/63/04/566066304.db2.gz PDSJJGUTBMDTNO-SNVBAGLBSA-N 0 1 383.857 3.021 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@@H](Cn2cncn2)C1 ZINC000247778030 566066682 /nfs/dbraw/zinc/06/66/82/566066682.db2.gz RFHRQSYBPCNODX-QWHCGFSZSA-N 0 1 382.295 3.324 10 0 GGAEMN CCOCC[N@H+]1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1C ZINC000247775830 566066896 /nfs/dbraw/zinc/06/68/96/566066896.db2.gz QOOHFYHMJLVWNC-CQSZACIVSA-N 0 1 388.339 3.365 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)[N-]c3ccc(Cl)c(C[NH+](C)C)c3)cn21 ZINC000416422489 566067146 /nfs/dbraw/zinc/06/71/46/566067146.db2.gz MCNJBPORPARMBV-LBPRGKRZSA-N 0 1 382.917 3.296 10 0 GGAEMN CC[C@@H]1CN([C@H](C)C(=O)Nc2cc(Cl)ccc2Cl)CCN1CCOC ZINC000247815057 566067154 /nfs/dbraw/zinc/06/71/54/566067154.db2.gz WAUZWBDTVRSMPT-UKRRQHHQSA-N 0 1 388.339 3.363 10 0 GGAEMN O=C(NCc1ccccc1Br)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000364740873 566068362 /nfs/dbraw/zinc/06/83/62/566068362.db2.gz SOXICSHWLUEBBZ-HNNXBMFYSA-N 0 1 386.253 3.156 10 0 GGAEMN O[C@@]12CCCC[C@H]1CN(Cc1cc3c(cc1Br)OCCO3)CC2 ZINC000248065425 566071765 /nfs/dbraw/zinc/07/17/65/566071765.db2.gz ZKEHRKSXEAXPPJ-KBXCAEBGSA-N 0 1 382.298 3.347 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2ccc(Cl)c(F)c2)[C@H]1c1ccccc1 ZINC000248674727 566085765 /nfs/dbraw/zinc/08/57/65/566085765.db2.gz XJSQZEDWIKEDPF-QZTJIDSGSA-N 0 1 382.888 3.344 10 0 GGAEMN CN(C)CCN(Cc1ccsc1)S(=O)(=O)c1c(F)cccc1Cl ZINC000416557092 566087579 /nfs/dbraw/zinc/08/75/79/566087579.db2.gz MWKKXWWIQFYHRH-UHFFFAOYSA-N 0 1 376.906 3.293 10 0 GGAEMN O[C@H](CC1CCCC1)CN1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000365282380 566094649 /nfs/dbraw/zinc/09/46/49/566094649.db2.gz UEUMRNJRBCJFHN-CYBMUJFWSA-N 0 1 378.464 3.010 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)CC1 ZINC000249074791 566095249 /nfs/dbraw/zinc/09/52/49/566095249.db2.gz AYZIEBYOBKQMKC-HOTGVXAUSA-N 0 1 385.291 3.104 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)CC1 ZINC000249135887 566098384 /nfs/dbraw/zinc/09/83/84/566098384.db2.gz UKBZBBYRWGGZDH-LSDHHAIUSA-N 0 1 385.291 3.104 10 0 GGAEMN O=C1[C@H](N2CC[C@]3(O)CCCC[C@H]3C2)CCN1c1cccc(Br)c1 ZINC000249317330 566100357 /nfs/dbraw/zinc/10/03/57/566100357.db2.gz PSBOXSRWWJMZMH-POZUXBRTSA-N 0 1 393.325 3.181 10 0 GGAEMN Cc1nc(-c2ccc(S(=O)(=O)N3CCCC[C@@H]3c3nnc[nH]3)s2)cs1 ZINC000180935349 566101597 /nfs/dbraw/zinc/10/15/97/566101597.db2.gz KUXYBVQAEPCYBY-GFCCVEGCSA-N 0 1 395.535 3.214 10 0 GGAEMN O=S(=O)(C=Cc1cccc(Br)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000180938432 566101620 /nfs/dbraw/zinc/10/16/20/566101620.db2.gz PXZYDXOUHCRZBQ-KGXGESDWSA-N 0 1 397.298 3.095 10 0 GGAEMN CSC[C@H](O)CN1CCC[C@H]1c1ccc(I)cc1 ZINC000249455180 566102902 /nfs/dbraw/zinc/10/29/02/566102902.db2.gz NGWMQZMIJGNOQT-KGLIPLIRSA-N 0 1 377.291 3.152 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C[C@H](C)O ZINC000249534727 566103583 /nfs/dbraw/zinc/10/35/83/566103583.db2.gz CBURVFWDBTXUMF-NHYWBVRUSA-N 0 1 378.822 3.276 10 0 GGAEMN CN1CC[C@@H](CNC(=O)CCOCC(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000249712183 566106379 /nfs/dbraw/zinc/10/63/79/566106379.db2.gz YTPSPHKFGBYBJF-YVEFUNNKSA-N 0 1 378.822 3.260 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000250154576 566108990 /nfs/dbraw/zinc/10/89/90/566108990.db2.gz NEJVIMIBPZLYAU-CJNGLKHVSA-N 0 1 389.323 3.066 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000250243775 566109109 /nfs/dbraw/zinc/10/91/09/566109109.db2.gz UWRRZQNQZFVPFP-GDBMZVCRSA-N 0 1 389.323 3.066 10 0 GGAEMN CO[C@@H]1CN([C@@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC[C@@H]1C ZINC000251518172 566110260 /nfs/dbraw/zinc/11/02/60/566110260.db2.gz CMOLDTPNTRFKPD-GRDNDAEWSA-N 0 1 383.330 3.153 10 0 GGAEMN C[C@H]1CN(C(=O)Nc2ccc(Cl)c(Br)c2)[C@@H](C)CN1CCO ZINC000416929191 566113183 /nfs/dbraw/zinc/11/31/83/566113183.db2.gz ZXHVPFNHUYRREX-QWRGUYRKSA-N 0 1 390.709 3.021 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)c(Cl)c(OC)c1 ZINC000416945624 566114589 /nfs/dbraw/zinc/11/45/89/566114589.db2.gz AFOBYMWLVTTZKW-JTQLQIEISA-N 0 1 385.873 3.252 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)Nc3ccc(F)cc3Br)cn21 ZINC000416942006 566114667 /nfs/dbraw/zinc/11/46/67/566114667.db2.gz RGEDIZUHHZNOQV-SECBINFHSA-N 0 1 388.262 3.483 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)Nc3ccc(F)cc3Br)cn21 ZINC000416942007 566115157 /nfs/dbraw/zinc/11/51/57/566115157.db2.gz RGEDIZUHHZNOQV-VIFPVBQESA-N 0 1 388.262 3.483 10 0 GGAEMN C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1csc(I)c1 ZINC000252661297 566115472 /nfs/dbraw/zinc/11/54/72/566115472.db2.gz IFUKBNLXCJNFEE-JQWIXIFHSA-N 0 1 390.290 3.052 10 0 GGAEMN C[C@H]1CN2CCCC[C@H]2CN1C(=O)c1csc(I)c1 ZINC000252661297 566115475 /nfs/dbraw/zinc/11/54/75/566115475.db2.gz IFUKBNLXCJNFEE-JQWIXIFHSA-N 0 1 390.290 3.052 10 0 GGAEMN C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1csc(I)c1 ZINC000252661299 566116344 /nfs/dbraw/zinc/11/63/44/566116344.db2.gz IFUKBNLXCJNFEE-PWSUYJOCSA-N 0 1 390.290 3.052 10 0 GGAEMN C[C@@H]1CN2CCCC[C@H]2CN1C(=O)c1csc(I)c1 ZINC000252661299 566116347 /nfs/dbraw/zinc/11/63/47/566116347.db2.gz IFUKBNLXCJNFEE-PWSUYJOCSA-N 0 1 390.290 3.052 10 0 GGAEMN CNC(=O)[C@@H](NCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)C(C)C ZINC000365849227 566122734 /nfs/dbraw/zinc/12/27/34/566122734.db2.gz PJTBADWNEZUBDY-RDJZCZTQSA-N 0 1 386.323 3.017 10 0 GGAEMN Cc1cc(NC(=O)C[N@H+]2[C@H](C(=O)[O-])C[C@H]3CCCC[C@@H]32)ccc1Br ZINC000261597160 566125544 /nfs/dbraw/zinc/12/55/44/566125544.db2.gz ACRSYPPBFINJDM-KCXAZCMYSA-N 0 1 395.297 3.414 10 0 GGAEMN CCOc1cc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)ccc1OC ZINC000181226273 566126124 /nfs/dbraw/zinc/12/61/24/566126124.db2.gz MDJXYGFGQLGMSK-UHFFFAOYSA-N 0 1 376.356 3.309 10 0 GGAEMN O=C1OCC[C@H]1CCN1CCC[C@H]1c1ccccc1I ZINC000365919031 566126744 /nfs/dbraw/zinc/12/67/44/566126744.db2.gz JDQPQTOXICAPGA-DOMZBBRYSA-N 0 1 385.245 3.381 10 0 GGAEMN O=C(NCc1ccc(F)cc1Br)N1CCC(c2cnc[nH]2)CC1 ZINC000365921560 566127113 /nfs/dbraw/zinc/12/71/13/566127113.db2.gz OBGJHYAUPUXKLP-UHFFFAOYSA-N 0 1 381.249 3.401 10 0 GGAEMN COCCOCc1ccc(CN[C@@H](CO)c2cccc(Br)c2)cc1 ZINC000289526425 566127335 /nfs/dbraw/zinc/12/73/35/566127335.db2.gz BOUYPTXGWKMJCS-IBGZPJMESA-N 0 1 394.309 3.435 10 0 GGAEMN O=C(NCCc1ccc(Br)cc1)N1CCC(c2cnc[nH]2)CC1 ZINC000365921290 566127851 /nfs/dbraw/zinc/12/78/51/566127851.db2.gz MWLCWPIJFLCXRC-UHFFFAOYSA-N 0 1 377.286 3.304 10 0 GGAEMN COCCOCc1ccc(CN[C@H](CO)c2cccc(Br)c2)cc1 ZINC000289526435 566127874 /nfs/dbraw/zinc/12/78/74/566127874.db2.gz BOUYPTXGWKMJCS-LJQANCHMSA-N 0 1 394.309 3.435 10 0 GGAEMN COc1ccc2c(c1)CCN2C(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000261690915 566129096 /nfs/dbraw/zinc/12/90/96/566129096.db2.gz HOYZZLABEGCJOA-GOSISDBHSA-N 0 1 375.266 3.221 10 0 GGAEMN C[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(Br)nc1 ZINC000289575096 566129942 /nfs/dbraw/zinc/12/99/42/566129942.db2.gz DNDOXXHYZRGKKV-GFCCVEGCSA-N 0 1 383.311 3.240 10 0 GGAEMN C[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(Br)nc1 ZINC000289575098 566130272 /nfs/dbraw/zinc/13/02/72/566130272.db2.gz DNDOXXHYZRGKKV-LBPRGKRZSA-N 0 1 383.311 3.240 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1ccc(Br)cc1F ZINC000261748404 566132501 /nfs/dbraw/zinc/13/25/01/566132501.db2.gz UMWUKWFGKBUMJR-KMUNFCNLSA-N 0 1 399.260 3.244 10 0 GGAEMN C[C@H]1OCC[C@]12CN(Cc1nc3ccc(Br)cc3[nH]1)C[C@@H](C)O2 ZINC000366072868 566134187 /nfs/dbraw/zinc/13/41/87/566134187.db2.gz LIVGVDCZWWDHIR-QFSBIZTOSA-N 0 1 380.286 3.094 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)N(Cc1csc(Br)c1)C1CC1 ZINC000366081169 566134437 /nfs/dbraw/zinc/13/44/37/566134437.db2.gz ASGCNJROUXAGSG-LLVKDONJSA-N 0 1 395.326 3.465 10 0 GGAEMN CC(C)(NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccccc1Br ZINC000366089465 566135778 /nfs/dbraw/zinc/13/57/78/566135778.db2.gz IPRNCNBIZLNHLD-NSHDSACASA-N 0 1 377.286 3.264 10 0 GGAEMN COc1cc(Br)c(CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc1O ZINC000289699391 566136675 /nfs/dbraw/zinc/13/66/75/566136675.db2.gz FYAZWZUSHQGDBO-CYBMUJFWSA-N 0 1 379.254 3.431 10 0 GGAEMN Cc1ccc(I)cc1C(=O)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181367947 566137233 /nfs/dbraw/zinc/13/72/33/566137233.db2.gz LKCNJCOIFMPTIB-CYBMUJFWSA-N 0 1 396.232 3.085 10 0 GGAEMN O=C(CSc1cccc(Br)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181373103 566137621 /nfs/dbraw/zinc/13/76/21/566137621.db2.gz FZHSVSLOTRLNTG-ZDUSSCGKSA-N 0 1 381.299 3.413 10 0 GGAEMN Cc1ccc(I)c(C(=O)N2CCCC[C@H]2c2nnc[nH]2)c1 ZINC000181391816 566138206 /nfs/dbraw/zinc/13/82/06/566138206.db2.gz KYKFUVSAJVWJQD-ZDUSSCGKSA-N 0 1 396.232 3.085 10 0 GGAEMN C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000181395103 566138263 /nfs/dbraw/zinc/13/82/63/566138263.db2.gz FABNXGLBRWBCKW-PXAZEXFGSA-N 0 1 398.322 3.237 10 0 GGAEMN C[C@@H](Cc1ccc(Br)cc1)C(=O)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181388983 566138303 /nfs/dbraw/zinc/13/83/03/566138303.db2.gz RHYCIUAWMTYYAV-WFASDCNBSA-N 0 1 377.286 3.500 10 0 GGAEMN COCCc1nc(C)c([C@H](C)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)s1 ZINC000181395259 566138326 /nfs/dbraw/zinc/13/83/26/566138326.db2.gz IYNVTRMDDCJGER-OLZOCXBDSA-N 0 1 382.551 3.456 10 0 GGAEMN C[C@](N)(C(=O)N1CCO[C@@H](c2ccsc2)C1)c1ccc(Br)cc1 ZINC000261869031 566138632 /nfs/dbraw/zinc/13/86/32/566138632.db2.gz XSJVGOASXGNYLD-NVXWUHKLSA-N 0 1 395.322 3.285 10 0 GGAEMN CC(=O)N1Cc2ccc(NS(=O)(=O)c3cc(C)c(F)cc3Cl)cc2C1 ZINC000366179570 566138764 /nfs/dbraw/zinc/13/87/64/566138764.db2.gz QIPHMLJDFQPTFX-UHFFFAOYSA-N 0 1 382.844 3.450 10 0 GGAEMN C[C@@](N)(C(=O)N1CCO[C@@H](c2ccsc2)C1)c1ccc(Br)cc1 ZINC000261869038 566138886 /nfs/dbraw/zinc/13/88/86/566138886.db2.gz XSJVGOASXGNYLD-WBVHZDCISA-N 0 1 395.322 3.285 10 0 GGAEMN COc1cc([C@@H](C)NCCNS(=O)(=O)c2cc(C)sc2C)ccc1F ZINC000181505416 566145086 /nfs/dbraw/zinc/14/50/86/566145086.db2.gz GVRQTCVJADWVTA-GFCCVEGCSA-N 0 1 386.514 3.142 10 0 GGAEMN Cc1nc2c(s1)[C@H](N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)CCC2 ZINC000366477812 566153595 /nfs/dbraw/zinc/15/35/95/566153595.db2.gz OEUQBSSOSQTWCS-IUODEOHRSA-N 0 1 379.551 3.444 10 0 GGAEMN Cc1nc2c(s1)[C@@H](N[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)CCC2 ZINC000366477805 566154161 /nfs/dbraw/zinc/15/41/61/566154161.db2.gz OEUQBSSOSQTWCS-DOMZBBRYSA-N 0 1 379.551 3.444 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)c2cc(F)c(Br)cc2Cl)[nH][nH]1 ZINC000366527183 566156274 /nfs/dbraw/zinc/15/62/74/566156274.db2.gz FJGJTLRWAYRIGF-UHFFFAOYSA-N 0 1 398.623 3.039 10 0 GGAEMN C[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@]2(CCCOC2)O1 ZINC000366598659 566160834 /nfs/dbraw/zinc/16/08/34/566160834.db2.gz VMEMHIPDJHIRSW-YVEFUNNKSA-N 0 1 380.286 3.095 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@]2(CCCOC2)O1 ZINC000366598656 566161365 /nfs/dbraw/zinc/16/13/65/566161365.db2.gz VMEMHIPDJHIRSW-PXAZEXFGSA-N 0 1 380.286 3.095 10 0 GGAEMN O=C(NCCCc1ccc(Br)cc1F)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417675084 566170718 /nfs/dbraw/zinc/17/07/18/566170718.db2.gz BLHONDQYLOWPDB-GASCZTMLSA-N 0 1 384.293 3.057 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccccc1Br)N1CCC(c2nc[nH]n2)CC1 ZINC000366807327 566171418 /nfs/dbraw/zinc/17/14/18/566171418.db2.gz XEDDQZXLJRSDFW-DZGCQCFKSA-N 0 1 390.285 3.012 10 0 GGAEMN CC(C)NS(=O)(=O)CCN[C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000181925606 566173365 /nfs/dbraw/zinc/17/33/65/566173365.db2.gz NSBSWWVDGQFPHM-NSHDSACASA-N 0 1 389.315 3.174 10 0 GGAEMN C[C@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(Br)nc1 ZINC000290592378 566181044 /nfs/dbraw/zinc/18/10/44/566181044.db2.gz GOLQGDORTOMLKU-LRDDRELGSA-N 0 1 392.272 3.435 10 0 GGAEMN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417950817 566183715 /nfs/dbraw/zinc/18/37/15/566183715.db2.gz XTPLSZKUEOYJDK-TUKIKUTGSA-N 0 1 384.293 3.055 10 0 GGAEMN COC(=O)c1cc(NC(=O)Cc2n[nH]c3ccccc32)ccc1Br ZINC000182110596 566184560 /nfs/dbraw/zinc/18/45/60/566184560.db2.gz HLNYDFIFHNZHBE-UHFFFAOYSA-N 0 1 388.221 3.293 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CC(NC(=O)N[C@@H]2CCCc3sc(Cl)cc32)C1 ZINC000263415235 566184572 /nfs/dbraw/zinc/18/45/72/566184572.db2.gz VVYQEMMFQWYLRP-GCZXYKMCSA-N 0 1 385.917 3.016 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1Cc1cn2ccc(Br)cc2n1 ZINC000263480340 566187583 /nfs/dbraw/zinc/18/75/83/566187583.db2.gz GEDYMRIQKSEADY-DFBGVHRSSA-N 0 1 378.270 3.315 10 0 GGAEMN Cc1sc(NC(=O)CN[C@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)c1C ZINC000182197051 566189026 /nfs/dbraw/zinc/18/90/26/566189026.db2.gz HPXDDPOOGUUEGZ-CYBMUJFWSA-N 0 1 380.535 3.366 10 0 GGAEMN CC(C)(C)NC(=O)CN1CCC(C(=O)Nc2cccc(Br)c2)CC1 ZINC000263647865 566191592 /nfs/dbraw/zinc/19/15/92/566191592.db2.gz AXSVROQRJUCXRC-UHFFFAOYSA-N 0 1 396.329 3.014 10 0 GGAEMN C[C@@H](NC1(c2cccc(Br)c2)CC1)c1ccc(S(N)(=O)=O)cc1 ZINC000182271177 566194501 /nfs/dbraw/zinc/19/45/01/566194501.db2.gz BTJMIVMNVNMWTM-GFCCVEGCSA-N 0 1 395.322 3.436 10 0 GGAEMN FC(F)(F)c1nc(N2CCC[C@H](c3nc[nH]n3)C2)ccc1Br ZINC000367279364 566194721 /nfs/dbraw/zinc/19/47/21/566194721.db2.gz UYUFGTNAQPQJGO-QMMMGPOBSA-N 0 1 376.180 3.365 10 0 GGAEMN COc1ccc(CNCC[C@H]2COc3ccccc3O2)c(Br)c1O ZINC000418099660 566197714 /nfs/dbraw/zinc/19/77/14/566197714.db2.gz QELRDVKQNMIAMX-ZDUSSCGKSA-N 0 1 394.265 3.483 10 0 GGAEMN O=C(N[C@H]1CSc2ccc(Br)cc21)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000418103351 566197821 /nfs/dbraw/zinc/19/78/21/566197821.db2.gz SOMDSZLMNNABIO-SCRDCRAPSA-N 0 1 382.327 3.132 10 0 GGAEMN COc1ccc(CNCC[C@@H]2COc3ccccc3O2)c(Br)c1O ZINC000418099657 566197983 /nfs/dbraw/zinc/19/79/83/566197983.db2.gz QELRDVKQNMIAMX-CYBMUJFWSA-N 0 1 394.265 3.483 10 0 GGAEMN O=C(N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000418127151 566198595 /nfs/dbraw/zinc/19/85/95/566198595.db2.gz NIYGMXSWLQPCPC-DGHZRAPYSA-N 0 1 396.304 3.370 10 0 GGAEMN Cc1cc(C[C@H](C)NCc2c(Br)cncc2Br)[nH]n1 ZINC000290992035 566199757 /nfs/dbraw/zinc/19/97/57/566199757.db2.gz ZZTORVSZBCOYKB-QMMMGPOBSA-N 0 1 388.107 3.359 10 0 GGAEMN Cc1cc(C[C@H](C)NCc2c(Br)cncc2Br)n[nH]1 ZINC000290992035 566199762 /nfs/dbraw/zinc/19/97/62/566199762.db2.gz ZZTORVSZBCOYKB-QMMMGPOBSA-N 0 1 388.107 3.359 10 0 GGAEMN C[C@@H](Cn1cncn1)NCc1csc(-c2cccc(Br)c2)n1 ZINC000263886737 566200507 /nfs/dbraw/zinc/20/05/07/566200507.db2.gz IYXIVAGMFVSFLR-NSHDSACASA-N 0 1 378.299 3.342 10 0 GGAEMN COC(=O)CCCCCNCc1c(Br)cncc1Br ZINC000291647884 566229665 /nfs/dbraw/zinc/22/96/65/566229665.db2.gz UKBZFQWSQBDHDZ-UHFFFAOYSA-N 0 1 394.107 3.430 10 0 GGAEMN O=C(NC[C@@H]1CCCN(C(=O)c2csc(Br)c2)C1)C(F)(F)F ZINC000291065618 566204057 /nfs/dbraw/zinc/20/40/57/566204057.db2.gz IFOWHXAYCIWIDP-QMMMGPOBSA-N 0 1 399.232 3.041 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N(C)CCc2cccc(Br)c2)n[nH]1 ZINC000291156377 566206536 /nfs/dbraw/zinc/20/65/36/566206536.db2.gz FHIBQNAMAGAFTB-GFCCVEGCSA-N 0 1 379.302 3.296 10 0 GGAEMN CN1CC[C@H](NCc2ncc(I)s2)[C@@H]1c1ccccc1 ZINC000367603366 566209524 /nfs/dbraw/zinc/20/95/24/566209524.db2.gz ZIFHXJSGCBFJFQ-WFASDCNBSA-N 0 1 399.301 3.283 10 0 GGAEMN Cn1cc(CNCc2cc(Br)c3c(c2)OCCO3)c(C(F)F)n1 ZINC000291267044 566211876 /nfs/dbraw/zinc/21/18/76/566211876.db2.gz SVMLKYFXPZWLCT-UHFFFAOYSA-N 0 1 388.212 3.181 10 0 GGAEMN Cc1cc(Br)ccc1CN1CCC(C(=O)Nc2nncs2)CC1 ZINC000367709071 566212356 /nfs/dbraw/zinc/21/23/56/566212356.db2.gz VUKQRWVDFQSIOV-UHFFFAOYSA-N 0 1 395.326 3.460 10 0 GGAEMN COc1ccccc1CNC(=O)CN[C@@H](C)c1cccc(Br)c1 ZINC000182577813 566212909 /nfs/dbraw/zinc/21/29/09/566212909.db2.gz OKTDWOUTLNVVGX-ZDUSSCGKSA-N 0 1 377.282 3.425 10 0 GGAEMN COc1cccc(CNC(=O)CN[C@H](C)c2cccc(Br)c2)c1 ZINC000182570338 566212996 /nfs/dbraw/zinc/21/29/96/566212996.db2.gz MGEOFZUNDQHMOL-CYBMUJFWSA-N 0 1 377.282 3.425 10 0 GGAEMN C[C@@H](NCC(=O)NC(=O)NCc1cccs1)c1cccc(Br)c1 ZINC000182578524 566213142 /nfs/dbraw/zinc/21/31/42/566213142.db2.gz PRKRSZIKZYDBGP-LLVKDONJSA-N 0 1 396.310 3.187 10 0 GGAEMN COc1ccccc1CNC(=O)CN[C@H](C)c1cccc(Br)c1 ZINC000182577829 566213178 /nfs/dbraw/zinc/21/31/78/566213178.db2.gz OKTDWOUTLNVVGX-CYBMUJFWSA-N 0 1 377.282 3.425 10 0 GGAEMN COc1cccc(CNC(=O)CN[C@@H](C)c2cccc(Br)c2)c1 ZINC000182570323 566213205 /nfs/dbraw/zinc/21/32/05/566213205.db2.gz MGEOFZUNDQHMOL-ZDUSSCGKSA-N 0 1 377.282 3.425 10 0 GGAEMN CC(C)(NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1 ZINC000367848706 566220279 /nfs/dbraw/zinc/22/02/79/566220279.db2.gz KTZZLJRQYBRASW-CYBMUJFWSA-N 0 1 377.286 3.264 10 0 GGAEMN NC(=O)[C@@H]1CCCCC[C@@H]1Nc1nc(C(F)(F)F)c(Br)s1 ZINC000418886229 566227104 /nfs/dbraw/zinc/22/71/04/566227104.db2.gz KKOXJQIEJQNELF-RQJHMYQMSA-N 0 1 386.237 3.192 10 0 GGAEMN CC(C)n1cnc(S(=O)(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)c1 ZINC000182875683 566227425 /nfs/dbraw/zinc/22/74/25/566227425.db2.gz PGEHIOOIIIDYER-CYBMUJFWSA-N 0 1 383.342 3.324 10 0 GGAEMN CN1CC[C@@H](NCc2ncc(C3OCCO3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000368028736 566227641 /nfs/dbraw/zinc/22/76/41/566227641.db2.gz FXFGRBMOOSFMLY-PBHICJAKSA-N 0 1 379.913 3.377 10 0 GGAEMN CN1CC[C@@H](NCc2ncc(C3OCCO3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000368028737 566228061 /nfs/dbraw/zinc/22/80/61/566228061.db2.gz FXFGRBMOOSFMLY-RHSMWYFYSA-N 0 1 379.913 3.377 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@@H](NCc2ccnc(Cl)c2Cl)C1 ZINC000291642109 566228888 /nfs/dbraw/zinc/22/88/88/566228888.db2.gz TVPZQCONTRQXCW-CQSZACIVSA-N 0 1 380.275 3.158 10 0 GGAEMN CC(C)[C@@H]1C[C@H](CN[C@H](C(N)=O)c2ccc(Br)cc2F)CCO1 ZINC000419256933 566231505 /nfs/dbraw/zinc/23/15/05/566231505.db2.gz YALXBBZDXYTFDA-RLCCDNCMSA-N 0 1 387.293 3.155 10 0 GGAEMN C[C@H](NCC(=O)N1CCN(Cc2cccs2)CC1)c1ccc(Cl)s1 ZINC000182958007 566231857 /nfs/dbraw/zinc/23/18/57/566231857.db2.gz ZEIGIPXFBCDLNK-ZDUSSCGKSA-N 0 1 383.970 3.458 10 0 GGAEMN Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1CCCc2sc(Cl)cc21 ZINC000291733895 566232482 /nfs/dbraw/zinc/23/24/82/566232482.db2.gz OBTFGGBWXXWVJE-HNNXBMFYSA-N 0 1 380.945 3.447 10 0 GGAEMN O=C(NCc1cc2cc(Br)ccc2[nH]1)N[C@H]1CCc2nc[nH]c2C1 ZINC000368206547 566233256 /nfs/dbraw/zinc/23/32/56/566233256.db2.gz SKRCERFTLSSMPS-LBPRGKRZSA-N 0 1 388.269 3.010 10 0 GGAEMN O=C(NCCc1nc2cc(Cl)ccc2s1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000368203026 566233279 /nfs/dbraw/zinc/23/32/79/566233279.db2.gz JWCZUZAWMKVIBU-LLVKDONJSA-N 0 1 375.885 3.072 10 0 GGAEMN Cc1n[nH]c(C(=O)NC[C@@H]2CCN(c3ccc(Br)cc3)C2)c1C ZINC000265246993 566234086 /nfs/dbraw/zinc/23/40/86/566234086.db2.gz RJKZCIVLRUGLQX-ZDUSSCGKSA-N 0 1 377.286 3.045 10 0 GGAEMN O=C(CCc1cc(Br)cs1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000368223228 566234208 /nfs/dbraw/zinc/23/42/08/566234208.db2.gz SYSQVEYJAPKLHE-HNNXBMFYSA-N 0 1 391.294 3.467 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)c2[nH]nc(C3CC3)c2Br)ccc1F ZINC000265304562 566234680 /nfs/dbraw/zinc/23/46/80/566234680.db2.gz NHMVPJCQNWOWRC-UHFFFAOYSA-N 0 1 395.276 3.180 10 0 GGAEMN O=C(Nc1cccc(I)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000183061376 566236364 /nfs/dbraw/zinc/23/63/64/566236364.db2.gz AZMHGFQYXMFTOG-LBPRGKRZSA-N 0 1 397.220 3.168 10 0 GGAEMN O=C(Nc1cccc(I)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000183061356 566236607 /nfs/dbraw/zinc/23/66/07/566236607.db2.gz AZMHGFQYXMFTOG-GFCCVEGCSA-N 0 1 397.220 3.168 10 0 GGAEMN O=C(Nc1ccccc1I)N1CCCC[C@H]1c1nnc[nH]1 ZINC000183059155 566236800 /nfs/dbraw/zinc/23/68/00/566236800.db2.gz JMLQWDFBLRYRNO-LBPRGKRZSA-N 0 1 397.220 3.168 10 0 GGAEMN O=C(Nc1ccccc1-c1nc[nH]n1)c1cc(Br)cc2nc[nH]c21 ZINC000368521763 566241026 /nfs/dbraw/zinc/24/10/26/566241026.db2.gz IMAJDCQWQWOHFD-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN O=C(Nc1cccc2c1OCC[C@H]2O)c1cc(Br)cc2nc[nH]c21 ZINC000368527729 566241075 /nfs/dbraw/zinc/24/10/75/566241075.db2.gz MAPUGZGMROEPAP-CQSZACIVSA-N 0 1 388.221 3.394 10 0 GGAEMN CC[C@@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1nccn1C ZINC000183325612 566244134 /nfs/dbraw/zinc/24/41/34/566244134.db2.gz YLIZBEREGRJOEU-CYBMUJFWSA-N 0 1 375.274 3.209 10 0 GGAEMN CC[C@@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1nccn1C ZINC000183325612 566244137 /nfs/dbraw/zinc/24/41/37/566244137.db2.gz YLIZBEREGRJOEU-CYBMUJFWSA-N 0 1 375.274 3.209 10 0 GGAEMN C[C@H](NC(=O)NCc1ccc(Br)cc1C(F)(F)F)c1nnc[nH]1 ZINC000183413024 566246149 /nfs/dbraw/zinc/24/61/49/566246149.db2.gz FFEKUGDEWAQRNW-ZETCQYMHSA-N 0 1 392.179 3.146 10 0 GGAEMN C[C@@H](NC(=O)NCc1ccc(Br)cc1C(F)(F)F)c1nnc[nH]1 ZINC000183413041 566246325 /nfs/dbraw/zinc/24/63/25/566246325.db2.gz FFEKUGDEWAQRNW-SSDOTTSWSA-N 0 1 392.179 3.146 10 0 GGAEMN O=C(CN[C@H](c1nnc[nH]1)c1ccccc1)Nc1ccc(Cl)c(Cl)c1 ZINC000368936543 566247871 /nfs/dbraw/zinc/24/78/71/566247871.db2.gz BYPOYVUDRGLNEN-INIZCTEOSA-N 0 1 376.247 3.429 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000183538303 566248512 /nfs/dbraw/zinc/24/85/12/566248512.db2.gz JLTANEYNEXFCLB-KRWDZBQOSA-N 0 1 390.281 3.124 10 0 GGAEMN Brc1ccc2ncc(CN[C@@H](c3nnc[nH]3)c3ccccc3)n2c1 ZINC000369020008 566249018 /nfs/dbraw/zinc/24/90/18/566249018.db2.gz TVKRBEMPPDLVQA-MRXNPFEDSA-N 0 1 383.253 3.094 10 0 GGAEMN O=C([C@@H]1CCCN(CCOc2ccccc2Br)C1)N1CCCC1 ZINC000508915927 566251141 /nfs/dbraw/zinc/25/11/41/566251141.db2.gz VYVROEAPZZGKAR-OAHLLOKOSA-N 0 1 381.314 3.162 10 0 GGAEMN [O-]c1c(Br)cc(C[N@H+]2CC[C@H]3COC[C@H]3C2)cc1Br ZINC000668705219 566258493 /nfs/dbraw/zinc/25/84/93/566258493.db2.gz HBPDGPLAZGODIY-WDEREUQCSA-N 0 1 391.103 3.386 10 0 GGAEMN CCOC(=O)C[C@@H](O)CN(Cc1cc(Br)ccc1F)C(C)C ZINC000599274516 566251828 /nfs/dbraw/zinc/25/18/28/566251828.db2.gz VLTFEMVZCQLCNN-CQSZACIVSA-N 0 1 376.266 3.113 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@H]1CCCN1CC(F)(F)F)c1ccc(Cl)cc1 ZINC000575104103 566251910 /nfs/dbraw/zinc/25/19/10/566251910.db2.gz GYPQVSKJRSYNBJ-CABCVRRESA-N 0 1 377.838 3.086 10 0 GGAEMN COC(=O)c1cnc(CN(C)CC2(c3ccc(Br)cc3)CC2)cn1 ZINC000599298941 566253713 /nfs/dbraw/zinc/25/37/13/566253713.db2.gz BPWORDYTIILIKQ-UHFFFAOYSA-N 0 1 390.281 3.189 10 0 GGAEMN O=C(NCc1cnn(-c2ccccc2)c1)c1n[nH]c2ccc(Br)cc21 ZINC000599347954 566254333 /nfs/dbraw/zinc/25/43/33/566254333.db2.gz AGNNAGBPYPJPMT-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN CNC(=O)C[C@H](NCc1ccc(OC)c(Br)c1)c1ccccc1 ZINC000481835452 566254855 /nfs/dbraw/zinc/25/48/55/566254855.db2.gz ZZZDGWSYMLTTHG-INIZCTEOSA-N 0 1 377.282 3.425 10 0 GGAEMN Cc1ccn2cc(CNC(=O)c3n[nH]c4ccc(Br)cc43)nc2c1 ZINC000599352018 566255183 /nfs/dbraw/zinc/25/51/83/566255183.db2.gz JJINOLPAOVCVCQ-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN CN(C)C(=O)N(C)[C@@H]1CCN(CC2=Cc3cc(Cl)cc(Cl)c3OC2)C1 ZINC000668687402 566256674 /nfs/dbraw/zinc/25/66/74/566256674.db2.gz COIOJJVFWMWZHV-OAHLLOKOSA-N 0 1 384.307 3.457 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2cccc(Br)c2[O-])[C@H]1c1ccccc1 ZINC000534844959 566257804 /nfs/dbraw/zinc/25/78/04/566257804.db2.gz ROSYJFPJZQTSPC-JKSUJKDBSA-N 0 1 375.266 3.330 10 0 GGAEMN [O-]c1c(Br)cc(C[N@@H+]2CC[C@H]3COC[C@H]3C2)cc1Br ZINC000668705219 566258490 /nfs/dbraw/zinc/25/84/90/566258490.db2.gz HBPDGPLAZGODIY-WDEREUQCSA-N 0 1 391.103 3.386 10 0 GGAEMN COc1c(C)cc(C)cc1S(=O)(=O)Nc1cccc(C[S@](C)=O)c1C ZINC000509090303 566261058 /nfs/dbraw/zinc/26/10/58/566261058.db2.gz POOVGGRTRKKHBR-DEOSSOPVSA-N 0 1 381.519 3.300 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)NC[C@@H](C)N(C)Cc1ccccc1 ZINC000624964631 566264012 /nfs/dbraw/zinc/26/40/12/566264012.db2.gz ZDQUKLXSEBWSLR-OAHLLOKOSA-N 0 1 376.513 3.498 10 0 GGAEMN COC(=O)c1cnc(CN2CC[C@@H](Cc3ccc(Br)cc3)C2)cn1 ZINC000599427200 566263987 /nfs/dbraw/zinc/26/39/87/566263987.db2.gz HIDLWMUALXIZFQ-AWEZNQCLSA-N 0 1 390.281 3.090 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C[C@@H](C)n3cc(Br)cn3)[nH]c21 ZINC000648340665 566267192 /nfs/dbraw/zinc/26/71/92/566267192.db2.gz TVXGXWUJZSADHS-LLVKDONJSA-N 0 1 376.258 3.098 10 0 GGAEMN Brc1ccn2cc(CN3C[C@]45COC[C@@]4(C3)CCCC5)nc2c1 ZINC000668784113 566267176 /nfs/dbraw/zinc/26/71/76/566267176.db2.gz BABWSDNJZNEJEZ-HDICACEKSA-N 0 1 376.298 3.489 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(Br)c(F)c1 ZINC000462280059 566273136 /nfs/dbraw/zinc/27/31/36/566273136.db2.gz MHIWLCSFOWAQCD-TXEJJXNPSA-N 0 1 393.322 3.129 10 0 GGAEMN C[C@@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ncc(Br)cn1 ZINC000556204093 566274911 /nfs/dbraw/zinc/27/49/11/566274911.db2.gz BVVNTDIEZDKWGK-GFCCVEGCSA-N 0 1 383.334 3.317 10 0 GGAEMN CCC[C@H](OCC)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000625116495 566277628 /nfs/dbraw/zinc/27/76/28/566277628.db2.gz VKEOLTCZXVEIGV-ZDUSSCGKSA-N 0 1 381.274 3.056 10 0 GGAEMN CCC[C@H](OCC)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000625116495 566277632 /nfs/dbraw/zinc/27/76/32/566277632.db2.gz VKEOLTCZXVEIGV-ZDUSSCGKSA-N 0 1 381.274 3.056 10 0 GGAEMN CC[N@@H+](CCNS(=O)(=O)c1c(Cl)cccc1Br)C(C)C ZINC000509234785 566281017 /nfs/dbraw/zinc/28/10/17/566281017.db2.gz AORSAXVXRPUIGC-UHFFFAOYSA-N 0 1 383.739 3.111 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2cc(F)cc(F)c2)[C@H]1c1cccs1 ZINC000462318759 566280925 /nfs/dbraw/zinc/28/09/25/566280925.db2.gz WXCHCYQNDDMIFW-SJCJKPOMSA-N 0 1 386.489 3.388 10 0 GGAEMN CCOc1ccc(Br)cc1CN(C[C@H](O)CC1(O)CCC1)C1CC1 ZINC000625136329 566281036 /nfs/dbraw/zinc/28/10/36/566281036.db2.gz KBZAKZFGKRPPKO-QGZVFWFLSA-N 0 1 398.341 3.478 10 0 GGAEMN NC(=O)NC(=O)CCCN1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000599637866 566282231 /nfs/dbraw/zinc/28/22/31/566282231.db2.gz WJHJLQBZUACGBK-ZDUSSCGKSA-N 0 1 388.693 3.215 10 0 GGAEMN COCC(C)(C)N1CCN(C(=O)[C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000648425451 566283392 /nfs/dbraw/zinc/28/33/92/566283392.db2.gz VFBRUOCPDYEBKT-QGZVFWFLSA-N 0 1 395.341 3.048 10 0 GGAEMN C[C@@H]1CN(C)C[C@H](C)N1C(=O)c1ccc(Cl)c(I)c1 ZINC000535226576 566287041 /nfs/dbraw/zinc/28/70/41/566287041.db2.gz QGZMATFVAXQVNN-AOOOYVTPSA-N 0 1 392.668 3.109 10 0 GGAEMN C[C@H]1CN(C)C[C@H](C)N1C(=O)c1ccc(Cl)c(I)c1 ZINC000535226581 566287423 /nfs/dbraw/zinc/28/74/23/566287423.db2.gz QGZMATFVAXQVNN-UWVGGRQHSA-N 0 1 392.668 3.109 10 0 GGAEMN COC(=O)C1C[C@H](C)N(Cc2nc3ccc(Br)cc3[nH]2)[C@@H](C)C1 ZINC000599699824 566287943 /nfs/dbraw/zinc/28/79/43/566287943.db2.gz ZJTASMJNLWTPJJ-QWRGUYRKSA-N 0 1 380.286 3.487 10 0 GGAEMN C[C@@H](NC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ncc(Br)cn1 ZINC000575851659 566292672 /nfs/dbraw/zinc/29/26/72/566292672.db2.gz HNZJJLVJAQXYDE-KGLIPLIRSA-N 0 1 389.297 3.052 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1ccnn1C1CCOCC1 ZINC000669348054 566296853 /nfs/dbraw/zinc/29/68/53/566296853.db2.gz HTKWVCOHFSUXGJ-UHFFFAOYSA-N 0 1 390.241 3.126 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1cnc(OCC2CC2)cn1 ZINC000556429122 566300446 /nfs/dbraw/zinc/30/04/46/566300446.db2.gz MMOKLOPCQKGJIC-UHFFFAOYSA-N 0 1 388.225 3.157 10 0 GGAEMN CC(C)c1cccc(S(=O)(=O)NCC2(N3CCSCC3)CCCC2)c1 ZINC000462425402 566300787 /nfs/dbraw/zinc/30/07/87/566300787.db2.gz GZTZETQREIATFR-UHFFFAOYSA-N 0 1 382.595 3.450 10 0 GGAEMN Cn1cc(-c2noc(-c3cc(-c4ccc(Br)cc4)n[nH]3)n2)ccc1=O ZINC000445615275 566301181 /nfs/dbraw/zinc/30/11/81/566301181.db2.gz GHLUAEFFIOZZNO-UHFFFAOYSA-N 0 1 398.220 3.255 10 0 GGAEMN Cn1cc(-c2noc(-c3[nH]nc(-c4ccccc4)c3Br)n2)ccc1=O ZINC000445615282 566301770 /nfs/dbraw/zinc/30/17/70/566301770.db2.gz GJANYGCDOHXSBC-UHFFFAOYSA-N 0 1 398.220 3.255 10 0 GGAEMN COc1ccc(S(=O)(=O)NCCN2CCCC[C@@H]2C)c(Cl)c1Cl ZINC000462443236 566304628 /nfs/dbraw/zinc/30/46/28/566304628.db2.gz WUINEDPDZCWCGF-NSHDSACASA-N 0 1 381.325 3.155 10 0 GGAEMN CS[C@H]1CN(S(=O)(=O)c2ccc(C(C)(C)C)s2)C[C@@H]1N1CCCC1 ZINC000445715671 566306981 /nfs/dbraw/zinc/30/69/81/566306981.db2.gz HMVGCJXRMLJZFB-KBPBESRZSA-N 0 1 388.624 3.246 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)cc1Cl)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000445710498 566307079 /nfs/dbraw/zinc/30/70/79/566307079.db2.gz WPRAQFOTNDWMTI-OAHLLOKOSA-N 0 1 397.287 3.321 10 0 GGAEMN O=S(=O)(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(Cl)cc(Cl)c1 ZINC000445715393 566307316 /nfs/dbraw/zinc/30/73/16/566307316.db2.gz DDSLLQIYJKKDGA-CQSZACIVSA-N 0 1 383.260 3.179 10 0 GGAEMN O=C1Nc2ccc(Br)cc2CC[C@@H]1N[C@@H](CO)c1ccsc1 ZINC000625328362 566307498 /nfs/dbraw/zinc/30/74/98/566307498.db2.gz NIOSUCONYNSJPK-GJZGRUSLSA-N 0 1 381.295 3.087 10 0 GGAEMN O=S(=O)(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(Cl)sc1Cl ZINC000445739428 566308671 /nfs/dbraw/zinc/30/86/71/566308671.db2.gz FRLLMLGLBUJOOI-NSHDSACASA-N 0 1 389.289 3.241 10 0 GGAEMN Cc1cnn(CCN2CCN([C@H](C)c3ccc(Br)cc3)CC2)c1 ZINC000556497727 566308909 /nfs/dbraw/zinc/30/89/09/566308909.db2.gz RWTXEWWABWHQIV-MRXNPFEDSA-N 0 1 377.330 3.333 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)cc(Cl)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000445757502 566309602 /nfs/dbraw/zinc/30/96/02/566309602.db2.gz NPMRZPSHTZQERA-OAHLLOKOSA-N 0 1 397.287 3.321 10 0 GGAEMN Cc1csc(NC(=O)CN[C@@H](c2cncc(Br)c2)C2CC2)n1 ZINC000556520834 566309698 /nfs/dbraw/zinc/30/96/98/566309698.db2.gz XIVIUGSPTXCAER-CQSZACIVSA-N 0 1 381.299 3.288 10 0 GGAEMN COc1ccc(CN[C@H](c2nnc[nH]2)c2ccccc2)c(Br)c1O ZINC000482513966 566312080 /nfs/dbraw/zinc/31/20/80/566312080.db2.gz RSSAPCGRWCXHHJ-HNNXBMFYSA-N 0 1 389.253 3.161 10 0 GGAEMN COc1ccc(CN[C@@H](c2nnc[nH]2)c2ccccc2)c(Br)c1O ZINC000482513969 566312509 /nfs/dbraw/zinc/31/25/09/566312509.db2.gz RSSAPCGRWCXHHJ-OAHLLOKOSA-N 0 1 389.253 3.161 10 0 GGAEMN CCCOc1ncccc1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000600056049 566312655 /nfs/dbraw/zinc/31/26/55/566312655.db2.gz RZUMJDBRVFRHBL-UHFFFAOYSA-N 0 1 389.253 3.439 10 0 GGAEMN O=C(NCc1ccc(Br)cc1Cl)N[C@H]1CCc2nc[nH]c2C1 ZINC000576081532 566313369 /nfs/dbraw/zinc/31/33/69/566313369.db2.gz RDMGKAIAYPHMTJ-NSHDSACASA-N 0 1 383.677 3.182 10 0 GGAEMN COc1cncc(C[N@@H+](Cc2cccc(Br)c2)C2CCOCC2)n1 ZINC000625364565 566313846 /nfs/dbraw/zinc/31/38/46/566313846.db2.gz JJILXUZSFKSMQV-UHFFFAOYSA-N 0 1 392.297 3.429 10 0 GGAEMN COc1cncc(CN(Cc2cccc(Br)c2)C2CCOCC2)n1 ZINC000625364565 566313851 /nfs/dbraw/zinc/31/38/51/566313851.db2.gz JJILXUZSFKSMQV-UHFFFAOYSA-N 0 1 392.297 3.429 10 0 GGAEMN C[C@@H]1C[C@@H](NC(=O)c2cc3c(cncc3Br)s2)CN1C1CC1 ZINC000648819016 566316616 /nfs/dbraw/zinc/31/66/16/566316616.db2.gz UGSFIRKLBUWWGW-NXEZZACHSA-N 0 1 380.311 3.414 10 0 GGAEMN O=C(NCCOc1ccc(F)c(F)c1)c1n[nH]c2ccc(Br)cc21 ZINC000600157589 566320335 /nfs/dbraw/zinc/32/03/35/566320335.db2.gz PHKYJOPODRBRGK-UHFFFAOYSA-N 0 1 396.191 3.412 10 0 GGAEMN CCCN(C)[C@H](CNS(=O)(=O)Cc1cc(C)on1)c1ccc(Cl)cc1 ZINC000509618993 566320521 /nfs/dbraw/zinc/32/05/21/566320521.db2.gz DTFFVWRODQDLSW-QGZVFWFLSA-N 0 1 385.917 3.139 10 0 GGAEMN Cc1cccn2cc(CCNC(=O)c3cc(Br)cc4nc[nH]c43)nc12 ZINC000669708062 566322583 /nfs/dbraw/zinc/32/25/83/566322583.db2.gz VTBFUTRYCKXLHV-UHFFFAOYSA-N 0 1 398.264 3.254 10 0 GGAEMN O=C(NC[C@H]1OCCc2ccccc21)c1cc(Br)cc2nc[nH]c21 ZINC000669704691 566322649 /nfs/dbraw/zinc/32/26/49/566322649.db2.gz MELFLUJNFFMPQL-MRXNPFEDSA-N 0 1 386.249 3.369 10 0 GGAEMN COC(=O)Cc1ccc(CNCc2ccc(Br)cc2OC)cc1 ZINC000600188184 566323419 /nfs/dbraw/zinc/32/34/19/566323419.db2.gz WJFFFHURVCBNEZ-UHFFFAOYSA-N 0 1 378.266 3.463 10 0 GGAEMN COC(=O)Cc1ccc(CNCc2cc(Br)cc3c2OCC3)cc1 ZINC000600185160 566323764 /nfs/dbraw/zinc/32/37/64/566323764.db2.gz MTICATBCQOLLET-UHFFFAOYSA-N 0 1 390.277 3.389 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)c1[nH]nc2c1CCCC2 ZINC000669727475 566323901 /nfs/dbraw/zinc/32/39/01/566323901.db2.gz FSXFKDOQVNINBD-ZDUSSCGKSA-N 0 1 376.254 3.305 10 0 GGAEMN Cn1nc(CNC(=O)c2cc(Br)cc3nc[nH]c32)c2ccccc21 ZINC000669717568 566324012 /nfs/dbraw/zinc/32/40/12/566324012.db2.gz ZLTVQMOQAULJKQ-UHFFFAOYSA-N 0 1 384.237 3.142 10 0 GGAEMN Brc1ccc(-n2cc(CN3CC(C4CCOCC4)C3)cn2)cc1 ZINC000669715892 566324120 /nfs/dbraw/zinc/32/41/20/566324120.db2.gz RYUCPICDTPUMEZ-UHFFFAOYSA-N 0 1 376.298 3.493 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC(C2CCOCC2)C1 ZINC000669738188 566326021 /nfs/dbraw/zinc/32/60/21/566326021.db2.gz ZPIFPCFYBBCYSJ-UHFFFAOYSA-N 0 1 390.281 3.338 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Br)[C@H](C)[C@@H](C)O1 ZINC000446073153 566327394 /nfs/dbraw/zinc/32/73/94/566327394.db2.gz RZCFRRNUAOIOLK-BYNQJWBRSA-N 0 1 392.721 3.340 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Br)[C@@H](C)[C@@H](C)O1 ZINC000446073154 566327856 /nfs/dbraw/zinc/32/78/56/566327856.db2.gz RZCFRRNUAOIOLK-CZXHOFHRSA-N 0 1 392.721 3.340 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000556752512 566328466 /nfs/dbraw/zinc/32/84/66/566328466.db2.gz FQZAMFJTJFYITM-KWCYVHTRSA-N 0 1 390.285 3.222 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000556752512 566328477 /nfs/dbraw/zinc/32/84/77/566328477.db2.gz FQZAMFJTJFYITM-KWCYVHTRSA-N 0 1 390.285 3.222 10 0 GGAEMN CCOC(=O)[C@@H]1c2ccoc2CCN1C(=O)c1cccc(Br)c1O ZINC000600245905 566328533 /nfs/dbraw/zinc/32/85/33/566328533.db2.gz UZNHYHNBDWNRMU-AWEZNQCLSA-N 0 1 394.221 3.050 10 0 GGAEMN CS[C@@H]1CN(C(=O)c2sc(C(F)(F)F)nc2C)C[C@@H]1N1CCCC1 ZINC000462586788 566328714 /nfs/dbraw/zinc/32/87/14/566328714.db2.gz AYDKQUCCNSHTTQ-WDEREUQCSA-N 0 1 379.473 3.122 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC[C@H](OC(F)F)C1 ZINC000576244252 566328729 /nfs/dbraw/zinc/32/87/29/566328729.db2.gz LYEPUHNPWRTRSK-NSHDSACASA-N 0 1 386.196 3.293 10 0 GGAEMN CCCN1CCC[C@H]1C(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000482732956 566329961 /nfs/dbraw/zinc/32/99/61/566329961.db2.gz CRTVSKBPLPFNCH-CVEARBPZSA-N 0 1 384.307 3.089 10 0 GGAEMN CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000482732960 566330136 /nfs/dbraw/zinc/33/01/36/566330136.db2.gz CRTVSKBPLPFNCH-HZPDHXFCSA-N 0 1 384.307 3.089 10 0 GGAEMN COCCN1CCC[C@@H](NC(=O)c2c(Cl)cc(F)cc2Br)C1 ZINC000648917498 566330504 /nfs/dbraw/zinc/33/05/04/566330504.db2.gz IIYROEGIZZXMMS-LLVKDONJSA-N 0 1 393.684 3.082 10 0 GGAEMN O=S1(=O)CCCN1[C@@H]1CCCN(Cc2ccc(Cl)c3ccccc23)C1 ZINC000420957579 566331260 /nfs/dbraw/zinc/33/12/60/566331260.db2.gz CVUJDOZOYXHIPW-MRXNPFEDSA-N 0 1 378.925 3.493 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(Br)c(OC(F)(F)F)c2)C1 ZINC000669894927 566335042 /nfs/dbraw/zinc/33/50/42/566335042.db2.gz ZCRWXBWBONTMHG-JTQLQIEISA-N 0 1 381.192 3.172 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(Br)c(OC(F)(F)F)c2)C1 ZINC000669894928 566335894 /nfs/dbraw/zinc/33/58/94/566335894.db2.gz ZCRWXBWBONTMHG-SNVBAGLBSA-N 0 1 381.192 3.172 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)CN1[C@H](C)CC[C@@H]1C ZINC000482850459 566337284 /nfs/dbraw/zinc/33/72/84/566337284.db2.gz NZYDRHVFAGFMOX-BETUJISGSA-N 0 1 385.302 3.286 10 0 GGAEMN CN(C)C[C@@H](Cc1ccccc1)NS(=O)(=O)Cc1ccc(F)c(Cl)c1 ZINC000535912417 566338460 /nfs/dbraw/zinc/33/84/60/566338460.db2.gz BNLXZBDCAQHRFL-MRXNPFEDSA-N 0 1 384.904 3.071 10 0 GGAEMN CC1(CC(F)F)CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000649018363 566339852 /nfs/dbraw/zinc/33/98/52/566339852.db2.gz OYQQICGLTCUNIL-UHFFFAOYSA-N 0 1 385.208 3.408 10 0 GGAEMN O=C(CSCC(=O)c1ccc(Cl)cc1)NC[C@H]1CCN1C1CCCC1 ZINC000600472698 566339992 /nfs/dbraw/zinc/33/99/92/566339992.db2.gz OJBQUDSWMHSHTA-QGZVFWFLSA-N 0 1 380.941 3.389 10 0 GGAEMN COC(=O)C[C@@H](C)CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600472275 566340621 /nfs/dbraw/zinc/34/06/21/566340621.db2.gz NQQRFMIBQLXSCT-NHYWBVRUSA-N 0 1 375.296 3.302 10 0 GGAEMN COC(=O)C[C@H](C)CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600472272 566340704 /nfs/dbraw/zinc/34/07/04/566340704.db2.gz NQQRFMIBQLXSCT-ABAIWWIYSA-N 0 1 375.296 3.302 10 0 GGAEMN COC(=O)c1cc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c[nH]1 ZINC000600470865 566340780 /nfs/dbraw/zinc/34/07/80/566340780.db2.gz JGDTUYCZKXSJJW-OAHLLOKOSA-N 0 1 384.263 3.141 10 0 GGAEMN O=C(Nc1cnc2c(Br)cccn12)c1cccc(-c2nnc[nH]2)c1 ZINC000556898088 566341475 /nfs/dbraw/zinc/34/14/75/566341475.db2.gz GMPKSQBUIJERFS-UHFFFAOYSA-N 0 1 383.209 3.134 10 0 GGAEMN CN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CN2CCC1CC2 ZINC000600512911 566343068 /nfs/dbraw/zinc/34/30/68/566343068.db2.gz SGIKWGWDWVGJOF-KRWDZBQOSA-N 0 1 389.297 3.005 10 0 GGAEMN CN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CN2CCC1CC2 ZINC000600512912 566343130 /nfs/dbraw/zinc/34/31/30/566343130.db2.gz SGIKWGWDWVGJOF-QGZVFWFLSA-N 0 1 389.297 3.005 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000576434942 566344617 /nfs/dbraw/zinc/34/46/17/566344617.db2.gz GAXSPSRFFGYOLD-OAHLLOKOSA-N 0 1 381.567 3.147 10 0 GGAEMN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)(F)F ZINC000556923056 566345218 /nfs/dbraw/zinc/34/52/18/566345218.db2.gz HYQNMHYCYFVKHX-OLZOCXBDSA-N 0 1 380.432 3.050 10 0 GGAEMN O=C1CCCN1CCCN1CCC[C@@H]1c1ccc(I)cc1 ZINC000536041673 566346216 /nfs/dbraw/zinc/34/62/16/566346216.db2.gz JYJHBAFIKPIROP-MRXNPFEDSA-N 0 1 398.288 3.441 10 0 GGAEMN O=C1CCCN1CCCN1CCC[C@H]1c1ccc(I)cc1 ZINC000536041669 566346743 /nfs/dbraw/zinc/34/67/43/566346743.db2.gz JYJHBAFIKPIROP-INIZCTEOSA-N 0 1 398.288 3.441 10 0 GGAEMN CC1(C)C[C@H](SCC(=O)Nc2cccc(CN3CCSCC3)c2)CO1 ZINC000600567567 566347457 /nfs/dbraw/zinc/34/74/57/566347457.db2.gz BMDCHTSFEKXBHB-KRWDZBQOSA-N 0 1 380.579 3.475 10 0 GGAEMN CNS(=O)(=O)CCCN(C)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000482973689 566347726 /nfs/dbraw/zinc/34/77/26/566347726.db2.gz DXQGRXPMJOZRMA-SFHVURJKSA-N 0 1 384.904 3.440 10 0 GGAEMN Cc1cc(C2(NS(=O)(=O)c3cc(Cl)sc3Cl)CCOCC2)on1 ZINC000625653299 566348000 /nfs/dbraw/zinc/34/80/00/566348000.db2.gz JGBMOWUMJMRYPS-UHFFFAOYSA-N 0 1 397.305 3.336 10 0 GGAEMN C[C@@H](C1CC1)n1nccc1NS(=O)(=O)c1cc(F)ccc1OC(F)F ZINC000421147432 566349312 /nfs/dbraw/zinc/34/93/12/566349312.db2.gz BTCZMSQFVGONQU-VIFPVBQESA-N 0 1 375.372 3.395 10 0 GGAEMN CCn1c(-c2ccccc2Br)nnc1N1CCN(CC)[C@@H](C)C1 ZINC000670110894 566349567 /nfs/dbraw/zinc/34/95/67/566349567.db2.gz RAAGBZMXLISCAN-ZDUSSCGKSA-N 0 1 378.318 3.258 10 0 GGAEMN CCCCN(C(=O)c1csc(=NC2CC2)[nH]1)[C@H]1CCc2ncsc2C1 ZINC000649162808 566349982 /nfs/dbraw/zinc/34/99/82/566349982.db2.gz ZXVWOBYXBVBCPV-ZDUSSCGKSA-N 0 1 376.551 3.396 10 0 GGAEMN O=C(NCc1csc(Br)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000446500572 566351946 /nfs/dbraw/zinc/35/19/46/566351946.db2.gz BGGPSVGYGXSQJR-CYBMUJFWSA-N 0 1 392.282 3.218 10 0 GGAEMN C[C@@H](CN1CC[C@H](Sc2ccc(Br)cc2)C1)CS(C)(=O)=O ZINC000625703378 566352304 /nfs/dbraw/zinc/35/23/04/566352304.db2.gz FXGOKCMRRSMNLX-WFASDCNBSA-N 0 1 392.384 3.296 10 0 GGAEMN O=C(NCc1csc(Br)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000446500573 566352478 /nfs/dbraw/zinc/35/24/78/566352478.db2.gz BGGPSVGYGXSQJR-ZDUSSCGKSA-N 0 1 392.282 3.218 10 0 GGAEMN C[C@@H](CN1CC[C@@H](Sc2ccc(Br)cc2)C1)CS(C)(=O)=O ZINC000625703376 566353096 /nfs/dbraw/zinc/35/30/96/566353096.db2.gz FXGOKCMRRSMNLX-SWLSCSKDSA-N 0 1 392.384 3.296 10 0 GGAEMN COC(=O)c1csc(NS(=O)(=O)C[C@H](OC)c2ccc(F)cc2)c1C ZINC000600651332 566354356 /nfs/dbraw/zinc/35/43/56/566354356.db2.gz HEPKVFKUIFZAOA-AWEZNQCLSA-N 0 1 387.454 3.112 10 0 GGAEMN COC(=O)c1csc(NS(=O)(=O)C[C@@H](OC)c2ccc(F)cc2)c1C ZINC000600651333 566354585 /nfs/dbraw/zinc/35/45/85/566354585.db2.gz HEPKVFKUIFZAOA-CQSZACIVSA-N 0 1 387.454 3.112 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCN(CC3CCOCC3)CC2)c1 ZINC000625721689 566354772 /nfs/dbraw/zinc/35/47/72/566354772.db2.gz NPSKXCZOGXWJSZ-UHFFFAOYSA-N 0 1 399.304 3.081 10 0 GGAEMN CC(C)[C@@H]1CN(C)CCN1C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625753387 566355516 /nfs/dbraw/zinc/35/55/16/566355516.db2.gz YVJZGAANKFRBPA-DZJNRPSUSA-N 0 1 377.326 3.133 10 0 GGAEMN CC(C)[C@@H]1CN(C)CCN1C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625753389 566356136 /nfs/dbraw/zinc/35/61/36/566356136.db2.gz YVJZGAANKFRBPA-LAVFITLUSA-N 0 1 377.326 3.133 10 0 GGAEMN O=C(NC[C@@H]1CN2CCN1CCC2)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000670446698 566363029 /nfs/dbraw/zinc/36/30/29/566363029.db2.gz AGYNBWDLJLRUEE-MRXNPFEDSA-N 0 1 375.925 3.188 10 0 GGAEMN Cc1ccc(CN(CCO)CCC(=O)Nc2ccc(Br)cc2)o1 ZINC000483204047 566364257 /nfs/dbraw/zinc/36/42/57/566364257.db2.gz RVNITPSNQZEYEJ-UHFFFAOYSA-N 0 1 381.270 3.174 10 0 GGAEMN CC[C@H]1CN(CCOc2cc(F)cc(Br)c2)C[C@]2(CCOC2)O1 ZINC000483200886 566364553 /nfs/dbraw/zinc/36/45/53/566364553.db2.gz QRSCVPKQLBGORL-RDJZCZTQSA-N 0 1 388.277 3.237 10 0 GGAEMN COC(=O)c1ccncc1NS(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000446824658 566367539 /nfs/dbraw/zinc/36/75/39/566367539.db2.gz VTGIBCKZBRQXFD-UHFFFAOYSA-N 0 1 375.233 3.117 10 0 GGAEMN C[C@H](CN(C)C(=O)c1ccc2scc(Br)c2c1)c1nn[nH]n1 ZINC000649480418 566368305 /nfs/dbraw/zinc/36/83/05/566368305.db2.gz CSKTVNGEPVFADK-MRVPVSSYSA-N 0 1 380.271 3.053 10 0 GGAEMN O=c1[nH]nc2n1CCN(Cc1ccc(-c3ccccc3Br)cc1)C2 ZINC000576685714 566369264 /nfs/dbraw/zinc/36/92/64/566369264.db2.gz NQOKEFMWPQTWRK-UHFFFAOYSA-N 0 1 385.265 3.429 10 0 GGAEMN CN(CC(C)(C)C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000510175520 566369587 /nfs/dbraw/zinc/36/95/87/566369587.db2.gz GCQGPWKRNZJUKQ-UHFFFAOYSA-N 0 1 380.290 3.422 10 0 GGAEMN CN(CC(C)(C)C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000510175520 566369595 /nfs/dbraw/zinc/36/95/95/566369595.db2.gz GCQGPWKRNZJUKQ-UHFFFAOYSA-N 0 1 380.290 3.422 10 0 GGAEMN C[C@H]1OCC[C@H]1N(CCO)Cc1cc(Br)ccc1OC(F)F ZINC000483269261 566369616 /nfs/dbraw/zinc/36/96/16/566369616.db2.gz RHCPCFKSLDWXRF-ZWNOBZJWSA-N 0 1 380.229 3.022 10 0 GGAEMN CN(CC(=O)NCc1ccc(I)cc1Cl)C1CCC1 ZINC000600824401 566369933 /nfs/dbraw/zinc/36/99/33/566369933.db2.gz AXQONBXOSTXGAG-UHFFFAOYSA-N 0 1 392.668 3.045 10 0 GGAEMN Cc1c(Cl)c(CNC[C@H](CO)Cc2cccc(Br)c2)nn1C ZINC000421402684 566371782 /nfs/dbraw/zinc/37/17/82/566371782.db2.gz WFLOSCVKZOTTCR-CYBMUJFWSA-N 0 1 386.721 3.085 10 0 GGAEMN Cc1n[nH]c(C)c1NC(=O)CN[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000625983663 566372571 /nfs/dbraw/zinc/37/25/71/566372571.db2.gz XBXQOWLUHKFPST-OAHLLOKOSA-N 0 1 384.311 3.164 10 0 GGAEMN CN(C)C[C@@H](NCC(=O)N(C)c1nccs1)c1ccc(Cl)c(Cl)c1 ZINC000625983724 566373120 /nfs/dbraw/zinc/37/31/20/566373120.db2.gz YVUOEUVXPWUMFN-CQSZACIVSA-N 0 1 387.336 3.305 10 0 GGAEMN Cc1cc(S(=O)(=O)N[C@@H](c2cnn(C)c2)C(F)(F)F)c(Cl)cc1F ZINC000446955747 566373234 /nfs/dbraw/zinc/37/32/34/566373234.db2.gz BJBURCDPVJPQJE-LBPRGKRZSA-N 0 1 385.770 3.103 10 0 GGAEMN CN(CCC(F)(F)F)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000576740488 566374895 /nfs/dbraw/zinc/37/48/95/566374895.db2.gz ADKJEKLIOFFSCL-UHFFFAOYSA-N 0 1 377.160 3.315 10 0 GGAEMN Cc1cc(NC(=O)[C@@H](C)N2C[C@@H]3CCC[C@]3(CO)C2)ccc1Br ZINC000626014274 566376248 /nfs/dbraw/zinc/37/62/48/566376248.db2.gz XNYNZNPARMWLJW-QWQRMKEZSA-N 0 1 381.314 3.179 10 0 GGAEMN COC[C@H](C)OC[C@@H](O)CN1CCC[C@H]1c1ccc(Br)cc1C ZINC000626010041 566376624 /nfs/dbraw/zinc/37/66/24/566376624.db2.gz CLNQOVOETNTDED-ZVZYQTTQSA-N 0 1 386.330 3.307 10 0 GGAEMN CC[C@H](CNC(=O)c1nscc1Br)N1CCc2ccccc2C1 ZINC000649602258 566376831 /nfs/dbraw/zinc/37/68/31/566376831.db2.gz USEKLMLXARBLCJ-CQSZACIVSA-N 0 1 394.338 3.472 10 0 GGAEMN Cc1cc(NC(=O)CN2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)n(C)n1 ZINC000626039886 566377889 /nfs/dbraw/zinc/37/78/89/566377889.db2.gz RGWMKINTFLPHOD-DZGCQCFKSA-N 0 1 391.313 3.308 10 0 GGAEMN CC(C)c1nc(C[S@@](=O)Cc2ccc(Br)c(F)c2F)n[nH]1 ZINC000600928551 566378164 /nfs/dbraw/zinc/37/81/64/566378164.db2.gz QYOBYEAOGJNSMR-NRFANRHFSA-N 0 1 378.242 3.418 10 0 GGAEMN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1CC(=O)NCc1cccnc1 ZINC000626041092 566378637 /nfs/dbraw/zinc/37/86/37/566378637.db2.gz QNEYNGDUROGBCV-RHSMWYFYSA-N 0 1 388.309 3.338 10 0 GGAEMN C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2nscc2Br)C1 ZINC000649641001 566380009 /nfs/dbraw/zinc/38/00/09/566380009.db2.gz XHMVHBWXWQAEMS-YPMHNXCESA-N 0 1 380.311 3.471 10 0 GGAEMN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2nscc2Br)C1 ZINC000649640998 566380753 /nfs/dbraw/zinc/38/07/53/566380753.db2.gz XHMVHBWXWQAEMS-AAEUAGOBSA-N 0 1 380.311 3.471 10 0 GGAEMN CC[C@@H](C)N[C@H](CNS(=O)(=O)c1ccc2ncsc2c1)c1ccco1 ZINC000510415644 566381914 /nfs/dbraw/zinc/38/19/14/566381914.db2.gz RAZYVVDNZKQIQE-IUODEOHRSA-N 0 1 379.507 3.297 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H](C)N2CCN(CCCF)CC2)c(Br)c1 ZINC000626072127 566382300 /nfs/dbraw/zinc/38/23/00/566382300.db2.gz IARAKZIMKSYGKG-CQSZACIVSA-N 0 1 386.309 3.062 10 0 GGAEMN O=S1(=O)NC(CNC2(c3ccccc3Cl)CCC2)=Nc2ccccc21 ZINC000649644212 566382283 /nfs/dbraw/zinc/38/22/83/566382283.db2.gz WGMRVPROEGHTIN-UHFFFAOYSA-N 0 1 375.881 3.331 10 0 GGAEMN COC(=O)CCN(Cc1cccc(Br)c1)Cc1nc(C)ccc1O ZINC000483443022 566384319 /nfs/dbraw/zinc/38/43/19/566384319.db2.gz SUAVCMBDNLNFJP-UHFFFAOYSA-N 0 1 393.281 3.423 10 0 GGAEMN O=c1cc(CN2CCC3(CC2)C(F)(F)C3(F)F)nc2ccc(Cl)cn12 ZINC000649709841 566387141 /nfs/dbraw/zinc/38/71/41/566387141.db2.gz CHUZSAZPQVSNBF-UHFFFAOYSA-N 0 1 375.753 3.214 10 0 GGAEMN OCCN(Cc1ccc(Br)s1)Cc1ccc(-n2cncn2)cc1 ZINC000483495392 566387445 /nfs/dbraw/zinc/38/74/45/566387445.db2.gz CJWZMAHJXSMKGW-UHFFFAOYSA-N 0 1 393.310 3.086 10 0 GGAEMN CCOC(=O)c1ncc(CSc2nc(-c3ccc(OC)cc3)n[nH]2)s1 ZINC000601072729 566388556 /nfs/dbraw/zinc/38/85/56/566388556.db2.gz QYSPKWYHSDINGJ-UHFFFAOYSA-N 0 1 376.463 3.406 10 0 GGAEMN O=S(=O)(NCC1(C(F)(F)F)CC1)c1cc(Br)c(F)cc1F ZINC000510509655 566390060 /nfs/dbraw/zinc/39/00/60/566390060.db2.gz XGARZEILKUMJJR-UHFFFAOYSA-N 0 1 394.159 3.348 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1 ZINC000576938872 566391205 /nfs/dbraw/zinc/39/12/05/566391205.db2.gz JRBCJZOXIAARKO-KSSFIOAISA-N 0 1 394.240 3.095 10 0 GGAEMN CC[C@@H](c1ccc(Br)cc1)N1CCC[C@@H](CS(=O)(=O)NC)C1 ZINC000626167821 566392163 /nfs/dbraw/zinc/39/21/63/566392163.db2.gz DEIQRTOVHOREKZ-CJNGLKHVSA-N 0 1 389.359 3.161 10 0 GGAEMN CCN1CCN(CC(=O)NCC2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC000447182526 566393580 /nfs/dbraw/zinc/39/35/80/566393580.db2.gz HGJNYZNZUYOOOK-UHFFFAOYSA-N 0 1 384.351 3.169 10 0 GGAEMN Ic1cnc(CN[C@H](C2CCC2)[C@@H]2CCCO2)s1 ZINC000601156686 566393822 /nfs/dbraw/zinc/39/38/22/566393822.db2.gz WMOBQKPGBGHMRM-GXFFZTMASA-N 0 1 378.279 3.185 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1cc(Br)ccc1OC(F)F ZINC000576997926 566396967 /nfs/dbraw/zinc/39/69/67/566396967.db2.gz AHNZSKDPLVIWMR-GXTWGEPZSA-N 0 1 396.272 3.298 10 0 GGAEMN CCC1CCN(C(=O)c2[nH]nc3ccc(I)cc32)CC1 ZINC000463284188 566397240 /nfs/dbraw/zinc/39/72/40/566397240.db2.gz VKTZWMOCHAUZAO-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN O=S(=O)(c1cc(C(F)(F)F)ccc1O)N1CCO[C@H](c2ccsc2)C1 ZINC000649845646 566398428 /nfs/dbraw/zinc/39/84/28/566398428.db2.gz UHZQQVHDWFHUCA-ZDUSSCGKSA-N 0 1 393.408 3.235 10 0 GGAEMN OC[C@]1(c2ccccc2)CCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000463361882 566403890 /nfs/dbraw/zinc/40/38/90/566403890.db2.gz OGZZOFZJPIINBD-IBGZPJMESA-N 0 1 386.293 3.461 10 0 GGAEMN Cc1cc2ncc([C@@H](C)N[C@H](CO)c3ccc(Br)cc3)c(C)n2n1 ZINC000536834844 566405519 /nfs/dbraw/zinc/40/55/19/566405519.db2.gz UPJUKXWPRODEQR-SJKOYZFVSA-N 0 1 389.297 3.493 10 0 GGAEMN C[C@H](NC[C@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(F)c1 ZINC000536828744 566405585 /nfs/dbraw/zinc/40/55/85/566405585.db2.gz WDBRHMUOUFTNGT-JQWIXIFHSA-N 0 1 377.890 3.026 10 0 GGAEMN COc1c(Br)c(C)sc1C(=O)NCCN1CCCC[C@H]1C ZINC000463384944 566405909 /nfs/dbraw/zinc/40/59/09/566405909.db2.gz OTINXFFRUKUJBQ-SNVBAGLBSA-N 0 1 375.332 3.432 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](N[C@H]2CCCOc3c(Br)cccc32)CC1=O ZINC000536875342 566407505 /nfs/dbraw/zinc/40/75/05/566407505.db2.gz IBCFCRAGNPCZAW-KNPMLCFXSA-N 0 1 379.298 3.262 10 0 GGAEMN CN(C)S(=O)(=O)c1cccc(CN(C)[C@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000463434224 566410666 /nfs/dbraw/zinc/41/06/66/566410666.db2.gz DMMTWFIFDPMSPU-CVEARBPZSA-N 0 1 378.460 3.490 10 0 GGAEMN COc1ccc(NC(=O)c2cn[nH]c2C(C)C)c(I)c1 ZINC000601539167 566410950 /nfs/dbraw/zinc/41/09/50/566410950.db2.gz NFRAXJKMWDJOFV-UHFFFAOYSA-N 0 1 385.205 3.399 10 0 GGAEMN CCc1cncc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000447488642 566411921 /nfs/dbraw/zinc/41/19/21/566411921.db2.gz LBWPHRCUEJBIMM-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN CCc1cncc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000447488642 566411929 /nfs/dbraw/zinc/41/19/29/566411929.db2.gz LBWPHRCUEJBIMM-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN O=C1[C@H](N2CC[C@]3(C2)CCCOC3)CCN1c1cccc(Br)c1 ZINC000671254943 566412655 /nfs/dbraw/zinc/41/26/55/566412655.db2.gz PLQJDFNYNLHTNK-AEFFLSMTSA-N 0 1 379.298 3.057 10 0 GGAEMN O=C1[C@H](N2CC[C@@]3(C2)CCCOC3)CCN1c1cccc(Br)c1 ZINC000671254947 566412910 /nfs/dbraw/zinc/41/29/10/566412910.db2.gz PLQJDFNYNLHTNK-SJLPKXTDSA-N 0 1 379.298 3.057 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1CC(=O)Nc1ccc(Br)c(C)c1 ZINC000671248939 566413096 /nfs/dbraw/zinc/41/30/96/566413096.db2.gz DQFDFPGTPYRECG-HNNXBMFYSA-N 0 1 396.329 3.077 10 0 GGAEMN C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc(I)cc32)CC1 ZINC000463511742 566415534 /nfs/dbraw/zinc/41/55/34/566415534.db2.gz HZXMDILPEMHDCN-SNVBAGLBSA-N 0 1 383.233 3.430 10 0 GGAEMN CC(C)[C@@H]1CCCN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463659742 566424542 /nfs/dbraw/zinc/42/45/42/566424542.db2.gz HOJDWNAWSQYMGK-ZDUSSCGKSA-N 0 1 383.233 3.428 10 0 GGAEMN Cc1ccsc1CNC(=O)c1n[nH]c2ccc(I)cc21 ZINC000463659035 566425073 /nfs/dbraw/zinc/42/50/73/566425073.db2.gz ULWCXCSLRTXHQA-UHFFFAOYSA-N 0 1 397.241 3.467 10 0 GGAEMN CN(C)CCN(Cc1ccc(F)cc1)S(=O)(=O)c1c(F)cccc1Cl ZINC000463667231 566425306 /nfs/dbraw/zinc/42/53/06/566425306.db2.gz FBMCEGXMXJQJQB-UHFFFAOYSA-N 0 1 388.867 3.371 10 0 GGAEMN Cn1cnc(=NC(=O)N2CCC[C@H]2c2ccc(Br)cc2Cl)[nH]1 ZINC000626571519 566425591 /nfs/dbraw/zinc/42/55/91/566425591.db2.gz OKUYHAYXHQJJDL-LBPRGKRZSA-N 0 1 384.665 3.022 10 0 GGAEMN Cn1cc([C@H](NCC(=O)Nc2ccc(Br)cc2)C(C)(C)C)cn1 ZINC000537173718 566426324 /nfs/dbraw/zinc/42/63/24/566426324.db2.gz FQGXBDZTASMEEF-INIZCTEOSA-N 0 1 379.302 3.498 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)n[nH]1 ZINC000577343426 566426272 /nfs/dbraw/zinc/42/62/72/566426272.db2.gz AGPFBXCCFGZDKW-HPEXNQPKSA-N 0 1 377.286 3.267 10 0 GGAEMN C[C@@H]1CN(C)[C@H](C)[C@@H](C)N1C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000650150927 566428210 /nfs/dbraw/zinc/42/82/10/566428210.db2.gz BSASVELCFZVWBO-IJLUTSLNSA-N 0 1 392.297 3.256 10 0 GGAEMN Cc1[nH]ncc1C1CCN(C(=O)Nc2ccnc(C)c2Br)CC1 ZINC000671553976 566429016 /nfs/dbraw/zinc/42/90/16/566429016.db2.gz IPZXETSAUJYTRD-UHFFFAOYSA-N 0 1 378.274 3.017 10 0 GGAEMN COC[C@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000537175703 566429152 /nfs/dbraw/zinc/42/91/52/566429152.db2.gz XELCUIXEIQLWFA-AEFFLSMTSA-N 0 1 398.272 3.305 10 0 GGAEMN NC(=O)c1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)c(F)c2)cc1Cl ZINC000447790202 566430281 /nfs/dbraw/zinc/43/02/81/566430281.db2.gz ZEGIFHQWLKOCOC-UHFFFAOYSA-N 0 1 396.749 3.398 10 0 GGAEMN COC(=O)C1(c2ccc(S(=O)(=O)Nc3scnc3C3CC3)cc2)CC1 ZINC000557875990 566431278 /nfs/dbraw/zinc/43/12/78/566431278.db2.gz GGFUNIXHDVRVPU-UHFFFAOYSA-N 0 1 378.475 3.026 10 0 GGAEMN Cc1ccc(-c2cc(=NC(=O)Cc3ccc(Br)cc3O)[nH][nH]2)o1 ZINC000447800713 566432431 /nfs/dbraw/zinc/43/24/31/566432431.db2.gz WKPBYGFCDSTQNV-UHFFFAOYSA-N 0 1 376.210 3.049 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)N2CCc3c2cccc3Br)C[C@@H](C)O1 ZINC000422137775 566435265 /nfs/dbraw/zinc/43/52/65/566435265.db2.gz AKMITRBDGWPNSW-ZIAGYGMSSA-N 0 1 396.329 3.021 10 0 GGAEMN C[C@@H](Oc1ccccc1Br)C(=O)Nc1cnn(-c2ccncc2)c1 ZINC000601978888 566435731 /nfs/dbraw/zinc/43/57/31/566435731.db2.gz STNIMIQMRFCBRH-GFCCVEGCSA-N 0 1 387.237 3.436 10 0 GGAEMN CN(C)S(=O)(=O)[C@@H]1CCCN(CCCSc2ccccc2Cl)C1 ZINC000511083437 566436559 /nfs/dbraw/zinc/43/65/59/566436559.db2.gz ZVGOHZIDGCGJQT-CQSZACIVSA-N 0 1 376.975 3.178 10 0 GGAEMN COCc1ccsc1C(=O)NCCc1nnc(-c2ccc(Cl)cc2)[nH]1 ZINC000511167736 566442232 /nfs/dbraw/zinc/44/22/32/566442232.db2.gz GFNPXZXUGHWERN-UHFFFAOYSA-N 0 1 376.869 3.306 10 0 GGAEMN O=S(=O)(NC1CCC(OC(F)F)CC1)c1c(Cl)ccc(F)c1F ZINC000650293937 566445895 /nfs/dbraw/zinc/44/58/95/566445895.db2.gz ALMJVBOKHZSWNJ-UHFFFAOYSA-N 0 1 375.771 3.447 10 0 GGAEMN COc1cccc(N2CCC[C@H](NCc3c(Br)c(C)nn3C)C2)c1 ZINC000447943233 566448769 /nfs/dbraw/zinc/44/87/69/566448769.db2.gz JNNGNVRKKRVTLF-AWEZNQCLSA-N 0 1 393.329 3.258 10 0 GGAEMN CC(C)C[C@H](N)c1noc(CN(C)C(=O)c2ccc(Br)s2)n1 ZINC000577609543 566449623 /nfs/dbraw/zinc/44/96/23/566449623.db2.gz BJPDSMWGIVYTNG-VIFPVBQESA-N 0 1 387.303 3.212 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC[C@@H](N3CCOCC3)CC2)c1 ZINC000626885146 566453983 /nfs/dbraw/zinc/45/39/83/566453983.db2.gz BOKONLHSXWMWHA-CQSZACIVSA-N 0 1 399.304 3.224 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC[C@H](N3CCOCC3)CC2)c1 ZINC000626885145 566454036 /nfs/dbraw/zinc/45/40/36/566454036.db2.gz BOKONLHSXWMWHA-AWEZNQCLSA-N 0 1 399.304 3.224 10 0 GGAEMN CC[C@@H](CS(=O)(=O)Nc1ccc(Sc2cccc(OC)c2)cn1)OC ZINC000650490550 566460243 /nfs/dbraw/zinc/46/02/43/566460243.db2.gz YJPLBWYYCZCZOL-ZDUSSCGKSA-N 0 1 382.507 3.408 10 0 GGAEMN C[C@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc2n(n1)CCC2 ZINC000577827688 566467150 /nfs/dbraw/zinc/46/71/50/566467150.db2.gz SEUYJEDXDXRZLK-NSHDSACASA-N 0 1 387.285 3.228 10 0 GGAEMN C[C@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc2n(n1)CCC2 ZINC000577827688 566467156 /nfs/dbraw/zinc/46/71/56/566467156.db2.gz SEUYJEDXDXRZLK-NSHDSACASA-N 0 1 387.285 3.228 10 0 GGAEMN FC(F)(F)c1nc(N2CCN(C[C@@H]3CCCO3)CC2)ccc1Br ZINC000672142516 566467380 /nfs/dbraw/zinc/46/73/80/566467380.db2.gz MODSPKFHPJERTE-NSHDSACASA-N 0 1 394.235 3.164 10 0 GGAEMN Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](CCO)c1ccccc1Br ZINC000423026159 566468547 /nfs/dbraw/zinc/46/85/47/566468547.db2.gz ARZPODZQAPBEDE-UGSOOPFHSA-N 0 1 378.314 3.386 10 0 GGAEMN Cc1ccc(I)c(C(=O)N2CCN(CC(C)C)CC2)c1 ZINC000511519097 566469653 /nfs/dbraw/zinc/46/96/53/566469653.db2.gz CEODXWFXDQQPIK-UHFFFAOYSA-N 0 1 386.277 3.013 10 0 GGAEMN C[C@H]1CN(C(=O)N[C@H]2CCCSc3ccc(Br)cc32)CCN1 ZINC000627179828 566471500 /nfs/dbraw/zinc/47/15/00/566471500.db2.gz NKDFJPMVGPDFED-FZMZJTMJSA-N 0 1 384.343 3.379 10 0 GGAEMN CCc1ccccc1NC(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511553391 566471865 /nfs/dbraw/zinc/47/18/65/566471865.db2.gz JIABGWAPAMCVGM-IBGZPJMESA-N 0 1 391.309 3.447 10 0 GGAEMN COC(=O)c1cccc(CN[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511558375 566472100 /nfs/dbraw/zinc/47/21/00/566472100.db2.gz XBOJZAMRTOCIHW-GOSISDBHSA-N 0 1 378.266 3.233 10 0 GGAEMN CCSc1ccc(CC(=O)N[C@@H](C)c2n[nH]c(C)n2)c(Br)c1 ZINC000627207403 566473025 /nfs/dbraw/zinc/47/30/25/566473025.db2.gz PCIIIKSEMNLAAX-VIFPVBQESA-N 0 1 383.315 3.408 10 0 GGAEMN C[C@@](CO)(NCC(=O)N(C1CC1)C1CCCC1)c1ccc(Br)cc1 ZINC000511581118 566473112 /nfs/dbraw/zinc/47/31/12/566473112.db2.gz ZCYZYORMULEGIS-IBGZPJMESA-N 0 1 395.341 3.180 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511603317 566474743 /nfs/dbraw/zinc/47/47/43/566474743.db2.gz AEURQQSLGKAXNH-QWQRMKEZSA-N 0 1 383.330 3.036 10 0 GGAEMN CC(C)CN(CC(C)C)C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511597888 566475387 /nfs/dbraw/zinc/47/53/87/566475387.db2.gz WGLMDDCLSTXJBB-LJQANCHMSA-N 0 1 399.373 3.387 10 0 GGAEMN CC1CCC(N(C)C(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)CC1 ZINC000511604241 566475658 /nfs/dbraw/zinc/47/56/58/566475658.db2.gz DYLWBCARWNUNDA-YVNUBYTISA-N 0 1 397.357 3.283 10 0 GGAEMN CC(C)CN(CC(C)C)C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511597887 566475803 /nfs/dbraw/zinc/47/58/03/566475803.db2.gz WGLMDDCLSTXJBB-IBGZPJMESA-N 0 1 399.373 3.387 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@H](COc2ccccc2Cl)C1 ZINC000558466893 566475979 /nfs/dbraw/zinc/47/59/79/566475979.db2.gz MPMPKMLQEHLPOC-INIZCTEOSA-N 0 1 388.961 3.102 10 0 GGAEMN CCc1ccc(NC(=O)CN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511622827 566476880 /nfs/dbraw/zinc/47/68/80/566476880.db2.gz LTGUSOCLISRLBP-LJQANCHMSA-N 0 1 391.309 3.447 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@H](COc2ccccc2Cl)C1 ZINC000558466894 566477217 /nfs/dbraw/zinc/47/72/17/566477217.db2.gz MPMPKMLQEHLPOC-MRXNPFEDSA-N 0 1 388.961 3.102 10 0 GGAEMN Cc1ccc(CC[C@@H](C)NS(=O)(=O)c2nc(C)c(Br)s2)o1 ZINC000537875078 566477564 /nfs/dbraw/zinc/47/75/64/566477564.db2.gz MYNCHDJDIWHSHW-MRVPVSSYSA-N 0 1 393.328 3.415 10 0 GGAEMN CC[C@H](C(=O)[O-])[N@@H+](C)Cc1cc(Br)c(OC(F)F)c(OC)c1 ZINC000650807605 566479490 /nfs/dbraw/zinc/47/94/90/566479490.db2.gz CJWCEACZIJWCKY-SNVBAGLBSA-N 0 1 382.201 3.354 10 0 GGAEMN Cc1c([C@H](C)NCC[C@@H](C)[S@@](C)=O)nnn1-c1cccc(Br)c1 ZINC000537963153 566482199 /nfs/dbraw/zinc/48/21/99/566482199.db2.gz ALJKLLQFYPOTNB-YCDSQXFLSA-N 0 1 399.358 3.146 10 0 GGAEMN Cc1c([C@H](C)NCC[C@H](C)[S@](C)=O)nnn1-c1cccc(Br)c1 ZINC000537963151 566482423 /nfs/dbraw/zinc/48/24/23/566482423.db2.gz ALJKLLQFYPOTNB-RSPIHXBNSA-N 0 1 399.358 3.146 10 0 GGAEMN CN1C[C@H]2[C@@H](CCN2C(=O)c2scc(Br)c2Br)C1 ZINC000627487631 566483512 /nfs/dbraw/zinc/48/35/12/566483512.db2.gz HYHATZGDFUYZGC-CBAPKCEASA-N 0 1 394.132 3.049 10 0 GGAEMN O=C(Cn1c(=O)[nH]c2ccccc21)Nc1nc2ccc(Br)cc2[nH]1 ZINC000464577085 566487211 /nfs/dbraw/zinc/48/72/11/566487211.db2.gz RZDMHQYDOUVUMQ-UHFFFAOYSA-N 0 1 386.209 3.019 10 0 GGAEMN CCc1nc(CNC(=O)c2c(F)ccc(C(F)(F)F)c2Br)n[nH]1 ZINC000627559072 566488510 /nfs/dbraw/zinc/48/85/10/566488510.db2.gz WYAVUOIPYFPMEP-UHFFFAOYSA-N 0 1 395.154 3.218 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000538057662 566490195 /nfs/dbraw/zinc/49/01/95/566490195.db2.gz YETCMKARSWMMPN-KHIZAZIESA-N 0 1 392.297 3.485 10 0 GGAEMN O=C(NCCc1ccc2c(c1)CCO2)c1n[nH]c2ccc(Br)cc21 ZINC000511850152 566491377 /nfs/dbraw/zinc/49/13/77/566491377.db2.gz SVTAAOMBLRDJSW-UHFFFAOYSA-N 0 1 386.249 3.233 10 0 GGAEMN CCc1cnc(CCNCc2ncc(I)s2)s1 ZINC000512023395 566506721 /nfs/dbraw/zinc/50/67/21/566506721.db2.gz KDFJKCLMEOFFLJ-UHFFFAOYSA-N 0 1 379.292 3.099 10 0 GGAEMN Cc1cc(NS(=O)(=O)c2ccc(Cl)cc2Cl)ccc1OCCO ZINC000485394385 566493700 /nfs/dbraw/zinc/49/37/00/566493700.db2.gz HMIAAZCJJYRPLQ-UHFFFAOYSA-N 0 1 376.261 3.474 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N(Cc1cccnc1)C1CC1 ZINC000485386209 566494174 /nfs/dbraw/zinc/49/41/74/566494174.db2.gz CUWCCONJZKTPSO-UHFFFAOYSA-N 0 1 398.260 3.490 10 0 GGAEMN C[C@](N)(C(=O)NCCC[C@@H]1CCCC[C@@H]1O)c1ccc(Br)cc1 ZINC000578130643 566494394 /nfs/dbraw/zinc/49/43/94/566494394.db2.gz VEDICSSZHSRDHW-QANKJYHBSA-N 0 1 383.330 3.071 10 0 GGAEMN CC[C@H](C)N1CCN(C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC1 ZINC000627663325 566496870 /nfs/dbraw/zinc/49/68/70/566496870.db2.gz YPVQOYUTPHCDOK-PWUKJLEFSA-N 0 1 377.326 3.278 10 0 GGAEMN C[C@@H](Cn1ncc2ccccc2c1=O)NCc1cscc1Br ZINC000511925950 566497036 /nfs/dbraw/zinc/49/70/36/566497036.db2.gz GXCXCSFBXXBATC-NSHDSACASA-N 0 1 378.295 3.399 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)NC1(c2ccccc2Br)CCC1 ZINC000651107736 566497365 /nfs/dbraw/zinc/49/73/65/566497365.db2.gz PJWCTKDCCBJIKA-GFCCVEGCSA-N 0 1 389.297 3.408 10 0 GGAEMN CCc1nc(NC(=O)c2ccc(NS(C)(=O)=O)nc2)sc1C(C)(C)C ZINC000627725749 566501306 /nfs/dbraw/zinc/50/13/06/566501306.db2.gz ZGJBHOCAXBXWSE-UHFFFAOYSA-N 0 1 382.511 3.022 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N(CCO)CCc1ccccc1 ZINC000602944038 566502296 /nfs/dbraw/zinc/50/22/96/566502296.db2.gz RSDMMKXBCXCSRC-UHFFFAOYSA-N 0 1 388.265 3.003 10 0 GGAEMN Fc1ccc(F)c(CCNCc2ncc(I)s2)c1 ZINC000512020702 566505806 /nfs/dbraw/zinc/50/58/06/566505806.db2.gz BAMZCSPENMOWNW-UHFFFAOYSA-N 0 1 380.201 3.358 10 0 GGAEMN C[C@@H](CCO)C1(CNC(=O)c2n[nH]c3ccc(Br)cc32)CCC1 ZINC000538310311 566506596 /nfs/dbraw/zinc/50/65/96/566506596.db2.gz LVENFSZGYDDTDT-NSHDSACASA-N 0 1 380.286 3.244 10 0 GGAEMN C[C@@H]1CC(C)(C)C[C@](CO)(NCc2ncc(I)s2)C1 ZINC000512052966 566508279 /nfs/dbraw/zinc/50/82/79/566508279.db2.gz NZEWENKLRAIBBM-QMTHXVAHSA-N 0 1 394.322 3.415 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC(C)(C)Cc1ccc(Br)cc1 ZINC000578284735 566508592 /nfs/dbraw/zinc/50/85/92/566508592.db2.gz LHYHZQXECVPSCS-UHFFFAOYSA-N 0 1 391.375 3.031 10 0 GGAEMN CSCCCN1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000464869441 566508641 /nfs/dbraw/zinc/50/86/41/566508641.db2.gz PBJLBNIYSJIXQQ-UHFFFAOYSA-N 0 1 375.460 3.015 10 0 GGAEMN CC(C)[C@@H]1CCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000538371115 566509906 /nfs/dbraw/zinc/50/99/06/566509906.db2.gz YVXCBOVUILFZKF-ZDUSSCGKSA-N 0 1 378.274 3.174 10 0 GGAEMN CC(C)[C@@H]1CCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000538371115 566509910 /nfs/dbraw/zinc/50/99/10/566509910.db2.gz YVXCBOVUILFZKF-ZDUSSCGKSA-N 0 1 378.274 3.174 10 0 GGAEMN CCCN1CCN(c2nnc(-c3ccc(F)cc3Br)n2CC)CC1 ZINC000558834467 566509964 /nfs/dbraw/zinc/50/99/64/566509964.db2.gz DULBMPFYEDGYTP-UHFFFAOYSA-N 0 1 396.308 3.399 10 0 GGAEMN O[C@H]1CCCC[C@@H]1CCCNCc1ncc(I)s1 ZINC000512067510 566510723 /nfs/dbraw/zinc/51/07/23/566510723.db2.gz LQSNHJOFKSUGKJ-MNOVXSKESA-N 0 1 380.295 3.169 10 0 GGAEMN COc1cc2nccc(NCc3noc(C4CC4)n3)c2cc1Br ZINC000578317238 566510883 /nfs/dbraw/zinc/51/08/83/566510883.db2.gz LBNGNHLLTCHAER-UHFFFAOYSA-N 0 1 375.226 3.300 10 0 GGAEMN C[C@@H]1CC[C@H](C)CN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000464933628 566511444 /nfs/dbraw/zinc/51/14/44/566511444.db2.gz HRVQIIJPPYSUSE-VHSXEESVSA-N 0 1 383.233 3.428 10 0 GGAEMN CC(=O)N(c1nc(CN[C@H]2CCOC3(CCSCC3)C2)cs1)C1CC1 ZINC000538423468 566512041 /nfs/dbraw/zinc/51/20/41/566512041.db2.gz BNQQAGYHTXKGOY-AWEZNQCLSA-N 0 1 381.567 3.193 10 0 GGAEMN CC(=O)N(c1nc(CN[C@@H]2CCOC3(CCSCC3)C2)cs1)C1CC1 ZINC000538423469 566512058 /nfs/dbraw/zinc/51/20/58/566512058.db2.gz BNQQAGYHTXKGOY-CQSZACIVSA-N 0 1 381.567 3.193 10 0 GGAEMN Fc1ccc2c(Br)cnc(N3CC[C@H](CN4CCOCC4)C3)c2c1 ZINC000651322270 566512360 /nfs/dbraw/zinc/51/23/60/566512360.db2.gz KYPADNVONDGTIQ-CYBMUJFWSA-N 0 1 394.288 3.295 10 0 GGAEMN O=C([C@H]1CCOc2ccc(Br)cc21)N1CCN(C2CCC2)CC1 ZINC000651339754 566513671 /nfs/dbraw/zinc/51/36/71/566513671.db2.gz SQQQAAQKGQHTTK-HNNXBMFYSA-N 0 1 379.298 3.012 10 0 GGAEMN C[C@@H](CNC(=O)c1ccc2scc(Br)c2c1)N1CCN(C)CC1 ZINC000448982216 566516458 /nfs/dbraw/zinc/51/64/58/566516458.db2.gz WPAQGGNMKKNJII-LBPRGKRZSA-N 0 1 396.354 3.030 10 0 GGAEMN CN(C)C[C@H](NC(=O)C(=O)Nc1ccsc1)c1ccc(Cl)c(Cl)c1 ZINC000627910675 566517050 /nfs/dbraw/zinc/51/70/50/566517050.db2.gz MUWCRIAZEVRTMV-AWEZNQCLSA-N 0 1 386.304 3.413 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3cc[nH]c(=O)c3Br)cccc21 ZINC000578385745 566517833 /nfs/dbraw/zinc/51/78/33/566517833.db2.gz ARHYACSLXUVMRA-CYBMUJFWSA-N 0 1 392.253 3.187 10 0 GGAEMN Cc1cc(N2CC[C@H](NCc3cncn3C(C)C)C2=O)ccc1Br ZINC000424179073 566518367 /nfs/dbraw/zinc/51/83/67/566518367.db2.gz SHDXCZWUHXSBNP-KRWDZBQOSA-N 0 1 391.313 3.430 10 0 GGAEMN CN1CC[C@H](CNCc2csc(COc3ccc(Cl)cc3)n2)CC1=O ZINC000424183222 566518508 /nfs/dbraw/zinc/51/85/08/566518508.db2.gz AXUCAUHFFFPBEW-ZDUSSCGKSA-N 0 1 379.913 3.334 10 0 GGAEMN O=C(NC[C@@H]1OCCc2ccccc21)c1n[nH]c2ccc(Br)cc21 ZINC000603339509 566520254 /nfs/dbraw/zinc/52/02/54/566520254.db2.gz FHDFKKJKGSNTGO-INIZCTEOSA-N 0 1 386.249 3.369 10 0 GGAEMN Cc1ccc2nc(CNC(=O)c3[nH]nc4ccc(Br)cc43)[nH]c2c1 ZINC000465184219 566522450 /nfs/dbraw/zinc/52/24/50/566522450.db2.gz JQPNGNAJDGGSFZ-UHFFFAOYSA-N 0 1 384.237 3.440 10 0 GGAEMN C[C@H](N[C@H]1CCC(=O)N(C)C1=O)c1ccc(Br)cc1C(F)(F)F ZINC000424313811 566526416 /nfs/dbraw/zinc/52/64/16/566526416.db2.gz JNAONKITPMZVLU-UFBFGSQYSA-N 0 1 393.203 3.266 10 0 GGAEMN CSc1cc(NC(=O)C(=O)NC[C@@H](c2cccs2)N(C)C)ccc1C ZINC000651494387 566526521 /nfs/dbraw/zinc/52/65/21/566526521.db2.gz CHJJETWSPSMHGS-AWEZNQCLSA-N 0 1 377.535 3.136 10 0 GGAEMN CC[C@H]1C[C@@H](C)CN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000465291598 566527002 /nfs/dbraw/zinc/52/70/02/566527002.db2.gz WJQYOPASDXMVRZ-KOLCDFICSA-N 0 1 383.233 3.428 10 0 GGAEMN C[C@@H](N[C@H]1CCC(=O)N(C)C1=O)c1ccc(Br)cc1C(F)(F)F ZINC000424313803 566527410 /nfs/dbraw/zinc/52/74/10/566527410.db2.gz JNAONKITPMZVLU-PELKAZGASA-N 0 1 393.203 3.266 10 0 GGAEMN CCOc1c(Cl)cc(CNCc2cccc(S(C)(=O)=O)c2)cc1OC ZINC000449091255 566527950 /nfs/dbraw/zinc/52/79/50/566527950.db2.gz PKHXFLWSSYKMSI-UHFFFAOYSA-N 0 1 383.897 3.441 10 0 GGAEMN COc1cccc(S(=O)(=O)CCN[C@H](C)c2ccc3ncsc3c2)c1 ZINC000485811249 566529835 /nfs/dbraw/zinc/52/98/35/566529835.db2.gz HBFVJJBUTFPSSH-CYBMUJFWSA-N 0 1 376.503 3.429 10 0 GGAEMN O=C1[C@@H](N[C@@H]2CCc3c2ccc(F)c3Br)CCN1CC(F)(F)F ZINC000449147300 566531035 /nfs/dbraw/zinc/53/10/35/566531035.db2.gz QEEILGQWUNJIHR-NEPJUHHUSA-N 0 1 395.194 3.328 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@@H]1CCCOC1 ZINC000449123486 566531997 /nfs/dbraw/zinc/53/19/97/566531997.db2.gz NDQNBZQQGGJSBO-GFCCVEGCSA-N 0 1 384.263 3.234 10 0 GGAEMN C[C@H](CC(=O)N1CCC(N2CCOCC2)CC1)c1ccc(Br)cc1 ZINC000628124619 566532045 /nfs/dbraw/zinc/53/20/45/566532045.db2.gz OADCEADRTBOXBZ-OAHLLOKOSA-N 0 1 395.341 3.266 10 0 GGAEMN COC(=O)c1sccc1NC(=O)CN[C@H](C)c1ccc2ncsc2c1 ZINC000485847465 566532473 /nfs/dbraw/zinc/53/24/73/566532473.db2.gz OSPUHJKTYRLTJS-SNVBAGLBSA-N 0 1 375.475 3.434 10 0 GGAEMN CC(C)(C(=O)N1CCC(N2CCOCC2)CC1)c1cccc(Br)c1 ZINC000628126128 566532650 /nfs/dbraw/zinc/53/26/50/566532650.db2.gz CRQSBXHMXMQLQZ-UHFFFAOYSA-N 0 1 395.341 3.050 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@@H](C)[C@H](C)CO ZINC000449165024 566532918 /nfs/dbraw/zinc/53/29/18/566532918.db2.gz SNUMPYMJAZTENQ-MNOVXSKESA-N 0 1 386.279 3.072 10 0 GGAEMN C[C@H](c1ccncc1)N1CCC(NC(=O)c2nscc2Br)CC1 ZINC000651558383 566533717 /nfs/dbraw/zinc/53/37/17/566533717.db2.gz OMVFQTUXLZSUPK-LLVKDONJSA-N 0 1 395.326 3.256 10 0 GGAEMN C[C@H]1CCC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)[C@@H]1C(=O)[O-] ZINC000424424750 566534763 /nfs/dbraw/zinc/53/47/63/566534763.db2.gz XBHLUXZKKQOSOW-LRDDRELGSA-N 0 1 378.270 3.320 10 0 GGAEMN C[C@@]1(CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCCS1 ZINC000628158248 566535859 /nfs/dbraw/zinc/53/58/59/566535859.db2.gz IWQJGHYRIGSBJA-KRWDZBQOSA-N 0 1 383.355 3.493 10 0 GGAEMN C[C@]1(CN2CCCN(S(=O)(=O)c3ccc(Cl)s3)CC2)CCCS1 ZINC000628160350 566536445 /nfs/dbraw/zinc/53/64/45/566536445.db2.gz RPCXOAJTPSRCAM-OAHLLOKOSA-N 0 1 395.015 3.384 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCSC[C@H]1C1CC1 ZINC000578599123 566536676 /nfs/dbraw/zinc/53/66/76/566536676.db2.gz ILSCKIPQJDFZFL-HNNXBMFYSA-N 0 1 393.306 3.258 10 0 GGAEMN O=S1(=O)CCCC[C@H]1CN[C@@H]1CCc2c1ccc(F)c2Br ZINC000449232244 566538315 /nfs/dbraw/zinc/53/83/15/566538315.db2.gz HKPBROJKSRKCFV-IINYFYTJSA-N 0 1 376.291 3.132 10 0 GGAEMN O=S1(=O)CCCC[C@@H]1CN[C@@H]1CCc2c1ccc(F)c2Br ZINC000449232245 566539204 /nfs/dbraw/zinc/53/92/04/566539204.db2.gz HKPBROJKSRKCFV-QMTHXVAHSA-N 0 1 376.291 3.132 10 0 GGAEMN O=S1(=O)CCCC[C@@H]1CN[C@H]1CCc2c1ccc(F)c2Br ZINC000449232246 566539619 /nfs/dbraw/zinc/53/96/19/566539619.db2.gz HKPBROJKSRKCFV-YGRLFVJLSA-N 0 1 376.291 3.132 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651609885 566541920 /nfs/dbraw/zinc/54/19/20/566541920.db2.gz OVLIABQZFPNAJN-CMPLNLGQSA-N 0 1 393.285 3.434 10 0 GGAEMN COc1ncc(C(=O)NC[C@H](c2cccc(F)c2)N(C)C)cc1Br ZINC000424574420 566542334 /nfs/dbraw/zinc/54/23/34/566542334.db2.gz YTZOXGAOMBYZRS-OAHLLOKOSA-N 0 1 396.260 3.025 10 0 GGAEMN CO[C@@H](C)CN(C)Cc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000628276044 566543061 /nfs/dbraw/zinc/54/30/61/566543061.db2.gz OVTYNYHOHUYUJR-AWEZNQCLSA-N 0 1 391.339 3.171 10 0 GGAEMN O=C(Nc1ccc2nccn2c1)c1cc(=O)c2cc(Br)ccc2[nH]1 ZINC000603881343 566544475 /nfs/dbraw/zinc/54/44/75/566544475.db2.gz FLJQDBGUQYPZQL-UHFFFAOYSA-N 0 1 383.205 3.191 10 0 GGAEMN CCN(CC)[C@H](CNC(=O)c1cnc(OC)c(Br)c1)c1ccco1 ZINC000424610766 566546938 /nfs/dbraw/zinc/54/69/38/566546938.db2.gz CCKBXZLPLIPKFZ-CQSZACIVSA-N 0 1 396.285 3.259 10 0 GGAEMN CCN(CC)[C@@H](CNC(=O)c1cnc(OC)c(Br)c1)c1ccco1 ZINC000424610763 566547386 /nfs/dbraw/zinc/54/73/86/566547386.db2.gz CCKBXZLPLIPKFZ-AWEZNQCLSA-N 0 1 396.285 3.259 10 0 GGAEMN Cc1nnc(SCC(=O)NCC/C=C/c2ccc(Br)cc2)[nH]1 ZINC000628335061 566547885 /nfs/dbraw/zinc/54/78/85/566547885.db2.gz DUDMHOPRHWIKHJ-DUXPYHPUSA-N 0 1 381.299 3.187 10 0 GGAEMN Cc1n[nH]c(SCC(=O)NCC/C=C/c2ccc(Br)cc2)n1 ZINC000628335061 566547888 /nfs/dbraw/zinc/54/78/88/566547888.db2.gz DUDMHOPRHWIKHJ-DUXPYHPUSA-N 0 1 381.299 3.187 10 0 GGAEMN CN(CC(=O)NCC/C=C/c1ccc(Br)cc1)[C@H]1CCSC1 ZINC000628335247 566547938 /nfs/dbraw/zinc/54/79/38/566547938.db2.gz HVLNWHWMIANISS-ICTCPBKTSA-N 0 1 383.355 3.406 10 0 GGAEMN C[C@@H](N[C@@H]1CCc2c1ccc(F)c2Br)C1(S(C)(=O)=O)CC1 ZINC000449322026 566548722 /nfs/dbraw/zinc/54/87/22/566548722.db2.gz NXGZVMZRFAKUNX-NOZJJQNGSA-N 0 1 376.291 3.131 10 0 GGAEMN O=C(NCC/C=C\c1ccc(Br)cc1)[C@@H]1CCCc2n[nH]nc21 ZINC000628336829 566548983 /nfs/dbraw/zinc/54/89/83/566548983.db2.gz PZYIMYDUGUFKHD-YZUOEBHYSA-N 0 1 375.270 3.207 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CC[C@@H](C2CC2)C1 ZINC000486012065 566549031 /nfs/dbraw/zinc/54/90/31/566549031.db2.gz BUTGLUAIWIXWOC-SNVBAGLBSA-N 0 1 381.217 3.040 10 0 GGAEMN COC(=O)c1ccc(C(F)(F)F)cc1NS(=O)(=O)c1ccc(F)cc1 ZINC000603980936 566549295 /nfs/dbraw/zinc/54/92/95/566549295.db2.gz MTUSMZFCJMVJJV-UHFFFAOYSA-N 0 1 377.315 3.432 10 0 GGAEMN Cc1nc(S(=O)(=O)NCCc2cc(F)ccc2F)sc1Br ZINC000538942447 566549415 /nfs/dbraw/zinc/54/94/15/566549415.db2.gz GNTAYPWEVUPAOV-UHFFFAOYSA-N 0 1 397.266 3.013 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)CN1CCOC[C@H]1CC1CCC1 ZINC000559465227 566551089 /nfs/dbraw/zinc/55/10/89/566551089.db2.gz IOMXCBUQZILDEW-IAGOWNOFSA-N 0 1 384.314 3.080 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)CN1CCOC[C@H]1CC1CCC1 ZINC000559465229 566551148 /nfs/dbraw/zinc/55/11/48/566551148.db2.gz IOMXCBUQZILDEW-SJORKVTESA-N 0 1 384.314 3.080 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)CN1CCOC[C@@H]1CC1CCC1 ZINC000559465226 566551293 /nfs/dbraw/zinc/55/12/93/566551293.db2.gz IOMXCBUQZILDEW-DLBZAZTESA-N 0 1 384.314 3.080 10 0 GGAEMN Nc1nc(-n2cccn2)cc(N2CCC[C@@H]2c2ccc(Br)cc2)n1 ZINC000538978991 566551413 /nfs/dbraw/zinc/55/14/13/566551413.db2.gz OVJANLVLXXQFND-CQSZACIVSA-N 0 1 385.269 3.179 10 0 GGAEMN C[C@@H](NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ncc(Br)cn1 ZINC000449340230 566552086 /nfs/dbraw/zinc/55/20/86/566552086.db2.gz NHKZXOIXRAYFSU-VXGBXAGGSA-N 0 1 398.326 3.097 10 0 GGAEMN CCNC(=O)c1ccc(=N[C@@H](CC)c2cc(F)cc(Br)c2)[nH]n1 ZINC000486041528 566552066 /nfs/dbraw/zinc/55/20/66/566552066.db2.gz NMMVITWKEGLSDP-ZDUSSCGKSA-N 0 1 381.249 3.113 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2ccc(Br)cc2F)c2ccccc21 ZINC000449356416 566552630 /nfs/dbraw/zinc/55/26/30/566552630.db2.gz HSQSKNGMIMDLPK-GFCCVEGCSA-N 0 1 384.270 3.249 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)s1 ZINC000466072836 566556362 /nfs/dbraw/zinc/55/63/62/566556362.db2.gz DLSUIDNEPWADBI-WFASDCNBSA-N 0 1 379.555 3.179 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)s1 ZINC000466072830 566556809 /nfs/dbraw/zinc/55/68/09/566556809.db2.gz DLSUIDNEPWADBI-DOMZBBRYSA-N 0 1 379.555 3.179 10 0 GGAEMN COC[C@](C)(O)CCNCc1csc(-c2cccc(Br)c2)n1 ZINC000449384421 566557041 /nfs/dbraw/zinc/55/70/41/566557041.db2.gz NHTJJGNWCGSRFV-MRXNPFEDSA-N 0 1 385.327 3.450 10 0 GGAEMN CCOc1c(Br)cc(CN2C[C@@H]3CCC[C@]3(CO)C2)cc1OC ZINC000628461091 566557255 /nfs/dbraw/zinc/55/72/55/566557255.db2.gz IHUADJWGANCEQW-KBXCAEBGSA-N 0 1 384.314 3.451 10 0 GGAEMN CS[C@H](C)CCC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000539118912 566561543 /nfs/dbraw/zinc/56/15/43/566561543.db2.gz JYLOUBKSZKVYTP-SNVBAGLBSA-N 0 1 383.315 3.382 10 0 GGAEMN CS[C@H](C)CCC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000539118912 566561545 /nfs/dbraw/zinc/56/15/45/566561545.db2.gz JYLOUBKSZKVYTP-SNVBAGLBSA-N 0 1 383.315 3.382 10 0 GGAEMN CCCOc1c(Br)cc(CN[C@H]2CCCNC2=O)cc1OCC ZINC000449435985 566562213 /nfs/dbraw/zinc/56/22/13/566562213.db2.gz GNXKQXZSTSPBBG-AWEZNQCLSA-N 0 1 385.302 3.005 10 0 GGAEMN O=C(NCCc1ccccc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000673864135 566562562 /nfs/dbraw/zinc/56/25/62/566562562.db2.gz OLXCYTVZBBQNPV-UHFFFAOYSA-N 0 1 386.253 3.394 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(F)c(-c3cccs3)c2)C1 ZINC000628496705 566562637 /nfs/dbraw/zinc/56/26/37/566562637.db2.gz XDISVJTYWNQXGK-HNNXBMFYSA-N 0 1 382.526 3.315 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN(CCCc2c(Cl)cccc2Cl)C1 ZINC000628496062 566562808 /nfs/dbraw/zinc/56/28/08/566562808.db2.gz HZRWNCFKOWXUIL-ZDUSSCGKSA-N 0 1 379.353 3.187 10 0 GGAEMN CCN(C)c1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cn1 ZINC000512890375 566566844 /nfs/dbraw/zinc/56/68/44/566566844.db2.gz JUFMQFJWVJLPRE-GOSISDBHSA-N 0 1 378.314 3.298 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1ccccc1OCc1cccc(Br)c1 ZINC000673947345 566567534 /nfs/dbraw/zinc/56/75/34/566567534.db2.gz FBBZEHJUNLDBCN-UHFFFAOYSA-N 0 1 387.237 3.076 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2C(F)(F)F)cc1 ZINC000559753837 566568387 /nfs/dbraw/zinc/56/83/87/566568387.db2.gz OZWZXAHQBPQQFO-UHFFFAOYSA-N 0 1 393.408 3.300 10 0 GGAEMN CCS(=O)(=O)C[C@H](C)NC[C@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000539306644 566572419 /nfs/dbraw/zinc/57/24/19/566572419.db2.gz AOJCQHRVXROMRW-XJKSGUPXSA-N 0 1 376.925 3.029 10 0 GGAEMN CCS(=O)(=O)C[C@@H](C)NC[C@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000539306643 566572457 /nfs/dbraw/zinc/57/24/57/566572457.db2.gz AOJCQHRVXROMRW-CZUORRHYSA-N 0 1 376.925 3.029 10 0 GGAEMN Cc1cc(CCNCc2ncc(Br)cc2Br)on1 ZINC000513012907 566573876 /nfs/dbraw/zinc/57/38/76/566573876.db2.gz UHLOLOZZCQHTDB-UHFFFAOYSA-N 0 1 375.064 3.235 10 0 GGAEMN COCCc1ccccc1NS(=O)(=O)c1ccc(C(=O)OC)cc1Cl ZINC000466418836 566575361 /nfs/dbraw/zinc/57/53/61/566575361.db2.gz BWMSDQWKHPJXIC-UHFFFAOYSA-N 0 1 383.853 3.116 10 0 GGAEMN CN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000486286968 566575890 /nfs/dbraw/zinc/57/58/90/566575890.db2.gz WECCONHUHSPQAS-LBPRGKRZSA-N 0 1 390.281 3.012 10 0 GGAEMN CN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@H]1CC[N@H+](C2CC2)C1 ZINC000486286968 566575895 /nfs/dbraw/zinc/57/58/95/566575895.db2.gz WECCONHUHSPQAS-LBPRGKRZSA-N 0 1 390.281 3.012 10 0 GGAEMN C[C@@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1ccc(Br)cn1 ZINC000579066955 566577259 /nfs/dbraw/zinc/57/72/59/566577259.db2.gz RZVWHPBFXRMPMH-QWHCGFSZSA-N 0 1 387.281 3.293 10 0 GGAEMN Cc1nc([C@H]2CCN(c3ccc(Br)c(C(F)(F)F)n3)C2)n[nH]1 ZINC000579086911 566578447 /nfs/dbraw/zinc/57/84/47/566578447.db2.gz RZHUBQREXAMEJO-QMMMGPOBSA-N 0 1 376.180 3.283 10 0 GGAEMN Cc1nnc([C@H]2CCN(c3ccc(Br)c(C(F)(F)F)n3)C2)[nH]1 ZINC000579086911 566578451 /nfs/dbraw/zinc/57/84/51/566578451.db2.gz RZHUBQREXAMEJO-QMMMGPOBSA-N 0 1 376.180 3.283 10 0 GGAEMN O[C@]1(CCNCc2csc(-c3cccc(Br)c3)n2)CCOC1 ZINC000651941848 566579112 /nfs/dbraw/zinc/57/91/12/566579112.db2.gz MCCLDHOWUVILGJ-MRXNPFEDSA-N 0 1 383.311 3.204 10 0 GGAEMN COc1ccc(CN[C@@H]2COc3ccc(F)cc3C2)c(Br)c1O ZINC000674216974 566580400 /nfs/dbraw/zinc/58/04/00/566580400.db2.gz ZQMDNOKYZMYIGQ-ZDUSSCGKSA-N 0 1 382.229 3.396 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cnc(CC3CC3)nc2)cc1Br ZINC000559976619 566581098 /nfs/dbraw/zinc/58/10/98/566581098.db2.gz DLZQNAOPYMIHMN-UHFFFAOYSA-N 0 1 382.283 3.301 10 0 GGAEMN O=C([O-])CCCC[N@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000579128553 566583181 /nfs/dbraw/zinc/58/31/81/566583181.db2.gz BNEGVZUSDSCJBI-CQSZACIVSA-N 0 1 387.261 3.411 10 0 GGAEMN Cn1cc(I)c(CN[C@H]2CC[C@@H](c3ccccc3)C2)n1 ZINC000449604876 566583661 /nfs/dbraw/zinc/58/36/61/566583661.db2.gz LTDCFDQHUOXTHW-KGLIPLIRSA-N 0 1 381.261 3.451 10 0 GGAEMN OCC1(CCNCc2ncc(Br)cc2Br)CCC1 ZINC000652036632 566585749 /nfs/dbraw/zinc/58/57/49/566585749.db2.gz QDZJAQLXRCEQGE-UHFFFAOYSA-N 0 1 378.108 3.249 10 0 GGAEMN C[C@@H](CC(=O)NC1(c2nn[nH]n2)CCCC1)c1ccc(F)c(Br)c1 ZINC000486401122 566585762 /nfs/dbraw/zinc/58/57/62/566585762.db2.gz JLRGRJJNMYMGID-JTQLQIEISA-N 0 1 396.264 3.181 10 0 GGAEMN O[C@@H]([C@@H]1CCN(CC2=Cc3cc(Br)ccc3OC2)C1)C(F)(F)F ZINC000449669325 566587995 /nfs/dbraw/zinc/58/79/95/566587995.db2.gz HRTPGEFLDDGTEC-ABAIWWIYSA-N 0 1 392.215 3.470 10 0 GGAEMN CNC(=O)CC[C@H]1CCCCN1Cc1nc2cc(Br)ccc2[nH]1 ZINC000513211493 566589274 /nfs/dbraw/zinc/58/92/74/566589274.db2.gz XIDIXBWAPCXMPX-CYBMUJFWSA-N 0 1 379.302 3.206 10 0 GGAEMN CNC(=O)CC[C@H]1CCCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000513211493 566589289 /nfs/dbraw/zinc/58/92/89/566589289.db2.gz XIDIXBWAPCXMPX-CYBMUJFWSA-N 0 1 379.302 3.206 10 0 GGAEMN CN(C)Cc1ccc(C(=O)Nc2ccc(I)cc2)cn1 ZINC000579263451 566595281 /nfs/dbraw/zinc/59/52/81/566595281.db2.gz YCNSXLVOMDQUTG-UHFFFAOYSA-N 0 1 381.217 3.000 10 0 GGAEMN CCO[C@@H]1COC[C@H]1NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000449717708 566595919 /nfs/dbraw/zinc/59/59/19/566595919.db2.gz NRJVHPUEABBUSB-HUUCEWRRSA-N 0 1 383.311 3.466 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2cccc(Cl)c2F)C1 ZINC000466738334 566596281 /nfs/dbraw/zinc/59/62/81/566596281.db2.gz URAXGPHMPROEHR-HNNXBMFYSA-N 0 1 388.936 3.185 10 0 GGAEMN CCCS(=O)(=O)NC[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605162762 566598680 /nfs/dbraw/zinc/59/86/80/566598680.db2.gz NNVCZMCAOGFAJB-HOCLYGCPSA-N 0 1 378.460 3.418 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CCCNC(=O)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000628968876 566600522 /nfs/dbraw/zinc/60/05/22/566600522.db2.gz UVYKEGOEMPWYQT-MRXNPFEDSA-N 0 1 386.323 3.019 10 0 GGAEMN CN(C)C[C@H](NC(=O)CNC(=O)CC(C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968389 566600558 /nfs/dbraw/zinc/60/05/58/566600558.db2.gz HOPKUSLMQYURFY-HNNXBMFYSA-N 0 1 388.339 3.265 10 0 GGAEMN C[C@@H](Cc1cnn(C)c1)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968046 566600981 /nfs/dbraw/zinc/60/09/81/566600981.db2.gz AHGUSGUOTDNNDD-YVEFUNNKSA-N 0 1 383.323 3.325 10 0 GGAEMN C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968131 566601211 /nfs/dbraw/zinc/60/12/11/566601211.db2.gz FATGPTMNNWACKJ-ABAIWWIYSA-N 0 1 388.339 3.263 10 0 GGAEMN O=C(NCc1c[nH]nn1)[C@H](Oc1ccc(Br)cc1)c1ccccc1 ZINC000674754699 566606732 /nfs/dbraw/zinc/60/67/32/566606732.db2.gz CAANLXVZBXIQBJ-MRXNPFEDSA-N 0 1 387.237 3.004 10 0 GGAEMN O=C(NCc1c[nH]nn1)[C@H](Oc1cccc(Br)c1)c1ccccc1 ZINC000674754730 566607006 /nfs/dbraw/zinc/60/70/06/566607006.db2.gz DJXKPLKOVZEGRR-MRXNPFEDSA-N 0 1 387.237 3.004 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(Br)cc3)[nH]c2c1 ZINC000466913472 566607602 /nfs/dbraw/zinc/60/76/02/566607602.db2.gz JJTWJNGPXHOPCK-UHFFFAOYSA-N 0 1 380.267 3.112 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3sccc3Br)[nH]c2c1 ZINC000466914257 566607929 /nfs/dbraw/zinc/60/79/29/566607929.db2.gz QHXNCGQJABLMLB-UHFFFAOYSA-N 0 1 386.296 3.174 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccccc3Br)[nH]c2c1 ZINC000466919346 566609468 /nfs/dbraw/zinc/60/94/68/566609468.db2.gz DSVHWLCIFHKUFB-UHFFFAOYSA-N 0 1 380.267 3.112 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000652431651 566610014 /nfs/dbraw/zinc/61/00/14/566610014.db2.gz GRAROHYHWVNKBY-NSHDSACASA-N 0 1 393.285 3.047 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(Br)c(C)c3)[nH]c2c1 ZINC000466936224 566610239 /nfs/dbraw/zinc/61/02/39/566610239.db2.gz PBXHSJXVBCCLTJ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN CCN1CCN(CC(=O)N2CCC[C@H]2c2ccc(Br)cc2C)CC1 ZINC000629076749 566610578 /nfs/dbraw/zinc/61/05/78/566610578.db2.gz AQZBNDPIURVIPA-SFHVURJKSA-N 0 1 394.357 3.059 10 0 GGAEMN O=C([O-])C[N@H+](C[C@H](O)COc1cc(Cl)ccc1Cl)C1CCCCC1 ZINC000652482501 566611916 /nfs/dbraw/zinc/61/19/16/566611916.db2.gz FAMRNYSPEVVCKM-AWEZNQCLSA-N 0 1 376.280 3.452 10 0 GGAEMN CCn1cc(Br)c(=O)c(NS(=O)(=O)Cc2c(C)cccc2C)c1 ZINC000560254339 566611779 /nfs/dbraw/zinc/61/17/79/566611779.db2.gz DOCDXBDABACDDP-UHFFFAOYSA-N 0 1 399.310 3.189 10 0 GGAEMN CCOC(=O)[C@@H]1CC[C@H](NCc2ccc(C(=O)OC)cc2Br)C1 ZINC000560276876 566613469 /nfs/dbraw/zinc/61/34/69/566613469.db2.gz RTKPDRMALQJECV-RISCZKNCSA-N 0 1 384.270 3.057 10 0 GGAEMN O=C(CNS(=O)(=O)c1c(Cl)ccc(F)c1F)C1CCC(F)(F)CC1 ZINC000425195802 566614461 /nfs/dbraw/zinc/61/44/61/566614461.db2.gz RUEXYGINWUXNRA-UHFFFAOYSA-N 0 1 387.782 3.291 10 0 GGAEMN O=C([O-])CC[C@H]1CCC[N@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000652496165 566614540 /nfs/dbraw/zinc/61/45/40/566614540.db2.gz MEVLGGMVHLGZGX-CHWSQXEVSA-N 0 1 376.280 3.310 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000629101102 566615609 /nfs/dbraw/zinc/61/56/09/566615609.db2.gz WAHFITUBQMRWAZ-QWRGUYRKSA-N 0 1 381.420 3.050 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CC[C@@H](c2nc(C3CC3)no2)C1 ZINC000560390180 566620695 /nfs/dbraw/zinc/62/06/95/566620695.db2.gz IZOBZZKNGULFTF-SNVBAGLBSA-N 0 1 378.226 3.045 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CC[C@H](c2nc(C3CC3)no2)C1 ZINC000560390179 566621157 /nfs/dbraw/zinc/62/11/57/566621157.db2.gz IZOBZZKNGULFTF-JTQLQIEISA-N 0 1 378.226 3.045 10 0 GGAEMN COc1cc2nccc(N3CCO[C@]4(CCCOC4)C3)c2cc1Br ZINC000425248668 566623368 /nfs/dbraw/zinc/62/33/68/566623368.db2.gz AVWJSFYTPKDKDO-GOSISDBHSA-N 0 1 393.281 3.392 10 0 GGAEMN C[C@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000652724343 566625180 /nfs/dbraw/zinc/62/51/80/566625180.db2.gz WPVFVRGKXONBGZ-GXSJLCMTSA-N 0 1 381.249 3.229 10 0 GGAEMN CC(C)O[C@@H]1CCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000652748264 566626969 /nfs/dbraw/zinc/62/69/69/566626969.db2.gz PWEBOKOIDSGRQO-CYBMUJFWSA-N 0 1 393.281 3.320 10 0 GGAEMN O=S(=O)(Nc1c[nH]nc1-c1ccccn1)c1cc(F)ccc1Br ZINC000540077753 566628339 /nfs/dbraw/zinc/62/83/39/566628339.db2.gz LBOWHHWBZBQCEH-UHFFFAOYSA-N 0 1 397.229 3.174 10 0 GGAEMN O=C(Nc1ccn(-c2ccc(Cl)cc2Cl)n1)[C@@H]1CCCc2[nH]ncc21 ZINC000540118236 566629304 /nfs/dbraw/zinc/62/93/04/566629304.db2.gz ROIFBVUXSVXZDI-LLVKDONJSA-N 0 1 376.247 3.383 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCC[C@@H]1c1ccc(Br)cn1 ZINC000560481933 566630137 /nfs/dbraw/zinc/63/01/37/566630137.db2.gz YCYXQHIROBSLND-MLGOLLRUSA-N 0 1 375.270 3.351 10 0 GGAEMN CCN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@@H]1CCCOC1 ZINC000652816478 566630983 /nfs/dbraw/zinc/63/09/83/566630983.db2.gz CYGQHIPRUOPFLG-CQSZACIVSA-N 0 1 378.270 3.480 10 0 GGAEMN COc1cc(Br)c(NC(=O)[C@H]2CCCc3[nH]ncc32)cc1OC ZINC000467184354 566632183 /nfs/dbraw/zinc/63/21/83/566632183.db2.gz ZJTRAYYIOOTNDR-VIFPVBQESA-N 0 1 380.242 3.248 10 0 GGAEMN C[C@@H](CNC(=O)[C@H]1CCCc2[nH]ncc21)Oc1cccc(Br)c1 ZINC000467205088 566633322 /nfs/dbraw/zinc/63/33/22/566633322.db2.gz FCEBFYUMAWWMIW-FZMZJTMJSA-N 0 1 378.270 3.176 10 0 GGAEMN C[C@H](CNC(=O)[C@H]1CCCc2[nH]ncc21)Oc1ccc(Br)cc1 ZINC000467202958 566633849 /nfs/dbraw/zinc/63/38/49/566633849.db2.gz UCSYFXXBUNADNL-RISCZKNCSA-N 0 1 378.270 3.176 10 0 GGAEMN Cn1ncc(Br)c1CNCCCC(=O)Nc1ccc(Cl)cc1 ZINC000486934065 566636108 /nfs/dbraw/zinc/63/61/08/566636108.db2.gz YESAIDSLRSSJGK-UHFFFAOYSA-N 0 1 385.693 3.345 10 0 GGAEMN Cn1ncc(Br)c1CNCCOc1cccc(C(F)(F)F)c1 ZINC000486923763 566636204 /nfs/dbraw/zinc/63/62/04/566636204.db2.gz IHPMNBZKLVKWGQ-UHFFFAOYSA-N 0 1 378.192 3.370 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1ccc(F)cc1OCC(F)(F)F)C1CC1 ZINC000629290290 566636770 /nfs/dbraw/zinc/63/67/70/566636770.db2.gz RFVYVKXOTHGKHH-CQSZACIVSA-N 0 1 385.379 3.324 10 0 GGAEMN Cn1ncc(Br)c1CNCCOc1ccc(C(F)(F)F)cc1 ZINC000486927637 566636759 /nfs/dbraw/zinc/63/67/59/566636759.db2.gz SLFZGSLTQAKWRV-UHFFFAOYSA-N 0 1 378.192 3.370 10 0 GGAEMN CC(C)[C@H]1CN(C)CCN1C(=O)N[C@@H](C)Cc1ccc(Br)cc1 ZINC000606645189 566637720 /nfs/dbraw/zinc/63/77/20/566637720.db2.gz XORADGBFYLTKCV-WMLDXEAASA-N 0 1 382.346 3.362 10 0 GGAEMN Cn1ncc(Br)c1CNCCNc1cccc(Br)c1 ZINC000487557224 566679590 /nfs/dbraw/zinc/67/95/90/566679590.db2.gz JBPAKZBGUGXDCU-UHFFFAOYSA-N 0 1 388.107 3.147 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCC(=O)Nc1ccc(Br)cc1 ZINC000467296865 566638371 /nfs/dbraw/zinc/63/83/71/566638371.db2.gz BGJAKFDDTOYOBO-NUTKFTJISA-N 0 1 395.297 3.051 10 0 GGAEMN CCN(Cc1ccccc1Br)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000579776005 566638480 /nfs/dbraw/zinc/63/84/80/566638480.db2.gz JEJXIUAMGUYRTB-CYBMUJFWSA-N 0 1 377.286 3.261 10 0 GGAEMN Cc1c([C@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)cnn1-c1cccc(Cl)c1 ZINC000560582197 566641293 /nfs/dbraw/zinc/64/12/93/566641293.db2.gz YGLIQONBXYQRRZ-GXTWGEPZSA-N 0 1 381.929 3.450 10 0 GGAEMN C[C@@H]1[C@@H](Cc2ccccc2)CCN1Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000425426629 566641334 /nfs/dbraw/zinc/64/13/34/566641334.db2.gz SNAAELAMGHLVOB-NVXWUHKLSA-N 0 1 378.563 3.452 10 0 GGAEMN CCN1CCN(CC(=O)N[C@@H](c2cccs2)c2ccc(Cl)cc2)CC1 ZINC000514074303 566641667 /nfs/dbraw/zinc/64/16/67/566641667.db2.gz LXCNVJWZNCGAMF-LJQANCHMSA-N 0 1 377.941 3.245 10 0 GGAEMN O=C(c1cc(Br)c(F)cc1[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000450190682 566642831 /nfs/dbraw/zinc/64/28/31/566642831.db2.gz VLCPGYKKZRKVSN-BZNIZROVSA-N 0 1 397.288 3.383 10 0 GGAEMN Cc1cn2cc([N-]S(=O)(=O)c3cc(Br)ccc3F)ccc2[nH+]1 ZINC000606751776 566643172 /nfs/dbraw/zinc/64/31/72/566643172.db2.gz DXIPUDKHXKKOHE-UHFFFAOYSA-N 0 1 384.230 3.345 10 0 GGAEMN O=C(CCCc1cccc(Br)c1)NCCCCN1CCOCC1 ZINC000675441520 566644126 /nfs/dbraw/zinc/64/41/26/566644126.db2.gz HSQACHXLVJFDLD-UHFFFAOYSA-N 0 1 383.330 3.000 10 0 GGAEMN O=C(NCC[C@@H]1COc2ccccc2O1)c1cccc(Br)c1O ZINC000560637099 566645498 /nfs/dbraw/zinc/64/54/98/566645498.db2.gz UIDAXJKPILUXHS-LLVKDONJSA-N 0 1 378.222 3.115 10 0 GGAEMN C[C@@H](c1ccc(CN2CCCC[C@H]2CNS(C)(=O)=O)cc1)C(F)(F)F ZINC000450253757 566649353 /nfs/dbraw/zinc/64/93/53/566649353.db2.gz PVLWROSVLDTTKG-BBRMVZONSA-N 0 1 378.460 3.256 10 0 GGAEMN C[C@H](c1ccc(CN2CCCC[C@H]2CNS(C)(=O)=O)cc1)C(F)(F)F ZINC000450253758 566649707 /nfs/dbraw/zinc/64/97/07/566649707.db2.gz PVLWROSVLDTTKG-CJNGLKHVSA-N 0 1 378.460 3.256 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1cccnc1C(F)(F)F)c1ccc(F)cc1 ZINC000629351308 566649789 /nfs/dbraw/zinc/64/97/89/566649789.db2.gz KNSYMOLOVXYWPV-CYBMUJFWSA-N 0 1 378.347 3.369 10 0 GGAEMN O=C(CSCc1ccc(Cl)cc1Cl)N1CCC[C@@H](c2nn[nH]n2)C1 ZINC000540423936 566650167 /nfs/dbraw/zinc/65/01/67/566650167.db2.gz UKTBPXQUSVTTLE-SNVBAGLBSA-N 0 1 386.308 3.146 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCO3)[C@@H]2CCC[C@H]21 ZINC000629373086 566652121 /nfs/dbraw/zinc/65/21/21/566652121.db2.gz JXJFQNFRJXKPMX-OUCADQQQSA-N 0 1 382.254 3.253 10 0 GGAEMN Cn1cc(NS(=O)(=O)c2cc(Cl)ccc2OC(F)F)c(C2CC2)n1 ZINC000579940471 566652645 /nfs/dbraw/zinc/65/26/45/566652645.db2.gz XXORKIINQOMTMK-UHFFFAOYSA-N 0 1 377.800 3.353 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCCO3)[C@@H]2CCC[C@H]21 ZINC000629372785 566652916 /nfs/dbraw/zinc/65/29/16/566652916.db2.gz HMBNWIMKHMABSM-GZBFAFLISA-N 0 1 396.281 3.296 10 0 GGAEMN O=C(c1nscc1Br)N1CCNC[C@H]1c1cccc(Cl)c1 ZINC000653137401 566652985 /nfs/dbraw/zinc/65/29/85/566652985.db2.gz ZGRCOTGXQGTTGC-LBPRGKRZSA-N 0 1 386.702 3.346 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@@H]2CCC[C@H]21 ZINC000629377213 566653134 /nfs/dbraw/zinc/65/31/34/566653134.db2.gz MBDIDLXGSPRCOE-YWPYICTPSA-N 0 1 378.270 3.401 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@@H]2CCC[C@H]21 ZINC000629377213 566653137 /nfs/dbraw/zinc/65/31/37/566653137.db2.gz MBDIDLXGSPRCOE-YWPYICTPSA-N 0 1 378.270 3.401 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)[C@H]2CCC[C@@H]21 ZINC000629373932 566653352 /nfs/dbraw/zinc/65/33/52/566653352.db2.gz QFMCHYWFMDKALG-NHIYQJMISA-N 0 1 388.291 3.308 10 0 GGAEMN Cn1cc([C@@H](NCC(=O)Nc2ccccc2Br)C(C)(C)C)cn1 ZINC000540478989 566653485 /nfs/dbraw/zinc/65/34/85/566653485.db2.gz QTAVCCLNBLXVLZ-MRXNPFEDSA-N 0 1 379.302 3.498 10 0 GGAEMN C[C@H]1C[C@@H](NC[C@@H]2CS(=O)(=O)c3ccccc3O2)c2ccsc2S1 ZINC000579957514 566653729 /nfs/dbraw/zinc/65/37/29/566653729.db2.gz PEAVLWPHMQPHEK-OUCADQQQSA-N 0 1 381.544 3.498 10 0 GGAEMN CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000675551284 566653634 /nfs/dbraw/zinc/65/36/34/566653634.db2.gz RCZCHFPEIVQPQQ-OAHLLOKOSA-N 0 1 382.888 3.374 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cc(Oc3cccc(Br)c3)ccn2)C1 ZINC000675565858 566653657 /nfs/dbraw/zinc/65/36/57/566653657.db2.gz ZSHDEUNVINDJBE-AWEZNQCLSA-N 0 1 390.281 3.460 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2sccc2Br)CC1 ZINC000629417488 566654068 /nfs/dbraw/zinc/65/40/68/566654068.db2.gz NTSHNLVOZUAWMG-UHFFFAOYSA-N 0 1 387.343 3.228 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(Br)ccc2F)CC1 ZINC000629419697 566654304 /nfs/dbraw/zinc/65/43/04/566654304.db2.gz DOQNZTUQYNHRBP-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN OCCCN1CCN(c2ccc3c(Cl)ccc(Br)c3n2)CC1 ZINC000450294713 566654571 /nfs/dbraw/zinc/65/45/71/566654571.db2.gz QRSBSGARRQXJQN-UHFFFAOYSA-N 0 1 384.705 3.155 10 0 GGAEMN O=C([O-])[C@@H]1Cc2c(Br)cccc2C[N@@H+]1C[C@H](O)C1CCCCC1 ZINC000579968203 566655040 /nfs/dbraw/zinc/65/50/40/566655040.db2.gz LWSHUUSJQPGDAJ-IRXDYDNUSA-N 0 1 382.298 3.202 10 0 GGAEMN COC(=O)c1conc1C(C)(C)NCc1nc2ccc(Br)cc2[nH]1 ZINC000425587286 566657157 /nfs/dbraw/zinc/65/71/57/566657157.db2.gz NFTXXLWXXCXAQZ-UHFFFAOYSA-N 0 1 393.241 3.125 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)Cc2cc(Br)ccc2C)n[nH]1 ZINC000450314783 566657416 /nfs/dbraw/zinc/65/74/16/566657416.db2.gz NNGISUKTCQLUNL-HNNXBMFYSA-N 0 1 377.286 3.480 10 0 GGAEMN C[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)c1ncc(Br)cn1 ZINC000560788938 566659549 /nfs/dbraw/zinc/65/95/49/566659549.db2.gz LUZSGYWYDMXOHN-BBRMVZONSA-N 0 1 389.297 3.081 10 0 GGAEMN O=C(Cc1noc2ccc(Br)cc21)N1CCC(c2cnc[nH]2)CC1 ZINC000514668585 566660568 /nfs/dbraw/zinc/66/05/68/566660568.db2.gz KEDITFMOWQHOBZ-UHFFFAOYSA-N 0 1 389.253 3.262 10 0 GGAEMN Cn1ncc(Br)c1CNCCOc1ncc(Cl)cc1Cl ZINC000487269273 566661099 /nfs/dbraw/zinc/66/10/99/566661099.db2.gz DKXPRQSJSNSXCF-UHFFFAOYSA-N 0 1 380.073 3.053 10 0 GGAEMN Cn1ncc(Br)c1CNCCc1ccccc1OC(F)(F)F ZINC000487297705 566661680 /nfs/dbraw/zinc/66/16/80/566661680.db2.gz QTWVYWIXNMYPPK-UHFFFAOYSA-N 0 1 378.192 3.414 10 0 GGAEMN Cn1ncc(Br)c1CNCCNc1ncc(Cl)cc1Cl ZINC000487291369 566661777 /nfs/dbraw/zinc/66/17/77/566661777.db2.gz VOTGEZVPQZTMLJ-UHFFFAOYSA-N 0 1 379.089 3.086 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCCc2nc3cc(Cl)ccc3s2)n[nH]1 ZINC000487313600 566663742 /nfs/dbraw/zinc/66/37/42/566663742.db2.gz ZXFDMMDIURMUOF-SNVBAGLBSA-N 0 1 377.901 3.454 10 0 GGAEMN O=C(NCCCOc1ccc(Cl)cc1Cl)N1CC[C@H](c2nc[nH]n2)C1 ZINC000425666345 566664623 /nfs/dbraw/zinc/66/46/23/566664623.db2.gz XZWGBHGGAIJCRJ-NSHDSACASA-N 0 1 384.267 3.080 10 0 GGAEMN COc1ncc(Br)cc1CNCCC(=O)Nc1cccc(F)c1 ZINC000629593012 566671036 /nfs/dbraw/zinc/67/10/36/566671036.db2.gz IMAFASZCEZIWKY-UHFFFAOYSA-N 0 1 382.233 3.110 10 0 GGAEMN O[C@@H](CNCc1cc(F)c(Br)cc1F)COc1ccccc1F ZINC000629597440 566671251 /nfs/dbraw/zinc/67/12/51/566671251.db2.gz KKGPHSYPXHAWPV-NSHDSACASA-N 0 1 390.199 3.396 10 0 GGAEMN O[C@H](CNCc1cc(F)c(Br)cc1F)COc1ccccc1F ZINC000629597439 566671271 /nfs/dbraw/zinc/67/12/71/566671271.db2.gz KKGPHSYPXHAWPV-LLVKDONJSA-N 0 1 390.199 3.396 10 0 GGAEMN O[C@H](CNCc1ccc(Br)c(F)c1F)COc1ccccc1F ZINC000629597082 566671346 /nfs/dbraw/zinc/67/13/46/566671346.db2.gz FJQKVQUNRNWLSI-LLVKDONJSA-N 0 1 390.199 3.396 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCC[C@H]1C1CC1 ZINC000607415622 566671750 /nfs/dbraw/zinc/67/17/50/566671750.db2.gz KYDMUMVWABSZGL-AWEZNQCLSA-N 0 1 390.285 3.318 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCC[C@H]1C1CC1 ZINC000607415622 566671756 /nfs/dbraw/zinc/67/17/56/566671756.db2.gz KYDMUMVWABSZGL-AWEZNQCLSA-N 0 1 390.285 3.318 10 0 GGAEMN C[C@@H]1C[C@H](C)CN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000607415074 566671840 /nfs/dbraw/zinc/67/18/40/566671840.db2.gz ADMBYAVONXEMQS-WDEREUQCSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1C[C@H](C)CN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000607415074 566671843 /nfs/dbraw/zinc/67/18/43/566671843.db2.gz ADMBYAVONXEMQS-WDEREUQCSA-N 0 1 378.274 3.174 10 0 GGAEMN Cc1ccnc([N-]S(=O)(=O)c2ccc(C[NH+](C)C)cc2)c1Br ZINC000580217275 566674686 /nfs/dbraw/zinc/67/46/86/566674686.db2.gz YLWRJHZMXRKYSK-UHFFFAOYSA-N 0 1 384.299 3.015 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 ZINC000561091171 566675038 /nfs/dbraw/zinc/67/50/38/566675038.db2.gz GVJUYKXOKRQCEY-CHWSQXEVSA-N 0 1 380.432 3.126 10 0 GGAEMN COc1ccc(F)c(CNCCNC(=O)c2cccc(Br)c2)c1 ZINC000580219470 566675456 /nfs/dbraw/zinc/67/54/56/566675456.db2.gz NWWYAMAIVJOSTQ-UHFFFAOYSA-N 0 1 381.245 3.116 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2cc(F)cc(Br)c2C1 ZINC000629739703 566679874 /nfs/dbraw/zinc/67/98/74/566679874.db2.gz HBZFLAKDRVQPEY-NSHDSACASA-N 0 1 378.245 3.001 10 0 GGAEMN CSC1(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCC1 ZINC000425937744 566682814 /nfs/dbraw/zinc/68/28/14/566682814.db2.gz NVEWCFRTJUUMDG-UHFFFAOYSA-N 0 1 381.299 3.136 10 0 GGAEMN CSC1(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCC1 ZINC000425937744 566682818 /nfs/dbraw/zinc/68/28/18/566682818.db2.gz NVEWCFRTJUUMDG-UHFFFAOYSA-N 0 1 381.299 3.136 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@H]2NCCc3ccccc32)cc1Br ZINC000580329738 566684583 /nfs/dbraw/zinc/68/45/83/566684583.db2.gz LECHJDHVRLZHBN-SFHVURJKSA-N 0 1 388.309 3.336 10 0 GGAEMN COc1cc(Br)ccc1CN(C)C[C@@H](O)COCc1ccccc1 ZINC000540997178 566686054 /nfs/dbraw/zinc/68/60/54/566686054.db2.gz ASPDITUYEXFBRJ-GOSISDBHSA-N 0 1 394.309 3.467 10 0 GGAEMN COc1cc(Br)ccc1CN(C)C[C@H](O)COCc1ccccc1 ZINC000540997179 566686310 /nfs/dbraw/zinc/68/63/10/566686310.db2.gz ASPDITUYEXFBRJ-SFHVURJKSA-N 0 1 394.309 3.467 10 0 GGAEMN O=C(Cc1cc(F)ccc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000676370135 566688193 /nfs/dbraw/zinc/68/81/93/566688193.db2.gz ZQJCWQYAIYFNGD-UHFFFAOYSA-N 0 1 375.201 3.350 10 0 GGAEMN CC(=O)Nc1cc(F)c(S(=O)(=O)Nc2c(O)cccc2F)c(F)c1Cl ZINC000608004218 566689512 /nfs/dbraw/zinc/68/95/12/566689512.db2.gz CRXQXQCAOJQYTL-UHFFFAOYSA-N 0 1 394.758 3.222 10 0 GGAEMN CCN(Cc1ccccc1)C(=O)CN[C@@H](CO)c1ccc(Br)cc1 ZINC000541052885 566690561 /nfs/dbraw/zinc/69/05/61/566690561.db2.gz CKDVOYPFYGFFTE-SFHVURJKSA-N 0 1 391.309 3.121 10 0 GGAEMN COCC[C@H](COC)N[C@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000515096928 566690851 /nfs/dbraw/zinc/69/08/51/566690851.db2.gz ADNSIHKCGALECX-IUODEOHRSA-N 0 1 397.317 3.040 10 0 GGAEMN O=C(CN[C@H](CCO)c1ccc(Cl)cc1)N1CCC[C@H](C(F)(F)F)C1 ZINC000561350412 566698307 /nfs/dbraw/zinc/69/83/07/566698307.db2.gz RMYKJTXPORUIMJ-DZGCQCFKSA-N 0 1 378.822 3.154 10 0 GGAEMN C[C@@H](NCC(=O)N1CCN(Cc2ccsc2)CC1)c1cccc(Cl)c1 ZINC000487946218 566698364 /nfs/dbraw/zinc/69/83/64/566698364.db2.gz JXTVVRYWMMGZKO-OAHLLOKOSA-N 0 1 377.941 3.397 10 0 GGAEMN O=C(CN[C@@H](CCO)c1ccc(Cl)cc1)N1CCC[C@H](C(F)(F)F)C1 ZINC000561350415 566698871 /nfs/dbraw/zinc/69/88/71/566698871.db2.gz RMYKJTXPORUIMJ-ZFWWWQNUSA-N 0 1 378.822 3.154 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](NCc2cc(Br)ccc2OC(F)F)CC1=O ZINC000608072793 566699965 /nfs/dbraw/zinc/69/99/65/566699965.db2.gz SMNOWZKIJUVWAD-WQAKAFBOSA-N 0 1 389.240 3.149 10 0 GGAEMN CC(C)(C)N1CCc2nc(NC(=O)c3scc4c3OCCO4)sc2C1 ZINC000653888496 566701228 /nfs/dbraw/zinc/70/12/28/566701228.db2.gz SGVDCWSNDOLJKO-UHFFFAOYSA-N 0 1 379.507 3.385 10 0 GGAEMN O=S1(=O)NC(CN[C@H](c2ccc(Cl)cc2)C2CC2)=Nc2ccccc21 ZINC000541205521 566703589 /nfs/dbraw/zinc/70/35/89/566703589.db2.gz DUWWVHHLIQIWAF-SFHVURJKSA-N 0 1 375.881 3.403 10 0 GGAEMN Cc1[nH+]cc2n1C[C@@H](C(=O)NCc1c(C(=O)[O-])sc3ccsc31)CC2 ZINC000630141273 566705785 /nfs/dbraw/zinc/70/57/85/566705785.db2.gz ZXCNBDZJPAKNDT-JTQLQIEISA-N 0 1 375.475 3.045 10 0 GGAEMN O=c1[nH]ccc2c1CN(Cc1cnn(-c3ccc(Br)cc3)c1)CC2 ZINC000426377204 566706336 /nfs/dbraw/zinc/70/63/36/566706336.db2.gz HJMBIAFABPDEIH-UHFFFAOYSA-N 0 1 385.265 3.294 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(Br)c(Cl)c2)nc1 ZINC000676870461 566712263 /nfs/dbraw/zinc/71/22/63/566712263.db2.gz JVFCJQVDSDLQDV-UHFFFAOYSA-N 0 1 377.647 3.307 10 0 GGAEMN C[C@H]1CN(Cc2ccc(-c3ccc(Br)cc3)o2)CCN1CCO ZINC000426496277 566715235 /nfs/dbraw/zinc/71/52/35/566715235.db2.gz ODIVUPCPTYIHCI-AWEZNQCLSA-N 0 1 379.298 3.208 10 0 GGAEMN CCOc1c(Br)cc(CN(CCOC)[C@H]2CCOC2)cc1OC ZINC000426513229 566715349 /nfs/dbraw/zinc/71/53/49/566715349.db2.gz GVXBDOXQCLBLAQ-AWEZNQCLSA-N 0 1 388.302 3.094 10 0 GGAEMN COCCN(Cc1ccc(Br)c(Br)c1)[C@@H]1CCOC1 ZINC000426505901 566715498 /nfs/dbraw/zinc/71/54/98/566715498.db2.gz ZXPQXCLMXGIYPS-GFCCVEGCSA-N 0 1 393.119 3.449 10 0 GGAEMN CCOc1cc(CN(CCOC)[C@H]2CCOC2)cc(Br)c1OC ZINC000426518157 566715680 /nfs/dbraw/zinc/71/56/80/566715680.db2.gz XAVRKJJRFQCFTH-AWEZNQCLSA-N 0 1 388.302 3.094 10 0 GGAEMN CCOc1cc(CN(CCOC)[C@@H]2CCOC2)cc(Br)c1OC ZINC000426518159 566716142 /nfs/dbraw/zinc/71/61/42/566716142.db2.gz XAVRKJJRFQCFTH-CQSZACIVSA-N 0 1 388.302 3.094 10 0 GGAEMN Cn1[nH]c([C@@H]2CCCN2CC/C=C\c2ccc(Br)cc2)nc1=N ZINC000450906670 566719324 /nfs/dbraw/zinc/71/93/24/566719324.db2.gz DRPWOWGGXDGPEQ-PRSOIBJXSA-N 0 1 376.302 3.231 10 0 GGAEMN CCN(Cc1cccc(Br)c1)[C@@H]1CCN(c2cc(C)nn2C)C1=O ZINC000488283499 566720108 /nfs/dbraw/zinc/72/01/08/566720108.db2.gz USOMELKINPHKMT-MRXNPFEDSA-N 0 1 391.313 3.118 10 0 GGAEMN C[C@H](c1ccc(CN2CCC[C@@H](S(=O)(=O)N(C)C)C2)cc1)C(F)(F)F ZINC000450970684 566726558 /nfs/dbraw/zinc/72/65/58/566726558.db2.gz FERFEDSENBUWGT-CZUORRHYSA-N 0 1 378.460 3.208 10 0 GGAEMN O=C(CNC(=O)c1cc2c(s1)CCCC2)Nc1cc(Cl)c(O)cc1F ZINC000561668762 566727112 /nfs/dbraw/zinc/72/71/12/566727112.db2.gz UXLWVZMUAIVRNI-UHFFFAOYSA-N 0 1 382.844 3.494 10 0 GGAEMN CC[C@@H]1CN(C(=O)NCCc2cccc(Cl)c2Cl)CCN1C[C@H](C)O ZINC000541496311 566728698 /nfs/dbraw/zinc/72/86/98/566728698.db2.gz QXMFENAESRCAOA-DZGCQCFKSA-N 0 1 388.339 3.023 10 0 GGAEMN COC(=O)c1cc(NS(=O)(=O)c2ccccc2SC)cc2[nH]ccc21 ZINC000561688415 566729055 /nfs/dbraw/zinc/72/90/55/566729055.db2.gz NRLPYUKFUUTSEL-UHFFFAOYSA-N 0 1 376.459 3.477 10 0 GGAEMN CC[C@H](NS(=O)(=O)c1cc(Cl)ccc1O[C@@H](C)COC)C(F)(F)F ZINC000468786528 566729829 /nfs/dbraw/zinc/72/98/29/566729829.db2.gz CBDCWKZXPJWWOW-ZANVPECISA-N 0 1 389.823 3.373 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)NCc2ccc(Br)cc2OC)C[C@H]1C ZINC000488495747 566730208 /nfs/dbraw/zinc/73/02/08/566730208.db2.gz JCUIOIOZWKKPCN-CHWSQXEVSA-N 0 1 384.318 3.082 10 0 GGAEMN COc1ccc(Br)c(C[NH2+][C@@H](C(=O)[O-])c2ccccc2OC)c1 ZINC000426795644 566730299 /nfs/dbraw/zinc/73/02/99/566730299.db2.gz YTGFTJLOFVNSFZ-MRXNPFEDSA-N 0 1 380.238 3.382 10 0 GGAEMN O=C([O-])[C@@]1([NH2+]Cc2ncc(Br)cc2F)CCc2c1cccc2F ZINC000630455937 566732410 /nfs/dbraw/zinc/73/24/10/566732410.db2.gz JHRRKRQSWFSRFH-MRXNPFEDSA-N 0 1 383.192 3.138 10 0 GGAEMN CN(C)c1ncc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)s1 ZINC000677245352 566735261 /nfs/dbraw/zinc/73/52/61/566735261.db2.gz GWIPTKHNFRJBTC-GDBMZVCRSA-N 0 1 382.892 3.063 10 0 GGAEMN O=C([O-])[C@@H]([NH2+]Cc1ccc(-c2ccc(Br)cc2)o1)[C@H]1CCCO1 ZINC000630470108 566735281 /nfs/dbraw/zinc/73/52/81/566735281.db2.gz RWVWXERHYKXNAU-CVEARBPZSA-N 0 1 380.238 3.431 10 0 GGAEMN O=C(N[C@H]1CCCc2cn[nH]c21)N1CCOc2cccc(Br)c2C1 ZINC000654495141 566736829 /nfs/dbraw/zinc/73/68/29/566736829.db2.gz IQCLDHDAOXVMEX-AWEZNQCLSA-N 0 1 391.269 3.154 10 0 GGAEMN O=C([O-])[C@@H]([NH2+]Cc1ccc(-c2cccc(Br)c2)o1)[C@@H]1CCCO1 ZINC000630470720 566737063 /nfs/dbraw/zinc/73/70/63/566737063.db2.gz WIHYOCFDATUKPA-HOTGVXAUSA-N 0 1 380.238 3.431 10 0 GGAEMN C[C@@](CO)(NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1cccc(O)c1 ZINC000451029852 566739794 /nfs/dbraw/zinc/73/97/94/566739794.db2.gz HXVPQHAYANHMCA-BXKMTCNYSA-N 0 1 388.316 3.304 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@H](C(C)(C)C)[C@H](O)C1)c1ccc(Br)cc1 ZINC000541625274 566739912 /nfs/dbraw/zinc/73/99/12/566739912.db2.gz NRJTUUMWRRUGBV-RRQGHBQHSA-N 0 1 397.357 3.355 10 0 GGAEMN O=C(CCNCc1cn2cccc(F)c2n1)Nc1ccc(Br)cc1 ZINC000677321843 566741409 /nfs/dbraw/zinc/74/14/09/566741409.db2.gz WHGUUFQCMCSFGJ-UHFFFAOYSA-N 0 1 391.244 3.354 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@H]3c4sccc4OC(C)(C)[C@@H]3O)ccc21 ZINC000516006237 566742782 /nfs/dbraw/zinc/74/27/82/566742782.db2.gz UHKHNSUZNNFURO-GOEBONIOSA-N 0 1 376.503 3.024 10 0 GGAEMN C[C@@H]1[C@H](CO)CCN1CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000488718202 566742776 /nfs/dbraw/zinc/74/27/76/566742776.db2.gz LXIAZFIBOQZQIN-ZJUUUORDSA-N 0 1 395.219 3.109 10 0 GGAEMN CC[C@@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccn(C)n1 ZINC000541743989 566744084 /nfs/dbraw/zinc/74/40/84/566744084.db2.gz CYMRQLJWASTSNR-CYBMUJFWSA-N 0 1 375.274 3.209 10 0 GGAEMN CC[C@@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccn(C)n1 ZINC000541743989 566744089 /nfs/dbraw/zinc/74/40/89/566744089.db2.gz CYMRQLJWASTSNR-CYBMUJFWSA-N 0 1 375.274 3.209 10 0 GGAEMN O=C(NCc1nccn1CC(F)(F)F)c1cn[nH]c1-c1ccc(Cl)s1 ZINC000427073247 566745299 /nfs/dbraw/zinc/74/52/99/566745299.db2.gz IJVIITZBLCBQOU-UHFFFAOYSA-N 0 1 389.790 3.480 10 0 GGAEMN C[C@@H](CNS(=O)(=O)c1cc(F)c(Br)cc1F)c1ccncc1 ZINC000677421194 566745506 /nfs/dbraw/zinc/74/55/06/566745506.db2.gz NAVDGHCRHNPNBE-VIFPVBQESA-N 0 1 391.237 3.204 10 0 GGAEMN CC(=O)Nc1nnc(SCc2nc3ccc(Br)cc3[nH]2)s1 ZINC000541780584 566748109 /nfs/dbraw/zinc/74/81/09/566748109.db2.gz CBOCBWKKXHXPCK-UHFFFAOYSA-N 0 1 384.284 3.428 10 0 GGAEMN C[C@@H](CNC(=O)c1c(F)cncc1Br)N1CCc2ccccc2C1 ZINC000630707071 566748449 /nfs/dbraw/zinc/74/84/49/566748449.db2.gz RKDLGIVLOOOCHD-LBPRGKRZSA-N 0 1 392.272 3.160 10 0 GGAEMN O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)c1c(F)cncc1Br ZINC000630724832 566748478 /nfs/dbraw/zinc/74/84/78/566748478.db2.gz GPRQQMWZIRHRRX-CQSZACIVSA-N 0 1 392.272 3.378 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCC(CN2CCOCC2)CC1 ZINC000630755584 566749593 /nfs/dbraw/zinc/74/95/93/566749593.db2.gz XYWFNLMKEDSNRG-UHFFFAOYSA-N 0 1 387.343 3.003 10 0 GGAEMN COc1cc(C(=O)Nc2cnn(-c3ccncc3)c2)sc1Br ZINC000677532686 566752064 /nfs/dbraw/zinc/75/20/64/566752064.db2.gz KBCVAMNANWDLCM-UHFFFAOYSA-N 0 1 379.239 3.352 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cnn(C)c2C(F)F)c(Cl)c1Cl ZINC000677550250 566752250 /nfs/dbraw/zinc/75/22/50/566752250.db2.gz DDFHRSNAJNYZHD-UHFFFAOYSA-N 0 1 386.207 3.474 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)[C@@H]1COc2ccc(Br)cc21 ZINC000677532711 566752322 /nfs/dbraw/zinc/75/23/22/566752322.db2.gz LLSNMWUVSURPOT-OAHLLOKOSA-N 0 1 385.221 3.145 10 0 GGAEMN CC[C@H](NS(=O)(=O)c1c2ccccc2sc1C(=O)OC)C(F)(F)F ZINC000469017675 566753434 /nfs/dbraw/zinc/75/34/34/566753434.db2.gz UMZTVYXDOWVLMO-JTQLQIEISA-N 0 1 381.397 3.307 10 0 GGAEMN CC(C)(C)NS(=O)(=O)c1ccc(C(=O)Nc2cc(F)cc(F)c2F)o1 ZINC000562030703 566758739 /nfs/dbraw/zinc/75/87/39/566758739.db2.gz KAIJEVWJNOWQLW-UHFFFAOYSA-N 0 1 376.356 3.026 10 0 GGAEMN O=C(Cc1ccc(I)cc1)Nc1nc2ccc(F)cc2[nH]1 ZINC000488931110 566758875 /nfs/dbraw/zinc/75/88/75/566758875.db2.gz GUTMNQWLGADYCF-UHFFFAOYSA-N 0 1 395.175 3.488 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000562052922 566760778 /nfs/dbraw/zinc/76/07/78/566760778.db2.gz CJLLSVFBJDVGGG-INIZCTEOSA-N 0 1 376.975 3.102 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1(C(F)F)CCC1 ZINC000630895701 566761116 /nfs/dbraw/zinc/76/11/16/566761116.db2.gz PHHUBMPRJHFVFV-UHFFFAOYSA-N 0 1 385.212 3.286 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1(C(F)F)CCC1 ZINC000630895701 566761121 /nfs/dbraw/zinc/76/11/21/566761121.db2.gz PHHUBMPRJHFVFV-UHFFFAOYSA-N 0 1 385.212 3.286 10 0 GGAEMN O=S(=O)(Nc1cnoc1)c1ccc(OC(F)(F)F)cc1Br ZINC000677805683 566763150 /nfs/dbraw/zinc/76/31/50/566763150.db2.gz XGEZDOUKNRQJNS-UHFFFAOYSA-N 0 1 387.133 3.137 10 0 GGAEMN CC(=O)N1CCCc2cc(S(=O)(=O)Nc3scnc3C3CC3)ccc21 ZINC000677804000 566764207 /nfs/dbraw/zinc/76/42/07/566764207.db2.gz DKWMYBCWMWXPOJ-UHFFFAOYSA-N 0 1 377.491 3.120 10 0 GGAEMN O=C(NCc1c[nH]nn1)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1 ZINC000677826929 566766144 /nfs/dbraw/zinc/76/61/44/566766144.db2.gz NHOLYKSTCZEVGF-UHFFFAOYSA-N 0 1 384.145 3.374 10 0 GGAEMN COCCN1CCC[C@@H](NC(=O)c2oc3ccccc3c2Br)C1 ZINC000630943134 566766525 /nfs/dbraw/zinc/76/65/25/566766525.db2.gz OBIOTWGZSWEVIX-GFCCVEGCSA-N 0 1 381.270 3.036 10 0 GGAEMN COC(=O)CCN(Cc1ccccc1)C(=O)c1cccc(Br)c1O ZINC000609549033 566769884 /nfs/dbraw/zinc/76/98/84/566769884.db2.gz YEXGYEXPXLAYTP-UHFFFAOYSA-N 0 1 392.249 3.360 10 0 GGAEMN O=C1[C@H](Sc2nc(-c3ccccc3Br)n[nH]2)CCN1C1CCC1 ZINC000631004664 566769994 /nfs/dbraw/zinc/76/99/94/566769994.db2.gz WRAFPECSUXYCSE-CYBMUJFWSA-N 0 1 393.310 3.480 10 0 GGAEMN O=C1[C@@H](Sc2nc(-c3ccc(Br)cc3)n[nH]2)CCN1C1CCC1 ZINC000631005048 566770358 /nfs/dbraw/zinc/77/03/58/566770358.db2.gz MOBJFLZEWSYPNS-ZDUSSCGKSA-N 0 1 393.310 3.480 10 0 GGAEMN C[C@@H](NCC(=O)Nc1nc2c(s1)CCCC2)c1ccc([S@@](C)=O)cc1 ZINC000542053772 566771914 /nfs/dbraw/zinc/77/19/14/566771914.db2.gz RGTXQWWAIMAYCB-XELLLNAOSA-N 0 1 377.535 3.049 10 0 GGAEMN Cc1cc(NS(=O)(=O)c2ccccc2C(F)(F)F)ccc1OCCO ZINC000542056908 566771991 /nfs/dbraw/zinc/77/19/91/566771991.db2.gz OEQUCWPMNFCUKH-UHFFFAOYSA-N 0 1 375.368 3.186 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000516605782 566772476 /nfs/dbraw/zinc/77/24/76/566772476.db2.gz BVJNEXOXPLAZGK-LLVKDONJSA-N 0 1 382.860 3.094 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NC(=O)N=c2nc(-c3ccsc3)[n-]s2)n[nH]1 ZINC000516620872 566773181 /nfs/dbraw/zinc/77/31/81/566773181.db2.gz PSUAQMFUMHBEJX-BDAKNGLRSA-N 0 1 377.499 3.203 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)N=c2nc(-c3ccsc3)[n-]s2)n[nH]1 ZINC000516620874 566773253 /nfs/dbraw/zinc/77/32/53/566773253.db2.gz PSUAQMFUMHBEJX-IUCAKERBSA-N 0 1 377.499 3.203 10 0 GGAEMN Cc1sccc1CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000469226543 566773504 /nfs/dbraw/zinc/77/35/04/566773504.db2.gz YFKUQJILXHFBNW-UHFFFAOYSA-N 0 1 391.294 3.463 10 0 GGAEMN Cc1sccc1CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000469226543 566773511 /nfs/dbraw/zinc/77/35/11/566773511.db2.gz YFKUQJILXHFBNW-UHFFFAOYSA-N 0 1 391.294 3.463 10 0 GGAEMN CC(C)N(CC(=O)N1CCOC[C@@H]1C1CC1)Cc1cccc(Br)c1 ZINC000677980581 566773594 /nfs/dbraw/zinc/77/35/94/566773594.db2.gz GEHSTSNYPQYJBX-GOSISDBHSA-N 0 1 395.341 3.297 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)CCCCc1cn[nH]n1)CC2 ZINC000469232033 566773924 /nfs/dbraw/zinc/77/39/24/566773924.db2.gz ZCPIEOPWCYBKLR-UHFFFAOYSA-N 0 1 377.286 3.173 10 0 GGAEMN CC(C)N(CC(=O)N1CCOC[C@H]1C1CC1)Cc1ccc(Br)cc1 ZINC000677981250 566774139 /nfs/dbraw/zinc/77/41/39/566774139.db2.gz ZEEVREWQPZHSCH-SFHVURJKSA-N 0 1 395.341 3.297 10 0 GGAEMN CC(C)N(CC(=O)N1CCOC[C@@H]1C1CC1)Cc1ccc(Br)cc1 ZINC000677981249 566774261 /nfs/dbraw/zinc/77/42/61/566774261.db2.gz ZEEVREWQPZHSCH-GOSISDBHSA-N 0 1 395.341 3.297 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)c2[nH]nc3ccc(Br)cc32)n[nH]1 ZINC000489220819 566775683 /nfs/dbraw/zinc/77/56/83/566775683.db2.gz PYJJTICAQKPUCV-RKDXNWHRSA-N 0 1 391.273 3.448 10 0 GGAEMN Cn1ccc(CN2CCC[C@H]2c2ccccc2I)cc1=O ZINC000609614085 566775657 /nfs/dbraw/zinc/77/56/57/566775657.db2.gz XQOXBAJBSMSPKW-INIZCTEOSA-N 0 1 394.256 3.327 10 0 GGAEMN Fc1cccnc1N1CC[C@H](NCc2ncc(Br)cc2Cl)C1 ZINC000631088930 566777762 /nfs/dbraw/zinc/77/77/62/566777762.db2.gz OUDIERSCHXGVBV-NSHDSACASA-N 0 1 385.668 3.400 10 0 GGAEMN CC(C)n1ncnc1CNC1CCN(Cc2ccc(Br)cc2)CC1 ZINC000631089735 566777833 /nfs/dbraw/zinc/77/78/33/566777833.db2.gz MXAQPWNKSIDYFE-UHFFFAOYSA-N 0 1 392.345 3.376 10 0 GGAEMN C[C@H]1C[C@H](N[C@H]2CCCN(Cc3nccn3C)C2=O)c2ccsc2S1 ZINC000542156986 566778486 /nfs/dbraw/zinc/77/84/86/566778486.db2.gz IZPADBVYRHOWPW-QEJZJMRPSA-N 0 1 376.551 3.188 10 0 GGAEMN CC(C)n1ncnc1CNCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000631102588 566779508 /nfs/dbraw/zinc/77/95/08/566779508.db2.gz XWCLKHLJULKWLF-UHFFFAOYSA-N 0 1 377.798 3.485 10 0 GGAEMN CC[C@@H]1COCCN1CCCOc1cccc(I)c1 ZINC000609673699 566779794 /nfs/dbraw/zinc/77/97/94/566779794.db2.gz YEGPTHUDCLNWNB-CQSZACIVSA-N 0 1 375.250 3.171 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000516749468 566780675 /nfs/dbraw/zinc/78/06/75/566780675.db2.gz STUUWVBDDNTMHJ-FPMFFAJLSA-N 0 1 382.302 3.055 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000516749467 566780735 /nfs/dbraw/zinc/78/07/35/566780735.db2.gz STUUWVBDDNTMHJ-BNOWGMLFSA-N 0 1 382.302 3.055 10 0 GGAEMN COc1ccc(NC(=O)[C@@H]2CCCc3[nH]ncc32)c(I)c1 ZINC000562329804 566781884 /nfs/dbraw/zinc/78/18/84/566781884.db2.gz FBTBBXVPFNIPFS-SNVBAGLBSA-N 0 1 397.216 3.082 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@H]2CCCC2(F)F)[C@@H]1c1cccs1 ZINC000451246271 566782340 /nfs/dbraw/zinc/78/23/40/566782340.db2.gz VOJGKDFXVBUAOX-IIAWOOMASA-N 0 1 392.537 3.486 10 0 GGAEMN CC[C@@H]1CN(C)CCN1C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000655143142 566783269 /nfs/dbraw/zinc/78/32/69/566783269.db2.gz NCDAWLHFWPIXNI-HIFRSBDPSA-N 0 1 382.302 3.008 10 0 GGAEMN Cn1nc2c(c1CN[C@@](C)(CO)c1ccc(Br)cc1)CCCC2 ZINC000631134850 566783204 /nfs/dbraw/zinc/78/32/04/566783204.db2.gz YWKPAVISSQLJLE-SFHVURJKSA-N 0 1 378.314 3.059 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@H](C)c2ccc(Br)cc2OC)n[nH]1 ZINC000469339773 566783426 /nfs/dbraw/zinc/78/34/26/566783426.db2.gz NJLWLBMAXCAMEI-ZJUUUORDSA-N 0 1 396.289 3.260 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@H](Cc1ccc(F)cc1)C(N)=O ZINC000469337821 566783463 /nfs/dbraw/zinc/78/34/63/566783463.db2.gz MSTCNOFQKQRWNA-MEDUHNTESA-N 0 1 395.272 3.344 10 0 GGAEMN Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)CCc1nn[nH]n1 ZINC000631130720 566783774 /nfs/dbraw/zinc/78/37/74/566783774.db2.gz YLIWBZIRYPBUPM-VIFPVBQESA-N 0 1 376.873 3.095 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@@H]2[C@@H]3CCC[C@@H]32)cc1 ZINC000562355712 566783886 /nfs/dbraw/zinc/78/38/86/566783886.db2.gz YAHVXXZXRWLMOX-MIFYACCESA-N 0 1 376.503 3.386 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cncc(Br)c2)cc2cccnc21 ZINC000427643375 566784391 /nfs/dbraw/zinc/78/43/91/566784391.db2.gz ZHCDBMOJVBACRP-UHFFFAOYSA-N 0 1 394.250 3.202 10 0 GGAEMN CC(C)[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C1(CO)CC=CC1 ZINC000655180591 566784525 /nfs/dbraw/zinc/78/45/25/566784525.db2.gz PHKZTCQQRVWYII-INIZCTEOSA-N 0 1 392.297 3.409 10 0 GGAEMN COc1ccc([C@H](CO)CNCc2ncc(Br)cc2Cl)cc1 ZINC000631157417 566787244 /nfs/dbraw/zinc/78/72/44/566787244.db2.gz AMVRBDBUDMEMEJ-LBPRGKRZSA-N 0 1 385.689 3.372 10 0 GGAEMN C[C@H](CC(=O)NCc1n[nH]c([C@@H]2CCCO2)n1)c1ccc(Br)cc1 ZINC000655231077 566788510 /nfs/dbraw/zinc/78/85/10/566788510.db2.gz IJTUFIRDHFPNBR-RISCZKNCSA-N 0 1 393.285 3.229 10 0 GGAEMN C[C@@H](CC(=O)NCc1n[nH]c([C@H]2CCCO2)n1)c1ccc(Br)cc1 ZINC000655231079 566788781 /nfs/dbraw/zinc/78/87/81/566788781.db2.gz IJTUFIRDHFPNBR-SMDDNHRTSA-N 0 1 393.285 3.229 10 0 GGAEMN CS(=O)(=O)Nc1cccc(CN[C@H](CCO)c2ccc(Cl)c(F)c2)c1 ZINC000631191550 566789029 /nfs/dbraw/zinc/78/90/29/566789029.db2.gz QVIGEKXQFWSHGU-QGZVFWFLSA-N 0 1 386.876 3.064 10 0 GGAEMN CC(C)(C(=O)NCc1n[nH]c([C@@H]2CCCO2)n1)c1cccc(Br)c1 ZINC000655235590 566789085 /nfs/dbraw/zinc/78/90/85/566789085.db2.gz KAAIPYDXGFGEOX-ZDUSSCGKSA-N 0 1 393.285 3.013 10 0 GGAEMN Clc1cc(CNCc2n[nH]c(C3CCOCC3)n2)ccc1Br ZINC000631214045 566790824 /nfs/dbraw/zinc/79/08/24/566790824.db2.gz SADKWRQAFZPYDW-UHFFFAOYSA-N 0 1 385.693 3.404 10 0 GGAEMN Cc1cc(Br)cc(Cl)c1C(=O)NCc1n[nH]c([C@@H]2CCCO2)n1 ZINC000655244346 566791079 /nfs/dbraw/zinc/79/10/79/566791079.db2.gz SUDRLHGESRGSSM-NSHDSACASA-N 0 1 399.676 3.311 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOc2cccc(Br)c2C1 ZINC000655319167 566793637 /nfs/dbraw/zinc/79/36/37/566793637.db2.gz AYCRCKNKWQHPJV-LLVKDONJSA-N 0 1 376.254 3.013 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000427801168 566800206 /nfs/dbraw/zinc/80/02/06/566800206.db2.gz IMMQDIMBRBUXHZ-GFCCVEGCSA-N 0 1 398.326 3.329 10 0 GGAEMN COc1ccc(F)cc1CNC[C@H](O)COc1ccc(Br)cc1 ZINC000517025860 566801640 /nfs/dbraw/zinc/80/16/40/566801640.db2.gz PCRKPXLPMAQKQW-HNNXBMFYSA-N 0 1 384.245 3.126 10 0 GGAEMN CCN1CCN(CC(=O)Nc2cc(Br)cc(C(F)(F)F)c2)CC1 ZINC000469592578 566802451 /nfs/dbraw/zinc/80/24/51/566802451.db2.gz IFASGPJFPXKUCK-UHFFFAOYSA-N 0 1 394.235 3.044 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccccc1 ZINC000451351232 566802547 /nfs/dbraw/zinc/80/25/47/566802547.db2.gz INDATWUIHHEXOA-ROUUACIJSA-N 0 1 382.888 3.344 10 0 GGAEMN Brc1ccc(CN2CC[C@@H](Nc3ncccn3)C2)c2ncccc12 ZINC000581727268 566802780 /nfs/dbraw/zinc/80/27/80/566802780.db2.gz WFXYEJPTFKNJQJ-CQSZACIVSA-N 0 1 384.281 3.474 10 0 GGAEMN Brc1cccc2ccc(NCc3n[nH]c(C4CCOCC4)n3)nc12 ZINC000631460676 566804898 /nfs/dbraw/zinc/80/48/98/566804898.db2.gz XHRCZYPCMPGXHD-UHFFFAOYSA-N 0 1 388.269 3.043 10 0 GGAEMN C[C@H](CN1CCN(C)CC1)NC(=O)Nc1cc(Cl)ccc1C(F)(F)F ZINC000489720993 566805523 /nfs/dbraw/zinc/80/55/23/566805523.db2.gz ZLSCELQPURTOLH-LLVKDONJSA-N 0 1 378.826 3.116 10 0 GGAEMN Cc1csc(-c2ccc(S(=O)(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)cc2)n1 ZINC000655523362 566808010 /nfs/dbraw/zinc/80/80/10/566808010.db2.gz HMQPAWFQOXSWCJ-GDBMZVCRSA-N 0 1 379.551 3.222 10 0 GGAEMN Cc1cccc2c1OC[C@@H](NC(=O)c1cc(Br)cc3nc[nH]c31)C2 ZINC000427971340 566808267 /nfs/dbraw/zinc/80/82/67/566808267.db2.gz LZTGMPFXKPBVLF-ZDUSSCGKSA-N 0 1 386.249 3.367 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1cc(-n2ccnc2)ccn1 ZINC000489796992 566810258 /nfs/dbraw/zinc/81/02/58/566810258.db2.gz NTLDQJGHYDRLRH-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccccc3Br)o2)C1 ZINC000517241427 566814077 /nfs/dbraw/zinc/81/40/77/566814077.db2.gz NGQRFAFBLPFBEN-VXGBXAGGSA-N 0 1 395.253 3.168 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000610231330 566816360 /nfs/dbraw/zinc/81/63/60/566816360.db2.gz MUJIDZFUHAOVSL-OLZOCXBDSA-N 0 1 392.253 3.400 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)[C@H]1C[C@H]1c1cccc(Br)c1 ZINC000610231250 566816563 /nfs/dbraw/zinc/81/65/63/566816563.db2.gz HEQVJKYZZWVSPS-STQMWFEESA-N 0 1 392.253 3.400 10 0 GGAEMN O=C(COc1c(Cl)cccc1Cl)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000542672704 566817349 /nfs/dbraw/zinc/81/73/49/566817349.db2.gz XIWFLKZTAACGEA-HNNXBMFYSA-N 0 1 377.231 3.396 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000542673962 566817440 /nfs/dbraw/zinc/81/74/40/566817440.db2.gz NSEMHQKWJJMGLO-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1ccc(F)c(Br)c1 ZINC000678771716 566817684 /nfs/dbraw/zinc/81/76/84/566817684.db2.gz YFQIBRDUMLYPBM-DQYPLSBCSA-N 0 1 399.304 3.409 10 0 GGAEMN O[C@]1(C(F)F)CCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000451434872 566817726 /nfs/dbraw/zinc/81/77/26/566817726.db2.gz QLTAPJOMUHATOR-MRXNPFEDSA-N 0 1 384.224 3.108 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1ccc(F)c(Br)c1 ZINC000678771718 566817772 /nfs/dbraw/zinc/81/77/72/566817772.db2.gz YFQIBRDUMLYPBM-JLZZUVOBSA-N 0 1 399.304 3.409 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)NCCN2CCCC[C@H]2C)cc1Cl ZINC000517284454 566817746 /nfs/dbraw/zinc/81/77/46/566817746.db2.gz DBGVJPBERJTZCM-LLVKDONJSA-N 0 1 381.325 3.155 10 0 GGAEMN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)c1ncsc1Br ZINC000581962755 566818128 /nfs/dbraw/zinc/81/81/28/566818128.db2.gz FGBWBMMBTYDRTC-ZDUSSCGKSA-N 0 1 380.311 3.300 10 0 GGAEMN Fc1cc(Br)cc2c1CC[C@@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631695536 566818288 /nfs/dbraw/zinc/81/82/88/566818288.db2.gz HFBIDAQOAWHEAC-HNNXBMFYSA-N 0 1 395.276 3.377 10 0 GGAEMN C[C@H](NCc1n[nH]c(C2CCOCC2)n1)c1ccc(F)cc1Br ZINC000631696863 566818402 /nfs/dbraw/zinc/81/84/02/566818402.db2.gz WBAQFSXMDBEQGO-JTQLQIEISA-N 0 1 383.265 3.451 10 0 GGAEMN Fc1ccc2c(c1Br)CC[C@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631694931 566818539 /nfs/dbraw/zinc/81/85/39/566818539.db2.gz FFVWZWLFZSRDIV-CQSZACIVSA-N 0 1 395.276 3.377 10 0 GGAEMN Brc1ccc2c(c1)[C@@H](NCc1n[nH]c(C3CCOCC3)n1)CC2 ZINC000631695841 566818887 /nfs/dbraw/zinc/81/88/87/566818887.db2.gz MZJSUZDBCCSLJH-HNNXBMFYSA-N 0 1 377.286 3.238 10 0 GGAEMN CCN(Cc1ccoc1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000610292116 566821483 /nfs/dbraw/zinc/82/14/83/566821483.db2.gz QLYRAGBNZPHMON-UHFFFAOYSA-N 0 1 395.200 3.423 10 0 GGAEMN CCOc1ccc(S(=O)(=O)Nc2cccc(OCC(F)(F)F)c2)cn1 ZINC000542730087 566821844 /nfs/dbraw/zinc/82/18/44/566821844.db2.gz ZAMPAHWQUWIEOP-UHFFFAOYSA-N 0 1 376.356 3.222 10 0 GGAEMN Cc1sc([C@@H](C)NC(=O)CCc2nn[nH]n2)nc1-c1ccc(Cl)cc1 ZINC000631744265 566822339 /nfs/dbraw/zinc/82/23/39/566822339.db2.gz AHEGAUVFUXDIIA-SECBINFHSA-N 0 1 376.873 3.095 10 0 GGAEMN C[C@H]1C[C@H](NC(=O)c2c(F)cncc2Br)CN1Cc1ccccc1 ZINC000631768065 566823855 /nfs/dbraw/zinc/82/38/55/566823855.db2.gz ASIXJSOEGDTPCW-JSGCOSHPSA-N 0 1 392.272 3.376 10 0 GGAEMN C[C@@H]1C[C@H](NC(=O)c2c(F)cncc2Br)CN1Cc1ccccc1 ZINC000631768066 566824369 /nfs/dbraw/zinc/82/43/69/566824369.db2.gz ASIXJSOEGDTPCW-OCCSQVGLSA-N 0 1 392.272 3.376 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccccc1OC(F)(F)F ZINC000517414254 566825991 /nfs/dbraw/zinc/82/59/91/566825991.db2.gz MOCHKQKRLQVPRN-BETUJISGSA-N 0 1 380.432 3.126 10 0 GGAEMN Cc1ncc(C(=O)N2CCC[C@@H]2c2ccc(I)cc2)[nH]1 ZINC000610366195 566826649 /nfs/dbraw/zinc/82/66/49/566826649.db2.gz VZIGZDDSOOUPDO-CQSZACIVSA-N 0 1 381.217 3.300 10 0 GGAEMN Brc1ccc2nc(CN[C@@H](c3nnc[nH]3)c3ccccc3)cn2c1 ZINC000428247652 566826858 /nfs/dbraw/zinc/82/68/58/566826858.db2.gz UTFDSYVZYXMIJO-MRXNPFEDSA-N 0 1 383.253 3.094 10 0 GGAEMN COCCN(Cc1ccnc(-c2ccc(Br)cc2)n1)[C@@H]1CCOC1 ZINC000490047094 566827050 /nfs/dbraw/zinc/82/70/50/566827050.db2.gz JFZOQORDDSXGIS-QGZVFWFLSA-N 0 1 392.297 3.143 10 0 GGAEMN CN(C(=O)c1c(F)cncc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000631818267 566828668 /nfs/dbraw/zinc/82/86/68/566828668.db2.gz HFYHEQYRLUDQQH-CQSZACIVSA-N 0 1 392.272 3.330 10 0 GGAEMN COC(=O)c1cc(CN[C@@H](C)c2ccc(Br)cc2OC)cn1C ZINC000582089801 566829749 /nfs/dbraw/zinc/82/97/49/566829749.db2.gz WVTHCPZTLMZMFF-NSHDSACASA-N 0 1 381.270 3.434 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1ccc(Cl)c(F)c1 ZINC000655662578 566829989 /nfs/dbraw/zinc/82/99/89/566829989.db2.gz SWBFECVKSMUDCB-PELKAZGASA-N 0 1 375.771 3.257 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000582115675 566831795 /nfs/dbraw/zinc/83/17/95/566831795.db2.gz NXKQXCBECSBIBG-KKUMJFAQSA-N 0 1 388.327 3.215 10 0 GGAEMN C[C@@H](C(=O)Nc1cc(I)ccc1O)N1[C@H](C)CC[C@@H]1C ZINC000610490755 566836529 /nfs/dbraw/zinc/83/65/29/566836529.db2.gz IEDWKVHYDSWELO-AXFHLTTASA-N 0 1 388.249 3.197 10 0 GGAEMN COC(=O)COc1ccc(CNCc2ccc(Br)cc2OC)cc1 ZINC000428385119 566837855 /nfs/dbraw/zinc/83/78/55/566837855.db2.gz DXLUMVIOWVLDCN-UHFFFAOYSA-N 0 1 394.265 3.299 10 0 GGAEMN COc1ccccc1[C@@H](CO)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000542912278 566837897 /nfs/dbraw/zinc/83/78/97/566837897.db2.gz ISSOXZGCZRSWJT-MLGOLLRUSA-N 0 1 386.275 3.065 10 0 GGAEMN Cc1cc2cc(C(=O)NC3(c4nn[nH]n4)CCCC3)oc2c(Br)c1 ZINC000542951605 566841213 /nfs/dbraw/zinc/84/12/13/566841213.db2.gz GIGSNBYYDPUVBK-UHFFFAOYSA-N 0 1 390.241 3.216 10 0 GGAEMN C[C@H]1C[C@H](NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)CCN1C ZINC000632030405 566842091 /nfs/dbraw/zinc/84/20/91/566842091.db2.gz RLUSNHAEPVNNTJ-CMPLNLGQSA-N 0 1 386.386 3.102 10 0 GGAEMN COCCN1CCC[C@H](NC(=O)c2c(C)cc(Br)cc2Cl)C1 ZINC000679231714 566842564 /nfs/dbraw/zinc/84/25/64/566842564.db2.gz YTZYWMUNPKEIEF-ZDUSSCGKSA-N 0 1 389.721 3.252 10 0 GGAEMN Brc1cccc(N2CC[C@@H](NCc3cc4n(n3)CCCC4)C2)c1 ZINC000655766495 566844555 /nfs/dbraw/zinc/84/45/55/566844555.db2.gz HHKUQNOUJNPNKS-OAHLLOKOSA-N 0 1 375.314 3.350 10 0 GGAEMN Brc1cccc(N2CC[C@H](NCc3cc4n(n3)CCCC4)C2)c1 ZINC000655766494 566844647 /nfs/dbraw/zinc/84/46/47/566844647.db2.gz HHKUQNOUJNPNKS-HNNXBMFYSA-N 0 1 375.314 3.350 10 0 GGAEMN C[C@@H](c1ccccc1)[C@@H](CO)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000679277849 566845715 /nfs/dbraw/zinc/84/57/15/566845715.db2.gz XPMNQZMMRRTAAK-MEDUHNTESA-N 0 1 388.265 3.220 10 0 GGAEMN C[C@@H](Cc1ccsc1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 ZINC000543056868 566848661 /nfs/dbraw/zinc/84/86/61/566848661.db2.gz BAXMVLRFPMVPLF-HNNXBMFYSA-N 0 1 382.526 3.215 10 0 GGAEMN COC(=O)[C@@H]1CCCC[C@@H]1NCc1nnc(-c2ccccc2Br)o1 ZINC000451602269 566848896 /nfs/dbraw/zinc/84/88/96/566848896.db2.gz UZUXNOPHCUQVRZ-OCCSQVGLSA-N 0 1 394.269 3.321 10 0 GGAEMN C[C@@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)s1 ZINC000543085531 566850576 /nfs/dbraw/zinc/85/05/76/566850576.db2.gz QUNYBWMZNDRZQV-VXGBXAGGSA-N 0 1 397.342 3.086 10 0 GGAEMN C[C@H](CN1CCOCC1)C(=O)NCCOc1c(Cl)cc(Cl)cc1Cl ZINC000543094803 566850605 /nfs/dbraw/zinc/85/06/05/566850605.db2.gz MZOSUOGHPUULRT-LLVKDONJSA-N 0 1 395.714 3.110 10 0 GGAEMN CC[C@H](NCc1cn(-c2ccccc2Br)nn1)[C@@H]1CCCCO1 ZINC000655856319 566853354 /nfs/dbraw/zinc/85/33/54/566853354.db2.gz MQUGHLFWSYSARU-RDJZCZTQSA-N 0 1 379.302 3.467 10 0 GGAEMN CC(C)(NS(=O)(=O)c1c(F)cc(F)cc1F)c1cc(C(F)(F)F)on1 ZINC000490453691 566853486 /nfs/dbraw/zinc/85/34/86/566853486.db2.gz OHWKHIVIKYRAHR-UHFFFAOYSA-N 0 1 388.289 3.324 10 0 GGAEMN C[C@@H]([N-]S(=O)(=O)c1onc(C2CC2)c1Cl)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000632197029 566860536 /nfs/dbraw/zinc/86/05/36/566860536.db2.gz KJBKQMXINYFZPE-YPMHNXCESA-N 0 1 387.933 3.137 10 0 GGAEMN CC(C)[C@H](C)NC(=O)C1CCN(C(=O)c2cccc(Br)c2O)CC1 ZINC000518030397 566862105 /nfs/dbraw/zinc/86/21/05/566862105.db2.gz MZGUYOHYHZQDOK-LBPRGKRZSA-N 0 1 397.313 3.168 10 0 GGAEMN O=C(N[C@H]1CCC(F)(F)C1)c1n[nH]c2ccc(I)cc21 ZINC000610790711 566864160 /nfs/dbraw/zinc/86/41/60/566864160.db2.gz CPQOJEMARFHLSS-QMMMGPOBSA-N 0 1 391.159 3.085 10 0 GGAEMN CO[C@@H](CCNC(=O)c1n[nH]c2ccc(Br)cc21)C(F)(F)F ZINC000470330582 566864936 /nfs/dbraw/zinc/86/49/36/566864936.db2.gz NUVRTXQWGHCWPT-JTQLQIEISA-N 0 1 380.164 3.023 10 0 GGAEMN CCC[C@@H](C)[C@H](CO)NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000563219729 566866027 /nfs/dbraw/zinc/86/60/27/566866027.db2.gz WKIORTQYVZCILN-DYVFJYSZSA-N 0 1 382.551 3.100 10 0 GGAEMN COc1cc(Br)c(C[NH2+][C@H](CC(=O)[O-])c2ccncc2)c(OC)c1 ZINC000582498327 566866400 /nfs/dbraw/zinc/86/64/00/566866400.db2.gz OKYPBQLCHUYYPA-OAHLLOKOSA-N 0 1 395.253 3.167 10 0 GGAEMN CC(C)(C)OC(=O)C1(C(=O)Nc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000563244338 566867501 /nfs/dbraw/zinc/86/75/01/566867501.db2.gz WVEBWJWUOQFHEN-UHFFFAOYSA-N 0 1 380.242 3.386 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCC[C@@H](OC(F)F)C1)c1ccc(Cl)cc1 ZINC000679698077 566868018 /nfs/dbraw/zinc/86/80/18/566868018.db2.gz DSVQTGLBGQHCIR-HUUCEWRRSA-N 0 1 375.847 3.356 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1cccc(Br)c1OC(F)F ZINC000563261195 566868954 /nfs/dbraw/zinc/86/89/54/566868954.db2.gz KYACYVBVWCEEQX-YPMHNXCESA-N 0 1 396.272 3.298 10 0 GGAEMN O=C1C[C@H]([C@H]2CCCCN2CC[S@@](=O)c2cc(Cl)ccc2Cl)CN1 ZINC000490613879 566870219 /nfs/dbraw/zinc/87/02/19/566870219.db2.gz ZWZGJJRQZMVZBM-ZITCRZFISA-N 0 1 389.348 3.092 10 0 GGAEMN Cc1ccc(C[N@@H+]2CC[C@H](CN(C)C(=O)c3s[n-]c(=O)c3Cl)C2)s1 ZINC000563264505 566870200 /nfs/dbraw/zinc/87/02/00/566870200.db2.gz JFHFGFJGJRWVPT-LLVKDONJSA-N 0 1 385.942 3.466 10 0 GGAEMN O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1csc(=NC2CC2)[nH]1 ZINC000543314219 566870919 /nfs/dbraw/zinc/87/09/19/566870919.db2.gz AMRLJMXKXZKAOW-LBPRGKRZSA-N 0 1 377.338 3.451 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3cn4ccc(Br)cc4n3)[nH]c21 ZINC000518231175 566871341 /nfs/dbraw/zinc/87/13/41/566871341.db2.gz VWBCRAHROBZJQS-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN O=S(=O)(Nc1cccc(OCCF)c1)c1cc2c(cc1Cl)OCCO2 ZINC000470440973 566872642 /nfs/dbraw/zinc/87/26/42/566872642.db2.gz QFCBTOIVNBYZLU-UHFFFAOYSA-N 0 1 387.816 3.260 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Nc2cc(C)cc(I)c2)n[nH]1 ZINC000490664905 566874245 /nfs/dbraw/zinc/87/42/45/566874245.db2.gz XMZQJMKBNCTXCB-SNVBAGLBSA-N 0 1 398.248 3.384 10 0 GGAEMN Fc1ccc([C@@H](NCCOc2ccc(Br)cc2)c2c[nH]nn2)cc1 ZINC000563319186 566875138 /nfs/dbraw/zinc/87/51/38/566875138.db2.gz ZDRYGZIZMSARFO-QGZVFWFLSA-N 0 1 391.244 3.464 10 0 GGAEMN O=C(NCc1cccc(Br)c1Cl)N[C@H]1CCc2nc[nH]c2C1 ZINC000563341096 566876521 /nfs/dbraw/zinc/87/65/21/566876521.db2.gz VQMUKZROJGTBGL-JTQLQIEISA-N 0 1 383.677 3.182 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@H]1c1ccc(Br)s1 ZINC000582635805 566881300 /nfs/dbraw/zinc/88/13/00/566881300.db2.gz ZBOVGDUXSVSWHB-GFCCVEGCSA-N 0 1 395.388 3.319 10 0 GGAEMN CSc1c[nH]nc1NS(=O)(=O)Cc1cccc(Br)c1C ZINC000656184064 566881342 /nfs/dbraw/zinc/88/13/42/566881342.db2.gz DOPQPWFHBYHKDO-UHFFFAOYSA-N 0 1 376.301 3.144 10 0 GGAEMN C[C@H](c1ccccc1)[C@H](NCc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000428838946 566883158 /nfs/dbraw/zinc/88/31/58/566883158.db2.gz ZFDUTRJKBYEIRF-DIFFPNOSSA-N 0 1 387.281 3.073 10 0 GGAEMN C[C@H](NCc1c(Cl)ccc2cccnc21)c1ccc(S(N)(=O)=O)cc1 ZINC000679934395 566883442 /nfs/dbraw/zinc/88/34/42/566883442.db2.gz OUESXEDHEXIQDL-LBPRGKRZSA-N 0 1 375.881 3.386 10 0 GGAEMN CCN(C1CCN(C)CC1)S(=O)(=O)c1c(Cl)cccc1Br ZINC000632408616 566883621 /nfs/dbraw/zinc/88/36/21/566883621.db2.gz ODHRXTDKJSBXHC-UHFFFAOYSA-N 0 1 395.750 3.207 10 0 GGAEMN CN(C)CCN(Cc1ccsc1)S(=O)(=O)c1onc(C2CC2)c1Cl ZINC000632442214 566884848 /nfs/dbraw/zinc/88/48/48/566884848.db2.gz WRNCHHGHGBVQBH-UHFFFAOYSA-N 0 1 389.930 3.019 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000543483127 566885578 /nfs/dbraw/zinc/88/55/78/566885578.db2.gz IGOADJNFPZBSDI-DOTOQJQBSA-N 0 1 397.357 3.136 10 0 GGAEMN COc1c(Br)cccc1CNC[C@@H]1CS(=O)(=O)c2ccccc21 ZINC000563506414 566889083 /nfs/dbraw/zinc/88/90/83/566889083.db2.gz OJSDYEPQHBCSFV-CYBMUJFWSA-N 0 1 396.306 3.118 10 0 GGAEMN CCOC(=O)[C@@H](Cc1cc(Cl)cc(Cl)c1)NC(=O)c1[nH]nc(C)c1C ZINC000470658635 566892644 /nfs/dbraw/zinc/89/26/44/566892644.db2.gz JSERYAHCOCXWSY-CQSZACIVSA-N 0 1 384.263 3.238 10 0 GGAEMN CC(C)(C)C1=CCN(CCNC(=O)c2c(F)cncc2Br)CC1 ZINC000632544457 566893201 /nfs/dbraw/zinc/89/32/01/566893201.db2.gz GVKQDQKGFHUIJF-UHFFFAOYSA-N 0 1 384.293 3.391 10 0 GGAEMN C[C@H]1C[C@@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000491095152 566894137 /nfs/dbraw/zinc/89/41/37/566894137.db2.gz XPNZVOGNDLICSV-GJZGRUSLSA-N 0 1 381.314 3.022 10 0 GGAEMN C[C@@H]1C[C@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000491095154 566894174 /nfs/dbraw/zinc/89/41/74/566894174.db2.gz XPNZVOGNDLICSV-HUUCEWRRSA-N 0 1 381.314 3.022 10 0 GGAEMN COc1ccc(Br)c(CN(C)C(=O)N[C@@H](C)Cc2cc(C)[nH]n2)c1 ZINC000428986743 566894457 /nfs/dbraw/zinc/89/44/57/566894457.db2.gz PQGBKPXCQQVBGS-NSHDSACASA-N 0 1 395.301 3.262 10 0 GGAEMN NC(=O)c1cccc(CSCc2nc3ccc(Br)cc3[nH]2)n1 ZINC000543641000 566897501 /nfs/dbraw/zinc/89/75/01/566897501.db2.gz JAEQMRFLLNXYPR-UHFFFAOYSA-N 0 1 377.267 3.253 10 0 GGAEMN CN(C)[C@H](CN1C(=O)N[C@H](Cc2cccc(Cl)c2)C1=O)c1cccs1 ZINC000518742397 566901093 /nfs/dbraw/zinc/90/10/93/566901093.db2.gz UMEZNCYGSKLPSS-HUUCEWRRSA-N 0 1 377.897 3.167 10 0 GGAEMN N[C@H](c1cn(CCOCC2CCCC2)nn1)c1ccc(Br)cc1 ZINC000656466114 566901906 /nfs/dbraw/zinc/90/19/06/566901906.db2.gz VTEMDCFLFUWMAQ-KRWDZBQOSA-N 0 1 379.302 3.296 10 0 GGAEMN CSc1ncc(Cl)c(C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)n1 ZINC000582884934 566902078 /nfs/dbraw/zinc/90/20/78/566902078.db2.gz ACJGDTVJFIYJOQ-ZDUSSCGKSA-N 0 1 378.885 3.489 10 0 GGAEMN O[C@H]([C@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)C(F)(F)F ZINC000451896652 566902325 /nfs/dbraw/zinc/90/23/25/566902325.db2.gz VHJNXOLTWOQMNQ-BLLLJJGKSA-N 0 1 379.806 3.289 10 0 GGAEMN O[C@@H]([C@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000451895701 566902558 /nfs/dbraw/zinc/90/25/58/566902558.db2.gz UFHDFZCCURJFSF-SDBXPKJASA-N 0 1 378.192 3.071 10 0 GGAEMN O=C1C[C@@H](N2CCC[C@@H](CCF)C2)C(=O)N1c1ccc(Br)cc1 ZINC000656477139 566903005 /nfs/dbraw/zinc/90/30/05/566903005.db2.gz HCUSTNXHQKTBHM-SWLSCSKDSA-N 0 1 383.261 3.153 10 0 GGAEMN N[C@@H](c1cn(CCOCC2CCCC2)nn1)c1ccc(Br)cc1 ZINC000656466115 566903049 /nfs/dbraw/zinc/90/30/49/566903049.db2.gz VTEMDCFLFUWMAQ-QGZVFWFLSA-N 0 1 379.302 3.296 10 0 GGAEMN C[C@](N)(C(=O)NC[C@@H]1CC12CCSCC2)c1ccc(Br)cc1 ZINC000582903637 566903367 /nfs/dbraw/zinc/90/33/67/566903367.db2.gz LKTCSYNBXRCFLK-XJKSGUPXSA-N 0 1 383.355 3.273 10 0 GGAEMN CCOC(=O)C[C@@H](O)CN1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000611238010 566904512 /nfs/dbraw/zinc/90/45/12/566904512.db2.gz WXYZFGDIJNXGEB-OCCSQVGLSA-N 0 1 376.280 3.151 10 0 GGAEMN CCOc1cc(CN[C@@]2(CO)CCc3ccccc32)cc(Br)c1O ZINC000656509573 566906259 /nfs/dbraw/zinc/90/62/59/566906259.db2.gz JSJHLKHMFIJMNY-LJQANCHMSA-N 0 1 392.293 3.477 10 0 GGAEMN O=C1[C@H](N2CCC[C@]3(CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000451912885 566906751 /nfs/dbraw/zinc/90/67/51/566906751.db2.gz VFAKHUCUZWIEDS-AEFFLSMTSA-N 0 1 379.298 3.057 10 0 GGAEMN CC(C)(CNC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccccc1Br ZINC000518850430 566906903 /nfs/dbraw/zinc/90/69/03/566906903.db2.gz FQKQZOFQXCNTBM-GFCCVEGCSA-N 0 1 391.313 3.307 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)CN(C)[C@@H]1CCSC1 ZINC000470827233 566907457 /nfs/dbraw/zinc/90/74/57/566907457.db2.gz MLYLCIQOUOCQLM-WCQYABFASA-N 0 1 387.343 3.072 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)CN(C)[C@H]1CCSC1 ZINC000470827234 566907682 /nfs/dbraw/zinc/90/76/82/566907682.db2.gz MLYLCIQOUOCQLM-YPMHNXCESA-N 0 1 387.343 3.072 10 0 GGAEMN Cc1cccc(S(=O)(=O)Nc2cc(I)ccc2O)c1 ZINC000611291006 566907809 /nfs/dbraw/zinc/90/78/09/566907809.db2.gz IWMVSQWFRRUYPL-UHFFFAOYSA-N 0 1 389.214 3.106 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cccc(Br)c2Cl)CCN1C ZINC000563676559 566907889 /nfs/dbraw/zinc/90/78/89/566907889.db2.gz IQXGRQFSQSFXBP-GHMZBOCLSA-N 0 1 395.750 3.206 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)CN(C)[C@H]1CCSC1 ZINC000470827231 566908213 /nfs/dbraw/zinc/90/82/13/566908213.db2.gz MLYLCIQOUOCQLM-AAEUAGOBSA-N 0 1 387.343 3.072 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@@H](C)[C@H]1OCCc2sccc21 ZINC000429167371 566912629 /nfs/dbraw/zinc/91/26/29/566912629.db2.gz LGNPRFQZZAKALB-BLLLJJGKSA-N 0 1 378.460 3.387 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@H](C)[C@@H]1OCCc2sccc21 ZINC000429167376 566913124 /nfs/dbraw/zinc/91/31/24/566913124.db2.gz LGNPRFQZZAKALB-WBMJQRKESA-N 0 1 378.460 3.387 10 0 GGAEMN Cn1c(CNC[C@H](O)COc2c(Cl)cccc2Cl)nc2ccccc21 ZINC000563732988 566913273 /nfs/dbraw/zinc/91/32/73/566913273.db2.gz UYMUECOLGVOULQ-LBPRGKRZSA-N 0 1 380.275 3.410 10 0 GGAEMN O=S(=O)(N[C@@H]1COc2ccc(F)cc2C1)c1c(Cl)ccc(F)c1F ZINC000563766439 566914065 /nfs/dbraw/zinc/91/40/65/566914065.db2.gz MJCMADAVDVPHQQ-JTQLQIEISA-N 0 1 377.771 3.039 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCN(C2CCOCC2)C[C@H]1C ZINC000632781399 566914811 /nfs/dbraw/zinc/91/48/11/566914811.db2.gz YEKVLOQAZVDCOQ-LLVKDONJSA-N 0 1 387.343 3.144 10 0 GGAEMN C[N@@H+]1CC[C@@H](N=c2[n-]nc(-c3ccon3)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000583042777 566916164 /nfs/dbraw/zinc/91/61/64/566916164.db2.gz ZZEMGYHMVULUCS-OCCSQVGLSA-N 0 1 379.848 3.265 10 0 GGAEMN C[N@H+]1CC[C@@H](N=c2[n-]nc(-c3ccon3)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000583042777 566916170 /nfs/dbraw/zinc/91/61/70/566916170.db2.gz ZZEMGYHMVULUCS-OCCSQVGLSA-N 0 1 379.848 3.265 10 0 GGAEMN C[N@@H+]1CC[C@@H](N=c2[n-]nc(-c3ccon3)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000583042778 566916362 /nfs/dbraw/zinc/91/63/62/566916362.db2.gz ZZEMGYHMVULUCS-TZMCWYRMSA-N 0 1 379.848 3.265 10 0 GGAEMN C[N@H+]1CC[C@@H](N=c2[n-]nc(-c3ccon3)s2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000583042778 566916369 /nfs/dbraw/zinc/91/63/69/566916369.db2.gz ZZEMGYHMVULUCS-TZMCWYRMSA-N 0 1 379.848 3.265 10 0 GGAEMN CCc1nc([C@@H](C)S(=O)(=O)c2ccc(Br)c(Cl)c2)n[nH]1 ZINC000656556907 566917434 /nfs/dbraw/zinc/91/74/34/566917434.db2.gz VAFCPUIVJYYUQX-SSDOTTSWSA-N 0 1 378.679 3.318 10 0 GGAEMN O=C([O-])C[C@@H]([NH2+]Cc1cn(C2CCC2)nn1)c1cccc(Br)c1 ZINC000656564993 566917459 /nfs/dbraw/zinc/91/74/59/566917459.db2.gz BYVGUXFKRYFHPH-OAHLLOKOSA-N 0 1 379.258 3.071 10 0 GGAEMN C[C@@H](C(=O)[O-])[C@@H]([NH2+]Cc1cn(C2CCC2)nn1)c1ccc(Br)cc1 ZINC000656567583 566917631 /nfs/dbraw/zinc/91/76/31/566917631.db2.gz VXUYJBFTDYXKQE-BDJLRTHQSA-N 0 1 393.285 3.317 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)[C@@H]1Cc2cc(Br)ccc2O1 ZINC000470958311 566918061 /nfs/dbraw/zinc/91/80/61/566918061.db2.gz BSMXHTGPINGWSX-HNNXBMFYSA-N 0 1 385.221 3.176 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCC[C@@H](N2CCOCC2)CC1 ZINC000632877226 566920391 /nfs/dbraw/zinc/92/03/91/566920391.db2.gz DLTJZALBPPXBSZ-CYBMUJFWSA-N 0 1 387.343 3.146 10 0 GGAEMN CCOC(=O)C1CCC(O)(CN2CCc3cc(Br)ccc3C2)CC1 ZINC000429286069 566920817 /nfs/dbraw/zinc/92/08/17/566920817.db2.gz QHLRNTMERLYRPO-UHFFFAOYSA-N 0 1 396.325 3.292 10 0 GGAEMN CN(C)c1ccncc1C(=O)NCc1cc2cccnc2cc1Br ZINC000680590168 566921176 /nfs/dbraw/zinc/92/11/76/566921176.db2.gz LNVFFQLRHJGMNQ-UHFFFAOYSA-N 0 1 385.265 3.388 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1cc2cc(C)cc(Br)c2o1 ZINC000543912033 566922033 /nfs/dbraw/zinc/92/20/33/566922033.db2.gz CMTZUJVFNVPWLZ-CQSZACIVSA-N 0 1 395.297 3.344 10 0 GGAEMN O=C(CN[C@H](c1cccs1)C1(CO)CCC1)Nc1nc2c(s1)CCC2 ZINC000452063571 566929542 /nfs/dbraw/zinc/92/95/42/566929542.db2.gz XBSYAQLWHNGDMV-MRXNPFEDSA-N 0 1 377.535 3.125 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1ccc2c(c1)CCOC2 ZINC000656635839 566929672 /nfs/dbraw/zinc/92/96/72/566929672.db2.gz JXBPYYZCLSSJSK-UHFFFAOYSA-N 0 1 398.278 3.331 10 0 GGAEMN CN(C)Cc1cc(-c2noc(CCn3cc(Br)cn3)n2)ccc1F ZINC000680753268 566929771 /nfs/dbraw/zinc/92/97/71/566929771.db2.gz HHILDRAXFZOZGB-UHFFFAOYSA-N 0 1 394.248 3.139 10 0 GGAEMN COc1cc(OC)c(S(=O)(=O)Nc2ccc3c(c2)CCOC3)cc1Cl ZINC000656647700 566930207 /nfs/dbraw/zinc/93/02/07/566930207.db2.gz YINGNQBWXMFVDE-UHFFFAOYSA-N 0 1 383.853 3.231 10 0 GGAEMN O=C(Nc1ccc(Br)c(C2CC2)n1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000519325312 566932701 /nfs/dbraw/zinc/93/27/01/566932701.db2.gz AKYLBSGCPLGATP-SNVBAGLBSA-N 0 1 376.258 3.124 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CCOc2cccc(Cl)c2Cl)C1 ZINC000492436353 566933163 /nfs/dbraw/zinc/93/31/63/566933163.db2.gz PMXGRBXPRIKSNU-AWEZNQCLSA-N 0 1 389.323 3.235 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CC=C(c3cccc(Br)c3)CC2)C1 ZINC000680814627 566933239 /nfs/dbraw/zinc/93/32/39/566933239.db2.gz PYTJYVHJESGDBM-QGZVFWFLSA-N 0 1 378.314 3.342 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CCOc2cccc(Cl)c2Cl)C1 ZINC000492436358 566933796 /nfs/dbraw/zinc/93/37/96/566933796.db2.gz PMXGRBXPRIKSNU-CQSZACIVSA-N 0 1 389.323 3.235 10 0 GGAEMN NC(=O)[C@@H](Cc1ccccc1)N[C@H]1CSCc2ccc(Br)cc21 ZINC000656685106 566933928 /nfs/dbraw/zinc/93/39/28/566933928.db2.gz KGRRHHQLILEHKK-SJORKVTESA-N 0 1 391.334 3.423 10 0 GGAEMN NC(=O)[C@H](NC[C@@H]1C[C@H](c2ccccc2)CO1)c1cccc(Br)c1 ZINC000656685380 566933974 /nfs/dbraw/zinc/93/39/74/566933974.db2.gz PFRVWAFCGBGYBQ-RYQLBKOJSA-N 0 1 389.293 3.138 10 0 GGAEMN NC(=O)[C@H](NC[C@@H]1C[C@H](c2ccccc2)CO1)c1ccc(Br)cc1 ZINC000656685610 566934195 /nfs/dbraw/zinc/93/41/95/566934195.db2.gz VTWPYLLUKMEGTN-RYQLBKOJSA-N 0 1 389.293 3.138 10 0 GGAEMN C[C@@H]1CN(CCO)CCN1Cc1csc(-c2ccc(Br)cc2)n1 ZINC000452110665 566936907 /nfs/dbraw/zinc/93/69/07/566936907.db2.gz AGPMHJMUKHVLMD-CYBMUJFWSA-N 0 1 396.354 3.071 10 0 GGAEMN O=C(Nc1cc(Br)ccc1NC1CC1)[C@@H]1CCc2[nH]cnc2C1 ZINC000611752204 566936889 /nfs/dbraw/zinc/93/68/89/566936889.db2.gz VRYMNYQSEZMKTC-SNVBAGLBSA-N 0 1 375.270 3.490 10 0 GGAEMN CC(C)N1CC[C@H](N(C)S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000452105285 566937543 /nfs/dbraw/zinc/93/75/43/566937543.db2.gz NPFRFGQXPKRCDY-NSHDSACASA-N 0 1 395.750 3.206 10 0 GGAEMN CC(=O)Nc1ccc(S(=O)(=O)Nc2cncc3c2CCCC3)cc1Cl ZINC000656736714 566942215 /nfs/dbraw/zinc/94/22/15/566942215.db2.gz OYEWCEJWVYWJPB-UHFFFAOYSA-N 0 1 379.869 3.373 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NCc1cc(Br)ccn1)C2 ZINC000452144464 566943167 /nfs/dbraw/zinc/94/31/67/566943167.db2.gz GUZQIYBLYUOBPB-LLVKDONJSA-N 0 1 377.286 3.112 10 0 GGAEMN COc1cc(Br)ccc1CCCN1CC[C@](O)(C(F)(F)F)C1 ZINC000544146735 566943522 /nfs/dbraw/zinc/94/35/22/566943522.db2.gz UBRPKFKRBNADQW-CQSZACIVSA-N 0 1 382.220 3.389 10 0 GGAEMN CCC[C@@H](NC(=O)c1ccc2scc(Br)c2c1)c1nn[nH]n1 ZINC000519521834 566944376 /nfs/dbraw/zinc/94/43/76/566944376.db2.gz JNUGQZBSVYDUAT-LLVKDONJSA-N 0 1 380.271 3.448 10 0 GGAEMN Cc1ccc(Br)c([N-]S(=O)(=O)c2ccc(C[NH+](C)C)cc2)n1 ZINC000656739245 566944519 /nfs/dbraw/zinc/94/45/19/566944519.db2.gz DRZBCYXZNMDGRQ-UHFFFAOYSA-N 0 1 384.299 3.015 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1cc(C)ccc1C(F)(F)F)C1CCOCC1 ZINC000656742176 566946047 /nfs/dbraw/zinc/94/60/47/566946047.db2.gz HSKYMNRLOBAOCB-OAHLLOKOSA-N 0 1 381.416 3.197 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](CCOc2cccc(Br)c2)C1 ZINC000656758646 566948096 /nfs/dbraw/zinc/94/80/96/566948096.db2.gz KADMNPDSFYFEAY-MNOVXSKESA-N 0 1 396.203 3.413 10 0 GGAEMN CS(=O)(=O)N1CC[C@@H](CN2CCC(c3c(Cl)cccc3Cl)CC2)C1 ZINC000564151482 566950553 /nfs/dbraw/zinc/95/05/53/566950553.db2.gz GWLKHYKJLOIJMF-ZDUSSCGKSA-N 0 1 391.364 3.454 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc(C(F)(F)F)ccc1Br ZINC000493575591 566951184 /nfs/dbraw/zinc/95/11/84/566951184.db2.gz CPIAXJMDUARGSG-VIFPVBQESA-N 0 1 388.187 3.478 10 0 GGAEMN CS(=O)(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccc(Cl)cc2)c1 ZINC000612056003 566951369 /nfs/dbraw/zinc/95/13/69/566951369.db2.gz DEAZTEYLDMUSRW-UHFFFAOYSA-N 0 1 395.289 3.166 10 0 GGAEMN Cc1nc(C(C)C)sc1[C@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564209726 566954642 /nfs/dbraw/zinc/95/46/42/566954642.db2.gz DMYDOEMRQZKBKT-GXTWGEPZSA-N 0 1 380.535 3.460 10 0 GGAEMN Cn1c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(=O)[O-])nc2ccc(Br)cc21 ZINC000519648448 566955416 /nfs/dbraw/zinc/95/54/16/566955416.db2.gz WGLRUAYGPPOEDG-IETSOEAISA-N 0 1 378.270 3.021 10 0 GGAEMN COc1ccc(CN2CCC[C@H](C(=O)N3CCCC3)C2)c(Br)c1 ZINC000583526296 566959318 /nfs/dbraw/zinc/95/93/18/566959318.db2.gz FPPAXDGXQZIMSK-HNNXBMFYSA-N 0 1 381.314 3.292 10 0 GGAEMN CN(CCc1ccncc1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000544390190 566959880 /nfs/dbraw/zinc/95/98/80/566959880.db2.gz NUPHQGHWISQDJF-UHFFFAOYSA-N 0 1 386.249 3.000 10 0 GGAEMN O=S(=O)(NC1CCN(C2CC2)CC1)c1cc(Cl)cc(Br)c1 ZINC000656869448 566960856 /nfs/dbraw/zinc/96/08/56/566960856.db2.gz QWWJABGVSSSZSB-UHFFFAOYSA-N 0 1 393.734 3.008 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000656873784 566962643 /nfs/dbraw/zinc/96/26/43/566962643.db2.gz MZERRBOUMYBLTM-ZBFHGGJFSA-N 0 1 378.460 3.159 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccc(Cl)cc2-n2cccn2)ccc1F ZINC000471581269 566962930 /nfs/dbraw/zinc/96/29/30/566962930.db2.gz NUTQQGRLZDXLCZ-UHFFFAOYSA-N 0 1 381.816 3.474 10 0 GGAEMN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000612303493 566963295 /nfs/dbraw/zinc/96/32/95/566963295.db2.gz HUUZAQMKFISLPO-XPUUQOCRSA-N 0 1 395.194 3.218 10 0 GGAEMN CC[C@@H](COCC(F)(F)F)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000452334613 566964802 /nfs/dbraw/zinc/96/48/02/566964802.db2.gz IOZWRARIMUTWPH-VIFPVBQESA-N 0 1 394.191 3.413 10 0 GGAEMN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](CO)c2ccsc2)cc1 ZINC000471617175 566966138 /nfs/dbraw/zinc/96/61/38/566966138.db2.gz GWTSWSUZBQADLU-KBXCAEBGSA-N 0 1 382.551 3.163 10 0 GGAEMN O=C(NC[C@@H]1CCCN1CCCO)c1sc2ccccc2c1Br ZINC000452360330 566968307 /nfs/dbraw/zinc/96/83/07/566968307.db2.gz INICXFCOORURCP-LBPRGKRZSA-N 0 1 397.338 3.240 10 0 GGAEMN Cc1ccc(Br)c(C(=O)N2CCc3nc[nH]c3C23CCOCC3)c1 ZINC000633526516 566968585 /nfs/dbraw/zinc/96/85/85/566968585.db2.gz SDAQWYQHEMBWMF-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN Cc1cccc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)c1Br ZINC000633527581 566968671 /nfs/dbraw/zinc/96/86/71/566968671.db2.gz YSCIRDDSILEKNX-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN Cc1sc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)cc1Br ZINC000633528594 566968948 /nfs/dbraw/zinc/96/89/48/566968948.db2.gz ZMESEUNIZMJDAI-UHFFFAOYSA-N 0 1 396.310 3.246 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(F)c(F)cc1Br ZINC000544580642 566969334 /nfs/dbraw/zinc/96/93/34/566969334.db2.gz CENQNZXSVYQDIR-CQSZACIVSA-N 0 1 393.191 3.365 10 0 GGAEMN Cc1cc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)ccc1Br ZINC000633527078 566969517 /nfs/dbraw/zinc/96/95/17/566969517.db2.gz GVWAFCJWAWYGFM-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633528415 566969642 /nfs/dbraw/zinc/96/96/42/566969642.db2.gz ISCMQGLUAVTSQK-UHFFFAOYSA-N 0 1 396.310 3.246 10 0 GGAEMN O=C(c1n[nH]cc1C(F)(F)F)N1CCO[C@H](c2c(F)cccc2Cl)C1 ZINC000633564056 566970546 /nfs/dbraw/zinc/97/05/46/566970546.db2.gz LKBZEGCPXUXXFJ-NSHDSACASA-N 0 1 377.725 3.435 10 0 GGAEMN CC(C)(Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000583667097 566970605 /nfs/dbraw/zinc/97/06/05/566970605.db2.gz KHMUAJFAGGBAPG-CQSZACIVSA-N 0 1 391.313 3.350 10 0 GGAEMN CCS(=O)(=O)c1c(Cl)cccc1CNc1cnn(-c2ccncc2)c1 ZINC000681366779 566970647 /nfs/dbraw/zinc/97/06/47/566970647.db2.gz DKKJVMRSSOVRIN-UHFFFAOYSA-N 0 1 376.869 3.326 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@H](C(F)(F)F)O1 ZINC000681405284 566973438 /nfs/dbraw/zinc/97/34/38/566973438.db2.gz WRWAFDHBUCFTCZ-PRHODGIISA-N 0 1 378.192 3.477 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)cc(Br)c2)CCN1C ZINC000656915670 566973368 /nfs/dbraw/zinc/97/33/68/566973368.db2.gz NLWWFWHKAKBJTJ-GXFFZTMASA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)cc(Br)c2)CCN1C ZINC000656915672 566973592 /nfs/dbraw/zinc/97/35/92/566973592.db2.gz NLWWFWHKAKBJTJ-ZWNOBZJWSA-N 0 1 395.750 3.206 10 0 GGAEMN CC(C)[C@H](NCc1nc2ccc(Br)cc2[nH]1)C(=O)N1CCCC1 ZINC000681409440 566973874 /nfs/dbraw/zinc/97/38/74/566973874.db2.gz RUSYMYXDNYGQJT-INIZCTEOSA-N 0 1 379.302 3.062 10 0 GGAEMN CCC(CC)C(=O)N1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000681401457 566974504 /nfs/dbraw/zinc/97/45/04/566974504.db2.gz VILVSJSAHGPTKF-UHFFFAOYSA-N 0 1 393.329 3.406 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N1CC[C@H](N(C)Cc2ccccc2)C1 ZINC000656921276 566975185 /nfs/dbraw/zinc/97/51/85/566975185.db2.gz MALFMWMAMCWIJT-HOCLYGCPSA-N 0 1 378.460 3.111 10 0 GGAEMN CC(C)N1C(=O)C[C@H](NC[C@@H](O)C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000494237382 566975771 /nfs/dbraw/zinc/97/57/71/566975771.db2.gz KMPNIPAXWHFKNR-GUTXKFCHSA-N 0 1 382.785 3.042 10 0 GGAEMN Cc1cc(I)cc(NC(=O)N[C@@H]2CCc3nc[nH]c3C2)c1 ZINC000583722546 566976731 /nfs/dbraw/zinc/97/67/31/566976731.db2.gz CWKJJCGNWHVTOC-LLVKDONJSA-N 0 1 396.232 3.002 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000612515619 566977525 /nfs/dbraw/zinc/97/75/25/566977525.db2.gz LYGHHBIGWQICKC-CMPLNLGQSA-N 0 1 380.261 3.164 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000656936235 566977701 /nfs/dbraw/zinc/97/77/01/566977701.db2.gz XRJHXPPAJHGFHV-ZBFHGGJFSA-N 0 1 378.460 3.111 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000656933406 566978560 /nfs/dbraw/zinc/97/85/60/566978560.db2.gz OFYUZVUGDIPSAC-IJEWVQPXSA-N 0 1 378.460 3.157 10 0 GGAEMN COc1ccc(CCC(=O)N[C@H]2CCCc3cn[nH]c32)c(Br)c1 ZINC000612533495 566980285 /nfs/dbraw/zinc/98/02/85/566980285.db2.gz UNMHNAILAGZQBK-HNNXBMFYSA-N 0 1 378.270 3.307 10 0 GGAEMN C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)[C@@H]1CCN(S(C)(=O)=O)C1 ZINC000430100308 566981096 /nfs/dbraw/zinc/98/10/96/566981096.db2.gz ASLQCIZPZSNBIW-LRFDDAOPSA-N 0 1 376.444 3.074 10 0 GGAEMN C[N@H+]1CC[C@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@H]1c1ccccc1 ZINC000656945205 566981444 /nfs/dbraw/zinc/98/14/44/566981444.db2.gz LZARZFVAMAAMFU-ZWKOTPCHSA-N 0 1 382.888 3.344 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@H]1c1ccccc1 ZINC000656945205 566981451 /nfs/dbraw/zinc/98/14/51/566981451.db2.gz LZARZFVAMAAMFU-ZWKOTPCHSA-N 0 1 382.888 3.344 10 0 GGAEMN COc1ccc(OCCN(CCO)Cc2cc(Br)cs2)cc1 ZINC000494284606 566982773 /nfs/dbraw/zinc/98/27/73/566982773.db2.gz HFOFSVUHQRDXRZ-UHFFFAOYSA-N 0 1 386.311 3.393 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@@H](CO)Cc1ccccc1Br ZINC000430113702 566983143 /nfs/dbraw/zinc/98/31/43/566983143.db2.gz NKSSTQINZXXPPG-ZDUSSCGKSA-N 0 1 394.313 3.185 10 0 GGAEMN OCCC1(CNCc2c(Br)cncc2Br)CCC1 ZINC000583784092 566983269 /nfs/dbraw/zinc/98/32/69/566983269.db2.gz MXRSUHWCPLFNPG-UHFFFAOYSA-N 0 1 378.108 3.249 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2cc(Br)cc(N3CCCC3)c2)n[nH]1 ZINC000612601560 566983525 /nfs/dbraw/zinc/98/35/25/566983525.db2.gz QUVBQVKTUSWFKG-LBPRGKRZSA-N 0 1 391.313 3.442 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000656960922 566984870 /nfs/dbraw/zinc/98/48/70/566984870.db2.gz QJZNKSHKXZRLOF-IIAWOOMASA-N 0 1 378.460 3.015 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N(CCCO)Cc1ccc(Cl)c(Cl)c1 ZINC000612623446 566985653 /nfs/dbraw/zinc/98/56/53/566985653.db2.gz KWKKHNMODGHVNV-ZDUSSCGKSA-N 0 1 382.291 3.233 10 0 GGAEMN CC(C)[C@@H](CC(F)(F)F)NS(=O)(=O)c1ncccc1Br ZINC000656968542 566986187 /nfs/dbraw/zinc/98/61/87/566986187.db2.gz UWKTXOISIBBVBO-SECBINFHSA-N 0 1 375.210 3.099 10 0 GGAEMN CC[NH+]1CCN(c2cccc([N-]S(=O)(=O)c3cc(C)sc3C)c2)CC1 ZINC000471925712 566986882 /nfs/dbraw/zinc/98/68/82/566986882.db2.gz VIKUBKPENKFIEH-UHFFFAOYSA-N 0 1 379.551 3.308 10 0 GGAEMN C[C@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@@H](c1ccccc1)N(C)C ZINC000583831338 566987210 /nfs/dbraw/zinc/98/72/10/566987210.db2.gz LYFAXXHUZNLUAN-GUYCJALGSA-N 0 1 389.293 3.439 10 0 GGAEMN CC(C)Oc1cc(Br)cc(C(=O)N(C)[C@@H]2CN3CCC2CC3)c1 ZINC000471943449 566988759 /nfs/dbraw/zinc/98/87/59/566988759.db2.gz HNLWQBUGICCQGM-QGZVFWFLSA-N 0 1 381.314 3.403 10 0 GGAEMN CCCSc1nc(=NC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)s[n-]1 ZINC000471944074 566989150 /nfs/dbraw/zinc/98/91/50/566989150.db2.gz PYBREBMLNAYZBP-KGLIPLIRSA-N 0 1 377.539 3.029 10 0 GGAEMN CC(C)Oc1cc(Br)cc(C(=O)N(C)[C@H]2CN3CCC2CC3)c1 ZINC000471943448 566989290 /nfs/dbraw/zinc/98/92/90/566989290.db2.gz HNLWQBUGICCQGM-KRWDZBQOSA-N 0 1 381.314 3.403 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(OC)cc2Br)[C@@H]1n1cccn1 ZINC000564588299 566990452 /nfs/dbraw/zinc/99/04/52/566990452.db2.gz BLNMJEIYIGXPIN-ZACQAIPSSA-N 0 1 380.286 3.163 10 0 GGAEMN NC(=O)[C@@H](NC[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(Br)cc1 ZINC000564608460 566991928 /nfs/dbraw/zinc/99/19/28/566991928.db2.gz MJUFZZRLSAROTC-KURKYZTESA-N 0 1 389.293 3.485 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000656992302 566992670 /nfs/dbraw/zinc/99/26/70/566992670.db2.gz BHXMEUHQVXEQKJ-IIAWOOMASA-N 0 1 378.460 3.157 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C ZINC000656992295 566992858 /nfs/dbraw/zinc/99/28/58/566992858.db2.gz BHXMEUHQVXEQKJ-FMKPAKJESA-N 0 1 378.460 3.157 10 0 GGAEMN CC[C@H](NCC(=O)N1CCOC[C@@H]1C1CC1)c1cc(F)cc(Br)c1 ZINC000681596386 566992929 /nfs/dbraw/zinc/99/29/29/566992929.db2.gz KCOZCBSMWOIBQT-DLBZAZTESA-N 0 1 399.304 3.266 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc3nc(C)sc3c2)c1 ZINC000494362796 566993350 /nfs/dbraw/zinc/99/33/50/566993350.db2.gz BOKYWVQTQOJIEB-GFCCVEGCSA-N 0 1 375.519 3.364 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCc3c(F)ccc(Br)c3C2)cn1 ZINC000452586426 566993586 /nfs/dbraw/zinc/99/35/86/566993586.db2.gz KUKUYQZFKSWXKL-UHFFFAOYSA-N 0 1 392.272 3.243 10 0 GGAEMN CN(Cc1ccc(F)cc1Br)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000583904968 566994711 /nfs/dbraw/zinc/99/47/11/566994711.db2.gz XFSFTFCYIICTCJ-GFCCVEGCSA-N 0 1 381.249 3.010 10 0 GGAEMN COCCN(Cc1ccccn1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000520338492 566998143 /nfs/dbraw/zinc/99/81/43/566998143.db2.gz ICTLYBXRBAOGII-UHFFFAOYSA-N 0 1 389.253 3.009 10 0 GGAEMN CC[C@@H]1Cc2c(Br)cccc2CN1C[C@H](O)COC[C@@H]1CCCO1 ZINC000583974089 566998889 /nfs/dbraw/zinc/99/88/89/566998889.db2.gz GYDUTPCNIJUAJX-IKGGRYGDSA-N 0 1 398.341 3.142 10 0 GGAEMN COc1cc(CNCc2ccc(Br)cc2OC)cc2c1OCO2 ZINC000494409863 566999068 /nfs/dbraw/zinc/99/90/68/566999068.db2.gz HRERMOHTLBEBGK-UHFFFAOYSA-N 0 1 380.238 3.485 10 0 GGAEMN C[C@H](Sc1ccc(Br)cc1)C(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000520372174 567001854 /nfs/dbraw/zinc/00/18/54/567001854.db2.gz DSJICVLFMWKDTM-LRDDRELGSA-N 0 1 383.355 3.482 10 0 GGAEMN C[C@@H]1CN(CCOc2ccc(Br)cc2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000430271527 567003963 /nfs/dbraw/zinc/00/39/63/567003963.db2.gz VJVGGEZPGQXNNS-IIDMSEBBSA-N 0 1 384.314 3.486 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000452670516 567004565 /nfs/dbraw/zinc/00/45/65/567004565.db2.gz YOIJINUYZPNEKJ-DFBGVHRSSA-N 0 1 378.270 3.091 10 0 GGAEMN C[C@H](NC[C@H]1CS(=O)(=O)c2ccccc21)c1ccc(Br)cn1 ZINC000584035583 567006611 /nfs/dbraw/zinc/00/66/11/567006611.db2.gz LPSGHAWJNQYOHW-RYUDHWBXSA-N 0 1 381.295 3.066 10 0 GGAEMN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)cn1 ZINC000564779546 567007956 /nfs/dbraw/zinc/00/79/56/567007956.db2.gz VKQBXUSIOKBYDP-DYVFJYSZSA-N 0 1 376.298 3.194 10 0 GGAEMN C[C@@H](Sc1ccccc1Cl)C(=O)NCc1n[nH]c(C2CCOCC2)n1 ZINC000633991832 567008710 /nfs/dbraw/zinc/00/87/10/567008710.db2.gz XYJWRRBHHPKXQK-LLVKDONJSA-N 0 1 380.901 3.149 10 0 GGAEMN CC(C)(C)N1CC[C@@H](NS(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000657062726 567008946 /nfs/dbraw/zinc/00/89/46/567008946.db2.gz SEUXJFCNEJZDJZ-SNVBAGLBSA-N 0 1 395.750 3.254 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1ccc(Cl)c(Br)c1 ZINC000633991107 567009126 /nfs/dbraw/zinc/00/91/26/567009126.db2.gz YMYGEUQVMGXBSB-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2nc([C@@H](N)CC(C)C)no2)s1 ZINC000564798573 567009346 /nfs/dbraw/zinc/00/93/46/567009346.db2.gz XZOVHOCUFPPJDF-QWHCGFSZSA-N 0 1 384.527 3.011 10 0 GGAEMN O[C@@H](C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1)C(F)(F)F ZINC000564794139 567009626 /nfs/dbraw/zinc/00/96/26/567009626.db2.gz ZEAAZVPZLVCQAL-AWEZNQCLSA-N 0 1 392.219 3.461 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1ccc(Cl)cc1Br ZINC000634010243 567010144 /nfs/dbraw/zinc/01/01/44/567010144.db2.gz RYJDOLBDKOBYOL-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN O=C(Cc1[nH]nc2ccccc21)N[C@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21 ZINC000634028460 567012521 /nfs/dbraw/zinc/01/25/21/567012521.db2.gz HZXXSCGGSQERHS-CCKFTAQKSA-N 0 1 382.261 3.322 10 0 GGAEMN COC(=O)c1coc(S(=O)(=O)Nc2c3c(ccc2Cl)CC(C)(C)O3)c1 ZINC000430373573 567012914 /nfs/dbraw/zinc/01/29/14/567012914.db2.gz FNSQGLOUSNFQQP-UHFFFAOYSA-N 0 1 385.825 3.234 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)Nc1ccc(C)cc1Br ZINC000494622294 567013014 /nfs/dbraw/zinc/01/30/14/567013014.db2.gz ANIOSDJNVFOYGE-CQSZACIVSA-N 0 1 383.311 3.389 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)n[nH]1 ZINC000520591611 567013816 /nfs/dbraw/zinc/01/38/16/567013816.db2.gz SADKQLSEKLURBB-ZETCQYMHSA-N 0 1 389.670 3.364 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)n[nH]1 ZINC000520591609 567014306 /nfs/dbraw/zinc/01/43/06/567014306.db2.gz SADKQLSEKLURBB-SSDOTTSWSA-N 0 1 389.670 3.364 10 0 GGAEMN CN(C)Cc1cc(-c2noc(-c3cc(S(C)(=O)=O)cs3)n2)ccc1F ZINC000545026651 567014504 /nfs/dbraw/zinc/01/45/04/567014504.db2.gz JFRZCJLCMKCESH-UHFFFAOYSA-N 0 1 381.454 3.069 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@H](C)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000494655682 567015023 /nfs/dbraw/zinc/01/50/23/567015023.db2.gz LJDAZHNTBBDJHX-MFKMUULPSA-N 0 1 379.482 3.456 10 0 GGAEMN Brc1ccccc1-n1cc(CNCCc2cnc(C3CC3)nc2)nn1 ZINC000584142353 567015738 /nfs/dbraw/zinc/01/57/38/567015738.db2.gz UBZLYLIZOYUEJM-UHFFFAOYSA-N 0 1 399.296 3.030 10 0 GGAEMN COc1cc(Br)ccc1CNCc1ccc(Cn2cncn2)cc1 ZINC000520639562 567015684 /nfs/dbraw/zinc/01/56/84/567015684.db2.gz FVCOEYUYNQLYLU-UHFFFAOYSA-N 0 1 387.281 3.387 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000494653736 567015833 /nfs/dbraw/zinc/01/58/33/567015833.db2.gz ZREAFLZPFJZCFH-SMDDNHRTSA-N 0 1 383.311 3.469 10 0 GGAEMN C[C@@H]1CN(C)[C@@H](C)CN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000613190967 567019995 /nfs/dbraw/zinc/01/99/95/567019995.db2.gz KNERVKXKMKVREW-UONOGXRCSA-N 0 1 380.330 3.214 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCN(C(=O)C2CCCCC2)CC1 ZINC000520736346 567022782 /nfs/dbraw/zinc/02/27/82/567022782.db2.gz NGTYJVDDSUSNRR-UHFFFAOYSA-N 0 1 395.297 3.019 10 0 GGAEMN C[C@](N)(C(=O)N[C@@H]1C[C@@]1(F)c1ccccc1)c1ccc(Br)cc1 ZINC000564941710 567022856 /nfs/dbraw/zinc/02/28/56/567022856.db2.gz BPXRPDUDTVMFIG-KBAYOESNSA-N 0 1 377.257 3.377 10 0 GGAEMN C[C@](N)(C(=O)N[C@H]1C[C@@]1(F)c1ccccc1)c1ccc(Br)cc1 ZINC000564941708 567023039 /nfs/dbraw/zinc/02/30/39/567023039.db2.gz BPXRPDUDTVMFIG-CGTJXYLNSA-N 0 1 377.257 3.377 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN[C@H](C)c1nncn1C ZINC000494787048 567023554 /nfs/dbraw/zinc/02/35/54/567023554.db2.gz HWCKALUVBZIBEX-CYBMUJFWSA-N 0 1 394.317 3.264 10 0 GGAEMN C[C@@H]1[C@H](C)N(C(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1C ZINC000613226386 567023508 /nfs/dbraw/zinc/02/35/08/567023508.db2.gz MDEOVGHKIKRJEU-KGLIPLIRSA-N 0 1 380.330 3.214 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000520779911 567024136 /nfs/dbraw/zinc/02/41/36/567024136.db2.gz ZHJVLPYPWHKUTR-RYUDHWBXSA-N 0 1 396.887 3.483 10 0 GGAEMN C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ncnc2cccc(I)c21 ZINC000545164835 567024247 /nfs/dbraw/zinc/02/42/47/567024247.db2.gz YSIGKAIFLOHPOP-QMTHXVAHSA-N 0 1 394.260 3.129 10 0 GGAEMN C[C@]1(CNS(=O)(=O)c2cc(F)c(Br)cc2F)CC1(F)F ZINC000657157926 567026537 /nfs/dbraw/zinc/02/65/37/567026537.db2.gz XYOKZHCZAXITCA-SNVBAGLBSA-N 0 1 376.169 3.051 10 0 GGAEMN COc1cnccc1[C@@H](C)NC[C@@H](O)COc1cc(F)cc(Br)c1 ZINC000584270528 567027821 /nfs/dbraw/zinc/02/78/21/567027821.db2.gz GIPZYFTZBRIMDU-BXUZGUMPSA-N 0 1 399.260 3.082 10 0 GGAEMN Cc1cnc(C(=O)N(CC[NH+](C)C)Cc2ccc(Br)cc2)c([O-])c1 ZINC000494841722 567028699 /nfs/dbraw/zinc/02/86/99/567028699.db2.gz GHFXROMQXNHAHZ-UHFFFAOYSA-N 0 1 392.297 3.062 10 0 GGAEMN C[C@]1(CCNS(=O)(=O)c2cc(F)c(Br)cc2F)CC1(F)F ZINC000657160812 567029089 /nfs/dbraw/zinc/02/90/89/567029089.db2.gz WDYBOUPYLPOLGI-NSHDSACASA-N 0 1 390.196 3.441 10 0 GGAEMN O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)[C@@H]1CCc2[nH]cnc2C1 ZINC000613306266 567029905 /nfs/dbraw/zinc/02/99/05/567029905.db2.gz YNBBMDGVERBNEN-VXGBXAGGSA-N 0 1 379.291 3.217 10 0 GGAEMN Cc1cscc1CN[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430724599 567030826 /nfs/dbraw/zinc/03/08/26/567030826.db2.gz OLJGHLXGKXYZGV-SNVBAGLBSA-N 0 1 389.340 3.317 10 0 GGAEMN Cn1cc(C[C@H]2CCC[C@@H]2NS(=O)(=O)c2c(Cl)ccc(F)c2F)cn1 ZINC000657180132 567033556 /nfs/dbraw/zinc/03/35/56/567033556.db2.gz ZTWYMTTTYCXCNA-RISCZKNCSA-N 0 1 389.855 3.041 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC2(C1)CCOCC2 ZINC000613348831 567033697 /nfs/dbraw/zinc/03/36/97/567033697.db2.gz UPNFMQQPGUMPGV-UHFFFAOYSA-N 0 1 376.254 3.092 10 0 GGAEMN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@H](c2ccncn2)C1 ZINC000613380587 567034858 /nfs/dbraw/zinc/03/48/58/567034858.db2.gz JTRXGTWCMCMSGA-DZGCQCFKSA-N 0 1 382.291 3.403 10 0 GGAEMN Cc1ccc(CN2CC[C@H](NC(=O)c3nscc3Br)C2)cc1 ZINC000634459418 567034962 /nfs/dbraw/zinc/03/49/62/567034962.db2.gz UOORNIVMUZNOFT-ZDUSSCGKSA-N 0 1 380.311 3.218 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@H](c2ccncn2)C1 ZINC000613380582 567035423 /nfs/dbraw/zinc/03/54/23/567035423.db2.gz IORDOYXLTDVDLW-KBPBESRZSA-N 0 1 382.291 3.403 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@@H](c2ccncn2)C1 ZINC000613380583 567035473 /nfs/dbraw/zinc/03/54/73/567035473.db2.gz IORDOYXLTDVDLW-KGLIPLIRSA-N 0 1 382.291 3.403 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC(c3ccccc3Br)CC2)C1 ZINC000682202104 567036665 /nfs/dbraw/zinc/03/66/65/567036665.db2.gz DLXNWWPRZQTNSJ-OAHLLOKOSA-N 0 1 380.330 3.432 10 0 GGAEMN O[C@H](COc1cc(F)cc(Br)c1)CN1CCC[C@@H](OC(F)F)C1 ZINC000682219802 567037811 /nfs/dbraw/zinc/03/78/11/567037811.db2.gz VAQWGLCEWWEDPH-QWHCGFSZSA-N 0 1 398.219 3.032 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613450349 567038258 /nfs/dbraw/zinc/03/82/58/567038258.db2.gz BABDWTAGEMNUKY-CYBMUJFWSA-N 0 1 392.297 3.035 10 0 GGAEMN CO[C@@H](CSc1nc(-c2ccccc2Br)n[nH]1)[C@H]1CCOC1 ZINC000657233137 567039346 /nfs/dbraw/zinc/03/93/46/567039346.db2.gz RREFRDNRVSEIHR-GWCFXTLKSA-N 0 1 384.299 3.378 10 0 GGAEMN O=c1c2c([n-]n1-c1ccc(Br)cn1)C[N@H+](Cc1ccccc1)CC2 ZINC000634593377 567039525 /nfs/dbraw/zinc/03/95/25/567039525.db2.gz MYOWXVSQCNPNTC-OAHLLOKOSA-N 0 1 385.265 3.069 10 0 GGAEMN NC(=O)[C@H](N[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)c1ccc(F)cc1 ZINC000634576545 567039573 /nfs/dbraw/zinc/03/95/73/567039573.db2.gz UNCHREZRJMYLAS-XLNGHYISSA-N 0 1 375.241 3.043 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2c(Br)ccc(F)c2C1 ZINC000613493188 567039904 /nfs/dbraw/zinc/03/99/04/567039904.db2.gz SFDQUAKXSWGKGI-SNVBAGLBSA-N 0 1 378.245 3.001 10 0 GGAEMN CCn1nc(C)c(CNC(=O)c2n[nH]c3ccc(Br)cc32)c1C ZINC000521108959 567042294 /nfs/dbraw/zinc/04/22/94/567042294.db2.gz BFDNTZYRRCVBAS-UHFFFAOYSA-N 0 1 376.258 3.089 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1ccnn1C(C)(C)C ZINC000682422421 567042785 /nfs/dbraw/zinc/04/27/85/567042785.db2.gz HMXBKVGAQWNWNY-UHFFFAOYSA-N 0 1 388.287 3.210 10 0 GGAEMN O=c1c2c([n-]n1-c1cncc(Br)c1)CC[N@H+](Cc1ccccc1)C2 ZINC000634620494 567043016 /nfs/dbraw/zinc/04/30/16/567043016.db2.gz GFPCPQAHPURSAL-INIZCTEOSA-N 0 1 385.265 3.069 10 0 GGAEMN Brc1cccc(N2CC[C@H](CNCc3cn(C4CCC4)nn3)C2)c1 ZINC000657329474 567045958 /nfs/dbraw/zinc/04/59/58/567045958.db2.gz MDPYFFVRQGOECR-CQSZACIVSA-N 0 1 390.329 3.382 10 0 GGAEMN Fc1cncc(Br)c1CNc1ccc(CCN2CCOCC2)cc1 ZINC000657323367 567046792 /nfs/dbraw/zinc/04/67/92/567046792.db2.gz DDWBPCFIKPBEIG-UHFFFAOYSA-N 0 1 394.288 3.470 10 0 GGAEMN COc1ccc(CNCc2c(C(F)(F)F)cnn2C)cc1Br ZINC000657341159 567048451 /nfs/dbraw/zinc/04/84/51/567048451.db2.gz NMIMAXGOSFBDAD-UHFFFAOYSA-N 0 1 378.192 3.500 10 0 GGAEMN CCC[C@H]1CN(C(=O)Cc2cscc2Br)CCN1CCOC ZINC000495132386 567048468 /nfs/dbraw/zinc/04/84/68/567048468.db2.gz WDHYEJBCIUYNKX-AWEZNQCLSA-N 0 1 389.359 3.012 10 0 GGAEMN C[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cncc(Br)c1 ZINC000565243732 567049617 /nfs/dbraw/zinc/04/96/17/567049617.db2.gz OOIXNSWQWRJHSQ-SUMWQHHRSA-N 0 1 376.298 3.194 10 0 GGAEMN Fc1cncc(Br)c1CNCCCc1nnc2n1CCCCC2 ZINC000657344343 567049912 /nfs/dbraw/zinc/04/99/12/567049912.db2.gz MRLMMTFKDBRALP-UHFFFAOYSA-N 0 1 382.281 3.024 10 0 GGAEMN CCc1cc(N2CCC[C@H](NCc3c(F)cncc3Br)C2)ncn1 ZINC000657358437 567051464 /nfs/dbraw/zinc/05/14/64/567051464.db2.gz DEFXWGRKQQOKDT-ZDUSSCGKSA-N 0 1 394.292 3.094 10 0 GGAEMN CC[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccsc1 ZINC000453068379 567051417 /nfs/dbraw/zinc/05/14/17/567051417.db2.gz AURNDAHXDXOMIZ-HNNXBMFYSA-N 0 1 386.564 3.071 10 0 GGAEMN O=S1(=O)CC(CCN[C@@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000682500123 567051739 /nfs/dbraw/zinc/05/17/39/567051739.db2.gz WSGHJMMZPMAPFB-MRXNPFEDSA-N 0 1 384.295 3.156 10 0 GGAEMN CN(C)C(=O)c1cccc(CCNCc2c(F)cncc2Br)c1 ZINC000657377447 567051724 /nfs/dbraw/zinc/05/17/24/567051724.db2.gz ZNNXIQMKHMOOJB-UHFFFAOYSA-N 0 1 380.261 3.017 10 0 GGAEMN Fc1cncc(Br)c1CNCCc1csc(N2CCCC2)n1 ZINC000657365999 567052300 /nfs/dbraw/zinc/05/23/00/567052300.db2.gz INGKROLWDAZFTA-UHFFFAOYSA-N 0 1 385.306 3.372 10 0 GGAEMN Cn1c(CCNCc2c(F)cncc2Br)nc2cc(F)ccc21 ZINC000657368086 567052376 /nfs/dbraw/zinc/05/23/76/567052376.db2.gz UPASFUBICWBPSN-UHFFFAOYSA-N 0 1 381.224 3.341 10 0 GGAEMN O=C(NCCCNCc1c(F)cncc1Br)c1cccc(F)c1 ZINC000657358081 567052562 /nfs/dbraw/zinc/05/25/62/567052562.db2.gz VGVNPMFZCYFJGT-UHFFFAOYSA-N 0 1 384.224 3.032 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1CC[C@H](OC)C[C@H]1C(=O)[O-] ZINC000565255443 567052540 /nfs/dbraw/zinc/05/25/40/567052540.db2.gz SBFJGPWTYIGTAR-GJZGRUSLSA-N 0 1 386.286 3.302 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCCc2cc(OC(F)(F)F)ccc21 ZINC000565276885 567053143 /nfs/dbraw/zinc/05/31/43/567053143.db2.gz RTTUMOKODKLHDP-UHFFFAOYSA-N 0 1 380.432 3.009 10 0 GGAEMN Cc1cc(Br)c2c(c1)CC[N@H+](CC1(O)CCC(C(=O)[O-])CC1)C2 ZINC000634693220 567053200 /nfs/dbraw/zinc/05/32/00/567053200.db2.gz SNWJWRCCVMCTRW-UHFFFAOYSA-N 0 1 382.298 3.122 10 0 GGAEMN Cc1nc(C)c(S(=O)(=O)N[C@@]2(C(F)(F)F)CCc3ccccc32)s1 ZINC000545466285 567054100 /nfs/dbraw/zinc/05/41/00/567054100.db2.gz HGGCOBITPISGHT-AWEZNQCLSA-N 0 1 376.425 3.442 10 0 GGAEMN Clc1ccccc1-c1n[n-]c(=N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)s1 ZINC000545472272 567054594 /nfs/dbraw/zinc/05/45/94/567054594.db2.gz OQCYBQLXFPNJEJ-JKSUJKDBSA-N 0 1 378.929 3.336 10 0 GGAEMN O=C1[C@H](NCc2cnn3c2CCC3)CCCN1c1ccc(Cl)cc1Cl ZINC000657446879 567055809 /nfs/dbraw/zinc/05/58/09/567055809.db2.gz HQAIAKKKGBGHSV-OAHLLOKOSA-N 0 1 379.291 3.421 10 0 GGAEMN CN1CCC[C@H](CNC(=O)c2cccc([S@](C)=O)c2)[C@H]1c1cccs1 ZINC000613711004 567056621 /nfs/dbraw/zinc/05/66/21/567056621.db2.gz XXVWPTOCNLNVQK-DZQNVJDRSA-N 0 1 376.547 3.298 10 0 GGAEMN OC[C@H](CNCc1c(F)cncc1Br)Cc1ccc(F)c(F)c1 ZINC000657448704 567057126 /nfs/dbraw/zinc/05/71/26/567057126.db2.gz WHLFFCAJKMMUIF-NSHDSACASA-N 0 1 389.215 3.202 10 0 GGAEMN O[C@@H]1C[C@H](O)CN(Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000682554917 567058106 /nfs/dbraw/zinc/05/81/06/567058106.db2.gz ZQHAJBHWRUNCJW-IYBDPMFKSA-N 0 1 378.266 3.169 10 0 GGAEMN CCOc1cc(CN[C@H]2CCN(C(C)(C)C)C2=O)cc(Br)c1O ZINC000521438275 567060144 /nfs/dbraw/zinc/06/01/44/567060144.db2.gz ZOVHAWDNEHDSHI-ZDUSSCGKSA-N 0 1 385.302 3.042 10 0 GGAEMN C[C@H](NCc1cnn2c1CCC2)c1ccc(Br)cc1OCCCO ZINC000657472207 567060307 /nfs/dbraw/zinc/06/03/07/567060307.db2.gz JEVDLFDNSUAORR-ZDUSSCGKSA-N 0 1 394.313 3.204 10 0 GGAEMN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cccc([S@](C)=O)c1 ZINC000613771289 567060283 /nfs/dbraw/zinc/06/02/83/567060283.db2.gz CMQGJKIVPCZLQF-VWLOTQADSA-N 0 1 378.925 3.281 10 0 GGAEMN CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cccc([S@@](C)=O)c1 ZINC000613771284 567060409 /nfs/dbraw/zinc/06/04/09/567060409.db2.gz CMQGJKIVPCZLQF-RUZDIDTESA-N 0 1 378.925 3.281 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(F)c(NC(N)=O)c2)c(Cl)cc1F ZINC000431147115 567060659 /nfs/dbraw/zinc/06/06/59/567060659.db2.gz ARBJROZVMJNNQD-UHFFFAOYSA-N 0 1 375.784 3.218 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)c1cn[nH]c1-c1ccccn1 ZINC000565394588 567063484 /nfs/dbraw/zinc/06/34/84/567063484.db2.gz KDWIEDVSNSKILT-CQSZACIVSA-N 0 1 399.248 3.488 10 0 GGAEMN O=C(c1cc(-c2cccc(Br)c2)no1)N1CCN2CCC1CC2 ZINC000613861036 567065614 /nfs/dbraw/zinc/06/56/14/567065614.db2.gz JEHSQCVHVXJCAI-UHFFFAOYSA-N 0 1 376.254 3.024 10 0 GGAEMN CC(C)[C@@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)c1ccnn1C ZINC000682648278 567065920 /nfs/dbraw/zinc/06/59/20/567065920.db2.gz RCQCPJSUVPRWAH-CYBMUJFWSA-N 0 1 390.285 3.229 10 0 GGAEMN Cc1cc(S(=O)(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c(C)s1 ZINC000521568853 567067430 /nfs/dbraw/zinc/06/74/30/567067430.db2.gz RGGDWBMWZJRMCX-UHFFFAOYSA-N 0 1 388.505 3.396 10 0 GGAEMN COc1sc(CNCc2ccc(CNC(C)=O)cc2)cc1Br ZINC000657543986 567067646 /nfs/dbraw/zinc/06/76/46/567067646.db2.gz KOTBTOXPZKWIPY-UHFFFAOYSA-N 0 1 383.311 3.445 10 0 GGAEMN COc1c(Br)cccc1CNCc1ccc(CNC(C)=O)cc1 ZINC000657544704 567067903 /nfs/dbraw/zinc/06/79/03/567067903.db2.gz QUUSKEVMOAWZNP-UHFFFAOYSA-N 0 1 377.282 3.384 10 0 GGAEMN O=C(N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1)[C@@H]1CCc2[nH]cnc2C1 ZINC000613903257 567070950 /nfs/dbraw/zinc/07/09/50/567070950.db2.gz YUAFNURHMPFDKD-YPMHNXCESA-N 0 1 379.291 3.217 10 0 GGAEMN COC[C@@H](NCc1cn(-c2cccc(Cl)c2Cl)nn1)C1CCOCC1 ZINC000657565843 567071463 /nfs/dbraw/zinc/07/14/63/567071463.db2.gz VHBWPKZDVKALRW-OAHLLOKOSA-N 0 1 385.295 3.105 10 0 GGAEMN CN(CCc1ccc(Br)cc1)CC(=O)N1CCO[C@@H]2CCCC[C@@H]21 ZINC000521656460 567072201 /nfs/dbraw/zinc/07/22/01/567072201.db2.gz KTOQUHYPPNHKOY-ZWKOTPCHSA-N 0 1 395.341 3.093 10 0 GGAEMN CN(CCc1ccc(Br)cc1)CC(=O)N1CCO[C@@H]2CCCC[C@H]21 ZINC000521656458 567072474 /nfs/dbraw/zinc/07/24/74/567072474.db2.gz KTOQUHYPPNHKOY-QZTJIDSGSA-N 0 1 395.341 3.093 10 0 GGAEMN Cc1csc(CN[C@@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1 ZINC000453318494 567074080 /nfs/dbraw/zinc/07/40/80/567074080.db2.gz MCTUCYJNZQDARY-JTQLQIEISA-N 0 1 389.340 3.317 10 0 GGAEMN Cc1csc(CN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1 ZINC000453318495 567074153 /nfs/dbraw/zinc/07/41/53/567074153.db2.gz MCTUCYJNZQDARY-SNVBAGLBSA-N 0 1 389.340 3.317 10 0 GGAEMN Cc1ccc(C(=O)NC[C@@H]2CN(CC(C)C)CCO2)c(C)c1Br ZINC000682854142 567075365 /nfs/dbraw/zinc/07/53/65/567075365.db2.gz SGPDBCZWEQYPRC-OAHLLOKOSA-N 0 1 383.330 3.153 10 0 GGAEMN COCc1nc(CNCc2cc(C(F)(F)F)ccc2Br)n[nH]1 ZINC000657610313 567076682 /nfs/dbraw/zinc/07/66/82/567076682.db2.gz YUPOKTGDQORFLO-UHFFFAOYSA-N 0 1 379.180 3.022 10 0 GGAEMN COC[C@@]1(C(=O)[O-])CC[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000565543828 567078213 /nfs/dbraw/zinc/07/82/13/567078213.db2.gz JLJFLQXHDZKRCZ-GOSISDBHSA-N 0 1 380.897 3.310 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCCCN1C[C@@H](C)O[C@H](C)C1 ZINC000496735316 567079941 /nfs/dbraw/zinc/07/99/41/567079941.db2.gz FNXGVIOMCYRFGA-MCIONIFRSA-N 0 1 389.323 3.376 10 0 GGAEMN Cc1c([C@@H](C)NC[C@@H]2CCC[C@H]2O)nnn1-c1cccc(Br)c1 ZINC000453366222 567080507 /nfs/dbraw/zinc/08/05/07/567080507.db2.gz CWZKVTKHYNLGLH-PVXIVEMSSA-N 0 1 379.302 3.150 10 0 GGAEMN Cc1ccc(C(=O)N2CCN(CC3CCOCC3)CC2)c(C)c1Br ZINC000682903268 567081145 /nfs/dbraw/zinc/08/11/45/567081145.db2.gz BNWRASCMNFXQQP-UHFFFAOYSA-N 0 1 395.341 3.250 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)NCC[N@@H+]2CC=C(C)CC2)cc1Br ZINC000545858549 567082049 /nfs/dbraw/zinc/08/20/49/567082049.db2.gz CNXAWFBHSLAIJR-CQSZACIVSA-N 0 1 396.329 3.470 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)NCCN2CC=C(C)CC2)cc1Br ZINC000545858549 567082052 /nfs/dbraw/zinc/08/20/52/567082052.db2.gz CNXAWFBHSLAIJR-CQSZACIVSA-N 0 1 396.329 3.470 10 0 GGAEMN CCc1nc(C2CCN(c3ncnc4ccc(Br)cc43)CC2)n[nH]1 ZINC000682923272 567084399 /nfs/dbraw/zinc/08/43/99/567084399.db2.gz CNVKTGUDYYYQCX-UHFFFAOYSA-N 0 1 387.285 3.457 10 0 GGAEMN CCc1nnc(C2CCN(c3ncnc4ccc(Br)cc43)CC2)[nH]1 ZINC000682923272 567084406 /nfs/dbraw/zinc/08/44/06/567084406.db2.gz CNVKTGUDYYYQCX-UHFFFAOYSA-N 0 1 387.285 3.457 10 0 GGAEMN COc1ccc(-c2n[nH]c(SCc3ccn(C)n3)n2)cc1Br ZINC000473523543 567086310 /nfs/dbraw/zinc/08/63/10/567086310.db2.gz VZLYALCOTMPQLR-UHFFFAOYSA-N 0 1 380.271 3.269 10 0 GGAEMN C[C@]1(CNC(=O)c2n[nH]c3ccc(Br)cc32)CCO[C@@H]1C1CC1 ZINC000545953761 567091627 /nfs/dbraw/zinc/09/16/27/567091627.db2.gz SEDAZAKEGQNGHU-NVXWUHKLSA-N 0 1 378.270 3.260 10 0 GGAEMN Cc1nc(-c2ccc(CCNC(=O)N3C[C@H]4CCC[C@@H](C3)N4)s2)cs1 ZINC000521985409 567091850 /nfs/dbraw/zinc/09/18/50/567091850.db2.gz APWJLYALHYJBBB-OKILXGFUSA-N 0 1 376.551 3.258 10 0 GGAEMN CC(C)[C@@]1(C(=O)[O-])CC[N@@H+](C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000565722110 567092454 /nfs/dbraw/zinc/09/24/54/567092454.db2.gz GVBXMUQSHQLGJF-YVEFUNNKSA-N 0 1 376.280 3.166 10 0 GGAEMN CCCOc1c(Cl)cc(CNCC2(S(=O)(=O)CC)CC2)cc1OC ZINC000657757079 567092731 /nfs/dbraw/zinc/09/27/31/567092731.db2.gz ACJPRCIGPLWAGR-UHFFFAOYSA-N 0 1 375.918 3.194 10 0 GGAEMN Cn1ncc(Br)c1CN1CCC2(CC1)OCCc1ccccc12 ZINC000453584303 567094974 /nfs/dbraw/zinc/09/49/74/567094974.db2.gz ZXTLPKXRBXTGSR-UHFFFAOYSA-N 0 1 376.298 3.247 10 0 GGAEMN O=C(NCCN1CC=CCC1)c1cc(Br)cc(N2CCCC2)c1 ZINC000614260032 567097522 /nfs/dbraw/zinc/09/75/22/567097522.db2.gz RYQDNVXDVYJMSW-UHFFFAOYSA-N 0 1 378.314 3.041 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc(Br)ccc1OC(F)F ZINC000565779231 567098052 /nfs/dbraw/zinc/09/80/52/567098052.db2.gz TYSPPPIZYWAYPT-SECBINFHSA-N 0 1 386.196 3.061 10 0 GGAEMN C[C@@H](O)[C@@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccccc1 ZINC000657819959 567098968 /nfs/dbraw/zinc/09/89/68/567098968.db2.gz VBMWQAVHGHHVAF-SJKOYZFVSA-N 0 1 378.266 3.432 10 0 GGAEMN COCCN1CCCN(C(=O)c2coc3c2cc(Br)cc3C)CC1 ZINC000473731864 567100028 /nfs/dbraw/zinc/10/00/28/567100028.db2.gz NKNHVAODRRWZRY-UHFFFAOYSA-N 0 1 395.297 3.298 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)[C@H](C)C1 ZINC000497479573 567100277 /nfs/dbraw/zinc/10/02/77/567100277.db2.gz QIIUPLHHBREGNV-WQGACYEGSA-N 0 1 386.323 3.077 10 0 GGAEMN C[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1cncc(Br)c1 ZINC000657862478 567100901 /nfs/dbraw/zinc/10/09/01/567100901.db2.gz DRMZRHIIZMETRN-GFCCVEGCSA-N 0 1 383.311 3.240 10 0 GGAEMN COc1ccc(Br)cc1[C@H]1CCCN1C(=O)N[C@@H]1CCCN(C)C1 ZINC000586853202 567101662 /nfs/dbraw/zinc/10/16/62/567101662.db2.gz UEPMHZYPXUUCFQ-GDBMZVCRSA-N 0 1 396.329 3.398 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)s[n-]1 ZINC000473827420 567104672 /nfs/dbraw/zinc/10/46/72/567104672.db2.gz HUJPUPYGHVBRMJ-WCQYABFASA-N 0 1 379.555 3.239 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)s[n-]1 ZINC000473825573 567105087 /nfs/dbraw/zinc/10/50/87/567105087.db2.gz CIPDWVVEAZATKT-STQMWFEESA-N 0 1 379.555 3.381 10 0 GGAEMN CN(CCN1CCCS1(=O)=O)Cc1cccc2c(Br)cccc12 ZINC000683219127 567107072 /nfs/dbraw/zinc/10/70/72/567107072.db2.gz VXUSKUMCZRFZAJ-UHFFFAOYSA-N 0 1 397.338 3.070 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)s[n-]1 ZINC000473845455 567107224 /nfs/dbraw/zinc/10/72/24/567107224.db2.gz WWHMEXJEQYQAEW-DGCLKSJQSA-N 0 1 379.555 3.239 10 0 GGAEMN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)c1cnccc1N(C)C ZINC000546129375 567107924 /nfs/dbraw/zinc/10/79/24/567107924.db2.gz QOXYIPAHQFHZQV-NSHDSACASA-N 0 1 380.261 3.410 10 0 GGAEMN Cc1ncc(C(=O)N2CCC[C@H]2c2ccccc2I)[nH]1 ZINC000522243011 567108661 /nfs/dbraw/zinc/10/86/61/567108661.db2.gz HPLARTJHUQCCIW-AWEZNQCLSA-N 0 1 381.217 3.300 10 0 GGAEMN CN(C)[C@@H](CNC(=O)c1cc[nH]c(=O)c1Br)c1ccc(Cl)cc1 ZINC000565926170 567111354 /nfs/dbraw/zinc/11/13/54/567111354.db2.gz RAFIHVINOQLOKU-ZDUSSCGKSA-N 0 1 398.688 3.236 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635763581 567111603 /nfs/dbraw/zinc/11/16/03/567111603.db2.gz BGUBOCRJWCBRDM-DSPGLSBSSA-N 0 1 378.270 3.168 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@@H](N3CCOCC3)CC2)c(C)c1Br ZINC000614436469 567112511 /nfs/dbraw/zinc/11/25/11/567112511.db2.gz WRFYJEVBFWBISK-MRXNPFEDSA-N 0 1 395.341 3.393 10 0 GGAEMN C[C@H]1CN(CCCNC(=O)C(C)(C)c2cccc(Br)c2)C[C@H](C)O1 ZINC000588081082 567112515 /nfs/dbraw/zinc/11/25/15/567112515.db2.gz JOXQXJGKUAFTJC-GJZGRUSLSA-N 0 1 397.357 3.342 10 0 GGAEMN CC(C)[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)[C@H](O)C(F)(F)F ZINC000614474594 567113988 /nfs/dbraw/zinc/11/39/88/567113988.db2.gz RSEVYEVGYVVISG-JQWIXIFHSA-N 0 1 394.191 3.003 10 0 GGAEMN COCCN(Cc1cc(Br)cs1)C(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635853229 567114912 /nfs/dbraw/zinc/11/49/12/567114912.db2.gz MOKVKHWFMJKWAZ-CHWSQXEVSA-N 0 1 384.299 3.012 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(Cl)c(Br)c2)nc1 ZINC000683344067 567115015 /nfs/dbraw/zinc/11/50/15/567115015.db2.gz KEXMUZBFFGNXPA-UHFFFAOYSA-N 0 1 377.647 3.307 10 0 GGAEMN CCCCSc1ccc(Cl)cc1C(=O)NC[C@H]1CN2CCN1CCC2 ZINC000614501419 567117095 /nfs/dbraw/zinc/11/70/95/567117095.db2.gz DUVCBNUUCMQFGE-INIZCTEOSA-N 0 1 381.973 3.352 10 0 GGAEMN C[C@H](NC[C@H]1CC[N@H+]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060183 567119117 /nfs/dbraw/zinc/11/91/17/567119117.db2.gz KGVZBSUNOKEYBM-WDEREUQCSA-N 0 1 394.368 3.164 10 0 GGAEMN Cc1c([C@H](C)N[C@H](CO)C2CCC2)nnn1-c1cccc(Br)c1 ZINC000658086712 567120299 /nfs/dbraw/zinc/12/02/99/567120299.db2.gz FAPAUUYVCHGNNX-MEDUHNTESA-N 0 1 379.302 3.150 10 0 GGAEMN C[C@H]1CCCC[N@H+]1CCCCNC(=O)Cc1ccc(Br)cc1O ZINC000431992774 567121879 /nfs/dbraw/zinc/12/18/79/567121879.db2.gz GQPDDKDXUHXQHA-AWEZNQCLSA-N 0 1 383.330 3.468 10 0 GGAEMN C[C@H]1C[C@@H](NC2CCN(Cc3ccccc3Br)CC2)c2ncnn21 ZINC000658100273 567122103 /nfs/dbraw/zinc/12/21/03/567122103.db2.gz GPXBQUVYWLNWRZ-SUMWQHHRSA-N 0 1 390.329 3.301 10 0 GGAEMN COCc1nc(CN[C@H](c2ccc(OC)cc2Br)C(C)C)n[nH]1 ZINC000658155947 567125877 /nfs/dbraw/zinc/12/58/77/567125877.db2.gz FQIMIBPEBMXVIQ-INIZCTEOSA-N 0 1 383.290 3.209 10 0 GGAEMN C[C@H]1CCN(Cc2ccccc2)CCN1S(=O)(=O)CCc1cccs1 ZINC000683463852 567126049 /nfs/dbraw/zinc/12/60/49/567126049.db2.gz IOLGBBWZYATADW-KRWDZBQOSA-N 0 1 378.563 3.217 10 0 GGAEMN COCc1nnc(C[NH2+][C@H]2c3cc(Br)ccc3SC[C@@H]2C)[n-]1 ZINC000658157734 567126878 /nfs/dbraw/zinc/12/68/78/567126878.db2.gz CWDJFHBGSKZFAA-BJOHPYRUSA-N 0 1 383.315 3.286 10 0 GGAEMN COc1cccc([C@H](CNC(=O)Cc2cscc2Br)N(C)C)c1 ZINC000432053173 567127617 /nfs/dbraw/zinc/12/76/17/567127617.db2.gz DGGJVOQNQZOZLG-INIZCTEOSA-N 0 1 397.338 3.481 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)NCc1cccc(OC2CC2)c1F ZINC000658172117 567127859 /nfs/dbraw/zinc/12/78/59/567127859.db2.gz QCPAODULUPWWMN-LBPRGKRZSA-N 0 1 395.272 3.469 10 0 GGAEMN CCS(=O)(=O)C[C@H](C)N[C@H]1CSCc2ccc(Br)cc21 ZINC000658186145 567127917 /nfs/dbraw/zinc/12/79/17/567127917.db2.gz BTHFNHNAHZAPQX-HZMBPMFUSA-N 0 1 378.357 3.150 10 0 GGAEMN Cc1nc(CNC[C@@H](O)COCc2ccccc2F)sc1Br ZINC000566120416 567128089 /nfs/dbraw/zinc/12/80/89/567128089.db2.gz PYPFOIIWVJFZFT-GFCCVEGCSA-N 0 1 389.290 3.020 10 0 GGAEMN Cc1nc(CNC[C@H](O)COCc2ccccc2F)sc1Br ZINC000566120417 567128283 /nfs/dbraw/zinc/12/82/83/567128283.db2.gz PYPFOIIWVJFZFT-LBPRGKRZSA-N 0 1 389.290 3.020 10 0 GGAEMN CCS(=O)(=O)C[C@@H](C)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000658186147 567128390 /nfs/dbraw/zinc/12/83/90/567128390.db2.gz BTHFNHNAHZAPQX-QMTHXVAHSA-N 0 1 378.357 3.150 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC2(C1)CC(F)(F)C2 ZINC000683497487 567129240 /nfs/dbraw/zinc/12/92/40/567129240.db2.gz PDBSKEAWNOQZMC-UHFFFAOYSA-N 0 1 383.192 3.162 10 0 GGAEMN C[C@]1(CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1(F)F ZINC000658216872 567129472 /nfs/dbraw/zinc/12/94/72/567129472.db2.gz DBTIWWYXTURDOW-WCQYABFASA-N 0 1 380.254 3.303 10 0 GGAEMN CC(C)Oc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cn1 ZINC000588624598 567129515 /nfs/dbraw/zinc/12/95/15/567129515.db2.gz GOVDABCRUXGIDC-UHFFFAOYSA-N 0 1 384.841 3.094 10 0 GGAEMN Cc1noc(C)c1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000522788211 567130015 /nfs/dbraw/zinc/13/00/15/567130015.db2.gz FAZBUQUWMPIWQL-UHFFFAOYSA-N 0 1 391.229 3.161 10 0 GGAEMN Cc1noc(C)c1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000522788211 567130021 /nfs/dbraw/zinc/13/00/21/567130021.db2.gz FAZBUQUWMPIWQL-UHFFFAOYSA-N 0 1 391.229 3.161 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2cc(F)cc(Br)c2)[nH]n1 ZINC000432127027 567132528 /nfs/dbraw/zinc/13/25/28/567132528.db2.gz QRWJJLCTVXGFRK-UHFFFAOYSA-N 0 1 393.260 3.085 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000658297945 567133924 /nfs/dbraw/zinc/13/39/24/567133924.db2.gz BLZXTRBQBSVVRE-AWEZNQCLSA-N 0 1 388.327 3.220 10 0 GGAEMN C[C@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1ncc(Br)cc1F ZINC000658291165 567134474 /nfs/dbraw/zinc/13/44/74/567134474.db2.gz TVESHFUJBDAAJN-APHBMKBZSA-N 0 1 398.320 3.277 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)[C@@H](C)[C@@H](C)O1 ZINC000474110210 567135970 /nfs/dbraw/zinc/13/59/70/567135970.db2.gz NNQJFMVZQHNUDG-GRYCIOLGSA-N 0 1 378.270 3.477 10 0 GGAEMN CC1=CCN(CCNC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)CC1 ZINC000546568522 567136931 /nfs/dbraw/zinc/13/69/31/567136931.db2.gz YYEDOOSKWUCRDL-UHFFFAOYSA-N 0 1 390.698 3.354 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cc(C)ccc3Br)[nH]c2c1 ZINC000497968622 567137536 /nfs/dbraw/zinc/13/75/36/567137536.db2.gz JAZNSWNPKIOJRH-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN NC(=O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2-n2cccc2)c1 ZINC000522957542 567138667 /nfs/dbraw/zinc/13/86/67/567138667.db2.gz JFUNEYIOLPOJQC-UHFFFAOYSA-N 0 1 375.837 3.030 10 0 GGAEMN NC1(c2noc([C@H](c3cc(Cl)cc(Cl)c3)N3CCOCC3)n2)CCC1 ZINC000566216305 567139407 /nfs/dbraw/zinc/13/94/07/567139407.db2.gz BALCOYWZDNHMSX-AWEZNQCLSA-N 0 1 383.279 3.136 10 0 GGAEMN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000474150693 567140749 /nfs/dbraw/zinc/14/07/49/567140749.db2.gz BIRBOSIGSYACBZ-KOLCDFICSA-N 0 1 395.219 3.434 10 0 GGAEMN Cc1ccc([C@H](N)C(=O)Nc2ccc(CN(C)C)c(Br)c2)cc1 ZINC000566250534 567142013 /nfs/dbraw/zinc/14/20/13/567142013.db2.gz BCCOOPBTBHFOIE-KRWDZBQOSA-N 0 1 376.298 3.458 10 0 GGAEMN COc1cc(Cl)ccc1S(=O)(=O)Nc1ccc2ccc(=O)n(C)c2c1 ZINC000683731578 567149104 /nfs/dbraw/zinc/14/91/04/567149104.db2.gz HVALGHMYVXHHAQ-UHFFFAOYSA-N 0 1 378.837 3.001 10 0 GGAEMN Cc1[nH]c2nc(S(=O)(=O)[C@@H]3CCc4ccccc43)nc-2cc1Br ZINC000683732331 567149206 /nfs/dbraw/zinc/14/92/06/567149206.db2.gz QVEANTMRLKQNQX-CQSZACIVSA-N 0 1 392.278 3.490 10 0 GGAEMN OC[C@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000474264957 567152665 /nfs/dbraw/zinc/15/26/65/567152665.db2.gz GZSUAOLLXOZGLI-KDOFPFPSSA-N 0 1 382.287 3.325 10 0 GGAEMN OC[C@H]1c2ccccc2CCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000474264957 567152670 /nfs/dbraw/zinc/15/26/70/567152670.db2.gz GZSUAOLLXOZGLI-KDOFPFPSSA-N 0 1 382.287 3.325 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2Br)n[nH]1)[C@@H]1C[C@H]1C1CCOCC1 ZINC000636555939 567156588 /nfs/dbraw/zinc/15/65/88/567156588.db2.gz IZGAACONPGEQGT-QWHCGFSZSA-N 0 1 391.269 3.235 10 0 GGAEMN O=C(Cc1cscc1Br)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000498209166 567158590 /nfs/dbraw/zinc/15/85/90/567158590.db2.gz WUGWXGXZPRJUKK-AWEZNQCLSA-N 0 1 377.267 3.077 10 0 GGAEMN OC(=Cc1ccc(Br)cc1O)Nc1nc(-c2ccccc2)ns1 ZINC000432414505 567159946 /nfs/dbraw/zinc/15/99/46/567159946.db2.gz LHHWZQLXZAJOOC-UHFFFAOYSA-N 0 1 390.262 3.276 10 0 GGAEMN C[C@H](CNC(=O)c1cnccc1N(C)C)Oc1ccc(Br)cc1 ZINC000546796193 567160108 /nfs/dbraw/zinc/16/01/08/567160108.db2.gz SZJDVNGFLRLKIH-GFCCVEGCSA-N 0 1 378.270 3.107 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)N1CC[C@H](Oc2cncc(Br)c2)C1 ZINC000615125958 567161201 /nfs/dbraw/zinc/16/12/01/567161201.db2.gz DMEGJXUJVSJFEY-ZDUSSCGKSA-N 0 1 393.285 3.293 10 0 GGAEMN CCN(CCOc1ccc(Br)cc1)C(=O)C(C)(C)c1c[nH]cn1 ZINC000683920355 567162726 /nfs/dbraw/zinc/16/27/26/567162726.db2.gz VIVJIAIZPIVHSC-UHFFFAOYSA-N 0 1 380.286 3.377 10 0 GGAEMN CC(C)Oc1cc(NS(=O)(=O)c2cc(F)cc(Cl)c2)ccc1C(N)=O ZINC000432498041 567163908 /nfs/dbraw/zinc/16/39/08/567163908.db2.gz ULQSTCJHLHPTON-UHFFFAOYSA-N 0 1 386.832 3.166 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC(Nc3cccc(Br)c3)CC2)C1 ZINC000683979209 567167554 /nfs/dbraw/zinc/16/75/54/567167554.db2.gz IKEJNZYFZKIGNC-QGZVFWFLSA-N 0 1 395.345 3.129 10 0 GGAEMN CCc1n[nH]c(C(=O)NCCN2CC=C(C(C)(C)C)CC2)c1Br ZINC000566577591 567169381 /nfs/dbraw/zinc/16/93/81/567169381.db2.gz OHUUIFPUDGDOLB-UHFFFAOYSA-N 0 1 383.334 3.143 10 0 GGAEMN CCc1cc(C(=O)N2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)n[nH]1 ZINC000498347012 567170770 /nfs/dbraw/zinc/17/07/70/567170770.db2.gz ZJZGXNXPWAUPPV-UHFFFAOYSA-N 0 1 381.307 3.279 10 0 GGAEMN O=C(CS(=O)(=O)c1ccc(Cl)cc1)Nc1cc(F)cc(Cl)c1O ZINC000474433645 567172009 /nfs/dbraw/zinc/17/20/09/567172009.db2.gz VCPZHZDQIAENDV-UHFFFAOYSA-N 0 1 378.208 3.251 10 0 GGAEMN O=C(Nc1cc(F)cc(Cl)c1O)[C@H]1CSCN1C(=O)c1ccccc1 ZINC000474446139 567172765 /nfs/dbraw/zinc/17/27/65/567172765.db2.gz NTXUJDPKLACRHR-CQSZACIVSA-N 0 1 380.828 3.339 10 0 GGAEMN Cc1cc(Br)cc(C(=O)N2CCOC[C@H]2[C@@H]2CCC[N@@H+]2C)c1C ZINC000615274493 567174452 /nfs/dbraw/zinc/17/44/52/567174452.db2.gz JICPGWHTPPAYFF-IRXDYDNUSA-N 0 1 381.314 3.001 10 0 GGAEMN COC(=O)[C@@](C)(NC(=O)c1cccc(Br)c1O)c1ccc(F)cc1 ZINC000566655517 567176023 /nfs/dbraw/zinc/17/60/23/567176023.db2.gz OYORZWHPGNRMRR-KRWDZBQOSA-N 0 1 396.212 3.112 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3ccncc3Br)cccc21 ZINC000684089764 567176257 /nfs/dbraw/zinc/17/62/57/567176257.db2.gz RCDHRHZTRDOJPE-HNNXBMFYSA-N 0 1 376.254 3.482 10 0 GGAEMN Cc1nc(CS(=O)(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)cs1 ZINC000684101325 567178718 /nfs/dbraw/zinc/17/87/18/567178718.db2.gz ZYOSIKWHIIIDOD-XJKSGUPXSA-N 0 1 385.580 3.016 10 0 GGAEMN COc1cc(NC(=O)N2C[C@H]3CCC[C@@H](C2)N3)c(Cl)cc1Br ZINC000659047691 567179729 /nfs/dbraw/zinc/17/97/29/567179729.db2.gz KFLQJYDSXXFNCB-AOOOYVTPSA-N 0 1 388.693 3.469 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2c(F)ccc(Br)c2C1 ZINC000615453605 567184387 /nfs/dbraw/zinc/18/43/87/567184387.db2.gz NYRSKJMPMSOOJC-SNVBAGLBSA-N 0 1 378.245 3.001 10 0 GGAEMN Brc1ccc(-c2nc(CNc3ncnc4ccsc43)n[nH]2)cc1 ZINC000524161715 567184964 /nfs/dbraw/zinc/18/49/64/567184964.db2.gz OACBYQPOOCSGLQ-UHFFFAOYSA-N 0 1 387.266 3.273 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNc3ncnc4ccsc43)n2)cc1 ZINC000524161715 567184975 /nfs/dbraw/zinc/18/49/75/567184975.db2.gz OACBYQPOOCSGLQ-UHFFFAOYSA-N 0 1 387.266 3.273 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C[C@@H]1C ZINC000498567224 567185982 /nfs/dbraw/zinc/18/59/82/567185982.db2.gz MSCVLSJJTBSYIQ-NWDGAFQWSA-N 0 1 392.297 3.258 10 0 GGAEMN COc1cc2nc(C)sc2cc1NS(=O)(=O)c1ccc(N(C)C)cc1 ZINC000432767922 567187508 /nfs/dbraw/zinc/18/75/08/567187508.db2.gz MLTSGWPTIWEJMO-UHFFFAOYSA-N 0 1 377.491 3.480 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)NCCN1CC=CCC1 ZINC000474672831 567189572 /nfs/dbraw/zinc/18/95/72/567189572.db2.gz ANUOFUQWVNXCCF-CYBMUJFWSA-N 0 1 382.302 3.080 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000524351738 567195256 /nfs/dbraw/zinc/19/52/56/567195256.db2.gz RQGJTBDSWVVALM-NSHDSACASA-N 0 1 385.942 3.366 10 0 GGAEMN COc1ccc(CN(C)C)cc1NC(=O)C(=O)c1ccc(Br)cc1 ZINC000524380826 567195729 /nfs/dbraw/zinc/19/57/29/567195729.db2.gz FNLSBQPOBXQPGK-UHFFFAOYSA-N 0 1 391.265 3.341 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)NCC1(c2ccc(Br)cc2)CCCC1 ZINC000659275012 567198744 /nfs/dbraw/zinc/19/87/44/567198744.db2.gz ADYPHUWHYJMBCZ-INIZCTEOSA-N 0 1 383.330 3.129 10 0 GGAEMN C[C@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(Br)cn1 ZINC000566890390 567199582 /nfs/dbraw/zinc/19/95/82/567199582.db2.gz YHYFUFLLHXEJKB-LBPRGKRZSA-N 0 1 383.311 3.240 10 0 GGAEMN O=C(c1cc(-c2ccoc2)[nH]n1)N1CCOc2c(Br)cccc2C1 ZINC000684332662 567202190 /nfs/dbraw/zinc/20/21/90/567202190.db2.gz YSEINWPMMWFGEU-UHFFFAOYSA-N 0 1 388.221 3.467 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)NCC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000659322312 567205297 /nfs/dbraw/zinc/20/52/97/567205297.db2.gz ILMUYKWRIBWKNM-AWEZNQCLSA-N 0 1 378.822 3.259 10 0 GGAEMN CCC(=O)N1CSC[C@H]1C(=O)N(C)[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000615816702 567207742 /nfs/dbraw/zinc/20/77/42/567207742.db2.gz OSEXRLFQNHNIBI-YGRLFVJLSA-N 0 1 380.901 3.047 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)NC1(c2ccc(Br)cc2)CCCCC1 ZINC000659337734 567208116 /nfs/dbraw/zinc/20/81/16/567208116.db2.gz SQCKSUIXWVPXEW-INIZCTEOSA-N 0 1 383.330 3.477 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1csc(-c2ccccc2Cl)n1 ZINC000590115984 567209468 /nfs/dbraw/zinc/20/94/68/567209468.db2.gz NPUMYRPYTCELAU-CYBMUJFWSA-N 0 1 379.913 3.304 10 0 GGAEMN O=C(N[C@H]1CCc2c1ccc(F)c2Br)[C@H]1CCc2[nH]cnc2C1 ZINC000615871004 567213197 /nfs/dbraw/zinc/21/31/97/567213197.db2.gz IGLFMJKQUCXZOZ-ZANVPECISA-N 0 1 378.245 3.220 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccc(Cl)cc1 ZINC000547474555 567214009 /nfs/dbraw/zinc/21/40/09/567214009.db2.gz BAHFYDFWNMFEKP-HOTGVXAUSA-N 0 1 378.929 3.184 10 0 GGAEMN CC1(C)CN(C(=O)c2cc(Oc3cccc(Br)c3)ccn2)CCN1 ZINC000474958536 567214092 /nfs/dbraw/zinc/21/40/92/567214092.db2.gz ASVXLDBKOTUTTE-UHFFFAOYSA-N 0 1 390.281 3.460 10 0 GGAEMN CN1CCC[C@H]1C(=O)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000474961699 567214131 /nfs/dbraw/zinc/21/41/31/567214131.db2.gz HRHFROXOFAUWSB-MSOLQXFVSA-N 0 1 388.309 3.338 10 0 GGAEMN CC(C)[C@H](C)CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000524800938 567215259 /nfs/dbraw/zinc/21/52/59/567215259.db2.gz MJNKEHDQKZVRLP-LLVKDONJSA-N 0 1 380.290 3.326 10 0 GGAEMN CC(C)[C@H](C)CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000524800938 567215262 /nfs/dbraw/zinc/21/52/62/567215262.db2.gz MJNKEHDQKZVRLP-LLVKDONJSA-N 0 1 380.290 3.326 10 0 GGAEMN COCCOc1ncccc1NS(=O)(=O)c1cccc(Cl)c1Cl ZINC000590264680 567216249 /nfs/dbraw/zinc/21/62/49/567216249.db2.gz OATORXDEJJOYAN-UHFFFAOYSA-N 0 1 377.249 3.214 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN(C)C[C@H](O)Cc1ccccc1 ZINC000433038077 567217023 /nfs/dbraw/zinc/21/70/23/567217023.db2.gz FJTRKBOJOXTPCK-QGZVFWFLSA-N 0 1 392.293 3.271 10 0 GGAEMN COc1cccc(S(=O)(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)c1 ZINC000684579057 567217300 /nfs/dbraw/zinc/21/73/00/567217300.db2.gz DIAGVMDEYRYIIZ-RDTXWAMCSA-N 0 1 380.535 3.118 10 0 GGAEMN O=C(Nc1nc(-c2ccncc2)n[nH]1)c1cc2c(cccc2Br)[nH]1 ZINC000433081830 567220932 /nfs/dbraw/zinc/22/09/32/567220932.db2.gz HYLKKGZSYVUUDD-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN CCc1nc(CN2CCC[C@H]2c2ccccc2I)n[nH]1 ZINC000475032348 567221063 /nfs/dbraw/zinc/22/10/63/567221063.db2.gz LEIUPYLXZAGLON-ZDUSSCGKSA-N 0 1 382.249 3.309 10 0 GGAEMN O=C(NCCN1CCCOCC1)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000454998232 567221829 /nfs/dbraw/zinc/22/18/29/567221829.db2.gz JTFLITPJEMTEGX-KRWDZBQOSA-N 0 1 396.329 3.018 10 0 GGAEMN CC[C@@H]1CN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C[C@@]2(CCOC2)O1 ZINC000684626376 567221912 /nfs/dbraw/zinc/22/19/12/567221912.db2.gz XRWBOQPXSNWDMV-PMUMKWKESA-N 0 1 390.307 3.003 10 0 GGAEMN O=C(Cc1cc(Cl)ccc1Br)Nc1nc(-c2ccncc2)n[nH]1 ZINC000433103093 567222477 /nfs/dbraw/zinc/22/24/77/567222477.db2.gz IEQOENTZDCWJOW-UHFFFAOYSA-N 0 1 392.644 3.464 10 0 GGAEMN CC1(C)CN(C[C@H](O)COc2cc(Cl)ccc2Cl)C[C@@]2(CCOC2)O1 ZINC000684627196 567224106 /nfs/dbraw/zinc/22/41/06/567224106.db2.gz RDDZLDKQNAKJLV-KBXCAEBGSA-N 0 1 390.307 3.003 10 0 GGAEMN CC1(C)CN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C[C@@]2(CCOC2)O1 ZINC000684626820 567224152 /nfs/dbraw/zinc/22/41/52/567224152.db2.gz BAXOGRATLADCDU-SCLBCKFNSA-N 0 1 390.307 3.003 10 0 GGAEMN CC1(C)CN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C[C@@]2(CCOC2)O1 ZINC000684626818 567224195 /nfs/dbraw/zinc/22/41/95/567224195.db2.gz BAXOGRATLADCDU-FZKQIMNGSA-N 0 1 390.307 3.003 10 0 GGAEMN O=C(Nc1nc(-c2ccc3ccccc3n2)n[nH]1)c1cc(Br)c[nH]1 ZINC000590405895 567224364 /nfs/dbraw/zinc/22/43/64/567224364.db2.gz CQRWITBJHWRSSX-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN Cc1cc([C@@H]2CCCN2C[C@H](O)COC[C@H]2CCCO2)ccc1Br ZINC000684668082 567226461 /nfs/dbraw/zinc/22/64/61/567226461.db2.gz AGXZLNZEZPDCOU-SCTDSRPQSA-N 0 1 398.341 3.451 10 0 GGAEMN CCC[C@H]1CN(C(=O)Nc2nc(C(F)(F)F)cs2)CCN1CCOC ZINC000499143504 567226939 /nfs/dbraw/zinc/22/69/39/567226939.db2.gz YDKKCGKYXSJHPK-NSHDSACASA-N 0 1 380.436 3.127 10 0 GGAEMN CCc1nc(CNC(=O)Nc2ccc(C(F)(F)F)cc2Br)n[nH]1 ZINC000455039691 567227327 /nfs/dbraw/zinc/22/73/27/567227327.db2.gz XRNREUSMYNTGLL-UHFFFAOYSA-N 0 1 392.179 3.470 10 0 GGAEMN C[C@H](NC(=O)Nc1cnn(-c2ccncc2)c1)c1ccc(Br)cn1 ZINC000684687250 567228076 /nfs/dbraw/zinc/22/80/76/567228076.db2.gz GFJQNZOHRHDULX-NSHDSACASA-N 0 1 387.241 3.308 10 0 GGAEMN Cc1ccncc1[C@@H](C)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000684677153 567228276 /nfs/dbraw/zinc/22/82/76/567228276.db2.gz QATRCTQSMQLWOI-NWDGAFQWSA-N 0 1 398.326 3.212 10 0 GGAEMN O=C(Nc1nc2n(n1)CCCC2)c1c(F)c(F)c(Br)c(F)c1F ZINC000616164992 567229604 /nfs/dbraw/zinc/22/96/04/567229604.db2.gz CMVNGXOLWIIQNF-UHFFFAOYSA-N 0 1 393.138 3.186 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@@H](C2CC2)C1 ZINC000547605959 567229642 /nfs/dbraw/zinc/22/96/42/567229642.db2.gz NTLULXGVWZSPAC-MRXNPFEDSA-N 0 1 376.254 3.090 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(F)c(Br)cc2Cl)CC1 ZINC000475168843 567230077 /nfs/dbraw/zinc/23/00/77/567230077.db2.gz IMHVAZZDDSJKBZ-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(C(=O)c3ccc(Cl)cc3Cl)CC2)n[nH]1 ZINC000659836729 567230761 /nfs/dbraw/zinc/23/07/61/567230761.db2.gz VARKZKOSDGKBMU-NSHDSACASA-N 0 1 382.295 3.193 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(C(=O)c3ccc(Cl)cc3Cl)CC2)n[nH]1 ZINC000659836724 567230874 /nfs/dbraw/zinc/23/08/74/567230874.db2.gz VARKZKOSDGKBMU-LLVKDONJSA-N 0 1 382.295 3.193 10 0 GGAEMN CC[C@H](C)N1CCN(C(=O)Nc2ccc(Br)c(C(=O)OC)c2)CC1 ZINC000455074947 567231010 /nfs/dbraw/zinc/23/10/10/567231010.db2.gz JXTQNCFTEPGTSW-LBPRGKRZSA-N 0 1 398.301 3.184 10 0 GGAEMN [O-]C(=[NH+]c1ccncc1I)N1CC2(CC2)c2ccccc21 ZINC000455084851 567232900 /nfs/dbraw/zinc/23/29/00/567232900.db2.gz VFCZSAYMRQGSFD-UHFFFAOYSA-N 0 1 391.212 3.192 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1cc2n[nH]cc2c(C)c1 ZINC000499270961 567233389 /nfs/dbraw/zinc/23/33/89/567233389.db2.gz YGJHGVSGMHKHNA-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN CO[C@@H](CN1CCN(C(=O)c2ccc(Br)cc2)CC1)C1CCC1 ZINC000659869486 567233382 /nfs/dbraw/zinc/23/33/82/567233382.db2.gz WAJTYGMMBCMRSO-KRWDZBQOSA-N 0 1 381.314 3.022 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@H](C)C(C)(C)O ZINC000590643806 567237129 /nfs/dbraw/zinc/23/71/29/567237129.db2.gz CAFUIIHASCYVQB-SNVBAGLBSA-N 0 1 386.279 3.215 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H](OCC2CC2)C1 ZINC000547670148 567238308 /nfs/dbraw/zinc/23/83/08/567238308.db2.gz YAHNJJNALTUESY-CYBMUJFWSA-N 0 1 378.270 3.357 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)C1(c2cncc(Br)c2)CC1 ZINC000684899554 567243070 /nfs/dbraw/zinc/24/30/70/567243070.db2.gz MOCRDBPVCTUSQU-UHFFFAOYSA-N 0 1 384.237 3.095 10 0 GGAEMN CC(C)(O)CN(Cc1ncc(Br)cc1Cl)C1CCOCC1 ZINC000659990744 567244541 /nfs/dbraw/zinc/24/45/41/567244541.db2.gz PBDDIIZASSRZGL-UHFFFAOYSA-N 0 1 377.710 3.249 10 0 GGAEMN C[C@@H]1[C@@H](C(F)(F)F)CCN1Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000547771106 567244724 /nfs/dbraw/zinc/24/47/24/567244724.db2.gz QZNBEPGZAPCQPH-SKDRFNHKSA-N 0 1 390.203 3.230 10 0 GGAEMN Brc1ccc2oc(CN[C@H]3CCCN(c4ncccn4)C3)nc2c1 ZINC000638379462 567246370 /nfs/dbraw/zinc/24/63/70/567246370.db2.gz CTMLULUDIBQUEU-ZDUSSCGKSA-N 0 1 388.269 3.139 10 0 GGAEMN NC(=O)[C@@H](NCc1cnc(-c2ccccc2)[nH]1)c1cccc(Br)c1 ZINC000475444685 567249867 /nfs/dbraw/zinc/24/98/67/567249867.db2.gz YIPUFMHDGXHCDV-INIZCTEOSA-N 0 1 385.265 3.155 10 0 GGAEMN C[C@@H](Cc1cnc[nH]1)C(=O)NC1(c2ccc(Br)cc2)CCOCC1 ZINC000567483741 567250114 /nfs/dbraw/zinc/25/01/14/567250114.db2.gz BBHJFNJXZJHMHZ-ZDUSSCGKSA-N 0 1 392.297 3.173 10 0 GGAEMN C[C@H](Cc1cnc[nH]1)C(=O)NC1(c2ccc(Br)cc2)CCOCC1 ZINC000567483740 567250351 /nfs/dbraw/zinc/25/03/51/567250351.db2.gz BBHJFNJXZJHMHZ-CYBMUJFWSA-N 0 1 392.297 3.173 10 0 GGAEMN CCc1ccc([C@H]2CNCCN2C(=O)c2cc(Br)cn2C)cc1 ZINC000567604813 567260422 /nfs/dbraw/zinc/26/04/22/567260422.db2.gz FPGJFFINWJXYBE-QGZVFWFLSA-N 0 1 376.298 3.137 10 0 GGAEMN CN1CC(=O)N(CCN(Cc2ccccc2Br)C2CCCC2)C1=O ZINC000660100436 567261700 /nfs/dbraw/zinc/26/17/00/567261700.db2.gz LSIURYWGRDSBQF-UHFFFAOYSA-N 0 1 394.313 3.088 10 0 GGAEMN CCc1cnc(N2CCN(C(=O)c3cccc(Br)c3O)CC2)s1 ZINC000525770537 567264147 /nfs/dbraw/zinc/26/41/47/567264147.db2.gz RPWLSOBNHXATKX-UHFFFAOYSA-N 0 1 396.310 3.136 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@H](C2CC2)C1 ZINC000547927846 567265296 /nfs/dbraw/zinc/26/52/96/567265296.db2.gz SEVJFBXVDAKVRI-ZDUSSCGKSA-N 0 1 376.254 3.090 10 0 GGAEMN Cc1cnc(CCCC(=O)Nc2nc(-c3ccccc3Br)n[nH]2)o1 ZINC000567680619 567267799 /nfs/dbraw/zinc/26/77/99/567267799.db2.gz ZGIYULXLQSUFKJ-UHFFFAOYSA-N 0 1 390.241 3.492 10 0 GGAEMN O=c1cc(CN[C@H](c2cccnc2)C2CC2)nc2ccc(Br)cn12 ZINC000525833880 567268511 /nfs/dbraw/zinc/26/85/11/567268511.db2.gz PUXMTEXTSKWTCU-SFHVURJKSA-N 0 1 385.265 3.093 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@@H](c2cccs2)N(C)C)c1Br ZINC000525847204 567269213 /nfs/dbraw/zinc/26/92/13/567269213.db2.gz KKHFRSOQMTUNKT-LBPRGKRZSA-N 0 1 383.315 3.060 10 0 GGAEMN NC(=O)[C@@H](NC[C@@H]1CC12CCSCC2)c1ccc(Br)cc1F ZINC000567722606 567272382 /nfs/dbraw/zinc/27/23/82/567272382.db2.gz NUMMDAPJJNXCAU-HZMBPMFUSA-N 0 1 387.318 3.238 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CC2(C1)CCCC2 ZINC000547998698 567272745 /nfs/dbraw/zinc/27/27/45/567272745.db2.gz JHVYKXQVUVVCJG-UHFFFAOYSA-N 0 1 390.285 3.320 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CC2(C1)CCCC2 ZINC000547998698 567272747 /nfs/dbraw/zinc/27/27/47/567272747.db2.gz JHVYKXQVUVVCJG-UHFFFAOYSA-N 0 1 390.285 3.320 10 0 GGAEMN COc1cc(Cl)ccc1[C@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000567733537 567272642 /nfs/dbraw/zinc/27/26/42/567272642.db2.gz IQEAHAHRIMBHLB-GXTWGEPZSA-N 0 1 381.881 3.234 10 0 GGAEMN COCCOCCOCCCN1Cc2cc(Br)ccc2C[C@@H]1C ZINC000660162203 567273984 /nfs/dbraw/zinc/27/39/84/567273984.db2.gz LKXJUOSAYLIENY-HNNXBMFYSA-N 0 1 386.330 3.265 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)Nc2ccc(Br)c(C(=O)OC)c2)C[C@H]1C ZINC000548081794 567277930 /nfs/dbraw/zinc/27/79/30/567277930.db2.gz LKUAASMFRJCTKA-VXGBXAGGSA-N 0 1 398.301 3.182 10 0 GGAEMN Cc1c(CN(C)C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)cnn1C ZINC000548070788 567277979 /nfs/dbraw/zinc/27/79/79/567277979.db2.gz FIOSIAXSRRMBMM-UHFFFAOYSA-N 0 1 388.269 3.153 10 0 GGAEMN CN(C)CCN(CC1CCCCC1)S(=O)(=O)c1ccc2ncsc2c1 ZINC000475802073 567278763 /nfs/dbraw/zinc/27/87/63/567278763.db2.gz VSARVJJXAJKNPU-UHFFFAOYSA-N 0 1 381.567 3.429 10 0 GGAEMN Cc1cc2c(o1)c(C(=O)NC1(c3nn[nH]n3)CCCC1)ccc2Br ZINC000525954404 567279015 /nfs/dbraw/zinc/27/90/15/567279015.db2.gz ZHNRORIBHGXMCF-UHFFFAOYSA-N 0 1 390.241 3.216 10 0 GGAEMN CC(C)[C@@H](NCc1coc(S(N)(=O)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000660201807 567279433 /nfs/dbraw/zinc/27/94/33/567279433.db2.gz ZXUKMTBEQYFGMJ-OAHLLOKOSA-N 0 1 376.400 3.433 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)N3CCC[C@@H](c4nn[nH]n4)C3)coc21 ZINC000548107343 567280128 /nfs/dbraw/zinc/28/01/28/567280128.db2.gz DZRRYSFSZUMFLK-SNVBAGLBSA-N 0 1 390.241 3.037 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)N3CCC[C@H](c4nn[nH]n4)C3)coc21 ZINC000548107342 567280623 /nfs/dbraw/zinc/28/06/23/567280623.db2.gz DZRRYSFSZUMFLK-JTQLQIEISA-N 0 1 390.241 3.037 10 0 GGAEMN CC(C)CCc1nnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)s1 ZINC000617093066 567281234 /nfs/dbraw/zinc/28/12/34/567281234.db2.gz DZJCXTADQXXXAH-MNOVXSKESA-N 0 1 381.420 3.049 10 0 GGAEMN COCC[C@@H]1CCCCN(C(=O)[C@@](C)(N)c2ccc(Br)cc2)C1 ZINC000567825123 567282016 /nfs/dbraw/zinc/28/20/16/567282016.db2.gz WOHGWINUSTYPIT-KSSFIOAISA-N 0 1 383.330 3.288 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)N1CCSC[C@@H]1c1nccs1)C2 ZINC000526014132 567283209 /nfs/dbraw/zinc/28/32/09/567283209.db2.gz WOHMVCOYAZFPGQ-IUODEOHRSA-N 0 1 376.551 3.411 10 0 GGAEMN C[C@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)n1cccc1 ZINC000591455392 567283451 /nfs/dbraw/zinc/28/34/51/567283451.db2.gz ZMROHWHYPGMZCC-GFCCVEGCSA-N 0 1 388.269 3.303 10 0 GGAEMN C[C@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)n1cccc1 ZINC000591455392 567283457 /nfs/dbraw/zinc/28/34/57/567283457.db2.gz ZMROHWHYPGMZCC-GFCCVEGCSA-N 0 1 388.269 3.303 10 0 GGAEMN CC(C)C[C@H](N)c1noc(Cc2cc3c(cc2Br)OCCO3)n1 ZINC000567852580 567283531 /nfs/dbraw/zinc/28/35/31/567283531.db2.gz SKCZGIXIRRYJBM-LBPRGKRZSA-N 0 1 382.258 3.240 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000685589518 567283778 /nfs/dbraw/zinc/28/37/78/567283778.db2.gz ZXKQFUNWBZGRCR-QWRGUYRKSA-N 0 1 398.413 3.157 10 0 GGAEMN COc1ccc([C@@H](C)NC[C@H]2CS(=O)(=O)c3ccccc3O2)c(Cl)c1 ZINC000567857557 567284488 /nfs/dbraw/zinc/28/44/88/567284488.db2.gz IOLXIQUWAKPEFI-OCCSQVGLSA-N 0 1 381.881 3.234 10 0 GGAEMN C[C@H](NC[C@H]1CS(=O)(=O)c2ccccc2O1)c1ccc(Br)cc1 ZINC000567858091 567284830 /nfs/dbraw/zinc/28/48/30/567284830.db2.gz VBFSWRAACXXSHN-WFASDCNBSA-N 0 1 396.306 3.335 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@]1(c1ccccc1)C(F)(F)F ZINC000685597071 567285323 /nfs/dbraw/zinc/28/53/23/567285323.db2.gz DEGGTFYKUXENLR-INIZCTEOSA-N 0 1 378.460 3.212 10 0 GGAEMN COc1ccccc1[C@@H](CO)NCc1nc2ccc(Br)cc2[nH]1 ZINC000548158730 567285747 /nfs/dbraw/zinc/28/57/47/567285747.db2.gz IZUVIRVKYUQORB-OAHLLOKOSA-N 0 1 376.254 3.157 10 0 GGAEMN CC(C)[C@H]1C[C@H]1C(=O)Nc1cc(Br)ccc1N1CCN(C)CC1 ZINC000475890937 567286338 /nfs/dbraw/zinc/28/63/38/567286338.db2.gz DQOQBTOLPRNNIM-HUUCEWRRSA-N 0 1 380.330 3.432 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cccc(F)c1Br ZINC000499972127 567287729 /nfs/dbraw/zinc/28/77/29/567287729.db2.gz IVQVNJZBXGVYNC-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN Cc1nc2ccccc2n1CCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000499993800 567288669 /nfs/dbraw/zinc/28/86/69/567288669.db2.gz BRVGRTYCYWDAIV-UHFFFAOYSA-N 0 1 398.264 3.414 10 0 GGAEMN O=C(Nc1ccn(-c2ccncc2)n1)C1(c2ccccc2Br)CC1 ZINC000475944563 567288966 /nfs/dbraw/zinc/28/89/66/567288966.db2.gz FYBCTQNNDDCJKM-UHFFFAOYSA-N 0 1 383.249 3.122 10 0 GGAEMN CN(C(=O)c1cc2sc(N3CCCC3)nc2s1)[C@H]1CCN(C2CC2)C1 ZINC000475933719 567289137 /nfs/dbraw/zinc/28/91/37/567289137.db2.gz OSYBLINSPNEGCZ-ZDUSSCGKSA-N 0 1 376.551 3.267 10 0 GGAEMN COC[C@H](CN1CCC[C@H]1c1nc(-c2ccccc2Br)no1)OC ZINC000660383191 567290536 /nfs/dbraw/zinc/29/05/36/567290536.db2.gz ZVFVFYDMZICMEW-WFASDCNBSA-N 0 1 396.285 3.297 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)Nc2ccc(Br)cc2C(=O)OC)C[C@@H]1C ZINC000500033788 567291460 /nfs/dbraw/zinc/29/14/60/567291460.db2.gz CJDGQBTUYZAKOW-RYUDHWBXSA-N 0 1 398.301 3.182 10 0 GGAEMN Clc1cc(Br)cnc1CN[C@@H]1CCCC[C@@H]1N1CCOCC1 ZINC000660387517 567291624 /nfs/dbraw/zinc/29/16/24/567291624.db2.gz KEUMBSWFCATIDH-ZBFHGGJFSA-N 0 1 388.737 3.231 10 0 GGAEMN CC(C)CN1CCN(C(=O)Cc2c(F)ccc(Br)c2F)CC1 ZINC000500024743 567292172 /nfs/dbraw/zinc/29/21/72/567292172.db2.gz DXYBEEOKTMIHDF-UHFFFAOYSA-N 0 1 375.257 3.070 10 0 GGAEMN Clc1cc(Br)cnc1CN[C@H]1CCCC[C@H]1N1CCOCC1 ZINC000660387515 567292292 /nfs/dbraw/zinc/29/22/92/567292292.db2.gz KEUMBSWFCATIDH-GOEBONIOSA-N 0 1 388.737 3.231 10 0 GGAEMN CNS(=O)(=O)c1ccc(CN(C)Cc2ccc(Br)cc2C)cc1 ZINC000660419339 567292819 /nfs/dbraw/zinc/29/28/19/567292819.db2.gz WEGRCRHBXBYWTN-UHFFFAOYSA-N 0 1 397.338 3.298 10 0 GGAEMN Brc1cncc(Br)c1CNC1CC(n2cccn2)C1 ZINC000639218733 567297375 /nfs/dbraw/zinc/29/73/75/567297375.db2.gz GXTNKYFBOOEEGO-UHFFFAOYSA-N 0 1 386.091 3.296 10 0 GGAEMN C[S@@](=O)c1ccc(C(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)cc1 ZINC000591801570 567298559 /nfs/dbraw/zinc/29/85/59/567298559.db2.gz UBWIWBRSMZSKLK-RUZDIDTESA-N 0 1 377.535 3.289 10 0 GGAEMN CO[C@H](CN(CCNC(C)=O)Cc1ccc(Br)s1)C1CCC1 ZINC000660483158 567299080 /nfs/dbraw/zinc/29/90/80/567299080.db2.gz MDXDAYXLBNTXDW-OAHLLOKOSA-N 0 1 389.359 3.264 10 0 GGAEMN C[S@@](=O)c1cccc(C(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)c1 ZINC000591802280 567299110 /nfs/dbraw/zinc/29/91/10/567299110.db2.gz NXKDDZXGLIOFEG-RUZDIDTESA-N 0 1 377.535 3.289 10 0 GGAEMN C[C@H](c1ccccc1)[C@H](CO)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000685816696 567299243 /nfs/dbraw/zinc/29/92/43/567299243.db2.gz OTUFMPQBAOZAGM-BZNIZROVSA-N 0 1 388.265 3.220 10 0 GGAEMN C[C@H](c1ccccc1)[C@@H](CO)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000685816695 567299675 /nfs/dbraw/zinc/29/96/75/567299675.db2.gz OTUFMPQBAOZAGM-BDJLRTHQSA-N 0 1 388.265 3.220 10 0 GGAEMN CCCC[C@@H](NC(=O)NCC)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000434240398 567300662 /nfs/dbraw/zinc/30/06/62/567300662.db2.gz SISVVMFAXBUTQU-GFCCVEGCSA-N 0 1 396.289 3.142 10 0 GGAEMN C[C@H](NCc1nnc(C(F)(F)F)s1)C1CCN(CC(F)(F)F)CC1 ZINC000660487084 567300822 /nfs/dbraw/zinc/30/08/22/567300822.db2.gz OJPLQVQOUQWWLB-QMMMGPOBSA-N 0 1 376.370 3.309 10 0 GGAEMN CNS(=O)(=O)c1ccc(CN2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000660489342 567301075 /nfs/dbraw/zinc/30/10/75/567301075.db2.gz WDCGALWPGZFDDL-HNNXBMFYSA-N 0 1 376.444 3.149 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1cn[nH]c1-c1ccccn1 ZINC000685827552 567301190 /nfs/dbraw/zinc/30/11/90/567301190.db2.gz BZARHVVXXZEDBW-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074493 567302429 /nfs/dbraw/zinc/30/24/29/567302429.db2.gz KINIYCXCDJSBIG-JKSUJKDBSA-N 0 1 380.897 3.451 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074493 567302434 /nfs/dbraw/zinc/30/24/34/567302434.db2.gz KINIYCXCDJSBIG-JKSUJKDBSA-N 0 1 380.897 3.451 10 0 GGAEMN COc1ccc(C[N@@H+]2C[C@@H](c3ccc(Br)cc3)[C@H](C(=O)[O-])C2)cn1 ZINC000568073547 567302490 /nfs/dbraw/zinc/30/24/90/567302490.db2.gz DVMXPGWDYQOHDL-JKSUJKDBSA-N 0 1 391.265 3.153 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)c1cn[nH]c1-c1cnn(C)c1 ZINC000434344889 567305285 /nfs/dbraw/zinc/30/52/85/567305285.db2.gz RJQAFWXLCYVSSX-UHFFFAOYSA-N 0 1 388.269 3.153 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@@H]1CCCN(C)C1 ZINC000617414872 567305993 /nfs/dbraw/zinc/30/59/93/567305993.db2.gz SVMWFEWVPULFTR-CMPLNLGQSA-N 0 1 375.694 3.080 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cccnc2Oc2cccc(Br)c2)C1 ZINC000617414141 567306170 /nfs/dbraw/zinc/30/61/70/567306170.db2.gz ANXFALUUSQWBDG-CQSZACIVSA-N 0 1 390.281 3.460 10 0 GGAEMN CCc1c(C(=O)N[C@H]2CCCN(C)C2)cnn1-c1ccc(Br)cc1 ZINC000617415717 567306209 /nfs/dbraw/zinc/30/62/09/567306209.db2.gz MPWHZZWDSWWASH-AWEZNQCLSA-N 0 1 391.313 3.021 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2csc(-c3cc(Br)cs3)n2)C1 ZINC000617415690 567306253 /nfs/dbraw/zinc/30/62/53/567306253.db2.gz LWACDSYGTQYFAT-JTQLQIEISA-N 0 1 386.340 3.458 10 0 GGAEMN C[C@]1(C2CC2)CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)CCO1 ZINC000617398509 567306393 /nfs/dbraw/zinc/30/63/93/567306393.db2.gz IHZPWEXRNVCXMT-GOSISDBHSA-N 0 1 390.281 3.480 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)N[C@H]1CCCN(C)C1 ZINC000617415900 567306851 /nfs/dbraw/zinc/30/68/51/567306851.db2.gz TZJOCPXQDYMIMR-HNNXBMFYSA-N 0 1 391.313 3.076 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2csc(-c3cc(Br)cs3)n2)C1 ZINC000617415691 567306968 /nfs/dbraw/zinc/30/69/68/567306968.db2.gz LWACDSYGTQYFAT-SNVBAGLBSA-N 0 1 386.340 3.458 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@H]1CCCN(C)C1 ZINC000617414873 567307035 /nfs/dbraw/zinc/30/70/35/567307035.db2.gz SVMWFEWVPULFTR-JQWIXIFHSA-N 0 1 375.694 3.080 10 0 GGAEMN C[C@H](Cc1ccccc1C(F)(F)F)N(C)Cc1coc(S(N)(=O)=O)c1 ZINC000660549391 567307675 /nfs/dbraw/zinc/30/76/75/567307675.db2.gz LSSPZMJABCPWEQ-LLVKDONJSA-N 0 1 376.400 3.009 10 0 GGAEMN C[C@@H](Cc1ccccc1C(F)(F)F)N(C)Cc1coc(S(N)(=O)=O)c1 ZINC000660549392 567308216 /nfs/dbraw/zinc/30/82/16/567308216.db2.gz LSSPZMJABCPWEQ-NSHDSACASA-N 0 1 376.400 3.009 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NC[C@H](C)CC(F)F ZINC000592066858 567311366 /nfs/dbraw/zinc/31/13/66/567311366.db2.gz ICENDITVVGZQGH-SSDOTTSWSA-N 0 1 390.235 3.350 10 0 GGAEMN CCC[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)c1nn[nH]n1 ZINC000476312153 567313314 /nfs/dbraw/zinc/31/33/14/567313314.db2.gz YCMVBVHYWVFQHC-JTQLQIEISA-N 0 1 376.617 3.026 10 0 GGAEMN CCC[C@@H](NC(=O)c1cc(F)c(Br)cc1Cl)c1nn[nH]n1 ZINC000476312163 567313420 /nfs/dbraw/zinc/31/34/20/567313420.db2.gz YCMVBVHYWVFQHC-SNVBAGLBSA-N 0 1 376.617 3.026 10 0 GGAEMN C[C@@H](CNC(=O)N(C)CC1CN(C)C1)Sc1ccc(Br)cc1 ZINC000660628610 567313471 /nfs/dbraw/zinc/31/34/71/567313471.db2.gz ALJTWPDNBPIFHL-LBPRGKRZSA-N 0 1 386.359 3.133 10 0 GGAEMN C[C@@H](NC[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ncc(Br)cn1 ZINC000660624711 567313903 /nfs/dbraw/zinc/31/39/03/567313903.db2.gz GCJZOPGYNLSKTR-OLZOCXBDSA-N 0 1 383.334 3.174 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(C)o2)c(I)c1 ZINC000434633867 567316811 /nfs/dbraw/zinc/31/68/11/567316811.db2.gz MHDBLZBQMAXNBV-UHFFFAOYSA-N 0 1 393.202 3.002 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)c(F)c2)n[nH]1 ZINC000527159163 567317596 /nfs/dbraw/zinc/31/75/96/567317596.db2.gz ZQFRBQWHEMNYFV-SULUZNBOSA-N 0 1 395.276 3.406 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(OC(F)F)c(Cl)c2)[C@@H]1SC ZINC000592166181 567317833 /nfs/dbraw/zinc/31/78/33/567317833.db2.gz HQWUPEVENLOQSV-KYOSRNDESA-N 0 1 394.871 3.379 10 0 GGAEMN NCc1ccc(C(=O)N2CCC[C@H]2c2ccccc2I)o1 ZINC000592141189 567318076 /nfs/dbraw/zinc/31/80/76/567318076.db2.gz IOAUCMYMAKRPFW-AWEZNQCLSA-N 0 1 396.228 3.320 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCC(=O)N2CC[C@H](C)Sc3ccccc32)[C@@H]1SC ZINC000592165712 567318175 /nfs/dbraw/zinc/31/81/75/567318175.db2.gz DYZWOMDHXMONKB-ZDXGLAPJSA-N 0 1 380.579 3.403 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@H](c1cccs1)C(C)(C)CO ZINC000568331940 567319624 /nfs/dbraw/zinc/31/96/24/567319624.db2.gz YFXCPUHWDOTINO-OAHLLOKOSA-N 0 1 380.476 3.444 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@@H]2CCN(c3cccc(Br)c3)C2=O)[C@@H]1SC ZINC000592173407 567320488 /nfs/dbraw/zinc/32/04/88/567320488.db2.gz SHAJDZNYADMAOJ-FPCVCCKLSA-N 0 1 399.354 3.053 10 0 GGAEMN CNC(=O)Cc1nc(CN(C)[C@@H](C)c2nc3ccc(Cl)cc3[nH]2)cs1 ZINC000660710064 567320909 /nfs/dbraw/zinc/32/09/09/567320909.db2.gz OFFLAKUGYOVYSJ-JTQLQIEISA-N 0 1 377.901 3.154 10 0 GGAEMN CCN(C(=O)CSc1nc(C)nc2sc(C)c(C)c21)[C@H]1CCN(C)C1 ZINC000617560113 567322056 /nfs/dbraw/zinc/32/20/56/567322056.db2.gz HMLVXIRHEYUILY-AWEZNQCLSA-N 0 1 378.567 3.261 10 0 GGAEMN CCN(C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1)[C@H]1CCN(C)C1 ZINC000617560163 567323579 /nfs/dbraw/zinc/32/35/79/567323579.db2.gz IWRPKSHVKFFBLH-AWEZNQCLSA-N 0 1 380.901 3.035 10 0 GGAEMN Cn1ncc(Br)c1CN[C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000500471557 567323806 /nfs/dbraw/zinc/32/38/06/567323806.db2.gz QKMUUVPYQOZPRX-MRXNPFEDSA-N 0 1 384.705 3.327 10 0 GGAEMN CCN(C(=O)c1cc(-c2ccc(Br)cc2)no1)[C@H]1CCN(C)C1 ZINC000617562224 567323944 /nfs/dbraw/zinc/32/39/44/567323944.db2.gz DIGGSKYWBGCJAK-AWEZNQCLSA-N 0 1 378.270 3.270 10 0 GGAEMN COc1ccc(C(=O)COc2cc(F)ccc2Br)c2c1C(=O)CO2 ZINC000568377815 567324294 /nfs/dbraw/zinc/32/42/94/567324294.db2.gz XRIYTZAAOCITJW-UHFFFAOYSA-N 0 1 395.180 3.434 10 0 GGAEMN Brc1ccc2nc(CN3CCC[C@@H](n4ccnn4)CC3)oc2c1 ZINC000639824076 567326308 /nfs/dbraw/zinc/32/63/08/567326308.db2.gz GKNVPZQLASJXAB-CYBMUJFWSA-N 0 1 376.258 3.409 10 0 GGAEMN O=C(NC[C@H](CO)CC1CCCC1)c1n[nH]c2ccc(Br)cc21 ZINC000500540025 567328853 /nfs/dbraw/zinc/32/88/53/567328853.db2.gz ZEXFXZNAWFOPAK-GFCCVEGCSA-N 0 1 380.286 3.244 10 0 GGAEMN CC(C)NC(=O)CC[N@@H+](CCc1ccc(Cl)cc1)C[C@H](O)C(F)(F)F ZINC000568438148 567328924 /nfs/dbraw/zinc/32/89/24/567328924.db2.gz HUEPNUVMGMOZQZ-HNNXBMFYSA-N 0 1 380.838 3.022 10 0 GGAEMN CC(C)NC(=O)CCN(CCc1ccc(Cl)cc1)C[C@H](O)C(F)(F)F ZINC000568438148 567328926 /nfs/dbraw/zinc/32/89/26/567328926.db2.gz HUEPNUVMGMOZQZ-HNNXBMFYSA-N 0 1 380.838 3.022 10 0 GGAEMN C[C@H](CN(C)Cc1ccccc1)NS(=O)(=O)c1ccc2ncsc2c1 ZINC000476515622 567330930 /nfs/dbraw/zinc/33/09/30/567330930.db2.gz PIKGFCXQYNAQME-CQSZACIVSA-N 0 1 375.519 3.095 10 0 GGAEMN COc1cc(NC(=O)[C@H]2CCc3[nH]c(C(C)C)nc3C2)ncc1Br ZINC000476535259 567333262 /nfs/dbraw/zinc/33/32/62/567333262.db2.gz NGOIUADNNWNGBA-JTQLQIEISA-N 0 1 393.285 3.443 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(OC)c(O)c2Br)[C@@H]1SC ZINC000592376769 567333989 /nfs/dbraw/zinc/33/39/89/567333989.db2.gz GUPQBKOWKWUYSE-HCKVZZMMSA-N 0 1 376.316 3.162 10 0 GGAEMN Cc1nc(S(=O)(=O)[N-]Cc2ccc(C[NH+]3CCCCC3)cc2)sc1C ZINC000434946569 567336473 /nfs/dbraw/zinc/33/64/73/567336473.db2.gz JQACWFWBYBUXOX-UHFFFAOYSA-N 0 1 379.551 3.224 10 0 GGAEMN C[C@H]1[C@@H](NC(=O)c2ncsc2Br)CCN1Cc1ccccc1 ZINC000568550886 567337757 /nfs/dbraw/zinc/33/77/57/567337757.db2.gz MVXVGQMAICUTCE-AAEUAGOBSA-N 0 1 380.311 3.298 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000568582447 567340250 /nfs/dbraw/zinc/34/02/50/567340250.db2.gz SBXPXRHIFYJCMR-DZGCQCFKSA-N 0 1 376.913 3.497 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000592504807 567342331 /nfs/dbraw/zinc/34/23/31/567342331.db2.gz ZFDVYQGZRCFURO-BDJLRTHQSA-N 0 1 390.286 3.310 10 0 GGAEMN COC(=O)Cc1ccc(NS(=O)(=O)c2cccc(C)c2Br)cc1 ZINC000435132080 567344105 /nfs/dbraw/zinc/34/41/05/567344105.db2.gz HESGMZRWLUQVHS-UHFFFAOYSA-N 0 1 398.278 3.274 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CCc2ccc(F)c(Br)c2C1 ZINC000527593100 567344731 /nfs/dbraw/zinc/34/47/31/567344731.db2.gz FZGSTQMOPXSPSP-UHFFFAOYSA-N 0 1 395.276 3.320 10 0 GGAEMN CCOC(=O)c1sc([C@@H](C)NC(=O)[C@H](N)c2cccc(Cl)c2)nc1C ZINC000592538549 567345351 /nfs/dbraw/zinc/34/53/51/567345351.db2.gz TZZBNJREZPTYIR-ZWNOBZJWSA-N 0 1 381.885 3.159 10 0 GGAEMN C[C@@H]1COC2(CCC2)CN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000617945940 567346737 /nfs/dbraw/zinc/34/67/37/567346737.db2.gz ANHWGVMVRUONNG-LLVKDONJSA-N 0 1 391.265 3.074 10 0 GGAEMN COCc1nc(CNC(=O)c2sc(-c3ccc(Cl)s3)nc2C)n[nH]1 ZINC000617938267 567346839 /nfs/dbraw/zinc/34/68/39/567346839.db2.gz RBEUNWRAMZHDPX-UHFFFAOYSA-N 0 1 383.886 3.028 10 0 GGAEMN COCc1nnc(CNC(=O)c2sc(-c3ccc(Cl)s3)nc2C)[nH]1 ZINC000617938267 567346841 /nfs/dbraw/zinc/34/68/41/567346841.db2.gz RBEUNWRAMZHDPX-UHFFFAOYSA-N 0 1 383.886 3.028 10 0 GGAEMN CCN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@H]1CC[N@H+](CC)C1 ZINC000617923698 567346943 /nfs/dbraw/zinc/34/69/43/567346943.db2.gz HUZXPAHASHGZRY-LBPRGKRZSA-N 0 1 392.297 3.259 10 0 GGAEMN CCN(C(=O)c1c([O-])cnc2c(Br)cccc21)[C@H]1CC[N@@H+](CC)C1 ZINC000617923698 567346947 /nfs/dbraw/zinc/34/69/47/567346947.db2.gz HUZXPAHASHGZRY-LBPRGKRZSA-N 0 1 392.297 3.259 10 0 GGAEMN COCc1nc(CNC(=O)c2oc3c(cc(Br)cc3C)c2C)n[nH]1 ZINC000617935439 567346973 /nfs/dbraw/zinc/34/69/73/567346973.db2.gz AZTHDUJYFRCUBM-UHFFFAOYSA-N 0 1 393.241 3.007 10 0 GGAEMN COCc1nnc(CNC(=O)c2oc3c(cc(Br)cc3C)c2C)[nH]1 ZINC000617935439 567346980 /nfs/dbraw/zinc/34/69/80/567346980.db2.gz AZTHDUJYFRCUBM-UHFFFAOYSA-N 0 1 393.241 3.007 10 0 GGAEMN C[C@H]1COC2(CCC2)CN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000617945941 567347022 /nfs/dbraw/zinc/34/70/22/567347022.db2.gz ANHWGVMVRUONNG-NSHDSACASA-N 0 1 391.265 3.074 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1cc(F)ccc1Br ZINC000435227692 567350536 /nfs/dbraw/zinc/35/05/36/567350536.db2.gz UXPZBTLDEHCBTB-TXEJJXNPSA-N 0 1 393.322 3.129 10 0 GGAEMN N[C@H](Cc1ccccc1)C(=O)N1CCc2ccc(F)c(Br)c2C1 ZINC000527617024 567350784 /nfs/dbraw/zinc/35/07/84/567350784.db2.gz AJCPPQPIQMZBAW-MRXNPFEDSA-N 0 1 377.257 3.043 10 0 GGAEMN O=C([C@H]1Cc2ccccc2CN1)N1CCc2ccc(F)c(Br)c2C1 ZINC000527617456 567350862 /nfs/dbraw/zinc/35/08/62/567350862.db2.gz LRIAKFZEDLVWHM-QGZVFWFLSA-N 0 1 389.268 3.187 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1cc(F)ccc1Br ZINC000435227693 567351200 /nfs/dbraw/zinc/35/12/00/567351200.db2.gz UXPZBTLDEHCBTB-VXGBXAGGSA-N 0 1 393.322 3.129 10 0 GGAEMN CCCOc1ccc(Br)cc1CN1CC[C@H](Cn2ccnn2)C1 ZINC000661139142 567351632 /nfs/dbraw/zinc/35/16/32/567351632.db2.gz GZZVPGQWZSEXNZ-AWEZNQCLSA-N 0 1 379.302 3.352 10 0 GGAEMN CCCOc1ccc(Br)cc1CN1CC[C@@H](Cn2ccnn2)C1 ZINC000661139155 567351672 /nfs/dbraw/zinc/35/16/72/567351672.db2.gz GZZVPGQWZSEXNZ-CQSZACIVSA-N 0 1 379.302 3.352 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2ccc(F)c(Br)c2C1 ZINC000527627945 567351942 /nfs/dbraw/zinc/35/19/42/567351942.db2.gz KAPYHMXRIVKBBL-NSHDSACASA-N 0 1 378.245 3.001 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000476856565 567352386 /nfs/dbraw/zinc/35/23/86/567352386.db2.gz PHQCHZCBGPAJGS-CYBMUJFWSA-N 0 1 379.291 3.463 10 0 GGAEMN Brc1ccccc1-c1cnc(CN2CC[C@@H](Cn3ccnn3)C2)o1 ZINC000661143012 567352617 /nfs/dbraw/zinc/35/26/17/567352617.db2.gz FBEAORFQYPVNKB-CYBMUJFWSA-N 0 1 388.269 3.218 10 0 GGAEMN Cc1cc(Br)c(CN[C@@H](C)Cn2cncn2)cc1Br ZINC000527650740 567354676 /nfs/dbraw/zinc/35/46/76/567354676.db2.gz WJUDHXMLWYABAV-JTQLQIEISA-N 0 1 388.107 3.290 10 0 GGAEMN C[C@@H](CN1CCN(c2ccccn2)CC1)NCc1ccsc1Br ZINC000527660599 567356672 /nfs/dbraw/zinc/35/66/72/567356672.db2.gz FVGSCCJQVSULRM-AWEZNQCLSA-N 0 1 395.370 3.206 10 0 GGAEMN O=C(NCc1cc(Br)ccc1F)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000527660449 567356696 /nfs/dbraw/zinc/35/66/96/567356696.db2.gz QLBHVENOGCXTTK-HNNXBMFYSA-N 0 1 384.293 3.404 10 0 GGAEMN CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2nc3ccc(Br)cc3o2)C1 ZINC000661215040 567357613 /nfs/dbraw/zinc/35/76/13/567357613.db2.gz DRDWUSNVRHVJFH-KYOSRNDESA-N 0 1 383.286 3.246 10 0 GGAEMN CS(=O)(=O)[C@H]1CCC[C@H](NCc2ccc(Br)c(F)c2F)C1 ZINC000527665939 567357588 /nfs/dbraw/zinc/35/75/88/567357588.db2.gz RWJOTMCAPYGSAT-QWRGUYRKSA-N 0 1 382.270 3.173 10 0 GGAEMN O=C(NC[C@@H](c1ccco1)N1CCCCC1)c1cc[nH]c(=O)c1Br ZINC000435358767 567357986 /nfs/dbraw/zinc/35/79/86/567357986.db2.gz RMUVHLJQVYRBQX-ZDUSSCGKSA-N 0 1 394.269 3.100 10 0 GGAEMN O=C(NC[C@H](c1ccco1)N1CCCCC1)c1cc[nH]c(=O)c1Br ZINC000435358766 567358171 /nfs/dbraw/zinc/35/81/71/567358171.db2.gz RMUVHLJQVYRBQX-CYBMUJFWSA-N 0 1 394.269 3.100 10 0 GGAEMN COc1ccccc1[C@H](CNC(=O)[C@H]1C[C@@]1(C)Br)N1CCCC1 ZINC000527682967 567361173 /nfs/dbraw/zinc/36/11/73/567361173.db2.gz MQOMTCDTGKVRTL-RVKKMQEKSA-N 0 1 381.314 3.122 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 ZINC000618197536 567362248 /nfs/dbraw/zinc/36/22/48/567362248.db2.gz OYMOXHFBWSCLBH-UHFFFAOYSA-N 0 1 377.897 3.287 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000618194527 567362761 /nfs/dbraw/zinc/36/27/61/567362761.db2.gz BAJTWOPKGSMZSD-UHFFFAOYSA-N 0 1 393.281 3.255 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@H]1C ZINC000501077394 567362884 /nfs/dbraw/zinc/36/28/84/567362884.db2.gz URHMDGKZXFXZIP-NWDGAFQWSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@H]1C ZINC000501077394 567362892 /nfs/dbraw/zinc/36/28/92/567362892.db2.gz URHMDGKZXFXZIP-NWDGAFQWSA-N 0 1 392.301 3.422 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Cc1csc(-c2cccc(Br)c2)n1 ZINC000618196937 567363039 /nfs/dbraw/zinc/36/30/39/567363039.db2.gz UFYJYDRXJCLLFC-UHFFFAOYSA-N 0 1 394.338 3.135 10 0 GGAEMN O[C@@H](CN1CCOCC1)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000476995603 567363755 /nfs/dbraw/zinc/36/37/55/567363755.db2.gz MUUOBLAMZLTNDG-GOSISDBHSA-N 0 1 385.335 3.166 10 0 GGAEMN C[C@@H](CNC(=O)c1n[nH]c2ccc(I)cc21)CC(F)F ZINC000592827175 567366299 /nfs/dbraw/zinc/36/62/99/567366299.db2.gz XHTHTJRCKBMPGV-SSDOTTSWSA-N 0 1 393.175 3.189 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(Br)c(F)c2F)[C@H]1n1cccn1 ZINC000527711873 567366993 /nfs/dbraw/zinc/36/69/93/567366993.db2.gz BOSWBZPLBKQLNZ-XJKCOSOUSA-N 0 1 386.240 3.432 10 0 GGAEMN O=S(=O)(c1ccccc1)N1CC[C@H](NCc2ccsc2C(F)(F)F)C1 ZINC000527707549 567367049 /nfs/dbraw/zinc/36/70/49/567367049.db2.gz DZTBFOHTIVTIJX-ZDUSSCGKSA-N 0 1 390.452 3.320 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CC1)c1csc(-c2ccc(Cl)cc2Cl)n1 ZINC000477050318 567367299 /nfs/dbraw/zinc/36/72/99/567367299.db2.gz MLBJMURFMHRJCX-UHFFFAOYSA-N 0 1 381.248 3.049 10 0 GGAEMN COCCOc1cccc(CNC(=O)c2cccc(Br)c2O)c1 ZINC000592844379 567368069 /nfs/dbraw/zinc/36/80/69/567368069.db2.gz OJPKPRQXLGLVNQ-UHFFFAOYSA-N 0 1 380.238 3.110 10 0 GGAEMN CCc1cccnc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000501124222 567368342 /nfs/dbraw/zinc/36/83/42/567368342.db2.gz HMAURACTENZXMQ-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN CCc1cccnc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000501124222 567368349 /nfs/dbraw/zinc/36/83/49/567368349.db2.gz HMAURACTENZXMQ-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC[C@](O)(C2CC2)C1 ZINC000618288773 567370141 /nfs/dbraw/zinc/37/01/41/567370141.db2.gz HEQLAVQVYZWVNY-GOSISDBHSA-N 0 1 390.281 3.216 10 0 GGAEMN Cn1nccc1CCN1CCC[C@@H]1c1ccc(I)cc1 ZINC000549040628 567370395 /nfs/dbraw/zinc/37/03/95/567370395.db2.gz IUUAZTKPRGCVFT-MRXNPFEDSA-N 0 1 381.261 3.404 10 0 GGAEMN CN(C)[C@H](CNC(=O)NC[C@H]1CSc2ccccc2O1)c1ccsc1 ZINC000568979057 567370818 /nfs/dbraw/zinc/37/08/18/567370818.db2.gz QFHGMJUPUUDFKT-LSDHHAIUSA-N 0 1 377.535 3.203 10 0 GGAEMN O[C@@H](CNCc1csc(-c2cccc(Br)c2)n1)[C@H]1CCCO1 ZINC000527760855 567373536 /nfs/dbraw/zinc/37/35/36/567373536.db2.gz SYTAKXLYNWUYEQ-LSDHHAIUSA-N 0 1 383.311 3.202 10 0 GGAEMN CS[C@H]1CN(S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@@H]1N1CCCC1 ZINC000477135899 567374418 /nfs/dbraw/zinc/37/44/18/567374418.db2.gz BTCYNHOZJZFGKQ-KBPBESRZSA-N 0 1 395.377 3.194 10 0 GGAEMN COc1cc(Br)c(CNCCc2ccc(OC)nc2)c(OC)c1 ZINC000527792992 567374707 /nfs/dbraw/zinc/37/47/07/567374707.db2.gz FRBNXHPAJAVJLN-UHFFFAOYSA-N 0 1 381.270 3.202 10 0 GGAEMN CN(C)C[C@H](NCc1ccc(C(=O)N(C)C)[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000527810225 567376267 /nfs/dbraw/zinc/37/62/67/567376267.db2.gz PABKDFYMPFFZDR-KRWDZBQOSA-N 0 1 383.323 3.416 10 0 GGAEMN C[C@@]12COC[C@]1(C)CN(Cc1nnc(-c3ccccc3Br)o1)C2 ZINC000661499051 567376792 /nfs/dbraw/zinc/37/67/92/567376792.db2.gz KIQKVVMUWBGVPK-CALCHBBNSA-N 0 1 378.270 3.358 10 0 GGAEMN O=C(N[C@@H]1CSCc2ccc(Br)cc21)[C@@H]1CCc2[nH]cnc2C1 ZINC000618359859 567377821 /nfs/dbraw/zinc/37/78/21/567377821.db2.gz GJWIOVYGISNTTL-QLJPJBMISA-N 0 1 392.322 3.381 10 0 GGAEMN CC(F)(F)CNS(=O)(=O)c1ccc(Br)cc1C(F)(F)F ZINC000569091056 567378557 /nfs/dbraw/zinc/37/85/57/567378557.db2.gz APLHFWNAFHBOAT-UHFFFAOYSA-N 0 1 382.148 3.401 10 0 GGAEMN CO[C@@H](CN1CCO[C@H](c2ccc(Br)cc2)[C@H]1C)[C@H]1CCOC1 ZINC000661517985 567379291 /nfs/dbraw/zinc/37/92/91/567379291.db2.gz ZXJTXDLCTJJJLM-KCMWZYNZSA-N 0 1 384.314 3.262 10 0 GGAEMN C[C@@H]1CC[N@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@H]1C(=O)[O-] ZINC000569101788 567379672 /nfs/dbraw/zinc/37/96/72/567379672.db2.gz DKAPPXGEERJGPU-RKDXNWHRSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@H]1C(=O)[O-] ZINC000569101788 567379673 /nfs/dbraw/zinc/37/96/73/567379673.db2.gz DKAPPXGEERJGPU-RKDXNWHRSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@@H]3C[C@]3(C)Br)cc2)C[C@H](C)O1 ZINC000527907730 567383021 /nfs/dbraw/zinc/38/30/21/567383021.db2.gz BUGSRLJCKDXOHL-CSHUHZATSA-N 0 1 395.341 3.086 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCOc3ccc(Br)cc3C2)CC1 ZINC000549286523 567383662 /nfs/dbraw/zinc/38/36/62/567383662.db2.gz AFKUIDIQEYAYDY-UHFFFAOYSA-N 0 1 394.313 3.005 10 0 GGAEMN O[C@@]1(C2CC2)CCCN(Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000661635563 567383706 /nfs/dbraw/zinc/38/37/06/567383706.db2.gz PLSMWTHOKPFQPI-KRWDZBQOSA-N 0 1 378.270 3.236 10 0 GGAEMN COc1ccc(CNC[C@@H]2CS(=O)(=O)c3ccccc32)c(Br)c1 ZINC000569188168 567384940 /nfs/dbraw/zinc/38/49/40/567384940.db2.gz XWJNRXHWWOAKPC-CYBMUJFWSA-N 0 1 396.306 3.118 10 0 GGAEMN C[C@@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1cc(F)c(Br)cc1F ZINC000527948260 567386535 /nfs/dbraw/zinc/38/65/35/567386535.db2.gz DICSBMHCYKZCIF-RKDXNWHRSA-N 0 1 399.239 3.368 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000528004864 567389521 /nfs/dbraw/zinc/38/95/21/567389521.db2.gz GEMNFTUUJNMCEA-YFNQRXEKSA-N 0 1 388.327 3.069 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2CC[C@@]3(O)C[C@H]3C2)C1=O ZINC000661722673 567389551 /nfs/dbraw/zinc/38/95/51/567389551.db2.gz JRPZQQYRBXYINW-ZSZQSSIHSA-N 0 1 393.325 3.018 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)c2[nH]nc3ccc(Br)cc32)n[nH]1 ZINC000477343731 567390194 /nfs/dbraw/zinc/39/01/94/567390194.db2.gz ZNESVFWFDCCLPU-MRVPVSSYSA-N 0 1 377.246 3.058 10 0 GGAEMN C[C@H](N[C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000528006913 567390439 /nfs/dbraw/zinc/39/04/39/567390439.db2.gz PNHSSIUJRGXAFZ-BSBMIECYSA-N 0 1 381.325 3.103 10 0 GGAEMN CN(C)CCN(Cc1ccco1)S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000501464288 567391173 /nfs/dbraw/zinc/39/11/73/567391173.db2.gz XRUVVBBHJXJWKO-UHFFFAOYSA-N 0 1 391.320 3.480 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)NCc1nc2ccc(F)cc2[nH]1 ZINC000477385559 567391597 /nfs/dbraw/zinc/39/15/97/567391597.db2.gz WDLYTCIPYAWPPV-UHFFFAOYSA-N 0 1 378.201 3.029 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)Cc2ccc(Br)cc2O)ccc1F ZINC000477370604 567391776 /nfs/dbraw/zinc/39/17/76/567391776.db2.gz BISZGWHCNVDWOU-UHFFFAOYSA-N 0 1 395.272 3.214 10 0 GGAEMN CC(C)(C)c1nc(CN2CCOC[C@@H]2c2cccc(Br)c2)n[nH]1 ZINC000661733905 567391908 /nfs/dbraw/zinc/39/19/08/567391908.db2.gz QRIDAELOPORODW-CQSZACIVSA-N 0 1 379.302 3.438 10 0 GGAEMN c1csc(C[N@@H+]2CCC[C@@H](CN=c3[n-]nc(C4CCOCC4)s3)C2)c1 ZINC000549487356 567393564 /nfs/dbraw/zinc/39/35/64/567393564.db2.gz SNOZOKJNSHGKHQ-AWEZNQCLSA-N 0 1 378.567 3.240 10 0 GGAEMN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@@H](C)O[C@@H](C)C1 ZINC000661858173 567397702 /nfs/dbraw/zinc/39/77/02/567397702.db2.gz ZKPIRLICOQWLSD-QLFBSQMISA-N 0 1 383.330 3.295 10 0 GGAEMN CCN1CCN(CC(=O)N2CCC[C@@H]2c2ccc(Br)c(C)c2)CC1 ZINC000435982165 567397975 /nfs/dbraw/zinc/39/79/75/567397975.db2.gz WKBWUWDVXTZADL-GOSISDBHSA-N 0 1 394.357 3.059 10 0 GGAEMN Cc1cc(Br)c(CNC(=O)CCSc2nnc(C)[nH]2)s1 ZINC000618644476 567405126 /nfs/dbraw/zinc/40/51/26/567405126.db2.gz GIPIQPUOINVNHW-UHFFFAOYSA-N 0 1 375.317 3.044 10 0 GGAEMN CCCN(C)[C@@H](CNS(=O)(=O)CC(C)(C)OC)c1ccc(Cl)cc1 ZINC000569464633 567406493 /nfs/dbraw/zinc/40/64/93/567406493.db2.gz RVMFTBOHKKIQBP-INIZCTEOSA-N 0 1 376.950 3.067 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)NC(=O)c1ccc(CN(C)C)nc1 ZINC000549749101 567409253 /nfs/dbraw/zinc/40/92/53/567409253.db2.gz HDRYVPROLQMILQ-CYBMUJFWSA-N 0 1 376.298 3.267 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCC[C@]2(CCOC2)C1 ZINC000456720118 567409438 /nfs/dbraw/zinc/40/94/38/567409438.db2.gz MXTMVWCZHBDLTQ-SFHVURJKSA-N 0 1 390.281 3.482 10 0 GGAEMN CN(Cc1nnc[nH]1)C(=O)N[C@H]1CCCCc2cc(Br)ccc21 ZINC000662081282 567409972 /nfs/dbraw/zinc/40/99/72/567409972.db2.gz WTYHTQMALDOJNA-AWEZNQCLSA-N 0 1 378.274 3.176 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)cc1Cl)N1CC[C@H](N2CCCCC2)C1 ZINC000501886896 567410787 /nfs/dbraw/zinc/41/07/87/567410787.db2.gz IEHYZXFDSZUDBD-HNNXBMFYSA-N 0 1 377.337 3.383 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN([C@@H](C)C(=O)Nc2cccc(Br)c2)C1 ZINC000662118043 567412102 /nfs/dbraw/zinc/41/21/02/567412102.db2.gz NXKAPNFBDAXUIX-KBPBESRZSA-N 0 1 396.329 3.013 10 0 GGAEMN C[C@@]1(Br)C[C@@H]1C(=O)N1CCC(c2nnc(-c3ccccc3)[nH]2)CC1 ZINC000528335193 567412096 /nfs/dbraw/zinc/41/20/96/567412096.db2.gz CJOVPLQIJFGUOJ-RDTXWAMCSA-N 0 1 389.297 3.351 10 0 GGAEMN Cc1nc(CN2CCc3cc(Br)c(Br)cc3C2)n[nH]1 ZINC000662112491 567412211 /nfs/dbraw/zinc/41/22/11/567412211.db2.gz XLJUBFGFQRYZPN-UHFFFAOYSA-N 0 1 386.091 3.196 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN([C@H](C)C(=O)Nc2ccc(Br)cc2)C1 ZINC000662112938 567412313 /nfs/dbraw/zinc/41/23/13/567412313.db2.gz BSEOJYHIWVMAAV-ZIAGYGMSSA-N 0 1 396.329 3.013 10 0 GGAEMN COc1cc(Br)c(CN2CCC[C@@H](C(=O)NC(C)C)C2)cc1OC ZINC000662112731 567412540 /nfs/dbraw/zinc/41/25/40/567412540.db2.gz GHSPYCKPAGLVIS-CYBMUJFWSA-N 0 1 399.329 3.203 10 0 GGAEMN C[C@@]1(Br)C[C@H]1C(=O)N1CCC(c2nnc(-c3ccccc3)[nH]2)CC1 ZINC000528335189 567412770 /nfs/dbraw/zinc/41/27/70/567412770.db2.gz CJOVPLQIJFGUOJ-KBXCAEBGSA-N 0 1 389.297 3.351 10 0 GGAEMN Cc1ccc2c(Cl)c(C(=O)Nc3nn[nH]c3C(=O)NC3CC3)sc2c1 ZINC000662171963 567414832 /nfs/dbraw/zinc/41/48/32/567414832.db2.gz OSVFYMHMIZIERS-UHFFFAOYSA-N 0 1 375.841 3.126 10 0 GGAEMN COc1ccc(Br)cc1[C@@H]1CCCN1C[C@@H](O)CC1(O)CCC1 ZINC000528364418 567415635 /nfs/dbraw/zinc/41/56/35/567415635.db2.gz MPHRSYKNEYHZTB-HOCLYGCPSA-N 0 1 384.314 3.261 10 0 GGAEMN Cc1cc(Br)cc(C)c1CNC(=O)c1cn[nH]c1-c1cnn(C)c1 ZINC000436243673 567416456 /nfs/dbraw/zinc/41/64/56/567416456.db2.gz YEDLVGCATVZNTL-UHFFFAOYSA-N 0 1 388.269 3.120 10 0 GGAEMN O=C(c1ccc(Br)c(OC(F)(F)F)c1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000569601138 567417129 /nfs/dbraw/zinc/41/71/29/567417129.db2.gz RQKSAPQGQKHEIO-PHIMTYICSA-N 0 1 393.203 3.314 10 0 GGAEMN CC(C)Nc1cc(Br)ccc1NC(=O)[C@H](C)CN1CCOCC1 ZINC000618883527 567420472 /nfs/dbraw/zinc/42/04/72/567420472.db2.gz SJPGYAGJWFDIHN-CYBMUJFWSA-N 0 1 384.318 3.176 10 0 GGAEMN CC(C)Nc1cc(Br)ccc1NC(=O)[C@@H](C)CN1CCOCC1 ZINC000618883529 567421081 /nfs/dbraw/zinc/42/10/81/567421081.db2.gz SJPGYAGJWFDIHN-ZDUSSCGKSA-N 0 1 384.318 3.176 10 0 GGAEMN Cc1nc([C@](C)(NS(=O)(=O)c2cc(Cl)sc2Cl)C2CC2)no1 ZINC000569665476 567423013 /nfs/dbraw/zinc/42/30/13/567423013.db2.gz IVCDSGDBXUWNOP-GFCCVEGCSA-N 0 1 382.294 3.350 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CC(C2CCCC2)C1 ZINC000477885474 567424229 /nfs/dbraw/zinc/42/42/29/567424229.db2.gz HGEZPRDUNUTJQX-UHFFFAOYSA-N 0 1 395.244 3.430 10 0 GGAEMN Cn1cc(C[C@@H]2CCC[C@@H]2NC(=O)c2cccc(Br)c2O)cn1 ZINC000618928777 567424904 /nfs/dbraw/zinc/42/49/04/567424904.db2.gz BSPRWZGYMWOQAO-WFASDCNBSA-N 0 1 378.270 3.029 10 0 GGAEMN O=S(=O)(NC[C@H](n1cccn1)C(F)(F)F)c1cc(Cl)sc1Cl ZINC000528457911 567425224 /nfs/dbraw/zinc/42/52/24/567425224.db2.gz QLXJJGWSUHLXDS-ZETCQYMHSA-N 0 1 394.227 3.333 10 0 GGAEMN Cc1nc([C@](C)(NCc2nc3ccc(Br)cc3[nH]2)C2CC2)no1 ZINC000569704661 567425448 /nfs/dbraw/zinc/42/54/48/567425448.db2.gz PMIXBAONAABLQQ-MRXNPFEDSA-N 0 1 376.258 3.432 10 0 GGAEMN CO[C@H]1CCCC[C@H]1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000550111071 567428041 /nfs/dbraw/zinc/42/80/41/567428041.db2.gz ZLIFIGDBXBLFOR-KGLIPLIRSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@H]1CCCC[C@H]1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550111071 567428047 /nfs/dbraw/zinc/42/80/47/567428047.db2.gz ZLIFIGDBXBLFOR-KGLIPLIRSA-N 0 1 393.285 3.056 10 0 GGAEMN Fc1c(Br)ccc(CN2CCC[C@@H](N3CCOCC3)CC2)c1F ZINC000528492728 567428927 /nfs/dbraw/zinc/42/89/27/567428927.db2.gz SDGZSJNTFUQDEI-CQSZACIVSA-N 0 1 389.284 3.414 10 0 GGAEMN Fc1c(Br)ccc(CN2CCC[C@@H](CN3CCOCC3)C2)c1F ZINC000528485398 567429157 /nfs/dbraw/zinc/42/91/57/567429157.db2.gz CKZXSGFSWBCSKP-ZDUSSCGKSA-N 0 1 389.284 3.272 10 0 GGAEMN COC(=O)c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1O ZINC000436499036 567430107 /nfs/dbraw/zinc/43/01/07/567430107.db2.gz YLCPYFBOCIHCMZ-UHFFFAOYSA-N 0 1 390.193 3.070 10 0 GGAEMN C[N@@H+]1CC[C@H](NC(=O)c2cc(Br)ccc2[O-])[C@@H]1c1ccccc1 ZINC000436524313 567430928 /nfs/dbraw/zinc/43/09/28/567430928.db2.gz GOMWKQRISGKBCR-RDJZCZTQSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2cc(Br)ccc2[O-])[C@@H]1c1ccccc1 ZINC000436524313 567430934 /nfs/dbraw/zinc/43/09/34/567430934.db2.gz GOMWKQRISGKBCR-RDJZCZTQSA-N 0 1 375.266 3.330 10 0 GGAEMN COc1ccc(F)c(CNC[C@@H](O)COc2ccccc2Br)c1 ZINC000550171480 567431015 /nfs/dbraw/zinc/43/10/15/567431015.db2.gz LTKFJGHYJFDULJ-CYBMUJFWSA-N 0 1 384.245 3.126 10 0 GGAEMN COc1ccc(F)c(CNC[C@H](O)COc2ccccc2Br)c1 ZINC000550171481 567431164 /nfs/dbraw/zinc/43/11/64/567431164.db2.gz LTKFJGHYJFDULJ-ZDUSSCGKSA-N 0 1 384.245 3.126 10 0 GGAEMN C[N@@H+]1CC[C@@H](NC(=O)c2cc(Br)ccc2[O-])[C@@H]1c1ccccc1 ZINC000436524314 567431765 /nfs/dbraw/zinc/43/17/65/567431765.db2.gz GOMWKQRISGKBCR-WBVHZDCISA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2cc(Br)ccc2[O-])[C@@H]1c1ccccc1 ZINC000436524314 567431770 /nfs/dbraw/zinc/43/17/70/567431770.db2.gz GOMWKQRISGKBCR-WBVHZDCISA-N 0 1 375.266 3.330 10 0 GGAEMN CCn1cc(S(=O)(=O)N[C@@H](c2ccc(Cl)cc2)C(F)(F)F)nc1C ZINC000502418061 567433875 /nfs/dbraw/zinc/43/38/75/567433875.db2.gz IMWUXWOWWPZKLU-ZDUSSCGKSA-N 0 1 381.807 3.447 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)no2)C[C@H]1C(=O)[O-] ZINC000569810536 567434507 /nfs/dbraw/zinc/43/45/07/567434507.db2.gz LSMAGQVJQDZKJJ-ZWNOBZJWSA-N 0 1 380.242 3.042 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)no2)C[C@@H]1C(=O)[O-] ZINC000569810533 567434756 /nfs/dbraw/zinc/43/47/56/567434756.db2.gz LSMAGQVJQDZKJJ-GWCFXTLKSA-N 0 1 380.242 3.042 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000528546367 567435422 /nfs/dbraw/zinc/43/54/22/567435422.db2.gz DEQCXEDZZUSKCY-CQSZACIVSA-N 0 1 377.337 3.430 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)NC[C@H]1CCN1C1CCCC1 ZINC000528546367 567435425 /nfs/dbraw/zinc/43/54/25/567435425.db2.gz DEQCXEDZZUSKCY-CQSZACIVSA-N 0 1 377.337 3.430 10 0 GGAEMN Cc1ccc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c(Br)c1 ZINC000528547198 567436026 /nfs/dbraw/zinc/43/60/26/567436026.db2.gz NWULUFMJNFKYQK-CQSZACIVSA-N 0 1 387.343 3.053 10 0 GGAEMN Cc1ccc(S(=O)(=O)NC[C@H]2CCN2C2CCCC2)c(Br)c1 ZINC000528547198 567436031 /nfs/dbraw/zinc/43/60/31/567436031.db2.gz NWULUFMJNFKYQK-CQSZACIVSA-N 0 1 387.343 3.053 10 0 GGAEMN Cc1cccc(S(=O)(=O)NC[C@H]2CCN2C2CCCC2)c1Br ZINC000528551588 567437268 /nfs/dbraw/zinc/43/72/68/567437268.db2.gz NWIMURMCARGBCT-CQSZACIVSA-N 0 1 387.343 3.053 10 0 GGAEMN CC(C)[N@@H+](CCCOc1cccc(I)c1)CCC(=O)[O-] ZINC000593746184 567437627 /nfs/dbraw/zinc/43/76/27/567437627.db2.gz GEDPTEBJWATMES-UHFFFAOYSA-N 0 1 391.249 3.245 10 0 GGAEMN O=S(=O)(NC[C@@H]1CCN1C1CCCC1)c1ccc(CC(F)(F)F)cc1 ZINC000528553084 567437545 /nfs/dbraw/zinc/43/75/45/567437545.db2.gz QPGIXCJDXMHEBD-HNNXBMFYSA-N 0 1 376.444 3.087 10 0 GGAEMN Cc1nc(-c2ccc(CCNC(=O)c3cc(C(C)(C)N)no3)s2)cs1 ZINC000662457286 567437671 /nfs/dbraw/zinc/43/76/71/567437671.db2.gz LJVQCIORWCPKKE-UHFFFAOYSA-N 0 1 376.507 3.334 10 0 GGAEMN Cc1coc(C)c1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000550298281 567440330 /nfs/dbraw/zinc/44/03/30/567440330.db2.gz WOLFLUPLBLEXRM-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN Cc1coc(C)c1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550298281 567440335 /nfs/dbraw/zinc/44/03/35/567440335.db2.gz WOLFLUPLBLEXRM-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN CC(C)c1n[nH]c(C(N)=O)c1NC(=O)CCc1cccc(F)c1Br ZINC000457111260 567441311 /nfs/dbraw/zinc/44/13/11/567441311.db2.gz GIEUJIKDHJEZRM-UHFFFAOYSA-N 0 1 397.248 3.105 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)Nc1nc(-c2ccccc2)c(Br)s1 ZINC000662502399 567443546 /nfs/dbraw/zinc/44/35/46/567443546.db2.gz KYEHIUDAYNIRSQ-NSHDSACASA-N 0 1 384.299 3.263 10 0 GGAEMN COc1ccc(Br)cc1CN1CC2(CCOCC2)CC[C@@H]1CO ZINC000528642446 567444604 /nfs/dbraw/zinc/44/46/04/567444604.db2.gz YEMNHYNCVSTUES-MRXNPFEDSA-N 0 1 384.314 3.211 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC2(c3ccc(Br)cc3)CCC2)on1 ZINC000662525385 567444903 /nfs/dbraw/zinc/44/49/03/567444903.db2.gz RVCCOCFXKCKWJA-UHFFFAOYSA-N 0 1 392.297 3.483 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)no1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000662515689 567445312 /nfs/dbraw/zinc/44/53/12/567445312.db2.gz REXRNADMAZJBIY-OKILXGFUSA-N 0 1 376.254 3.071 10 0 GGAEMN C[C@@H](CCc1ccc(Br)cc1)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662528495 567446937 /nfs/dbraw/zinc/44/69/37/567446937.db2.gz AAPIJPCHVVIUBY-NSHDSACASA-N 0 1 380.286 3.382 10 0 GGAEMN Cc1n[nH]c(C(F)F)c1NC(=O)c1sc2c(c1Br)CNC2 ZINC000662543542 567447788 /nfs/dbraw/zinc/44/77/88/567447788.db2.gz VUWKCJWQWMMFJE-UHFFFAOYSA-N 0 1 377.214 3.335 10 0 GGAEMN COc1ccc(C(C)(C)NCc2cc(Cl)cc(S(N)(=O)=O)c2)cc1F ZINC000528680000 567448154 /nfs/dbraw/zinc/44/81/54/567448154.db2.gz QQBBJFSTRDZJTG-UHFFFAOYSA-N 0 1 386.876 3.160 10 0 GGAEMN O=C(N[C@@H]1CCc2cc(Br)ccc21)N1CCN(CC2CC2)CC1 ZINC000619380529 567449786 /nfs/dbraw/zinc/44/97/86/567449786.db2.gz VFHCMKSWJAGYBB-QGZVFWFLSA-N 0 1 378.314 3.174 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N2CC[C@@H](Oc3ccc(Cl)c(Cl)c3)C2)on1 ZINC000662646541 567454047 /nfs/dbraw/zinc/45/40/47/567454047.db2.gz QURPNGFNIPRQTA-LLVKDONJSA-N 0 1 384.263 3.469 10 0 GGAEMN CN1CCCC[C@@H]1C(=O)NCc1ccc(I)cc1Cl ZINC000619458442 567454463 /nfs/dbraw/zinc/45/44/63/567454463.db2.gz KILFHHVCIWHGQP-CYBMUJFWSA-N 0 1 392.668 3.045 10 0 GGAEMN CCc1ccc(S(=O)(=O)NCC2(N3CCC(OC)CC3)CCCC2)s1 ZINC000594034229 567454430 /nfs/dbraw/zinc/45/44/30/567454430.db2.gz HAZFLUVNGGRPAT-UHFFFAOYSA-N 0 1 386.583 3.012 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1cc(Br)ccc1F ZINC000594030839 567454447 /nfs/dbraw/zinc/45/44/47/567454447.db2.gz SKLDBJDKARFHCU-VXGBXAGGSA-N 0 1 393.322 3.129 10 0 GGAEMN O=C(N[C@@H]1CCOc2ccc(Br)cc21)N1CCN(C2CCC2)CC1 ZINC000502828807 567456089 /nfs/dbraw/zinc/45/60/89/567456089.db2.gz QTFSYGDAJGQUJJ-MRXNPFEDSA-N 0 1 394.313 3.152 10 0 GGAEMN O=C(N[C@H]1CCOc2ccc(Br)cc21)N1CCN(C2CCC2)CC1 ZINC000502828806 567456189 /nfs/dbraw/zinc/45/61/89/567456189.db2.gz QTFSYGDAJGQUJJ-INIZCTEOSA-N 0 1 394.313 3.152 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787628 567456384 /nfs/dbraw/zinc/45/63/84/567456384.db2.gz BULGSLHFZZEIFZ-WFASDCNBSA-N 0 1 384.263 3.066 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@@H](O)COc2cc(Cl)ccc2Cl)n[nH]1 ZINC000528792736 567456967 /nfs/dbraw/zinc/45/69/67/567456967.db2.gz VJGOLDJPXPLNIB-DOMZBBRYSA-N 0 1 384.263 3.066 10 0 GGAEMN C[C@@](N)(C(=O)Nc1ccc2c(c1)CCOC2)c1ccc(Br)cc1 ZINC000662691084 567457052 /nfs/dbraw/zinc/45/70/52/567457052.db2.gz FSMVFTOHZNVQNP-SFHVURJKSA-N 0 1 375.266 3.334 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@H](O)COc2c(Cl)cccc2Cl)n[nH]1 ZINC000528794420 567457261 /nfs/dbraw/zinc/45/72/61/567457261.db2.gz ZERSZGUURAGJJN-NHYWBVRUSA-N 0 1 384.263 3.066 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CCN(C2CCC2)CC1 ZINC000502848407 567458197 /nfs/dbraw/zinc/45/81/97/567458197.db2.gz UWUVHOWYDLTUCN-CQSZACIVSA-N 0 1 380.330 3.260 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCCc2ccc(F)c(Br)c2)cn1 ZINC000570103194 567458179 /nfs/dbraw/zinc/45/81/79/567458179.db2.gz PSFBOYBSKGMVKR-UHFFFAOYSA-N 0 1 380.261 3.017 10 0 GGAEMN O=C(N[C@@H]1CCc2cc(Br)ccc21)N1CCN(C2CCC2)CC1 ZINC000502860354 567459152 /nfs/dbraw/zinc/45/91/52/567459152.db2.gz ZXWMZLLBXGHWRX-QGZVFWFLSA-N 0 1 378.314 3.316 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)c1cc(C(C)(C)N)no1)CC2 ZINC000662807655 567462223 /nfs/dbraw/zinc/46/22/23/567462223.db2.gz ZDKFGLLUAIYQJM-UHFFFAOYSA-N 0 1 378.270 3.138 10 0 GGAEMN O=C(Nc1ccc2c(c1)NC(=O)CC2)c1cc(Br)cc2nc[nH]c21 ZINC000502969431 567462458 /nfs/dbraw/zinc/46/24/58/567462458.db2.gz LIWLQERBDGMEAS-UHFFFAOYSA-N 0 1 385.221 3.462 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)on1 ZINC000662797343 567462721 /nfs/dbraw/zinc/46/27/21/567462721.db2.gz YCSMOMUMJIIZPO-NSHDSACASA-N 0 1 383.279 3.184 10 0 GGAEMN C[S@](=O)c1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000502983637 567463416 /nfs/dbraw/zinc/46/34/16/567463416.db2.gz PUJVTWWRUFNZBG-QFIPXVFZSA-N 0 1 378.251 3.315 10 0 GGAEMN CCC(CC)(CC(=O)OC)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000502978260 567464026 /nfs/dbraw/zinc/46/40/26/567464026.db2.gz AVATYFPMJAVSEN-UHFFFAOYSA-N 0 1 382.258 3.177 10 0 GGAEMN Cn1nc(-c2ccncc2)cc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503025843 567465108 /nfs/dbraw/zinc/46/51/08/567465108.db2.gz VBLYSJXRDJKGRG-UHFFFAOYSA-N 0 1 397.236 3.373 10 0 GGAEMN COC[C@@H](Cc1ccccc1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503012303 567465207 /nfs/dbraw/zinc/46/52/07/567465207.db2.gz DUBJWXOLPLKSDT-CQSZACIVSA-N 0 1 388.265 3.313 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2cc(Br)co2)CC1 ZINC000457421398 567465182 /nfs/dbraw/zinc/46/51/82/567465182.db2.gz VKQIZTMOVDQKFA-UHFFFAOYSA-N 0 1 378.270 3.436 10 0 GGAEMN COC[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1ccc(C)o1 ZINC000503026796 567465354 /nfs/dbraw/zinc/46/53/54/567465354.db2.gz XRVJRFXGWKTHAL-ZDUSSCGKSA-N 0 1 378.226 3.344 10 0 GGAEMN C[C@H](CCc1cccn1C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503005404 567465406 /nfs/dbraw/zinc/46/54/06/567465406.db2.gz YSJLHUXPXOQLAR-LLVKDONJSA-N 0 1 375.270 3.415 10 0 GGAEMN N[C@@H](Cc1ccccc1)C(=O)N1CCc2[nH]c3ccc(Br)cc3c2C1 ZINC000662861885 567465609 /nfs/dbraw/zinc/46/56/09/567465609.db2.gz BAWKAFQXWJXRGK-KRWDZBQOSA-N 0 1 398.304 3.385 10 0 GGAEMN CC(C)(N)c1nocc1C(=O)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000662874566 567467507 /nfs/dbraw/zinc/46/75/07/567467507.db2.gz YHJQRAGCLRYDGV-UHFFFAOYSA-N 0 1 392.297 3.384 10 0 GGAEMN O=C(Nc1cccc(Cn2cncn2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503134909 567469770 /nfs/dbraw/zinc/46/97/70/567469770.db2.gz VNQHFUPKLNJCAC-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN C[N@@H+]1CC[C@@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000550952569 567469927 /nfs/dbraw/zinc/46/99/27/567469927.db2.gz UBPHDYWEKHGSDL-KGLIPLIRSA-N 0 1 377.901 3.058 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000550952569 567469932 /nfs/dbraw/zinc/46/99/32/567469932.db2.gz UBPHDYWEKHGSDL-KGLIPLIRSA-N 0 1 377.901 3.058 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000570252030 567470301 /nfs/dbraw/zinc/47/03/01/567470301.db2.gz BZSPMYSKDDCAPP-APHBMKBZSA-N 0 1 392.297 3.481 10 0 GGAEMN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662927734 567470506 /nfs/dbraw/zinc/47/05/06/567470506.db2.gz HBCHBGYUTZFHDT-ZDUSSCGKSA-N 0 1 380.286 3.382 10 0 GGAEMN C[C@H](CC(F)(F)F)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000457525022 567471246 /nfs/dbraw/zinc/47/12/46/567471246.db2.gz NSAVGCVGASTURG-MRVPVSSYSA-N 0 1 391.191 3.439 10 0 GGAEMN C[C@H](CC(F)(F)F)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000457525022 567471252 /nfs/dbraw/zinc/47/12/52/567471252.db2.gz NSAVGCVGASTURG-MRVPVSSYSA-N 0 1 391.191 3.439 10 0 GGAEMN O=S(=O)(Nc1cnc(CC2CC2)nc1)c1ccc(C(F)(F)F)cc1F ZINC000551037343 567473691 /nfs/dbraw/zinc/47/36/91/567473691.db2.gz NBBIIHDQODWKDU-UHFFFAOYSA-N 0 1 375.347 3.388 10 0 GGAEMN COC(=O)Cc1ccccc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000619725032 567475405 /nfs/dbraw/zinc/47/54/05/567475405.db2.gz AJYBKEIDHUPDMQ-UHFFFAOYSA-N 0 1 388.221 3.293 10 0 GGAEMN COC(=O)c1cc(F)cc(NS(=O)(=O)c2c(F)cccc2Cl)c1F ZINC000478681423 567476111 /nfs/dbraw/zinc/47/61/11/567476111.db2.gz XJSNUXPJCMJHPI-UHFFFAOYSA-N 0 1 379.743 3.345 10 0 GGAEMN C[C@@H](NC(=O)CN1CC[C@H](C)C1)c1nc(-c2ccc(Br)cc2)no1 ZINC000570343522 567477115 /nfs/dbraw/zinc/47/71/15/567477115.db2.gz QRFHFVHDAKIBQP-NWDGAFQWSA-N 0 1 393.285 3.018 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2cc(OC)c(Cl)cc2C2CC2)c[nH]1 ZINC000594464545 567477809 /nfs/dbraw/zinc/47/78/09/567477809.db2.gz PYLBEWOUPMIXNF-UHFFFAOYSA-N 0 1 384.841 3.142 10 0 GGAEMN O=C(NCCn1cnc2ccccc21)c1cc(Br)cc2nc[nH]c21 ZINC000503287385 567478303 /nfs/dbraw/zinc/47/83/03/567478303.db2.gz FEKVEBBYMUMOJX-UHFFFAOYSA-N 0 1 384.237 3.105 10 0 GGAEMN Cn1c(=O)oc2cc(NC(=O)c3cc(Br)cc4nc[nH]c43)ccc21 ZINC000503291720 567480357 /nfs/dbraw/zinc/48/03/57/567480357.db2.gz QSXZWOBBDMAMFE-UHFFFAOYSA-N 0 1 387.193 3.023 10 0 GGAEMN COC(=O)c1sccc1S(=O)(=O)N[C@@H](c1ccc(C)o1)C(F)(F)F ZINC000594481229 567480355 /nfs/dbraw/zinc/48/03/55/567480355.db2.gz KBCMYOCBNBAZCP-NSHDSACASA-N 0 1 383.369 3.018 10 0 GGAEMN COC(=O)c1scc(C)c1S(=O)(=O)N[C@H](c1ccc(C)o1)C(F)(F)F ZINC000594481249 567480608 /nfs/dbraw/zinc/48/06/08/567480608.db2.gz KPDUECQQZFJGNG-GFCCVEGCSA-N 0 1 397.396 3.326 10 0 GGAEMN Cc1ccc(Br)c(NC(=O)N2CCC(C)(N3CCOCC3)CC2)c1 ZINC000529041483 567480962 /nfs/dbraw/zinc/48/09/62/567480962.db2.gz UTBAKNNXCGHGAI-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3cccc(Br)c3Cl)cc21 ZINC000503352066 567481941 /nfs/dbraw/zinc/48/19/41/567481941.db2.gz HJYGMOUOJRMQGL-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN COC(=O)c1ccc2c(c1)[C@@H](NCc1ccc(S(C)(=O)=O)s1)CCC2 ZINC000594499754 567482037 /nfs/dbraw/zinc/48/20/37/567482037.db2.gz IKPHYIVNYQDWHQ-INIZCTEOSA-N 0 1 379.503 3.105 10 0 GGAEMN CC[C@H](NCc1cccc(Br)c1)c1cccc(S(N)(=O)=O)c1 ZINC000570426885 567483575 /nfs/dbraw/zinc/48/35/75/567483575.db2.gz DKFDXCUTIIOFHA-INIZCTEOSA-N 0 1 383.311 3.337 10 0 GGAEMN Cc1cccc(NC(=O)N2CCC(C)(N3CCOCC3)CC2)c1Br ZINC000529067466 567483784 /nfs/dbraw/zinc/48/37/84/567483784.db2.gz ZDUNUXJWPIEOHR-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN Cn1cc(-c2[nH]ncc2C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)cn1 ZINC000437268850 567485232 /nfs/dbraw/zinc/48/52/32/567485232.db2.gz NNKQIRYWWPTHFQ-SWLSCSKDSA-N 0 1 376.247 3.403 10 0 GGAEMN CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCc1cnc[nH]1 ZINC000478828543 567485746 /nfs/dbraw/zinc/48/57/46/567485746.db2.gz QGJHLJNQFMENGP-HNNXBMFYSA-N 0 1 383.279 3.177 10 0 GGAEMN COC(=O)[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1cccs1 ZINC000503452594 567485894 /nfs/dbraw/zinc/48/58/94/567485894.db2.gz DJCHCQMRSZOFOW-CYBMUJFWSA-N 0 1 394.250 3.031 10 0 GGAEMN CCc1nc(CCNC(=O)c2cc(Br)cc3nc[nH]c32)cs1 ZINC000503493274 567488941 /nfs/dbraw/zinc/48/89/41/567488941.db2.gz YVKFKUAVQKZMTG-UHFFFAOYSA-N 0 1 379.283 3.317 10 0 GGAEMN O=C(Nc1ccc(-n2ccnn2)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000503488142 567489132 /nfs/dbraw/zinc/48/91/32/567489132.db2.gz LJYGJRQJHCUVJD-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN COc1cc(F)cc(CNC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503528399 567491372 /nfs/dbraw/zinc/49/13/72/567491372.db2.gz CXEICRVGGCFZLA-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN COC(=O)[C@H]1CCCC[C@@]1(C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503516927 567491500 /nfs/dbraw/zinc/49/15/00/567491500.db2.gz CQMZNIXKNZRTFV-SJKOYZFVSA-N 0 1 394.269 3.177 10 0 GGAEMN COC(=O)c1cc(CNC[C@@H](O)COc2cccc(Cl)c2Cl)c(C)o1 ZINC000594616668 567492493 /nfs/dbraw/zinc/49/24/93/567492493.db2.gz WECVDIIHJFHQAH-GFCCVEGCSA-N 0 1 388.247 3.211 10 0 GGAEMN CCOC(=O)[C@@H]1CC[C@H](NCc2cn(-c3ccc(Cl)c(Cl)c3)nn2)C1 ZINC000437339534 567493454 /nfs/dbraw/zinc/49/34/54/567493454.db2.gz SPTKIVBDTLFUII-NEPJUHHUSA-N 0 1 383.279 3.396 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)c1ccc2cncn2c1 ZINC000551283247 567493760 /nfs/dbraw/zinc/49/37/60/567493760.db2.gz GILHDRMAFHFHHU-UHFFFAOYSA-N 0 1 394.294 3.447 10 0 GGAEMN Cn1c(=O)oc2c1cccc2NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503554294 567494393 /nfs/dbraw/zinc/49/43/93/567494393.db2.gz PLDMVOPJMZSLEP-UHFFFAOYSA-N 0 1 387.193 3.023 10 0 GGAEMN CC[C@@H]1CCCC[N@@H+]1CCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503582630 567494937 /nfs/dbraw/zinc/49/49/37/567494937.db2.gz DNKJAXUEECJYKJ-CYBMUJFWSA-N 0 1 379.302 3.320 10 0 GGAEMN CC[C@H]1CCCC[N@@H+]1CCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503582631 567495743 /nfs/dbraw/zinc/49/57/43/567495743.db2.gz DNKJAXUEECJYKJ-ZDUSSCGKSA-N 0 1 379.302 3.320 10 0 GGAEMN CN1C(=O)N([C@H]2CCc3nc[nH]c3C2)C(=O)[C@@H]1c1cccc(Cl)c1Cl ZINC000663318764 567496166 /nfs/dbraw/zinc/49/61/66/567496166.db2.gz MQSSWMBSSIARNX-VFZGTOFNSA-N 0 1 379.247 3.209 10 0 GGAEMN CC(C)CC[C@](C)(O)CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479052681 567498029 /nfs/dbraw/zinc/49/80/29/567498029.db2.gz BOWNSOCCDCWIQY-ZBEGNZNMSA-N 0 1 397.368 3.479 10 0 GGAEMN C[S@](=O)Cc1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503632426 567497921 /nfs/dbraw/zinc/49/79/21/567497921.db2.gz BFQYQLVCKCTGKA-QHCPKHFHSA-N 0 1 392.278 3.456 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)[C@@H](O)Cc1ccccc1 ZINC000503694408 567501541 /nfs/dbraw/zinc/50/15/41/567501541.db2.gz GXNYXLHSWFYMRI-BZNIZROVSA-N 0 1 388.265 3.047 10 0 GGAEMN CC(C)OCC[C@@H](O)CNCc1cc(Cl)ccc1I ZINC000594717908 567501741 /nfs/dbraw/zinc/50/17/41/567501741.db2.gz HGKFMGBZGNYPTE-CYBMUJFWSA-N 0 1 397.684 3.210 10 0 GGAEMN O=C(c1sc2ncccc2c1Cl)N1CCC[C@H](N2CCOCC2)CC1 ZINC000529274094 567501979 /nfs/dbraw/zinc/50/19/79/567501979.db2.gz ZLKXTFNHXVOTEB-ZDUSSCGKSA-N 0 1 379.913 3.277 10 0 GGAEMN C[C@@H](CC(=O)c1ccco1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503691955 567501970 /nfs/dbraw/zinc/50/19/70/567501970.db2.gz GXEXYVROOXQJOW-VIFPVBQESA-N 0 1 376.210 3.310 10 0 GGAEMN O=C(c1sc2ncccc2c1Cl)N1CCC[C@@H](N2CCOCC2)CC1 ZINC000529274092 567502042 /nfs/dbraw/zinc/50/20/42/567502042.db2.gz ZLKXTFNHXVOTEB-CYBMUJFWSA-N 0 1 379.913 3.277 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)Cc1ccccc1 ZINC000503717582 567503973 /nfs/dbraw/zinc/50/39/73/567503973.db2.gz PFMGLIFQIVCJQB-LLVKDONJSA-N 0 1 386.249 3.256 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cncc3c2CCCC3)cc1Cl ZINC000594727108 567505101 /nfs/dbraw/zinc/50/51/01/567505101.db2.gz XMFIDVWBTBGUIH-UHFFFAOYSA-N 0 1 380.853 3.201 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1CC(=O)Nc1ccc(Br)cc1C ZINC000551427056 567506069 /nfs/dbraw/zinc/50/60/69/567506069.db2.gz HQXAPDLDUGUXOU-HNNXBMFYSA-N 0 1 396.329 3.077 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1cc2c(c(Br)c1)OCO2 ZINC000551429105 567506359 /nfs/dbraw/zinc/50/63/59/567506359.db2.gz XYGATQSPSRIVEA-ZDUSSCGKSA-N 0 1 383.286 3.059 10 0 GGAEMN COc1cc(CNCc2c3c(nn2C)CCCC3)cc(Br)c1OC ZINC000643344316 567506417 /nfs/dbraw/zinc/50/64/17/567506417.db2.gz SFXQVKBUIRXHJJ-UHFFFAOYSA-N 0 1 394.313 3.368 10 0 GGAEMN C[C@@H]1CN(C(=O)N[C@H]2CCOc3ccc(Br)cc32)C[C@H](C)N1C ZINC000457952186 567508460 /nfs/dbraw/zinc/50/84/60/567508460.db2.gz ZCDCXKPGOMQZGL-ZOWXZIJZSA-N 0 1 382.302 3.007 10 0 GGAEMN C[C@@H](CS(C)(=O)=O)N[C@H]1CCCSc2ccc(Br)cc21 ZINC000663443295 567508648 /nfs/dbraw/zinc/50/86/48/567508648.db2.gz QPWRUHSLCGTLCS-GWCFXTLKSA-N 0 1 378.357 3.399 10 0 GGAEMN C[C@H](CS(C)(=O)=O)N[C@H]1CCCSc2ccc(Br)cc21 ZINC000663443297 567509327 /nfs/dbraw/zinc/50/93/27/567509327.db2.gz QPWRUHSLCGTLCS-MFKMUULPSA-N 0 1 378.357 3.399 10 0 GGAEMN C[C@@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cncc(Br)c1 ZINC000570740312 567509794 /nfs/dbraw/zinc/50/97/94/567509794.db2.gz KGWMXEAYSPQZKE-SJKOYZFVSA-N 0 1 392.272 3.435 10 0 GGAEMN C[C@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cncc(Br)c1 ZINC000570740315 567510106 /nfs/dbraw/zinc/51/01/06/567510106.db2.gz KGWMXEAYSPQZKE-YVEFUNNKSA-N 0 1 392.272 3.435 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)C(C)(C)c2cccc(Br)c2)n[nH]1 ZINC000458015169 567513215 /nfs/dbraw/zinc/51/32/15/567513215.db2.gz CHSFQGLHXRBTTI-UHFFFAOYSA-N 0 1 379.302 3.459 10 0 GGAEMN CCN1CCC(N(C)S(=O)(=O)c2cccc(Br)c2Cl)CC1 ZINC000551518828 567513146 /nfs/dbraw/zinc/51/31/46/567513146.db2.gz MMPWATIMYXAFIF-UHFFFAOYSA-N 0 1 395.750 3.207 10 0 GGAEMN C[C@](O)(C1CCN(C(=O)c2[nH]nc3ccc(Cl)cc32)CC1)C(F)(F)F ZINC000551522970 567514391 /nfs/dbraw/zinc/51/43/91/567514391.db2.gz GIXIONNPOBNDCU-HNNXBMFYSA-N 0 1 375.778 3.382 10 0 GGAEMN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000620338137 567514629 /nfs/dbraw/zinc/51/46/29/567514629.db2.gz KZAKAKHJNOFEMM-HIFRSBDPSA-N 0 1 376.298 3.415 10 0 GGAEMN CCC[C@H](C)[C@H](CO)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000570807555 567515208 /nfs/dbraw/zinc/51/52/08/567515208.db2.gz XBZOWNPEEMDICL-CQDKDKBSSA-N 0 1 390.343 3.054 10 0 GGAEMN COc1cc(C(=O)Nc2nc(C3CCC3)n[nH]2)cc(Br)c1OC ZINC000570832921 567517115 /nfs/dbraw/zinc/51/71/15/567517115.db2.gz CYIYYXGWOXQIQW-UHFFFAOYSA-N 0 1 381.230 3.104 10 0 GGAEMN COc1cc(C(=O)Nc2n[nH]c(C3CCC3)n2)cc(Br)c1OC ZINC000570832921 567517117 /nfs/dbraw/zinc/51/71/17/567517117.db2.gz CYIYYXGWOXQIQW-UHFFFAOYSA-N 0 1 381.230 3.104 10 0 GGAEMN O=C(Nc1ccc2c(c1)CCC(=O)N2)c1cc(Br)cc2nc[nH]c21 ZINC000504005257 567518327 /nfs/dbraw/zinc/51/83/27/567518327.db2.gz YZEZWJYQHJEOOU-UHFFFAOYSA-N 0 1 385.221 3.462 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C1 ZINC000620399082 567520490 /nfs/dbraw/zinc/52/04/90/567520490.db2.gz MMYVWTXWTTUPCD-LLVKDONJSA-N 0 1 380.901 3.168 10 0 GGAEMN CC(C)(C(=O)N1CC[C@@H](c2nc[nH]n2)C1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000529509237 567521981 /nfs/dbraw/zinc/52/19/81/567521981.db2.gz WPNGTJKEGRPGNE-QMTHXVAHSA-N 0 1 383.279 3.187 10 0 GGAEMN Cc1[nH]ncc1CNC(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000663690971 567522561 /nfs/dbraw/zinc/52/25/61/567522561.db2.gz WYPYWTRXQBWBGU-CQSZACIVSA-N 0 1 381.299 3.268 10 0 GGAEMN CCC1(CC)CN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000504089075 567523171 /nfs/dbraw/zinc/52/31/71/567523171.db2.gz FEPDDXSLMCHABC-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN Brc1cccc(-c2n[nH]c(-c3noc(C=C[C@@H]4CCCO4)n3)n2)c1 ZINC000643966521 567525759 /nfs/dbraw/zinc/52/57/59/567525759.db2.gz XVSPJWVSRMXIDO-DGMVEKRQSA-N 0 1 388.225 3.476 10 0 GGAEMN C[S@](=O)[C@H]1CCC[C@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000594959641 567528907 /nfs/dbraw/zinc/52/89/07/567528907.db2.gz GFXZQLGFISMSTF-RLVYNTFLSA-N 0 1 387.336 3.353 10 0 GGAEMN COCCN(Cc1c[nH]nc1-c1ccc(Br)s1)[C@@H]1CCOC1 ZINC000529553114 567529510 /nfs/dbraw/zinc/52/95/10/567529510.db2.gz DJDXLPGTFAOTPF-GFCCVEGCSA-N 0 1 386.315 3.138 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000504326360 567529596 /nfs/dbraw/zinc/52/95/96/567529596.db2.gz WKCKNFUQPAJGPT-AWEZNQCLSA-N 0 1 376.254 3.164 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)c1cccc(-c2nnc[nH]2)c1 ZINC000504324002 567530099 /nfs/dbraw/zinc/53/00/99/567530099.db2.gz IIJWWZHWGSIDPU-OAHLLOKOSA-N 0 1 399.248 3.488 10 0 GGAEMN Cc1c(Cl)c(CNCCc2ccc(I)cc2)nn1C ZINC000594995768 567532850 /nfs/dbraw/zinc/53/28/50/567532850.db2.gz UFYRPYKBGCFXCY-UHFFFAOYSA-N 0 1 389.668 3.319 10 0 GGAEMN C[C@@H](NC[C@H]1CCC(C)(C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479430526 567534634 /nfs/dbraw/zinc/53/46/34/567534634.db2.gz KZUMLGXFYHTSMC-NXEZZACHSA-N 0 1 381.325 3.249 10 0 GGAEMN COCCC1CCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000529627662 567535983 /nfs/dbraw/zinc/53/59/83/567535983.db2.gz AHQRIXICHXZCNY-UHFFFAOYSA-N 0 1 393.281 3.179 10 0 GGAEMN NC(=O)CC1(CNC(=O)c2cn[nH]c2-c2ccc(Cl)s2)CCCCC1 ZINC000620704997 567537379 /nfs/dbraw/zinc/53/73/79/567537379.db2.gz QSFWDMOQCBNTPY-UHFFFAOYSA-N 0 1 380.901 3.347 10 0 GGAEMN CS(=O)(=O)[C@H]1CCC[C@H](NCc2cc(F)c(Br)cc2F)C1 ZINC000529661410 567537414 /nfs/dbraw/zinc/53/74/14/567537414.db2.gz CMAVIPRZTPAALL-QWRGUYRKSA-N 0 1 382.270 3.173 10 0 GGAEMN Brc1cccc(N2CCN(Cc3ccc(-n4cncn4)cc3)CC2)c1 ZINC000551825807 567537735 /nfs/dbraw/zinc/53/77/35/567537735.db2.gz JDVAVRUBTLROBO-UHFFFAOYSA-N 0 1 398.308 3.352 10 0 GGAEMN O=C(c1cc(C(F)(F)F)[nH]n1)N1CCOc2cc(Br)ccc2C1 ZINC000620708918 567538522 /nfs/dbraw/zinc/53/85/22/567538522.db2.gz WFXVPFRISVVRNB-UHFFFAOYSA-N 0 1 390.159 3.226 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOc2cc(Br)ccc2C1 ZINC000620708486 567539041 /nfs/dbraw/zinc/53/90/41/567539041.db2.gz MADBURVHWILYBH-ZDUSSCGKSA-N 0 1 376.254 3.013 10 0 GGAEMN NC(=O)CCSc1ccccc1NS(=O)(=O)c1ccc2ncsc2c1 ZINC000479513725 567540014 /nfs/dbraw/zinc/54/00/14/567540014.db2.gz PGBDOAKBGIRWSK-UHFFFAOYSA-N 0 1 393.515 3.065 10 0 GGAEMN COc1ccc(NC(C)=O)c(NS(=O)(=O)c2ccc3ncsc3c2)c1 ZINC000479526861 567541481 /nfs/dbraw/zinc/54/14/81/567541481.db2.gz XSEUTKIDSRBVGO-UHFFFAOYSA-N 0 1 377.447 3.064 10 0 GGAEMN CCOCc1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2Cl)cc1 ZINC000438726557 567541475 /nfs/dbraw/zinc/54/14/75/567541475.db2.gz UYDZOPVWCNVBDB-UHFFFAOYSA-N 0 1 383.853 3.464 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCO[C@@H](CC(F)(F)F)C1 ZINC000620782118 567541606 /nfs/dbraw/zinc/54/16/06/567541606.db2.gz ZBRMIQNDYXZPBO-VIFPVBQESA-N 0 1 392.175 3.119 10 0 GGAEMN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000551921895 567543131 /nfs/dbraw/zinc/54/31/31/567543131.db2.gz HOTUVJDTFDCQMQ-KOLCDFICSA-N 0 1 398.688 3.267 10 0 GGAEMN C[C@H]1CN(C(=O)c2cccc(Br)c2O)C[C@H](CC(F)(F)F)O1 ZINC000620801654 567543532 /nfs/dbraw/zinc/54/35/32/567543532.db2.gz QEAYHFVITAANDZ-IUCAKERBSA-N 0 1 382.176 3.337 10 0 GGAEMN C[C@@H]1CCCCN1CCNC(=O)C1(c2cccc(Br)c2)CC(=O)C1 ZINC000438774837 567544570 /nfs/dbraw/zinc/54/45/70/567544570.db2.gz SEJXQGAJEOOWQM-CQSZACIVSA-N 0 1 393.325 3.040 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000620807826 567545297 /nfs/dbraw/zinc/54/52/97/567545297.db2.gz ANZZTWMTGAJNBG-CXAGYDPISA-N 0 1 389.323 3.066 10 0 GGAEMN CC(C)C1(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000458431677 567547165 /nfs/dbraw/zinc/54/71/65/567547165.db2.gz QDBMJNJDVHGMMB-UHFFFAOYSA-N 0 1 378.274 3.222 10 0 GGAEMN CC(C)C1(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000458431677 567547174 /nfs/dbraw/zinc/54/71/74/567547174.db2.gz QDBMJNJDVHGMMB-UHFFFAOYSA-N 0 1 378.274 3.222 10 0 GGAEMN CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2ccc(-c3ccccc3F)s2)C1 ZINC000571245937 567547606 /nfs/dbraw/zinc/54/76/06/567547606.db2.gz DUBXWQMSMXVTJX-OAHLLOKOSA-N 0 1 382.526 3.410 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)N1CC2(CC2)c2ccc(Br)cc21 ZINC000529822627 567548523 /nfs/dbraw/zinc/54/85/23/567548523.db2.gz NXHPTOSMJHTNOU-UHFFFAOYSA-N 0 1 375.270 3.358 10 0 GGAEMN Fc1ccc([C@@H](NCCNc2cccc(Br)c2)c2c[nH]nn2)cc1 ZINC000438825443 567549278 /nfs/dbraw/zinc/54/92/78/567549278.db2.gz ITAPYYLWKCKJPO-QGZVFWFLSA-N 0 1 390.260 3.497 10 0 GGAEMN O=C(NC/C=C\c1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000571278305 567550064 /nfs/dbraw/zinc/55/00/64/567550064.db2.gz IJGQFOOAHLZZRM-BOPNBLERSA-N 0 1 375.270 3.042 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCc2ccc(Br)c(F)c2F)cn1 ZINC000529876067 567551399 /nfs/dbraw/zinc/55/13/99/567551399.db2.gz FLCFQMPJTLBVIT-UHFFFAOYSA-N 0 1 384.224 3.114 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCC[C@H]2c2ccc(Br)cn2)n[nH]1 ZINC000458541303 567551872 /nfs/dbraw/zinc/55/18/72/567551872.db2.gz ANKDFXLKDHASAW-BZNIZROVSA-N 0 1 392.301 3.353 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCC[C@H]2c2ccc(Br)cn2)n[nH]1 ZINC000458541307 567552154 /nfs/dbraw/zinc/55/21/54/567552154.db2.gz ANKDFXLKDHASAW-ZBEGNZNMSA-N 0 1 392.301 3.353 10 0 GGAEMN CCCOc1c(Br)cc(CNC2COCCOC2)cc1OCC ZINC000644422572 567552381 /nfs/dbraw/zinc/55/23/81/567552381.db2.gz CFBNYWKTINHNGB-UHFFFAOYSA-N 0 1 388.302 3.142 10 0 GGAEMN Cc1ccc(Br)cc1CN=c1ccc(C(=O)NC2CCCC2)n[nH]1 ZINC000438892328 567552348 /nfs/dbraw/zinc/55/23/48/567552348.db2.gz WTDZZVXRFDMMOB-UHFFFAOYSA-N 0 1 389.297 3.254 10 0 GGAEMN Cc1ccccc1-c1nc(CNS(=O)(=O)c2c(F)cccc2Cl)no1 ZINC000438897632 567552843 /nfs/dbraw/zinc/55/28/43/567552843.db2.gz QNVWQGNKQVOKFX-UHFFFAOYSA-N 0 1 381.816 3.316 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)COc2cc(Cl)cc(Cl)c2)CC1 ZINC000529914509 567554412 /nfs/dbraw/zinc/55/44/12/567554412.db2.gz RYONXDKDPQBARV-UHFFFAOYSA-N 0 1 387.307 3.086 10 0 GGAEMN Cc1ccc(F)c(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1Br ZINC000529911004 567554539 /nfs/dbraw/zinc/55/45/39/567554539.db2.gz YKKFOJQXYJREPF-UHFFFAOYSA-N 0 1 399.304 3.224 10 0 GGAEMN Cc1cc(C)c(Br)c(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1 ZINC000529910665 567554630 /nfs/dbraw/zinc/55/46/30/567554630.db2.gz HIBRVBKCEPWARB-UHFFFAOYSA-N 0 1 395.341 3.393 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000571330914 567555321 /nfs/dbraw/zinc/55/53/21/567555321.db2.gz OZLNDOLWBJSHGT-ZIAGYGMSSA-N 0 1 380.476 3.459 10 0 GGAEMN Cc1csc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1Br ZINC000529911041 567555537 /nfs/dbraw/zinc/55/55/37/567555537.db2.gz ZUHMRPDMWAFVQA-UHFFFAOYSA-N 0 1 387.343 3.146 10 0 GGAEMN CC1=CCN(CCNC(=O)N(C)Cc2ccc(F)cc2Br)CC1 ZINC000479739614 567555919 /nfs/dbraw/zinc/55/59/19/567555919.db2.gz GOXLCALAXCOJST-UHFFFAOYSA-N 0 1 384.293 3.382 10 0 GGAEMN CN(C[C@@H]1CC1(C)C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000664200754 567557080 /nfs/dbraw/zinc/55/70/80/567557080.db2.gz CHUFHFOXDGBXEB-LBPRGKRZSA-N 0 1 392.301 3.422 10 0 GGAEMN CN(C[C@@H]1CC1(C)C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000664200754 567557083 /nfs/dbraw/zinc/55/70/83/567557083.db2.gz CHUFHFOXDGBXEB-LBPRGKRZSA-N 0 1 392.301 3.422 10 0 GGAEMN CC(C)[C@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000664203670 567557122 /nfs/dbraw/zinc/55/71/22/567557122.db2.gz YZOVYDWKHPXXJD-HNNXBMFYSA-N 0 1 392.301 3.468 10 0 GGAEMN CC(C)[C@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000664203670 567557125 /nfs/dbraw/zinc/55/71/25/567557125.db2.gz YZOVYDWKHPXXJD-HNNXBMFYSA-N 0 1 392.301 3.468 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NC(=O)c2cc(Br)cc3[nH]cnc32)n[nH]1 ZINC000505079456 567557126 /nfs/dbraw/zinc/55/71/26/567557126.db2.gz FVWSKJZQKHGZGK-BDAKNGLRSA-N 0 1 391.273 3.448 10 0 GGAEMN CC(C)(F)CCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000664203262 567557199 /nfs/dbraw/zinc/55/71/99/567557199.db2.gz UXUPSYHZVGNXQZ-UHFFFAOYSA-N 0 1 384.253 3.172 10 0 GGAEMN CC(C)(F)CCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000664203262 567557203 /nfs/dbraw/zinc/55/72/03/567557203.db2.gz UXUPSYHZVGNXQZ-UHFFFAOYSA-N 0 1 384.253 3.172 10 0 GGAEMN C[C@H](CC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000571373066 567557477 /nfs/dbraw/zinc/55/74/77/567557477.db2.gz UVOCVINYVNQVHQ-ZYHUDNBSSA-N 0 1 380.261 3.479 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NCC1=CCCC1 ZINC000664202916 567557857 /nfs/dbraw/zinc/55/78/57/567557857.db2.gz RELQMZUXDRGAEQ-UHFFFAOYSA-N 0 1 376.258 3.144 10 0 GGAEMN O=C(NCC1=CCCC1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000664202916 567557863 /nfs/dbraw/zinc/55/78/63/567557863.db2.gz RELQMZUXDRGAEQ-UHFFFAOYSA-N 0 1 376.258 3.144 10 0 GGAEMN Cc1cc(N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)c2cc(F)ccc2n1 ZINC000664193985 567558146 /nfs/dbraw/zinc/55/81/46/567558146.db2.gz WQMWCVFFAOPFFV-WFASDCNBSA-N 0 1 376.375 3.094 10 0 GGAEMN CC[C@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000664200782 567558181 /nfs/dbraw/zinc/55/81/81/567558181.db2.gz DCUZAWVGONLVQX-ZDUSSCGKSA-N 0 1 378.274 3.222 10 0 GGAEMN CC[C@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000664200782 567558186 /nfs/dbraw/zinc/55/81/86/567558186.db2.gz DCUZAWVGONLVQX-ZDUSSCGKSA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1Br ZINC000552097186 567559282 /nfs/dbraw/zinc/55/92/82/567559282.db2.gz VTXJCDPFJDAHCQ-DGCLKSJQSA-N 0 1 393.322 3.053 10 0 GGAEMN COCc1nc(CNc2cc(C)nc3c(F)cc(Br)cc23)n[nH]1 ZINC000664277734 567560964 /nfs/dbraw/zinc/56/09/64/567560964.db2.gz LZLYXMBFGDZIOQ-UHFFFAOYSA-N 0 1 380.221 3.321 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCO[C@](C)(C(F)F)C1)c1ccc(Cl)cc1 ZINC000664291839 567562262 /nfs/dbraw/zinc/56/22/62/567562262.db2.gz JIRVJEUUJJKHCD-PBHICJAKSA-N 0 1 375.847 3.008 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032721 567563153 /nfs/dbraw/zinc/56/31/53/567563153.db2.gz WNFAMXUERDXUAD-SJCJKPOMSA-N 0 1 381.307 3.241 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@@H]1CCC[C@@H](C(N)=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000530032763 567563774 /nfs/dbraw/zinc/56/37/74/567563774.db2.gz JVZSGKMXQLURFB-IOASZLSFSA-N 0 1 386.323 3.004 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1cc2c([nH]1)CCOC2)c1ccc(Cl)c(Cl)c1 ZINC000530032816 567563798 /nfs/dbraw/zinc/56/37/98/567563798.db2.gz KCCQROVZGYRRJR-QGZVFWFLSA-N 0 1 382.291 3.427 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1cc(C(N)=O)cs1)c1ccc(Cl)c(Cl)c1 ZINC000530032354 567563930 /nfs/dbraw/zinc/56/39/30/567563930.db2.gz QTSGKGKRPIVURX-ZDUSSCGKSA-N 0 1 386.304 3.187 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCC[C@@H]2c2ccc(Br)cn2)CC1 ZINC000458678518 567564911 /nfs/dbraw/zinc/56/49/11/567564911.db2.gz ZKHTWYSXZBYISV-QGZVFWFLSA-N 0 1 393.329 3.343 10 0 GGAEMN CCCOc1c(Br)cc(Br)cc1CN(C)CCO ZINC000505329026 567569828 /nfs/dbraw/zinc/56/98/28/567569828.db2.gz AKMAQTAEQAQSIO-UHFFFAOYSA-N 0 1 381.108 3.425 10 0 GGAEMN OC[C@H](NCc1coc(-c2ccc(I)cc2)n1)C1CCC1 ZINC000595618342 567573764 /nfs/dbraw/zinc/57/37/64/567573764.db2.gz XJLUZUDIAKCYIF-HNNXBMFYSA-N 0 1 398.244 3.197 10 0 GGAEMN COc1ccccc1CS(=O)(=O)c1nc2cc(Br)c(C)[nH]c-2n1 ZINC000479996095 567574580 /nfs/dbraw/zinc/57/45/80/567574580.db2.gz WEUJAEXJWOVTBN-UHFFFAOYSA-N 0 1 396.266 3.011 10 0 GGAEMN CC(C)c1nc(CS(=O)(=O)Cc2ccc(Br)c(F)c2F)n[nH]1 ZINC000530147423 567574740 /nfs/dbraw/zinc/57/47/40/567574740.db2.gz AMWRZXITGORMDZ-UHFFFAOYSA-N 0 1 394.241 3.084 10 0 GGAEMN C[C@@](N)(C(=O)NCCCNc1ccccc1F)c1ccc(Br)cc1 ZINC000571638922 567577385 /nfs/dbraw/zinc/57/73/85/567577385.db2.gz FTNOLBWJSLKFPB-SFHVURJKSA-N 0 1 394.288 3.381 10 0 GGAEMN C[C@@H](N[C@H]1CCc2c1cc(Br)cc2F)C1(S(C)(=O)=O)CC1 ZINC000552338953 567578912 /nfs/dbraw/zinc/57/89/12/567578912.db2.gz UQEHYDCRKIJAMB-OTYXRUKQSA-N 0 1 376.291 3.131 10 0 GGAEMN C[C@H](N[C@@H]1CCc2c1cc(Br)cc2F)C1(S(C)(=O)=O)CC1 ZINC000552338952 567579421 /nfs/dbraw/zinc/57/94/21/567579421.db2.gz UQEHYDCRKIJAMB-LKFCYVNXSA-N 0 1 376.291 3.131 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@H+](C[C@@H](O)c1ccccc1Br)CC2 ZINC000530168159 567579784 /nfs/dbraw/zinc/57/97/84/567579784.db2.gz JAUQBRCOPUHLAX-QGZVFWFLSA-N 0 1 394.240 3.378 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@@H+](C[C@@H](O)c1ccccc1Br)CC2 ZINC000530168159 567579788 /nfs/dbraw/zinc/57/97/88/567579788.db2.gz JAUQBRCOPUHLAX-QGZVFWFLSA-N 0 1 394.240 3.378 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCC(=O)c1ccc(C(F)(F)F)cc1 ZINC000571666462 567579801 /nfs/dbraw/zinc/57/98/01/567579801.db2.gz FBXGGRKPVAFEDT-UHFFFAOYSA-N 0 1 375.372 3.014 10 0 GGAEMN O=C([O-])[C@H]1c2ccoc2CC[N@@H+]1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000530170628 567580141 /nfs/dbraw/zinc/58/01/41/567580141.db2.gz UJPAXUOPXTXUJP-MEDUHNTESA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1F ZINC000552340436 567580741 /nfs/dbraw/zinc/58/07/41/567580741.db2.gz URTNLDSVGIWHDA-WCQYABFASA-N 0 1 393.322 3.053 10 0 GGAEMN C[C@@H](CC(=O)Nc1nc(-c2ccccc2Br)n[nH]1)[C@@H]1CCCO1 ZINC000621413708 567582896 /nfs/dbraw/zinc/58/28/96/567582896.db2.gz SJYLCSLVYDICOK-GWCFXTLKSA-N 0 1 379.258 3.378 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000664708653 567584138 /nfs/dbraw/zinc/58/41/38/567584138.db2.gz NIJOWEOVCTVFMK-MRXNPFEDSA-N 0 1 384.293 3.242 10 0 GGAEMN C[C@@H](O)CN1CCN(c2nnc(-c3cc(Cl)cc(Cl)c3)s2)[C@H](C)C1 ZINC000480197954 567586830 /nfs/dbraw/zinc/58/68/30/567586830.db2.gz HSOURFCNVXKOMT-GHMZBOCLSA-N 0 1 387.336 3.403 10 0 GGAEMN O=C(c1c[nH]c2cccc(Br)c12)N1CCC[C@H](c2n[nH]c(=O)o2)C1 ZINC000644884308 567588057 /nfs/dbraw/zinc/58/80/57/567588057.db2.gz UGCRQASQLIALCB-VIFPVBQESA-N 0 1 391.225 3.039 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2ncc(Cl)cc2I)o1 ZINC000480206663 567588959 /nfs/dbraw/zinc/58/89/59/567588959.db2.gz OZGVCGKJRJKWPO-UHFFFAOYSA-N 0 1 398.609 3.042 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(N3C(=O)CCCC3=O)c2)c(C)s1 ZINC000530284833 567589430 /nfs/dbraw/zinc/58/94/30/567589430.db2.gz QZOJYAKJMKKIDT-UHFFFAOYSA-N 0 1 378.475 3.209 10 0 GGAEMN COCc1nc(CNC(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)n[nH]1 ZINC000664810334 567590630 /nfs/dbraw/zinc/59/06/30/567590630.db2.gz JKURGABTFJVMMR-XYPYZODXSA-N 0 1 384.267 3.003 10 0 GGAEMN COCc1nnc(CNC(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)[nH]1 ZINC000664810334 567590633 /nfs/dbraw/zinc/59/06/33/567590633.db2.gz JKURGABTFJVMMR-XYPYZODXSA-N 0 1 384.267 3.003 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2ccn(-c3ccc(Br)cc3)n2)n[nH]1 ZINC000480319485 567595700 /nfs/dbraw/zinc/59/57/00/567595700.db2.gz LNYQQOWSFXEJDV-NSHDSACASA-N 0 1 388.269 3.027 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)c1cc(C(C)(C)N)no1 ZINC000595956240 567596574 /nfs/dbraw/zinc/59/65/74/567596574.db2.gz IASJIEAJBREBCU-UHFFFAOYSA-N 0 1 385.205 3.034 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(Br)c2ccccc2c1 ZINC000644977419 567596911 /nfs/dbraw/zinc/59/69/11/567596911.db2.gz DNYBAZRUETUVEH-UHFFFAOYSA-N 0 1 391.309 3.445 10 0 GGAEMN CC(C)(C)c1noc(-c2sc3c(c2I)CNC3)n1 ZINC000596020586 567599075 /nfs/dbraw/zinc/59/90/75/567599075.db2.gz MLNNEIWJGCNYNG-UHFFFAOYSA-N 0 1 375.235 3.303 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000530413857 567599525 /nfs/dbraw/zinc/59/95/25/567599525.db2.gz MUNTYMOPIRUVKA-ZFWWWQNUSA-N 0 1 379.917 3.133 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000530413857 567599535 /nfs/dbraw/zinc/59/95/35/567599535.db2.gz MUNTYMOPIRUVKA-ZFWWWQNUSA-N 0 1 379.917 3.133 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)N1CC(Oc2cccc(Cl)c2Cl)C1 ZINC000664925859 567600444 /nfs/dbraw/zinc/60/04/44/567600444.db2.gz DOZPNLMNBMCEIA-SNVBAGLBSA-N 0 1 381.263 3.047 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC(F)(F)c2ccc(Br)cc2)on1 ZINC000621674782 567602532 /nfs/dbraw/zinc/60/25/32/567602532.db2.gz CXOYZGJLNANXCE-UHFFFAOYSA-N 0 1 388.212 3.153 10 0 GGAEMN Cc1ccc(CNC[C@@H]2CS(=O)(=O)c3ccccc3O2)cc1Br ZINC000572000679 567605674 /nfs/dbraw/zinc/60/56/74/567605674.db2.gz OXUFXEOZGZJVCT-CQSZACIVSA-N 0 1 396.306 3.082 10 0 GGAEMN CCN(C)[C@@H](C(=O)N[C@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552729712 567605855 /nfs/dbraw/zinc/60/58/55/567605855.db2.gz FBRRDNXNHNYXJS-IUODEOHRSA-N 0 1 377.286 3.109 10 0 GGAEMN CCN(C)[C@@H](C(=O)N[C@@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552729713 567606017 /nfs/dbraw/zinc/60/60/17/567606017.db2.gz FBRRDNXNHNYXJS-SWLSCSKDSA-N 0 1 377.286 3.109 10 0 GGAEMN CN(C(=O)[C@@H]1CCCc2[nH]ncc21)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O ZINC000480443118 567606156 /nfs/dbraw/zinc/60/61/56/567606156.db2.gz SGLGJDUHHJMZER-GPNNCHTKSA-N 0 1 380.275 3.253 10 0 GGAEMN Nc1nc2c(c(N3CCO[C@@H](c4cccc(Br)c4)C3)n1)CCCC2 ZINC000645149130 567608657 /nfs/dbraw/zinc/60/86/57/567608657.db2.gz LHMAHCWQGQXXLZ-MRXNPFEDSA-N 0 1 389.297 3.108 10 0 GGAEMN O=S1(=O)CCCN1CCN1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000439950501 567608886 /nfs/dbraw/zinc/60/88/86/567608886.db2.gz OIUFUGTYMUMORQ-MRXNPFEDSA-N 0 1 376.444 3.268 10 0 GGAEMN CC(C)OC[C@H](O)CN1CCC[C@H]1c1ccccc1I ZINC000506597381 567632558 /nfs/dbraw/zinc/63/25/58/567632558.db2.gz VJABKZMFHKHQMT-CJNGLKHVSA-N 0 1 389.277 3.214 10 0 GGAEMN CCO[C@H](C)c1noc(CN(C)Cc2nc3ccc(Br)cc3[nH]2)n1 ZINC000480529802 567610095 /nfs/dbraw/zinc/61/00/95/567610095.db2.gz RFLPYVBBQJRLEP-SNVBAGLBSA-N 0 1 394.273 3.438 10 0 GGAEMN O[C@@]1(C(F)(F)F)CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000480538418 567610887 /nfs/dbraw/zinc/61/08/87/567610887.db2.gz SBFZYEAHYKCYMC-ZDUSSCGKSA-N 0 1 378.192 3.215 10 0 GGAEMN CO[C@H](C)c1noc(CN(C)Cc2nc3ccc(Br)cc3[nH]2)n1 ZINC000480554641 567611065 /nfs/dbraw/zinc/61/10/65/567611065.db2.gz NVOIWMJRBRWTPO-SECBINFHSA-N 0 1 380.246 3.048 10 0 GGAEMN O=C([C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)N1CCCC1 ZINC000480535910 567611193 /nfs/dbraw/zinc/61/11/93/567611193.db2.gz AKBWROXDUBPYTM-ZDUSSCGKSA-N 0 1 391.313 3.160 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccc(F)c(Br)c1 ZINC000645194468 567611608 /nfs/dbraw/zinc/61/16/08/567611608.db2.gz YFQIBRDUMLYPBM-AFAVFJNCSA-N 0 1 399.304 3.409 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000621819127 567613198 /nfs/dbraw/zinc/61/31/98/567613198.db2.gz FHHBKENZWKTEQS-UHFFFAOYSA-N 0 1 391.313 3.443 10 0 GGAEMN CC(C)(C(=O)N1CCO[C@H](c2cccc(Br)c2)C1)c1c[nH]cn1 ZINC000621811252 567613904 /nfs/dbraw/zinc/61/39/04/567613904.db2.gz MQYRPWTYFIEIKQ-AWEZNQCLSA-N 0 1 378.270 3.050 10 0 GGAEMN O=C(NC[C@H]([NH2+]Cc1ccccc1)c1ccco1)c1s[n-]c(=O)c1Cl ZINC000552870734 567614674 /nfs/dbraw/zinc/61/46/74/567614674.db2.gz PNFHSUJAIJKZMB-LBPRGKRZSA-N 0 1 377.853 3.356 10 0 GGAEMN CN(C)c1cc(Br)cc(C(=O)Nc2cnn(-c3ccncc3)c2)c1 ZINC000645266676 567616448 /nfs/dbraw/zinc/61/64/48/567616448.db2.gz HUMLFXGDVLKIDO-UHFFFAOYSA-N 0 1 386.253 3.348 10 0 GGAEMN Cn1ccc(-c2cc(C(=O)Nc3ccc(I)cc3)[nH]n2)c1 ZINC000552918115 567617576 /nfs/dbraw/zinc/61/75/76/567617576.db2.gz YYOGQWFCADDNKB-UHFFFAOYSA-N 0 1 392.200 3.272 10 0 GGAEMN O=C([O-])[C@]12COC[C@H]1C[N@@H+](Cc1cc(C(F)(F)F)ccc1Br)C2 ZINC000665345227 567619956 /nfs/dbraw/zinc/61/99/56/567619956.db2.gz JHKHQXGMMDKUHO-BXUZGUMPSA-N 0 1 394.187 3.001 10 0 GGAEMN O=C(COc1ccc(F)cc1Br)N1CCC(c2cnc[nH]2)CC1 ZINC000530719309 567620625 /nfs/dbraw/zinc/62/06/25/567620625.db2.gz NPQKAMMUZFESOX-UHFFFAOYSA-N 0 1 382.233 3.096 10 0 GGAEMN CC(C)C1(CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000440220075 567620654 /nfs/dbraw/zinc/62/06/54/567620654.db2.gz XBMJBWWDPMGSDB-UHFFFAOYSA-N 0 1 392.301 3.470 10 0 GGAEMN CC(C)C1(CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000440220075 567620660 /nfs/dbraw/zinc/62/06/60/567620660.db2.gz XBMJBWWDPMGSDB-UHFFFAOYSA-N 0 1 392.301 3.470 10 0 GGAEMN CCOc1cc(CN[C@@H](C)C(=O)N2CCCC[C@H]2C)cc(Br)c1O ZINC000459417214 567622135 /nfs/dbraw/zinc/62/21/35/567622135.db2.gz VWULJRVDGWXHQA-OLZOCXBDSA-N 0 1 399.329 3.433 10 0 GGAEMN CCOc1cc(CNCC(=O)N(C)C2CCCCC2)cc(Br)c1O ZINC000459426731 567623852 /nfs/dbraw/zinc/62/38/52/567623852.db2.gz NLWZIPHEOWCHHO-UHFFFAOYSA-N 0 1 399.329 3.434 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)cn1 ZINC000553096367 567626579 /nfs/dbraw/zinc/62/65/79/567626579.db2.gz KYASBQCGCWUDOO-QGZVFWFLSA-N 0 1 382.291 3.304 10 0 GGAEMN CSc1cccc(CSCC(=O)NC[C@H]2CN(CC(C)C)CCO2)c1 ZINC000596379206 567627548 /nfs/dbraw/zinc/62/75/48/567627548.db2.gz BOLLSLQALNAEIS-KRWDZBQOSA-N 0 1 382.595 3.115 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)[C@H]2CCc3[nH]cnc3C2)cc1Br ZINC000665532694 567628411 /nfs/dbraw/zinc/62/84/11/567628411.db2.gz QTSICWGSKGJWTA-PWSUYJOCSA-N 0 1 378.270 3.163 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)[C@H]2CCc3[nH]cnc3C2)cc1Br ZINC000665532693 567628895 /nfs/dbraw/zinc/62/88/95/567628895.db2.gz QTSICWGSKGJWTA-JQWIXIFHSA-N 0 1 378.270 3.163 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSC[C@H]2CCCCC2(F)F)C1 ZINC000596397844 567629087 /nfs/dbraw/zinc/62/90/87/567629087.db2.gz YDMOQNAIFVKDHU-CVEARBPZSA-N 0 1 378.529 3.018 10 0 GGAEMN CCCN(CCN1CCCCC1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000553152466 567630511 /nfs/dbraw/zinc/63/05/11/567630511.db2.gz RZGZUMVLFHAQRO-UHFFFAOYSA-N 0 1 381.314 3.356 10 0 GGAEMN CC(C)OC[C@H](O)CN1CCC[C@@H]1c1ccccc1I ZINC000506597383 567632685 /nfs/dbraw/zinc/63/26/85/567632685.db2.gz VJABKZMFHKHQMT-CZUORRHYSA-N 0 1 389.277 3.214 10 0 GGAEMN Cc1cc(NC(=O)CNc2nc(C3CCOCC3)no2)ccc1Br ZINC000665696534 567635658 /nfs/dbraw/zinc/63/56/58/567635658.db2.gz ONVPHQYCPZLQQS-UHFFFAOYSA-N 0 1 395.257 3.085 10 0 GGAEMN Brc1ccc2c(ccnc2N2CCN(C[C@H]3CCCO3)CC2)c1 ZINC000665688857 567636020 /nfs/dbraw/zinc/63/60/20/567636020.db2.gz LLRQGOMOBASVSE-MRXNPFEDSA-N 0 1 376.298 3.298 10 0 GGAEMN CC(=O)Nc1ncc(S(=O)(=O)Nc2cccc(C(F)F)c2Cl)s1 ZINC000572397091 567637028 /nfs/dbraw/zinc/63/70/28/567637028.db2.gz HWIAZDVACDUAMK-UHFFFAOYSA-N 0 1 381.813 3.493 10 0 GGAEMN CN(C)c1ncc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)s1 ZINC000531018263 567637577 /nfs/dbraw/zinc/63/75/77/567637577.db2.gz STDAFMCKXOEDFT-UHFFFAOYSA-N 0 1 393.314 3.047 10 0 GGAEMN CN(C)c1ncc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)s1 ZINC000531018263 567637580 /nfs/dbraw/zinc/63/75/80/567637580.db2.gz STDAFMCKXOEDFT-UHFFFAOYSA-N 0 1 393.314 3.047 10 0 GGAEMN Fc1ccc(N2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)nc1 ZINC000480874712 567639168 /nfs/dbraw/zinc/63/91/68/567639168.db2.gz ZMPXZPFZFQIMAR-UHFFFAOYSA-N 0 1 390.260 3.182 10 0 GGAEMN C[C@@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@@H](c1ccccc1)N(C)C ZINC000480895410 567640013 /nfs/dbraw/zinc/64/00/13/567640013.db2.gz IFRNFEVSYWUIOH-ACJLOTCBSA-N 0 1 375.519 3.266 10 0 GGAEMN Cc1nc(-c2cccc(NS(=O)(=O)c3cncc(Br)c3)c2)no1 ZINC000506707516 567640241 /nfs/dbraw/zinc/64/02/41/567640241.db2.gz MIRUKYZQEBHJPU-UHFFFAOYSA-N 0 1 395.238 3.003 10 0 GGAEMN O=C1NCCN(Cc2nc3ccc(Br)cc3[nH]2)[C@H]1c1cccs1 ZINC000480888286 567640449 /nfs/dbraw/zinc/64/04/49/567640449.db2.gz HTGCKQNVJMDQSR-HNNXBMFYSA-N 0 1 391.294 3.060 10 0 GGAEMN O=C(NCCOc1ccc(F)cc1F)c1n[nH]c2ccc(Br)cc21 ZINC000531130565 567642361 /nfs/dbraw/zinc/64/23/61/567642361.db2.gz AQKBJYGURTXLFA-UHFFFAOYSA-N 0 1 396.191 3.412 10 0 GGAEMN O=C(NCC(F)(F)c1ccc(Br)cc1)[C@H]1CCc2[nH]cnc2C1 ZINC000622206644 567643684 /nfs/dbraw/zinc/64/36/84/567643684.db2.gz JQWAALDZAVGPCL-JTQLQIEISA-N 0 1 384.224 3.185 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)Cc2ccc(Br)cc2O)n[nH]1 ZINC000506863206 567647520 /nfs/dbraw/zinc/64/75/20/567647520.db2.gz VSPZDCHYQLFQKX-VHSXEESVSA-N 0 1 381.274 3.206 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000572570684 567649180 /nfs/dbraw/zinc/64/91/80/567649180.db2.gz XZSDQAFKJRKYHY-KBPBESRZSA-N 0 1 391.313 3.350 10 0 GGAEMN C[C@@H](C1CC1)N(C)S(=O)(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000531244992 567649923 /nfs/dbraw/zinc/64/99/23/567649923.db2.gz IOLAGVPRNPSZMQ-MEDUHNTESA-N 0 1 382.917 3.328 10 0 GGAEMN C[C@@H]1CCN(CC(=O)NCc2cc(Br)ccc2OC(F)F)C1 ZINC000553418614 567652218 /nfs/dbraw/zinc/65/22/18/567652218.db2.gz WYIWAKAZJJNQHA-SNVBAGLBSA-N 0 1 377.229 3.009 10 0 GGAEMN C[C@H]1CCN(CC(=O)NCc2cc(Br)ccc2OC(F)F)C1 ZINC000553418613 567652562 /nfs/dbraw/zinc/65/25/62/567652562.db2.gz WYIWAKAZJJNQHA-JTQLQIEISA-N 0 1 377.229 3.009 10 0 GGAEMN O=C([O-])[C@@H]1C[N@H+](C[C@H](O)C2CCCCC2)C[C@H]1c1ccc(Br)cc1 ZINC000572609498 567653771 /nfs/dbraw/zinc/65/37/71/567653771.db2.gz RRVXMDKGRPHVJH-KSZLIROESA-N 0 1 396.325 3.490 10 0 GGAEMN OC[C@@]1(O)CCC[N@@H+](Cc2ccc(-c3ccccc3Br)s2)C1 ZINC000459719680 567654989 /nfs/dbraw/zinc/65/49/89/567654989.db2.gz NVTYWIFQPDWVTN-QGZVFWFLSA-N 0 1 382.323 3.497 10 0 GGAEMN COCc1nc(CNC(=O)N2CCc3cc(Cl)c(Cl)cc3[C@H]2C)n[nH]1 ZINC000666117575 567655436 /nfs/dbraw/zinc/65/54/36/567655436.db2.gz GMZHTESDXKESPW-SECBINFHSA-N 0 1 384.267 3.087 10 0 GGAEMN COCc1nnc(CNC(=O)N2CCc3cc(Cl)c(Cl)cc3[C@H]2C)[nH]1 ZINC000666117575 567655440 /nfs/dbraw/zinc/65/54/40/567655440.db2.gz GMZHTESDXKESPW-SECBINFHSA-N 0 1 384.267 3.087 10 0 GGAEMN O=S(=O)(Nc1cccc(-c2n[nH]c(C3CC3)n2)c1)c1cncc(Cl)c1 ZINC000507026344 567655486 /nfs/dbraw/zinc/65/54/86/567655486.db2.gz ODZCUBGBRJXYNF-UHFFFAOYSA-N 0 1 375.841 3.198 10 0 GGAEMN COCc1nc(CNC(=O)N(Cc2ccc(Cl)c(Cl)c2)C(C)C)n[nH]1 ZINC000666121834 567655528 /nfs/dbraw/zinc/65/55/28/567655528.db2.gz WIZZFAVVUHWOBU-UHFFFAOYSA-N 0 1 386.283 3.378 10 0 GGAEMN COCc1nnc(CNC(=O)N(Cc2ccc(Cl)c(Cl)c2)C(C)C)[nH]1 ZINC000666121834 567655534 /nfs/dbraw/zinc/65/55/34/567655534.db2.gz WIZZFAVVUHWOBU-UHFFFAOYSA-N 0 1 386.283 3.378 10 0 GGAEMN COCc1nc(CNC(=O)NC2(c3c(Cl)cccc3Cl)CCC2)n[nH]1 ZINC000666115521 567655633 /nfs/dbraw/zinc/65/56/33/567655633.db2.gz DKZCZBHSBLNSMJ-UHFFFAOYSA-N 0 1 384.267 3.137 10 0 GGAEMN COCc1nnc(CNC(=O)NC2(c3c(Cl)cccc3Cl)CCC2)[nH]1 ZINC000666115521 567655639 /nfs/dbraw/zinc/65/56/39/567655639.db2.gz DKZCZBHSBLNSMJ-UHFFFAOYSA-N 0 1 384.267 3.137 10 0 GGAEMN Cc1cc(NC(=O)CN2CCC[C@@H]([C@@H]3CCOC3)C2)ccc1Br ZINC000441201930 567657145 /nfs/dbraw/zinc/65/71/45/567657145.db2.gz QRGYMJBADXLQIY-HUUCEWRRSA-N 0 1 381.314 3.445 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NC[C@H](C)N1CCc2ccccc2C1 ZINC000666168062 567657347 /nfs/dbraw/zinc/65/73/47/567657347.db2.gz MDLICVQVSIRSHC-ZDUSSCGKSA-N 0 1 388.309 3.329 10 0 GGAEMN Brc1cc2c(cc1CN1CCC[C@H]([C@H]3CCOC3)C1)OCCO2 ZINC000441278637 567659160 /nfs/dbraw/zinc/65/91/60/567659160.db2.gz ATOOJKFQBLPDFH-KBPBESRZSA-N 0 1 382.298 3.469 10 0 GGAEMN Brc1cc2c(cc1CN1CCC[C@@H]([C@@H]3CCOC3)C1)OCCO2 ZINC000441278643 567659285 /nfs/dbraw/zinc/65/92/85/567659285.db2.gz ATOOJKFQBLPDFH-ZIAGYGMSSA-N 0 1 382.298 3.469 10 0 GGAEMN Brc1ccc(-c2nnc(CN3CCC[C@@H]([C@H]4CCOC4)C3)o2)o1 ZINC000441290974 567660687 /nfs/dbraw/zinc/66/06/87/567660687.db2.gz VNKANIMMKQVLKY-NEPJUHHUSA-N 0 1 382.258 3.341 10 0 GGAEMN Brc1ccc(-c2nnc(CN3CCC[C@H]([C@H]4CCOC4)C3)o2)o1 ZINC000441290977 567661083 /nfs/dbraw/zinc/66/10/83/567661083.db2.gz VNKANIMMKQVLKY-RYUDHWBXSA-N 0 1 382.258 3.341 10 0 GGAEMN Brc1ccc(-c2nnc(CN3CCC[C@H]([C@@H]4CCOC4)C3)o2)o1 ZINC000441290976 567661443 /nfs/dbraw/zinc/66/14/43/567661443.db2.gz VNKANIMMKQVLKY-NWDGAFQWSA-N 0 1 382.258 3.341 10 0 GGAEMN O=S(=O)(NCC[C@@H]1COc2ccccc2O1)c1c(Cl)ccc(F)c1F ZINC000553534730 567663358 /nfs/dbraw/zinc/66/33/58/567663358.db2.gz OXFGAALGXWYHOT-SNVBAGLBSA-N 0 1 389.807 3.127 10 0 GGAEMN CC(C)[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000531526748 567663585 /nfs/dbraw/zinc/66/35/85/567663585.db2.gz PFJMDFUFVBEYPL-CYBMUJFWSA-N 0 1 392.301 3.422 10 0 GGAEMN CC(C)[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000531526748 567663588 /nfs/dbraw/zinc/66/35/88/567663588.db2.gz PFJMDFUFVBEYPL-CYBMUJFWSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@H]1CCN(CC(=O)Nc2cccc(Oc3ncc(Br)cn3)c2)C1 ZINC000572779288 567664467 /nfs/dbraw/zinc/66/44/67/567664467.db2.gz GVMJZXMDIOQUMA-LBPRGKRZSA-N 0 1 391.269 3.312 10 0 GGAEMN COc1ccccc1N1CC[C@H](NC(=O)c2cccc(Br)c2O)C1 ZINC000531547180 567664588 /nfs/dbraw/zinc/66/45/88/567664588.db2.gz SOJVYSPEKXCTIH-LBPRGKRZSA-N 0 1 391.265 3.172 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NC(=O)c2cccc(Br)c2O)C1 ZINC000531547179 567664968 /nfs/dbraw/zinc/66/49/68/567664968.db2.gz SOJVYSPEKXCTIH-GFCCVEGCSA-N 0 1 391.265 3.172 10 0 GGAEMN C[C@@H](CNS(=O)(=O)c1cc(F)c(Br)cc1F)CC(F)F ZINC000645795020 567668719 /nfs/dbraw/zinc/66/87/19/567668719.db2.gz HTGLQQQMPWDJOX-ZCFIWIBFSA-N 0 1 378.185 3.297 10 0 GGAEMN O=C(Nc1cccc2c(Br)ccnc12)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000572823024 567669218 /nfs/dbraw/zinc/66/92/18/567669218.db2.gz AQMIUDUUWHDOJW-TXEJJXNPSA-N 0 1 375.270 3.356 10 0 GGAEMN CCN1CCN(CC(=O)N[C@@](C)(c2ccc(Br)cc2)C(C)C)CC1 ZINC000481294883 567669504 /nfs/dbraw/zinc/66/95/04/567669504.db2.gz MLEFIONKEPOLNM-LJQANCHMSA-N 0 1 396.373 3.074 10 0 GGAEMN Cc1cc(CCNC(=O)[C@](C)(N)c2ccc(Br)cc2)cc(C)c1O ZINC000572840147 567670020 /nfs/dbraw/zinc/67/00/20/567670020.db2.gz SLDJOMCONDODOU-LJQANCHMSA-N 0 1 391.309 3.304 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1cc2cc(Br)cc(C)c2o1 ZINC000507259480 567670696 /nfs/dbraw/zinc/67/06/96/567670696.db2.gz AVFDDVJESBBBOA-HNNXBMFYSA-N 0 1 395.297 3.344 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1cc2cc(Br)cc(C)c2o1 ZINC000507259481 567671035 /nfs/dbraw/zinc/67/10/35/567671035.db2.gz AVFDDVJESBBBOA-OAHLLOKOSA-N 0 1 395.297 3.344 10 0 GGAEMN O=C1[C@H](NCc2ccc(Br)c(F)c2)CCN1Cc1ccccc1 ZINC000531658604 567671447 /nfs/dbraw/zinc/67/14/47/567671447.db2.gz YVKATXSOWJDMQE-QGZVFWFLSA-N 0 1 377.257 3.479 10 0 GGAEMN Cc1nc([C@@H](C)NC(=O)N[C@@H]2CSCc3ccc(Br)cc32)n[nH]1 ZINC000666400080 567672031 /nfs/dbraw/zinc/67/20/31/567672031.db2.gz AWJNMUKSESYFBS-AMIZOPFISA-N 0 1 396.314 3.224 10 0 GGAEMN CN(Cc1cnc[nH]1)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666399750 567672675 /nfs/dbraw/zinc/67/26/75/567672675.db2.gz UJGGSCAAVBGMLG-CQSZACIVSA-N 0 1 381.299 3.302 10 0 GGAEMN O=C(NCCN1CC=CCC1)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666402392 567675119 /nfs/dbraw/zinc/67/51/19/567675119.db2.gz XZZYQSJVIOGZJS-MRXNPFEDSA-N 0 1 396.354 3.298 10 0 GGAEMN CCCN(C)[C@H](CNC(=O)NCC[C@H](C)[S@@](C)=O)c1ccc(Cl)cc1 ZINC000553677715 567675550 /nfs/dbraw/zinc/67/55/50/567675550.db2.gz RVZNRMKSQAEDTK-PHDITVQNSA-N 0 1 387.977 3.179 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1ccc(C(F)(F)F)cc1Br ZINC000666438955 567678041 /nfs/dbraw/zinc/67/80/41/567678041.db2.gz CRBKBNCUBAFKDP-UHFFFAOYSA-N 0 1 380.208 3.493 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)n[nH]1 ZINC000572966044 567678597 /nfs/dbraw/zinc/67/85/97/567678597.db2.gz HLIVPNMOYFCVJD-ZCFIWIBFSA-N 0 1 390.658 3.143 10 0 GGAEMN CC1=CCN(CCNC(=O)NC2(c3cccc(Br)c3)CC2)CC1 ZINC000460212493 567679154 /nfs/dbraw/zinc/67/91/54/567679154.db2.gz BFVQDGWYBDCTDX-UHFFFAOYSA-N 0 1 378.314 3.389 10 0 GGAEMN COCC[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1ccco1 ZINC000507525000 567683322 /nfs/dbraw/zinc/68/33/22/567683322.db2.gz FLLZHKSPWDPFTN-ZDUSSCGKSA-N 0 1 378.226 3.426 10 0 GGAEMN Cc1nc2cc(Br)cc(NC(=O)N[C@@H]3CCc4nc[nH]c4C3)c2o1 ZINC000573063194 567684664 /nfs/dbraw/zinc/68/46/64/567684664.db2.gz ZRRLGLHUXQVUJC-SNVBAGLBSA-N 0 1 390.241 3.301 10 0 GGAEMN Cc1nc([C@H](C)NC(=O)NCC2(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000666546125 567684644 /nfs/dbraw/zinc/68/46/44/567684644.db2.gz JQGAFUBIOMQVDL-NSHDSACASA-N 0 1 392.301 3.259 10 0 GGAEMN CSc1ncc(Cl)c(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)n1 ZINC000531893753 567685653 /nfs/dbraw/zinc/68/56/53/567685653.db2.gz QYWYAAUNQKNJCC-AWEZNQCLSA-N 0 1 376.913 3.198 10 0 GGAEMN O=S(=O)(NCc1noc(-c2ccccc2)n1)c1c(Cl)ccc(F)c1F ZINC000553809987 567687987 /nfs/dbraw/zinc/68/79/87/567687987.db2.gz SEZDLAFDWSVIMK-UHFFFAOYSA-N 0 1 385.779 3.147 10 0 GGAEMN Cc1cc(Br)c(CNC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)s1 ZINC000666640885 567691107 /nfs/dbraw/zinc/69/11/07/567691107.db2.gz YRWDTAAFZNHYPA-TZMCWYRMSA-N 0 1 386.359 3.445 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cc(F)c(F)cc2N2CCOCC2)c(C)s1 ZINC000507630942 567691584 /nfs/dbraw/zinc/69/15/84/567691584.db2.gz UYNIEEGJLHLPDN-UHFFFAOYSA-N 0 1 388.461 3.281 10 0 GGAEMN COc1cccc([C@@H](N)C(=O)N2CCc3ccc(F)c(Br)c3C2)c1 ZINC000623232259 567692125 /nfs/dbraw/zinc/69/21/25/567692125.db2.gz BWBBLFIBAKBYQF-QGZVFWFLSA-N 0 1 393.256 3.182 10 0 GGAEMN C[C@H]1Cc2cn[nH]c2[C@@H](C(=O)Nc2nccc3cc(Br)ccc32)C1 ZINC000623218369 567692274 /nfs/dbraw/zinc/69/22/74/567692274.db2.gz CNBBHRNEDMWQMY-BONVTDFDSA-N 0 1 385.265 3.447 10 0 GGAEMN C[C@@H]1Cc2c[nH]nc2[C@@H](C(=O)N2CCOc3cc(Br)ccc3C2)C1 ZINC000623226759 567692341 /nfs/dbraw/zinc/69/23/41/567692341.db2.gz LRULRCPFRUOQCY-ABAIWWIYSA-N 0 1 390.281 3.259 10 0 GGAEMN C[C@@H]1Cc2cn[nH]c2[C@H](C(=O)Nc2nccc3cc(Br)ccc32)C1 ZINC000623218370 567692589 /nfs/dbraw/zinc/69/25/89/567692589.db2.gz CNBBHRNEDMWQMY-MEBBXXQBSA-N 0 1 385.265 3.447 10 0 GGAEMN C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)N2CCOc3cccc(Br)c3C2)C1 ZINC000623224312 567692726 /nfs/dbraw/zinc/69/27/26/567692726.db2.gz CBFAODOIQGNNLJ-DGCLKSJQSA-N 0 1 390.281 3.259 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)n[nH]1 ZINC000532010074 567692814 /nfs/dbraw/zinc/69/28/14/567692814.db2.gz MHYFZXLCAKSMML-JQAFLVLXSA-N 0 1 377.286 3.267 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccc(Br)cc2C)C1 ZINC000646112948 567694207 /nfs/dbraw/zinc/69/42/07/567694207.db2.gz WGIBPJTYLWTUJR-CQSZACIVSA-N 0 1 379.220 3.258 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(CCOc2ccc(Cl)cc2Cl)C1 ZINC000646108149 567694851 /nfs/dbraw/zinc/69/48/51/567694851.db2.gz PNCYWOBMQWWSMH-AWEZNQCLSA-N 0 1 385.213 3.373 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2cccc(Br)c2C)C1 ZINC000646112542 567695144 /nfs/dbraw/zinc/69/51/44/567695144.db2.gz RKOAQKFQJQGDHM-AWEZNQCLSA-N 0 1 379.220 3.258 10 0 GGAEMN CC(C)[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)[C@H](O)C(F)(F)F ZINC000646110349 567695228 /nfs/dbraw/zinc/69/52/28/567695228.db2.gz KPUJBMOBTDNVOZ-JQWIXIFHSA-N 0 1 394.191 3.003 10 0 GGAEMN C[C@](N)(C(=O)NCc1ccn(C2CCCC2)n1)c1ccc(Br)cc1 ZINC000573204101 567697143 /nfs/dbraw/zinc/69/71/43/567697143.db2.gz IHUKREDDMHUJJP-GOSISDBHSA-N 0 1 391.313 3.251 10 0 GGAEMN O=C(CCN1CCc2nccc(Br)c2C1)NCC1CCCCC1 ZINC000623286342 567698570 /nfs/dbraw/zinc/69/85/70/567698570.db2.gz ORBRSGACUQFYTD-UHFFFAOYSA-N 0 1 380.330 3.289 10 0 GGAEMN O=C(CCN1CCc2nccc(Br)c2C1)Nc1cccc(F)c1 ZINC000623286425 567698779 /nfs/dbraw/zinc/69/87/79/567698779.db2.gz RYIPYBTUBVLOKW-UHFFFAOYSA-N 0 1 378.245 3.370 10 0 GGAEMN O=C(N[C@H]1CCN(C(=O)C2CCCCC2)C1)c1cccc(Br)c1O ZINC000532131962 567699123 /nfs/dbraw/zinc/69/91/23/567699123.db2.gz IMXSIMSWEBAQRH-ZDUSSCGKSA-N 0 1 395.297 3.066 10 0 GGAEMN COCCOc1c(Cl)cc(NC(=O)N2C[C@H]3CCC[C@@H](C2)N3)cc1Cl ZINC000573306062 567703236 /nfs/dbraw/zinc/70/32/36/567703236.db2.gz QEXKMVOEDJITBB-TXEJJXNPSA-N 0 1 388.295 3.377 10 0 GGAEMN O=C(c1cc(Br)cc(N2CCCC2)c1)N1CCN(CC2CC2)CC1 ZINC000666801143 567704459 /nfs/dbraw/zinc/70/44/59/567704459.db2.gz WSIJWBRESPIZCJ-UHFFFAOYSA-N 0 1 392.341 3.217 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2c(F)cccc2Cl)C1 ZINC000507793772 567705606 /nfs/dbraw/zinc/70/56/06/567705606.db2.gz NBLRHJPFRRPYDC-AWEZNQCLSA-N 0 1 388.936 3.185 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2OC(F)F)cc1 ZINC000460835156 567705867 /nfs/dbraw/zinc/70/58/67/567705867.db2.gz DJNXFCSACNSVHI-UHFFFAOYSA-N 0 1 375.324 3.015 10 0 GGAEMN O=C(CS(=O)(=O)c1ccc(Cl)cc1)Nc1cc(Cl)c(O)cc1F ZINC000554040220 567706023 /nfs/dbraw/zinc/70/60/23/567706023.db2.gz KUPHCRWMICNFKK-UHFFFAOYSA-N 0 1 378.208 3.251 10 0 GGAEMN CN1CCCN(C(=O)c2c(F)ccc(C(F)(F)F)c2Br)CC1 ZINC000623395409 567706542 /nfs/dbraw/zinc/70/65/42/567706542.db2.gz JTIWQTORIXMUDS-UHFFFAOYSA-N 0 1 383.183 3.385 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)NCc2csc(C(F)(F)F)c2)C[C@@H](C)O1 ZINC000623403864 567707229 /nfs/dbraw/zinc/70/72/29/567707229.db2.gz JVQQSQVVCNDWAQ-VXGBXAGGSA-N 0 1 379.448 3.065 10 0 GGAEMN CC(C)N1CCN(C(=O)N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000507794949 567707228 /nfs/dbraw/zinc/70/72/28/567707228.db2.gz IBUQFKCFGNIOGD-HNNXBMFYSA-N 0 1 382.302 3.008 10 0 GGAEMN CC[C@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1ccc(Cl)cc1Cl ZINC000554090266 567708588 /nfs/dbraw/zinc/70/85/88/567708588.db2.gz PDCPOOZFKBQNCA-CJNGLKHVSA-N 0 1 394.368 3.305 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000442809025 567709482 /nfs/dbraw/zinc/70/94/82/567709482.db2.gz IYHNKJGJWHEIHJ-HERUPUMHSA-N 0 1 381.325 3.249 10 0 GGAEMN O=C(Nc1nc2c(s1)CCCCC2)C(C[C@H]1COCCO1)C(F)(F)F ZINC000666896422 567711140 /nfs/dbraw/zinc/71/11/40/567711140.db2.gz PFVRCQQDACVDEM-WDEREUQCSA-N 0 1 378.416 3.335 10 0 GGAEMN O=C(c1cc(Br)ccc1Br)N1CCN2CCC1CC2 ZINC000507876083 567712222 /nfs/dbraw/zinc/71/22/22/567712222.db2.gz WBJGZKIZNLSNLM-UHFFFAOYSA-N 0 1 388.103 3.132 10 0 GGAEMN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCN2CCC1CC2 ZINC000507874715 567712374 /nfs/dbraw/zinc/71/23/74/567712374.db2.gz LFRHRTGLDHPVCH-LLVKDONJSA-N 0 1 387.705 3.176 10 0 GGAEMN COCc1cccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)c1 ZINC000442844508 567712826 /nfs/dbraw/zinc/71/28/26/567712826.db2.gz VVVDIWJESFZVJY-UHFFFAOYSA-N 0 1 377.340 3.238 10 0 GGAEMN CC[C@@H](NC(=O)C(=O)N1CCC(c2cnc[nH]2)CC1)c1ccc(Cl)s1 ZINC000554160768 567713761 /nfs/dbraw/zinc/71/37/61/567713761.db2.gz SUVSJTWCGCCACW-GFCCVEGCSA-N 0 1 380.901 3.098 10 0 GGAEMN CCC(CC)c1nnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)s1 ZINC000666969446 567715611 /nfs/dbraw/zinc/71/56/11/567715611.db2.gz RIRYPBCZHLSFPY-WDEREUQCSA-N 0 1 381.420 3.364 10 0 GGAEMN CCCCCc1nnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)s1 ZINC000666969120 567716095 /nfs/dbraw/zinc/71/60/95/567716095.db2.gz GHDHVPQTYCAUHK-MNOVXSKESA-N 0 1 381.420 3.193 10 0 GGAEMN O=C1NCCC[C@@H]1NCc1ccc(OCc2ccccc2)c(Br)c1 ZINC000507915527 567716215 /nfs/dbraw/zinc/71/62/15/567716215.db2.gz UIXGKTNLNWLYIK-KRWDZBQOSA-N 0 1 389.293 3.396 10 0 GGAEMN Fc1cc(CNCc2csc(C(F)(F)F)c2)cnc1N1CCOCC1 ZINC000623493590 567716310 /nfs/dbraw/zinc/71/63/10/567716310.db2.gz LEDQNVXRMCJCDU-UHFFFAOYSA-N 0 1 375.391 3.427 10 0 GGAEMN COC(=O)c1cc(Br)cc(NC(=O)[C@H]2CCc3[nH]cnc3C2)c1C ZINC000597783312 567716801 /nfs/dbraw/zinc/71/68/01/567716801.db2.gz INCRPZSGCJHXOQ-JTQLQIEISA-N 0 1 392.253 3.011 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@@H]3COCC[C@H]32)nn1 ZINC000573497213 567717710 /nfs/dbraw/zinc/71/77/10/567717710.db2.gz YHOUGLOXWNHNKZ-CZUORRHYSA-N 0 1 377.286 3.031 10 0 GGAEMN C[C@@H](CCc1ccc(Br)cc1)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000667033588 567719483 /nfs/dbraw/zinc/71/94/83/567719483.db2.gz UGSWFECFOOMVLV-JSGCOSHPSA-N 0 1 376.298 3.415 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cn(-c2ccc(Cl)c(Cl)c2)cn1 ZINC000461091569 567719607 /nfs/dbraw/zinc/71/96/07/567719607.db2.gz WEGMXZYYARJGKY-JTQLQIEISA-N 0 1 376.247 3.190 10 0 GGAEMN C[C@H](CCc1ccc(Br)cc1)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000667033590 567719882 /nfs/dbraw/zinc/71/98/82/567719882.db2.gz UGSWFECFOOMVLV-TZMCWYRMSA-N 0 1 376.298 3.415 10 0 GGAEMN CC(=O)NCC[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000554294484 567720169 /nfs/dbraw/zinc/72/01/69/567720169.db2.gz IQURZIYUOQVBLQ-ZDUSSCGKSA-N 0 1 379.302 3.064 10 0 GGAEMN CC(C)CN1CCN(C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC1 ZINC000623543836 567720973 /nfs/dbraw/zinc/72/09/73/567720973.db2.gz ALCHXZNVMLYNEL-CGTJXYLNSA-N 0 1 377.326 3.135 10 0 GGAEMN O=S(=O)(CCc1ccccc1Br)Nc1nc2ccc(F)cc2[nH]1 ZINC000461114497 567721667 /nfs/dbraw/zinc/72/16/67/567721667.db2.gz RYWHMFXSMAOTCM-UHFFFAOYSA-N 0 1 398.257 3.449 10 0 GGAEMN Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)ncc1Br ZINC000623564094 567722087 /nfs/dbraw/zinc/72/20/87/567722087.db2.gz RRUBKDJGHHWCNY-SFHVURJKSA-N 0 1 390.325 3.009 10 0 GGAEMN O[C@@H]1CC[N@H+](Cc2ccc(C[NH2+]Cc3ccsc3Br)cc2)C1 ZINC000623564205 567722268 /nfs/dbraw/zinc/72/22/68/567722268.db2.gz VRUXSWCKEGEKLS-MRXNPFEDSA-N 0 1 381.339 3.367 10 0 GGAEMN O=C(c1cc(Br)cc2nc[nH]c21)N1C[C@H](CO)Cc2ccccc21 ZINC000646525800 567723533 /nfs/dbraw/zinc/72/35/33/567723533.db2.gz WGVQAMMBIZUTTO-LLVKDONJSA-N 0 1 386.249 3.137 10 0 GGAEMN COc1cccc(N2C[C@@H](NCc3csc(Br)c3)CC2=O)c1 ZINC000508065689 567724101 /nfs/dbraw/zinc/72/41/01/567724101.db2.gz VZFOPWVGHDDFJQ-LBPRGKRZSA-N 0 1 381.295 3.414 10 0 GGAEMN CCS(=O)(=O)c1c(Cl)cccc1CNC[C@@H]1Cc2ccccc2CO1 ZINC000623602612 567725235 /nfs/dbraw/zinc/72/52/35/567725235.db2.gz XUSZVMNGZZGYKA-KRWDZBQOSA-N 0 1 379.909 3.365 10 0 GGAEMN COc1cccc(N2C[C@@H](NCc3ccc(Br)cc3F)CC2=O)c1 ZINC000508073170 567725299 /nfs/dbraw/zinc/72/52/99/567725299.db2.gz VSBUYXBDSZFBBJ-AWEZNQCLSA-N 0 1 393.256 3.492 10 0 GGAEMN CCOCc1nc([C@@H](C)NC(=O)c2cn[nH]c2-c2ccc(Cl)s2)no1 ZINC000461221304 567726135 /nfs/dbraw/zinc/72/61/35/567726135.db2.gz VRYVMZKVIBESMI-MRVPVSSYSA-N 0 1 381.845 3.202 10 0 GGAEMN OCCOC1(CNCc2ncc(Br)cc2F)CCC(F)(F)CC1 ZINC000623637534 567726207 /nfs/dbraw/zinc/72/62/07/567726207.db2.gz AFOGLGYICBYMCI-UHFFFAOYSA-N 0 1 397.235 3.030 10 0 GGAEMN COc1cccc(N2C[C@@H](NCc3ccc(F)c(Br)c3)CC2=O)c1 ZINC000508078494 567726163 /nfs/dbraw/zinc/72/61/63/567726163.db2.gz GVQZACDSMQBRLM-ZDUSSCGKSA-N 0 1 393.256 3.492 10 0 GGAEMN O=C(Nc1cnc(-c2ccc(Cl)s2)nc1)N1CCN(CC2CC2)CC1 ZINC000646542734 567726560 /nfs/dbraw/zinc/72/65/60/567726560.db2.gz JDHOIHFWYCRVAH-UHFFFAOYSA-N 0 1 377.901 3.418 10 0 GGAEMN COc1cccc(N2C[C@H](NCc3ccc(F)c(Br)c3)CC2=O)c1 ZINC000508078493 567726631 /nfs/dbraw/zinc/72/66/31/567726631.db2.gz GVQZACDSMQBRLM-CYBMUJFWSA-N 0 1 393.256 3.492 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c1 ZINC000623638216 567726914 /nfs/dbraw/zinc/72/69/14/567726914.db2.gz YVWYICKHAJITLT-STQMWFEESA-N 0 1 387.293 3.126 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)C2=Cc3cc(Br)ccc3OC2)n[nH]1 ZINC000532671034 567727698 /nfs/dbraw/zinc/72/76/98/567727698.db2.gz FELMNRSSEQKZAH-SNVBAGLBSA-N 0 1 376.254 3.004 10 0 GGAEMN Clc1ccc(Cl)c(CN[C@H]2CCN(c3ccc4nncn4n3)C2)c1Cl ZINC000623654169 567727769 /nfs/dbraw/zinc/72/77/69/567727769.db2.gz XQXNUMSPSLONAX-JTQLQIEISA-N 0 1 397.697 3.453 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)n[nH]1 ZINC000646544452 567727892 /nfs/dbraw/zinc/72/78/92/567727892.db2.gz VMTXPBURGUVCEW-MRVPVSSYSA-N 0 1 377.861 3.422 10 0 GGAEMN OC[C@]1(NCc2nccn2C(F)F)CCc2cc(Br)ccc2C1 ZINC000623644468 567728178 /nfs/dbraw/zinc/72/81/78/567728178.db2.gz YSTIUNCCZXEOSQ-INIZCTEOSA-N 0 1 386.240 3.050 10 0 GGAEMN CCc1cnc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000623645246 567728206 /nfs/dbraw/zinc/72/82/06/567728206.db2.gz USRLTOYJXPVKNY-KRWDZBQOSA-N 0 1 381.339 3.478 10 0 GGAEMN COCc1cnc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000623645183 567728355 /nfs/dbraw/zinc/72/83/55/567728355.db2.gz QYCONICXLAMSPI-KRWDZBQOSA-N 0 1 397.338 3.062 10 0 GGAEMN CCc1nc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)cs1 ZINC000623644078 567728376 /nfs/dbraw/zinc/72/83/76/567728376.db2.gz LWYMFXQLCRSBOJ-KRWDZBQOSA-N 0 1 381.339 3.478 10 0 GGAEMN C[C@H](CCc1cccn1C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000461328853 567728628 /nfs/dbraw/zinc/72/86/28/567728628.db2.gz AWHHJZPQBNNIGS-LLVKDONJSA-N 0 1 375.270 3.415 10 0 GGAEMN COc1ncc(Br)cc1CNC1CC[NH+](CCC(F)(F)F)CC1 ZINC000623664771 567729034 /nfs/dbraw/zinc/72/90/34/567729034.db2.gz NOZPQDLCWWTCNY-UHFFFAOYSA-N 0 1 396.251 3.359 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2cc(Br)cs2)[nH]n1 ZINC000532717647 567730466 /nfs/dbraw/zinc/73/04/66/567730466.db2.gz GCOBHOJRVQPQJY-UHFFFAOYSA-N 0 1 381.299 3.007 10 0 GGAEMN CC1=CCN(CCNC(=O)Nc2ccc3nccnc3c2Br)CC1 ZINC000554543095 567734599 /nfs/dbraw/zinc/73/45/99/567734599.db2.gz GRNWXGYSHRKIFV-UHFFFAOYSA-N 0 1 390.285 3.166 10 0 GGAEMN C[C@@H](NC(=O)N[C@@H]1CCCCc2cc(Br)ccc21)c1nnc[nH]1 ZINC000667213170 567735286 /nfs/dbraw/zinc/73/52/86/567735286.db2.gz MTJONHXJTKNMNI-QMTHXVAHSA-N 0 1 378.274 3.395 10 0 GGAEMN C[C@@H](NC(=O)N[C@H]1CCCCc2cc(Br)ccc21)c1nnc[nH]1 ZINC000667213171 567735408 /nfs/dbraw/zinc/73/54/08/567735408.db2.gz MTJONHXJTKNMNI-YGRLFVJLSA-N 0 1 378.274 3.395 10 0 GGAEMN Cc1cnc(NS(=O)(=O)c2cnccc2C(F)(F)F)c(Br)c1 ZINC000443134137 567735528 /nfs/dbraw/zinc/73/55/28/567735528.db2.gz PKKCYJRUMBCHNR-UHFFFAOYSA-N 0 1 396.188 3.367 10 0 GGAEMN O=C(NCCCc1nc[nH]n1)N[C@@H]1CCCCc2cc(Br)ccc21 ZINC000667211469 567735695 /nfs/dbraw/zinc/73/56/95/567735695.db2.gz ISIMXDLHRZDCJG-OAHLLOKOSA-N 0 1 392.301 3.267 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2cc(Br)cc3nc[nH]c32)[C@H]2CCCO[C@@H]21 ZINC000554562853 567735813 /nfs/dbraw/zinc/73/58/13/567735813.db2.gz CMQDPPOHWJXHKT-KMUNFCNLSA-N 0 1 378.270 3.259 10 0 GGAEMN CC(=O)Nc1ccccc1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000554563037 567736185 /nfs/dbraw/zinc/73/61/85/567736185.db2.gz SQDVPKBKXXQWQH-UHFFFAOYSA-N 0 1 387.237 3.214 10 0 GGAEMN CN(Cc1cc(C(C)(C)C)[nH]n1)C(=O)Cc1ccc(Br)cc1O ZINC000508280596 567741806 /nfs/dbraw/zinc/74/18/06/567741806.db2.gz SQWCTHOLAVYNFX-UHFFFAOYSA-N 0 1 380.286 3.376 10 0 GGAEMN COC(=O)[C@@H]1CCN(C(=O)c2cccc(Br)c2O)[C@@H]2CCCC[C@@H]12 ZINC000598180866 567742666 /nfs/dbraw/zinc/74/26/66/567742666.db2.gz MFNDVNVEMFLZQR-YWPYICTPSA-N 0 1 396.281 3.349 10 0 GGAEMN O=S(=O)(Cc1ccccc1Br)Nc1cc(C(F)(F)F)[nH]n1 ZINC000554726025 567745400 /nfs/dbraw/zinc/74/54/00/567745400.db2.gz QMSATWLFEYGJQG-UHFFFAOYSA-N 0 1 384.177 3.133 10 0 GGAEMN CN(C)C1(C(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)CC1 ZINC000667398316 567745645 /nfs/dbraw/zinc/74/56/45/567745645.db2.gz LNHPOSGJJRWGHP-UHFFFAOYSA-N 0 1 380.275 3.236 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(F)c(Br)c(Cl)c2)CC1 ZINC000508398997 567746922 /nfs/dbraw/zinc/74/69/22/567746922.db2.gz DFNTZABQDRQYSC-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN COCCN1CCCN(C(=O)c2cccc3cccc(Br)c32)CC1 ZINC000508399041 567747236 /nfs/dbraw/zinc/74/72/36/567747236.db2.gz DKIMJSXGDLVOOU-UHFFFAOYSA-N 0 1 391.309 3.397 10 0 GGAEMN Brc1ccc(N2CCN(C[C@H]3CCC4(CCCC4)O3)CC2)nc1 ZINC000554809050 567750152 /nfs/dbraw/zinc/75/01/52/567750152.db2.gz STKXXWYZGQNUFM-MRXNPFEDSA-N 0 1 380.330 3.458 10 0 GGAEMN COc1ccc(Br)c(CNC[C@H](O)COc2ccc(C)cc2)c1 ZINC000554836412 567751545 /nfs/dbraw/zinc/75/15/45/567751545.db2.gz NCOGVFUCDDZWRW-HNNXBMFYSA-N 0 1 380.282 3.296 10 0 GGAEMN COc1cc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)c(C)c(OC)c1 ZINC000443413523 567755189 /nfs/dbraw/zinc/75/51/89/567755189.db2.gz AIMSJOWQNIZVPA-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN C[C@@H]1CN(C[C@@H]2CCCN2Cc2c(F)cncc2Br)C[C@H](C)O1 ZINC000667558891 567756050 /nfs/dbraw/zinc/75/60/50/567756050.db2.gz VHXJAEOATUAMFW-MJBXVCDLSA-N 0 1 386.309 3.057 10 0 GGAEMN OC[C@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1ncc(Br)cc1F ZINC000624049031 567756528 /nfs/dbraw/zinc/75/65/28/567756528.db2.gz ZESLHEGYAOKPOO-PBHICJAKSA-N 0 1 394.288 3.278 10 0 GGAEMN O=C(NCC/C=C/c1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000624087433 567759271 /nfs/dbraw/zinc/75/92/71/567759271.db2.gz WZZOBJCUYLMXPK-BQTXGFLSSA-N 0 1 389.297 3.432 10 0 GGAEMN O=C(NCC/C=C\c1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000624087435 567759341 /nfs/dbraw/zinc/75/93/41/567759341.db2.gz WZZOBJCUYLMXPK-PEXHTFQZSA-N 0 1 389.297 3.432 10 0 GGAEMN C[C@H](N[C@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)sc1Cl ZINC000624113751 567760413 /nfs/dbraw/zinc/76/04/13/567760413.db2.gz MMNUYVQVTPAVCR-UWVGGRQHSA-N 0 1 383.308 3.422 10 0 GGAEMN O=C(N[C@H]1CCOC2(CCSCC2)C1)c1cccc(Br)c1O ZINC000533235496 567760626 /nfs/dbraw/zinc/76/06/26/567760626.db2.gz ORKIHTLUCMKNBC-NSHDSACASA-N 0 1 386.311 3.329 10 0 GGAEMN COc1ncc(S(=O)(=O)Nc2ccc3cnn(C(C)C)c3c2)cc1Cl ZINC000647126189 567760647 /nfs/dbraw/zinc/76/06/47/567760647.db2.gz CRHICGOVMXHCGI-UHFFFAOYSA-N 0 1 380.857 3.475 10 0 GGAEMN CCCN1Cc2cccc(NS(=O)(=O)c3cnc(OC)c(Cl)c3)c2C1 ZINC000647126646 567761834 /nfs/dbraw/zinc/76/18/34/567761834.db2.gz QOCKNMJVFVTVPS-UHFFFAOYSA-N 0 1 381.885 3.270 10 0 GGAEMN COc1ncc(Br)cc1CN[C@H](C)CC(=O)N(C)c1ccccc1 ZINC000624133430 567761861 /nfs/dbraw/zinc/76/18/61/567761861.db2.gz NZHQRAOZUIGSNI-CYBMUJFWSA-N 0 1 392.297 3.384 10 0 GGAEMN COc1ncc(Br)cc1CN[C@@H](C)CC(=O)Nc1ccc(F)cc1 ZINC000624132843 567761885 /nfs/dbraw/zinc/76/18/85/567761885.db2.gz AXOMGLIACRCBAS-NSHDSACASA-N 0 1 396.260 3.499 10 0 GGAEMN O=C(Nc1nc2ccc(I)cc2[nH]1)C1CC(F)(F)C1 ZINC000598425631 567766474 /nfs/dbraw/zinc/76/64/74/567766474.db2.gz WTMYBLZMBYEOIW-UHFFFAOYSA-N 0 1 377.132 3.151 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(C(F)(F)F)s3)[nH]c21 ZINC000462057052 567763955 /nfs/dbraw/zinc/76/39/55/567763955.db2.gz JHYDGXHXLZRSPR-UHFFFAOYSA-N 0 1 375.397 3.430 10 0 GGAEMN CCCN1CCN(c2nnc(-c3cccc(Br)c3)n2CC)CC1 ZINC000555022545 567764099 /nfs/dbraw/zinc/76/40/99/567764099.db2.gz YGXVIPWHIUIZJY-UHFFFAOYSA-N 0 1 378.318 3.260 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1cnc(-c2ccc(Cl)s2)nc1)C(C)C ZINC000647137342 567764402 /nfs/dbraw/zinc/76/44/02/567764402.db2.gz WWNDRBNSTHRAFH-NSHDSACASA-N 0 1 375.903 3.271 10 0 GGAEMN CN1CCOC[C@@H]1CN[C@@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000624176052 567765256 /nfs/dbraw/zinc/76/52/56/567765256.db2.gz BCASRDXXAYTQNL-WMLDXEAASA-N 0 1 383.261 3.191 10 0 GGAEMN O=C(C[C@H]1CCCCO1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598422325 567765244 /nfs/dbraw/zinc/76/52/44/567765244.db2.gz ARKIRNCHOICXBF-SNVBAGLBSA-N 0 1 385.205 3.065 10 0 GGAEMN O=C(Nc1ccc(-c2ccc(Cl)s2)nn1)N1CCN(CC2CC2)CC1 ZINC000667683177 567765243 /nfs/dbraw/zinc/76/52/43/567765243.db2.gz HFIJQPIWXAPOEQ-UHFFFAOYSA-N 0 1 377.901 3.418 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)Nc2ccc(-c3ccc(Cl)s3)nn2)n[nH]1 ZINC000667679951 567765433 /nfs/dbraw/zinc/76/54/33/567765433.db2.gz SYUFEEXUWLHACP-MRVPVSSYSA-N 0 1 377.861 3.422 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N(CC(C)C)C3CCN(C)CC3)cc2s1 ZINC000574225391 567765849 /nfs/dbraw/zinc/76/58/49/567765849.db2.gz ZZHXSFZJBSXZKI-UHFFFAOYSA-N 0 1 381.567 3.346 10 0 GGAEMN CCC1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CCOCC1 ZINC000598425715 567766006 /nfs/dbraw/zinc/76/60/06/567766006.db2.gz XRHJEBGRFSLXNL-UHFFFAOYSA-N 0 1 399.232 3.313 10 0 GGAEMN CC(C)c1nn(C)cc1NC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 ZINC000574260820 567766410 /nfs/dbraw/zinc/76/64/10/567766410.db2.gz PBVVZFQOEVWXJP-UHFFFAOYSA-N 0 1 389.253 3.400 10 0 GGAEMN CC1(C)CC[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598428828 567767175 /nfs/dbraw/zinc/76/71/75/567767175.db2.gz STUPZQUKGWIVMU-NSHDSACASA-N 0 1 385.205 3.064 10 0 GGAEMN CCOC1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1 ZINC000598428825 567767363 /nfs/dbraw/zinc/76/73/63/567767363.db2.gz SSWBHHOEHLVQGS-UHFFFAOYSA-N 0 1 385.205 3.065 10 0 GGAEMN O=C(C[C@H]1CCCC[C@@H]1O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428863 567767842 /nfs/dbraw/zinc/76/78/42/567767842.db2.gz TZGUFSHQSBXRSG-RNCFNFMXSA-N 0 1 399.232 3.047 10 0 GGAEMN Cc1c2cccc(Cl)c2sc1CN1CCN(CCC(=O)N(C)C)CC1 ZINC000508814007 567767883 /nfs/dbraw/zinc/76/78/83/567767883.db2.gz TVESHEDFAVPQOS-UHFFFAOYSA-N 0 1 379.957 3.459 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285271 567769351 /nfs/dbraw/zinc/76/93/51/567769351.db2.gz KDYFQVHOYMBTQF-NWDGAFQWSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285271 567769356 /nfs/dbraw/zinc/76/93/56/567769356.db2.gz KDYFQVHOYMBTQF-NWDGAFQWSA-N 0 1 394.212 3.115 10 0 GGAEMN CCCOC[C@H](Cc1cccc(Br)c1)NCc1cncnc1OC ZINC000647202977 567770323 /nfs/dbraw/zinc/77/03/23/567770323.db2.gz BMTLWVDJRXJLEI-KRWDZBQOSA-N 0 1 394.313 3.375 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1cc(OC(F)F)ccc1Br ZINC000647209397 567771141 /nfs/dbraw/zinc/77/11/41/567771141.db2.gz HEPUVWHJRUBZSU-RISCZKNCSA-N 0 1 396.272 3.298 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC[C@H](OC(F)F)C1 ZINC000555216860 567775440 /nfs/dbraw/zinc/77/54/40/567775440.db2.gz HIUWCNJUEFWHSN-JTQLQIEISA-N 0 1 386.196 3.293 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccc(F)cc1C(F)(F)F)C1CCOCC1 ZINC000647268112 567775499 /nfs/dbraw/zinc/77/54/99/567775499.db2.gz ROAVKPWCQAQUQN-CQSZACIVSA-N 0 1 385.379 3.028 10 0 GGAEMN COC(=O)c1cnc([C@H]2CCCN(C(=O)c3ccc(O)c(Cl)c3)C2)s1 ZINC000598563357 567776701 /nfs/dbraw/zinc/77/67/01/567776701.db2.gz UDBPDXNMOULPPJ-NSHDSACASA-N 0 1 380.853 3.309 10 0 GGAEMN CC(C)C[C@H](N)c1noc(-c2cccnc2-n2cc(Br)cn2)n1 ZINC000574398939 567777048 /nfs/dbraw/zinc/77/70/48/567777048.db2.gz PRKBLAJJKLIYEE-LBPRGKRZSA-N 0 1 377.246 3.126 10 0 GGAEMN CC(C)c1nc(CNC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)n[nH]1 ZINC000574406271 567777102 /nfs/dbraw/zinc/77/71/02/567777102.db2.gz QWNJMCMJIBZMMR-UHFFFAOYSA-N 0 1 390.658 3.143 10 0 GGAEMN C[C@@H](NC[C@@H](O)COc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647295097 567777601 /nfs/dbraw/zinc/77/76/01/567777601.db2.gz ZRJGIBVPYBCRNR-UKRRQHHQSA-N 0 1 394.313 3.072 10 0 GGAEMN C[C@@H](NCCNC(=O)c1ccc(Br)cc1)c1cc2n(n1)CCCC2 ZINC000647283649 567778099 /nfs/dbraw/zinc/77/80/99/567778099.db2.gz ILGYBZIJYRQXEK-CYBMUJFWSA-N 0 1 391.313 3.063 10 0 GGAEMN O=S1(=O)CC[C@H](NC[C@@H]2CSc3ccccc3O2)c2cc(F)ccc21 ZINC000647314285 567779632 /nfs/dbraw/zinc/77/96/32/567779632.db2.gz BLMIYCOHFMGQLE-HIFRSBDPSA-N 0 1 379.478 3.187 10 0 GGAEMN COC(=O)c1cc(OC)c(S(=O)(=O)N[C@@H](C(F)F)C2CCCCC2)s1 ZINC000598628929 567780412 /nfs/dbraw/zinc/78/04/12/567780412.db2.gz UTSDURZCCWTGDT-GFCCVEGCSA-N 0 1 397.465 3.036 10 0 GGAEMN COc1ccc2c(c1)C[C@H](NCc1cc(OC)c(O)cc1Br)CO2 ZINC000647361612 567780855 /nfs/dbraw/zinc/78/08/55/567780855.db2.gz LTTPJEKQKYHRLV-ZDUSSCGKSA-N 0 1 394.265 3.265 10 0 GGAEMN O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1n[nH]c2ccc(Br)cc21 ZINC000533656349 567781124 /nfs/dbraw/zinc/78/11/24/567781124.db2.gz PXRGFIRVYLERAP-IUIKQTSFSA-N 0 1 390.281 3.403 10 0 GGAEMN C[C@H](Cc1cc(Br)ccc1F)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000533716312 567784201 /nfs/dbraw/zinc/78/42/01/567784201.db2.gz JVMSICJMAOCYLF-ZWNOBZJWSA-N 0 1 380.261 3.479 10 0 GGAEMN C[C@@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CCCO1 ZINC000667947087 567784653 /nfs/dbraw/zinc/78/46/53/567784653.db2.gz FYLHHLNTPTVFEN-FZMZJTMJSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCCO1 ZINC000667947087 567784655 /nfs/dbraw/zinc/78/46/55/567784655.db2.gz FYLHHLNTPTVFEN-FZMZJTMJSA-N 0 1 393.285 3.056 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Cl)cc(Br)c2F)CC1 ZINC000444004777 567784796 /nfs/dbraw/zinc/78/47/96/567784796.db2.gz MOJZBFXZHDBYEP-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN C[C@@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@H]1CCCO1 ZINC000667947089 567785092 /nfs/dbraw/zinc/78/50/92/567785092.db2.gz FYLHHLNTPTVFEN-SMDDNHRTSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCCO1 ZINC000667947089 567785097 /nfs/dbraw/zinc/78/50/97/567785097.db2.gz FYLHHLNTPTVFEN-SMDDNHRTSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CCCC1 ZINC000667947359 567785585 /nfs/dbraw/zinc/78/55/85/567785585.db2.gz NRLLBPQJOBHRGJ-OAHLLOKOSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCCC1 ZINC000667947359 567785587 /nfs/dbraw/zinc/78/55/87/567785587.db2.gz NRLLBPQJOBHRGJ-OAHLLOKOSA-N 0 1 393.285 3.056 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc(Br)c(Cl)c2F)CC1 ZINC000444006160 567785762 /nfs/dbraw/zinc/78/57/62/567785762.db2.gz WCSIKQUEEDCNSV-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1ccc(Br)c(Cl)c1F ZINC000444038704 567786860 /nfs/dbraw/zinc/78/68/60/567786860.db2.gz JGJBTKGOEJXXPQ-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN CNC(=O)c1ccc(=N[C@H]2CCCSc3ccc(Br)cc32)[nH]n1 ZINC000624555561 567787457 /nfs/dbraw/zinc/78/74/57/567787457.db2.gz MPDONFWJUFAVLX-LBPRGKRZSA-N 0 1 393.310 3.060 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N(CCN(C)C)Cc3ccsc3)cc2s1 ZINC000574621952 567788102 /nfs/dbraw/zinc/78/81/02/567788102.db2.gz BISSVUPZCNEVIO-UHFFFAOYSA-N 0 1 395.575 3.419 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N3CCC(c4cn[nH]c4C)CC3)cc2s1 ZINC000555567101 567788985 /nfs/dbraw/zinc/78/89/85/567788985.db2.gz AQDWUWKXDFLPKQ-UHFFFAOYSA-N 0 1 376.507 3.205 10 0 GGAEMN CCn1c(CNC(=O)[C@@H]2CCCN2C2CC2)nc2cc(Br)ccc21 ZINC000555624421 567792514 /nfs/dbraw/zinc/79/25/14/567792514.db2.gz ZRTLFCAVKIZRCB-INIZCTEOSA-N 0 1 391.313 3.062 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cc(OC)ccc2Br)[C@H]1n1cccn1 ZINC000555646772 567793320 /nfs/dbraw/zinc/79/33/20/567793320.db2.gz FMIRKLSSEDCUIT-GVDBMIGSSA-N 0 1 380.286 3.163 10 0 GGAEMN OCCN(Cc1ccc(Br)s1)Cc1ccnn1-c1ccncc1 ZINC000668056430 567794536 /nfs/dbraw/zinc/79/45/36/567794536.db2.gz BUJFYHJAPFIGPI-UHFFFAOYSA-N 0 1 393.310 3.086 10 0 GGAEMN CCN(CC(F)(F)F)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444151931 567795218 /nfs/dbraw/zinc/79/52/18/567795218.db2.gz HMBXBQPFMWIVMH-UHFFFAOYSA-N 0 1 377.160 3.315 10 0 GGAEMN CCC1(N2CCOCC2)CCN(c2nc(C3CC3)ncc2Br)CC1 ZINC000624704581 567795974 /nfs/dbraw/zinc/79/59/74/567795974.db2.gz XTLBRNPHDKCTRF-UHFFFAOYSA-N 0 1 395.345 3.198 10 0 GGAEMN Brc1ccc2nc(CN3CCC(O[C@@H]4CCOC4)CC3)[nH]c2c1 ZINC000574768247 567796583 /nfs/dbraw/zinc/79/65/83/567796583.db2.gz MBZJCKBOPKJYLK-CQSZACIVSA-N 0 1 380.286 3.095 10 0 GGAEMN C[C@H]1Cc2cn[nH]c2[C@@H](C(=O)Nc2cc(I)ccc2O)C1 ZINC000598934189 567799001 /nfs/dbraw/zinc/79/90/01/567799001.db2.gz OLRCVTCPQYUPHU-KWQFWETISA-N 0 1 397.216 3.025 10 0 GGAEMN C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2cc(Br)c([O-])c(Br)c2)C1 ZINC000668186571 567799285 /nfs/dbraw/zinc/79/92/85/567799285.db2.gz MHHRWRNLFGRQMD-GWCFXTLKSA-N 0 1 390.119 3.053 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCCN(C[C@H]3CCCO3)CC2)c1 ZINC000624764736 567799272 /nfs/dbraw/zinc/79/92/72/567799272.db2.gz JNEAJZIZQNZEPR-CQSZACIVSA-N 0 1 399.304 3.224 10 0 GGAEMN CN(C(=O)c1cc(Cl)cc(Br)c1F)[C@@H]1CN2CCC1CC2 ZINC000444268273 567799648 /nfs/dbraw/zinc/79/96/48/567799648.db2.gz MELDYPIMYMZNJH-CYBMUJFWSA-N 0 1 375.669 3.408 10 0 GGAEMN CN(Cc1nccs1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444299442 567799962 /nfs/dbraw/zinc/79/99/62/567799962.db2.gz UZPIYWARBQUEQK-UHFFFAOYSA-N 0 1 378.251 3.019 10 0 GGAEMN CC(C)(C)OC(=O)c1ccc(CNCc2ccc(S(C)(=O)=O)cc2)s1 ZINC000598956935 567800778 /nfs/dbraw/zinc/80/07/78/567800778.db2.gz CFQZHCGOFDMQST-UHFFFAOYSA-N 0 1 381.519 3.397 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)[C@H]2COC(C)(C)C2)c2cccs2)CC1 ZINC000624797025 567800804 /nfs/dbraw/zinc/80/08/04/567800804.db2.gz KZTJHKQYYIMEJR-HZPDHXFCSA-N 0 1 386.583 3.008 10 0 GGAEMN CC1CCN([C@@H](CNS(=O)(=O)[C@H]2COC(C)(C)C2)c2cccs2)CC1 ZINC000624797021 567801345 /nfs/dbraw/zinc/80/13/45/567801345.db2.gz KZTJHKQYYIMEJR-CVEARBPZSA-N 0 1 386.583 3.008 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNCc1cccc(I)c1 ZINC000598990055 567801692 /nfs/dbraw/zinc/80/16/92/567801692.db2.gz ZRBQKUCWVBADTG-UHFFFAOYSA-N 0 1 395.166 3.333 10 0 GGAEMN [NH3+]C1(CNC(=O)c2ccc(Br)c([O-])c2)C2CC3CC(C2)CC1C3 ZINC000574875546 567802288 /nfs/dbraw/zinc/80/22/88/567802288.db2.gz SDQMGLYOWVXFLW-UHFFFAOYSA-N 0 1 379.298 3.038 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2cc(Cl)ccc2F)[C@@H]1O ZINC000668258166 567805184 /nfs/dbraw/zinc/80/51/84/567805184.db2.gz DGOKYLNQQSHLQV-OCCSQVGLSA-N 0 1 391.873 3.092 10 0 GGAEMN NC(=O)[C@@H](NC[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(Br)cc1 ZINC000574949185 567805358 /nfs/dbraw/zinc/80/53/58/567805358.db2.gz MJUFZZRLSAROTC-SQNIBIBYSA-N 0 1 389.293 3.485 10 0 GGAEMN Cn1cc([C@H](NCc2cc(F)cc(Br)c2)C2(CO)CCC2)cn1 ZINC000647944397 567807894 /nfs/dbraw/zinc/80/78/94/567807894.db2.gz FGUXSIUZFRITAI-INIZCTEOSA-N 0 1 382.277 3.315 10 0 GGAEMN FC(F)Oc1ccc(Br)c(CN2CC[C@H](Cn3ccnn3)C2)c1 ZINC000668453305 567810095 /nfs/dbraw/zinc/81/00/95/567810095.db2.gz GZAFXMBCFZAEEE-NSHDSACASA-N 0 1 387.228 3.164 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@H]1CCCN(c2cnn(C)c2)C1=O ZINC000444697688 567810225 /nfs/dbraw/zinc/81/02/25/567810225.db2.gz BNVHHWCZCIPODW-KRWDZBQOSA-N 0 1 391.313 3.118 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@@H]1CCCN(c2cnn(C)c2)C1=O ZINC000444697689 567810494 /nfs/dbraw/zinc/81/04/94/567810494.db2.gz BNVHHWCZCIPODW-QGZVFWFLSA-N 0 1 391.313 3.118 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1Cc1cc(OC(F)F)ccc1Br ZINC000648004441 567810526 /nfs/dbraw/zinc/81/05/26/567810526.db2.gz HZDYPGDEODWGCA-LLVKDONJSA-N 0 1 377.229 3.280 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1Cc1cc(OC(F)F)ccc1Br ZINC000648004442 567810757 /nfs/dbraw/zinc/81/07/57/567810757.db2.gz HZDYPGDEODWGCA-NSHDSACASA-N 0 1 377.229 3.280 10 0 GGAEMN CC1(C)CN(C[C@@H](O)COc2c(Cl)cccc2Cl)C[C@]2(CCOC2)O1 ZINC000575060238 567811558 /nfs/dbraw/zinc/81/15/58/567811558.db2.gz WTSSUXVLNUFOBC-ACJLOTCBSA-N 0 1 390.307 3.003 10 0 GGAEMN Cc1ccc(Cl)c(OC[C@H](O)CN2CCC[C@@H]([C@H](O)C(F)(F)F)C2)c1 ZINC000444727064 567812192 /nfs/dbraw/zinc/81/21/92/567812192.db2.gz PHNOFYWROKMVEN-IOASZLSFSA-N 0 1 381.822 3.023 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2cnc(-c3cccs3)s2)C1 ZINC000648073405 567813444 /nfs/dbraw/zinc/81/34/44/567813444.db2.gz LJERDFROPSFZRU-CQSZACIVSA-N 0 1 375.441 3.372 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1C[C@H]2COC[C@@]2(C)C1 ZINC000668594843 567814225 /nfs/dbraw/zinc/81/42/25/567814225.db2.gz HRHVLDUXCFVOAU-MAUKXSAKSA-N 0 1 384.314 3.333 10 0 GGAEMN CN(C(=O)c1cc(-c2ccc(Br)cc2)no1)[C@@H]1CCN(C2CC2)C1 ZINC000668598173 567814803 /nfs/dbraw/zinc/81/48/03/567814803.db2.gz IXVMGGLEBLAMOT-OAHLLOKOSA-N 0 1 390.281 3.413 10 0 GGAEMN C[C@@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@H](C)C1 ZINC000012809840 570221843 /nfs/dbraw/zinc/22/18/43/570221843.db2.gz PCJRGBRXXORJRI-KBPBESRZSA-N 0 1 385.430 3.223 10 0 GGAEMN CC(C)(C)c1ccc(CN2CCN(c3c4c(nc5ncnn53)CCC4)CC2)cc1 ZINC000023308736 570233586 /nfs/dbraw/zinc/23/35/86/570233586.db2.gz WGIQWHYUPUJWGG-UHFFFAOYSA-N 0 1 390.535 3.233 10 0 GGAEMN O=C(CN1CCC[C@H]1CN1CCc2ccccc21)N[C@H]1CCOc2ccccc21 ZINC000247765418 570240473 /nfs/dbraw/zinc/24/04/73/570240473.db2.gz KILZVJZPCBVPPH-FPOVZHCZSA-N 0 1 391.515 3.154 10 0 GGAEMN CCOC(=O)CCNC(=O)c1ccc(-c2[nH]nc3c2COc2ccccc2-3)cc1 ZINC000023315306 570241206 /nfs/dbraw/zinc/24/12/06/570241206.db2.gz OPJSOJGGRLXSOF-UHFFFAOYSA-N 0 1 391.427 3.319 10 0 GGAEMN CCNC(=O)c1cccc(CNC(=O)c2ccc(CN3CCCCC3)s2)c1 ZINC000072301526 570256423 /nfs/dbraw/zinc/25/64/23/570256423.db2.gz VWCDEARATYXFQN-UHFFFAOYSA-N 0 1 385.533 3.414 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)c3cccnc3Oc3ccccc3)cn2)CC1 ZINC000021131609 570288273 /nfs/dbraw/zinc/28/82/73/570288273.db2.gz HDRNBZQOPOKETM-UHFFFAOYSA-N 0 1 389.459 3.273 10 0 GGAEMN CC(C)(C)NC(=O)Nc1ccc(N2CCCN(Cc3cccnc3)CC2)nc1 ZINC000034682090 570300307 /nfs/dbraw/zinc/30/03/07/570300307.db2.gz LOXMTRWHQHOMFV-UHFFFAOYSA-N 0 1 382.512 3.109 10 0 GGAEMN CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)O[C@@H](C)C(C)=O)cc1 ZINC000022140867 570306457 /nfs/dbraw/zinc/30/64/57/570306457.db2.gz IAZDFRYBWCNFSP-AWEZNQCLSA-N 0 1 391.445 3.020 10 0 GGAEMN Cc1cc(C(=O)N2CCC([N@@H+](C)CC(=O)[O-])CC2)c(C)n1[C@H](C)c1ccccc1 ZINC000186628878 570306497 /nfs/dbraw/zinc/30/64/97/570306497.db2.gz LBVPNGMOWSSURJ-QGZVFWFLSA-N 0 1 397.519 3.335 10 0 GGAEMN Cc1cc(C(=O)N2CCC([N@@H+](C)CC(=O)[O-])CC2)c(C)n1[C@@H](C)c1ccccc1 ZINC000186628858 570306583 /nfs/dbraw/zinc/30/65/83/570306583.db2.gz LBVPNGMOWSSURJ-KRWDZBQOSA-N 0 1 397.519 3.335 10 0 GGAEMN CCOc1ccc([C@H](c2c(O)cc(C)n(CC)c2=O)N2CCN(CC)CC2)cc1 ZINC000024022943 570342519 /nfs/dbraw/zinc/34/25/19/570342519.db2.gz KPWRKBXKTPWYPN-JOCHJYFZSA-N 0 1 399.535 3.008 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@@H]1CCCN(C(=O)c2cccs2)C1)c1ccsc1 ZINC000023133432 570346101 /nfs/dbraw/zinc/34/61/01/570346101.db2.gz RUEHVLCYIGWBHF-ZBFHGGJFSA-N 0 1 391.562 3.081 10 0 GGAEMN S=c1n2ccccc2nn1CN1CCN(Cc2cccc3cccnc32)CC1 ZINC000023251048 570352873 /nfs/dbraw/zinc/35/28/73/570352873.db2.gz LVMVPQLKNGXKQG-UHFFFAOYSA-N 0 1 390.516 3.189 10 0 GGAEMN O=C1Nc2ccccc2N(O)N1c1ccc(S(=O)(=O)Nc2ccccn2)cc1 ZINC000004884404 570356280 /nfs/dbraw/zinc/35/62/80/570356280.db2.gz YKTASJRPIJIASI-UHFFFAOYSA-N 0 1 397.416 3.045 10 0 GGAEMN CN1CCN(c2ccc(CNC(=O)c3ccc(-c4ccc(F)cc4)o3)cn2)CC1 ZINC000024335635 570382216 /nfs/dbraw/zinc/38/22/16/570382216.db2.gz CHFQZZSOBPYCRE-UHFFFAOYSA-N 0 1 394.450 3.163 10 0 GGAEMN Cc1[nH]c2ccc(F)cc2c1CC(=O)NCC1(N2CCOCC2)CCCCC1 ZINC000024549746 570385478 /nfs/dbraw/zinc/38/54/78/570385478.db2.gz NPARZDRQVJXOLK-UHFFFAOYSA-N 0 1 387.499 3.309 10 0 GGAEMN O=C(CN1CCC[C@@H]1c1cccs1)NCc1ccc(CN2CCOCC2)cc1 ZINC000024572654 570385994 /nfs/dbraw/zinc/38/59/94/570385994.db2.gz CIQFWEWKLNMOAS-HXUWFJFHSA-N 0 1 399.560 3.034 10 0 GGAEMN O=C(CN1CCC[C@H]1c1cccs1)NCc1ccc(CN2CCOCC2)cc1 ZINC000024572658 570386075 /nfs/dbraw/zinc/38/60/75/570386075.db2.gz CIQFWEWKLNMOAS-FQEVSTJZSA-N 0 1 399.560 3.034 10 0 GGAEMN CCc1nc(-c2cc(S(=O)(=O)Nc3ccc4c(c3)OCO4)c(C)s2)no1 ZINC000035539308 570391480 /nfs/dbraw/zinc/39/14/80/570391480.db2.gz BAVANWCEKZUMSE-UHFFFAOYSA-N 0 1 393.446 3.198 10 0 GGAEMN Cc1cc(NC(=O)CCc2nc(CSc3nc4ccc(C)cc4[nH]3)no2)no1 ZINC000033270874 570404276 /nfs/dbraw/zinc/40/42/76/570404276.db2.gz BNPHIFLPBSLORI-UHFFFAOYSA-N 0 1 398.448 3.414 10 0 GGAEMN O=C(c1n[nH]c2c1CCc1ccccc1-2)N1CCN(Cc2ccc(F)cc2)CC1 ZINC000033313884 570406402 /nfs/dbraw/zinc/40/64/02/570406402.db2.gz QIZVIEOYJBLJQG-UHFFFAOYSA-N 0 1 390.462 3.272 10 0 GGAEMN Cc1cccc(N2C[C@@H](C(=O)Nc3nc(-c4ccccc4)n[nH]3)CC2=O)c1C ZINC000025155412 570407303 /nfs/dbraw/zinc/40/73/03/570407303.db2.gz VIHWAWBJNAZQMM-INIZCTEOSA-N 0 1 375.432 3.080 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2)n[nH]1)[C@H]1CC(=O)N(c2ccccc2Cl)C1 ZINC000025156218 570407595 /nfs/dbraw/zinc/40/75/95/570407595.db2.gz AVHKKEHVTGJISH-ZDUSSCGKSA-N 0 1 381.823 3.117 10 0 GGAEMN Cc1nn(C)c2nc(C(C)C)cc(C(=O)NC[C@H](c3ccsc3)N(C)C)c12 ZINC000025332031 570411485 /nfs/dbraw/zinc/41/14/85/570411485.db2.gz KPKLWAKGFCPNTQ-QGZVFWFLSA-N 0 1 385.537 3.494 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H](c1cccs1)N(C)C ZINC000025385311 570412799 /nfs/dbraw/zinc/41/27/99/570412799.db2.gz CCDOXKXCXJCSRY-FUHWJXTLSA-N 0 1 391.512 3.061 10 0 GGAEMN CCOC(=O)c1ccc(OC[C@H](O)CN2CCc3sccc3[C@@H]2C)cc1 ZINC000027473808 570434836 /nfs/dbraw/zinc/43/48/36/570434836.db2.gz BWAJFVFSQPXYEZ-GOEBONIOSA-N 0 1 375.490 3.284 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)C(=O)Nc2ccccc2Oc2cccc(F)c2)n[nH]1 ZINC000130649168 570464608 /nfs/dbraw/zinc/46/46/08/570464608.db2.gz DJGKUORMWZZXCO-CYBMUJFWSA-N 0 1 396.422 3.335 10 0 GGAEMN CCNC(=O)[C@@H]1Cc2ccccc2N2CCN(Cc3ccc(Cl)cc3)C[C@H]12 ZINC000035869952 570467820 /nfs/dbraw/zinc/46/78/20/570467820.db2.gz YDLDNZVHLUKFFQ-TZIWHRDSSA-N 0 1 383.923 3.339 10 0 GGAEMN COc1cccc(N2CC[C@@H](CNc3nc(C(F)(F)F)nc4[nH]cnc43)C2)c1 ZINC000252482121 570474542 /nfs/dbraw/zinc/47/45/42/570474542.db2.gz CYXVVJVDSCDXFZ-NSHDSACASA-N 0 1 392.385 3.319 10 0 GGAEMN O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1ccccc1OCc1ccccc1 ZINC000006589029 570486532 /nfs/dbraw/zinc/48/65/32/570486532.db2.gz RNAYIIQRRHSNHO-UHFFFAOYSA-N 0 1 393.443 3.165 10 0 GGAEMN COc1ccc(C)cc1NC(=O)[C@H](NCCCN1CCCC1=O)c1ccccc1 ZINC000006596405 570489687 /nfs/dbraw/zinc/48/96/87/570489687.db2.gz GVDRVEYHNUBFBR-JOCHJYFZSA-N 0 1 395.503 3.286 10 0 GGAEMN CCc1cc(N2CCN(Cc3ccc(C(C)(C)C)cc3)CC2)n2ncnc2n1 ZINC000022667616 570490286 /nfs/dbraw/zinc/49/02/86/570490286.db2.gz RODLWWRCZSJXJE-UHFFFAOYSA-N 0 1 378.524 3.306 10 0 GGAEMN c1nc(COc2ccc(CNCc3cccnc3N3CCOCC3)cc2)cs1 ZINC000030901532 570500946 /nfs/dbraw/zinc/50/09/46/570500946.db2.gz BXGZHEUJJAYXAX-UHFFFAOYSA-N 0 1 396.516 3.244 10 0 GGAEMN CCOc1ccc(-c2nc(CSc3nc(N)cc(N)n3)cs2)cc1OC ZINC000031354200 570504193 /nfs/dbraw/zinc/50/41/93/570504193.db2.gz RCRHRBBNZAVXQG-UHFFFAOYSA-N 0 1 389.506 3.464 10 0 GGAEMN C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CSc1nc(-c2ccccc2)n[nH]1 ZINC000005216701 570513253 /nfs/dbraw/zinc/51/32/53/570513253.db2.gz NYAWRKVUMLSGHA-ZDUSSCGKSA-N 0 1 393.472 3.328 10 0 GGAEMN CCOc1cccc2cc([C@@H](C)NC(=O)c3cc(=O)c4c(C)nn(C)c4[nH]3)oc21 ZINC000072307010 570524721 /nfs/dbraw/zinc/52/47/21/570524721.db2.gz AKDPCCVMNTVVLF-LLVKDONJSA-N 0 1 394.431 3.206 10 0 GGAEMN CCn1c(C)cc(O)c([C@H](c2ccc(OC)cc2OC)N2CCCCC2)c1=O ZINC000022697345 570529726 /nfs/dbraw/zinc/52/97/26/570529726.db2.gz LZCYMCPZKUMZLD-NRFANRHFSA-N 0 1 386.492 3.475 10 0 GGAEMN CCn1c(C)cc(O)c([C@@H](c2ccc(OC)cc2OC)N2CCCCC2)c1=O ZINC000022697348 570529748 /nfs/dbraw/zinc/52/97/48/570529748.db2.gz LZCYMCPZKUMZLD-OAQYLSRUSA-N 0 1 386.492 3.475 10 0 GGAEMN COc1cccc(CN(Cc2ccc3c(c2)OCO3)C[C@@H](O)COC(C)C)c1 ZINC000036098459 570536352 /nfs/dbraw/zinc/53/63/52/570536352.db2.gz ZVUFYJQAPWDBAM-LJQANCHMSA-N 0 1 387.476 3.212 10 0 GGAEMN COc1ccc(CN(Cc2ccc3c(c2)OCO3)C[C@@H](O)COC(C)C)cc1 ZINC000036102310 570538958 /nfs/dbraw/zinc/53/89/58/570538958.db2.gz ZTCMMKBWPQEFIS-LJQANCHMSA-N 0 1 387.476 3.212 10 0 GGAEMN CCOC[C@@H](O)CN(Cc1cccc(F)c1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036145913 570549009 /nfs/dbraw/zinc/54/90/09/570549009.db2.gz KEHZNWMPRRYIFK-SFTDATJTSA-N 0 1 386.467 3.218 10 0 GGAEMN CCOC[C@@H](O)CN(Cc1ccc(F)cc1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036145869 570549129 /nfs/dbraw/zinc/54/91/29/570549129.db2.gz MOWJCXHJKHMGKH-SFTDATJTSA-N 0 1 386.467 3.218 10 0 GGAEMN CC(C)CCN(CCC(=O)N1CCNCC1)C(=O)c1ccc(C(F)(F)F)cc1 ZINC000035421644 570552684 /nfs/dbraw/zinc/55/26/84/570552684.db2.gz IPHHQBRFBPAVFL-UHFFFAOYSA-N 0 1 399.457 3.016 10 0 GGAEMN CCN1CCN(Cc2nc3cc(NC(=O)c4cccc(C)c4)ccc3n2C)CC1 ZINC000022822147 570553985 /nfs/dbraw/zinc/55/39/85/570553985.db2.gz NHXXADRENPSHFR-UHFFFAOYSA-N 0 1 391.519 3.272 10 0 GGAEMN O=C(CN1CCC[C@H](c2nc[nH]n2)C1)Nc1ccccc1Oc1ccccc1 ZINC000225451717 570575469 /nfs/dbraw/zinc/57/54/69/570575469.db2.gz JRFXNPXVSQPSTP-INIZCTEOSA-N 0 1 377.448 3.415 10 0 GGAEMN O=C(CN[C@@]1(CO)CCCc2ccccc21)NC1CCC(C(F)(F)F)CC1 ZINC000225648479 570598117 /nfs/dbraw/zinc/59/81/17/570598117.db2.gz KQOBROVMFSKHPL-LADRWXRNSA-N 0 1 384.442 3.037 10 0 GGAEMN Cc1ccc(C2=NN(C(=O)CN3CCCC3)[C@H](c3ccc4c(c3)OCO4)C2)cc1 ZINC000036344430 570626353 /nfs/dbraw/zinc/62/63/53/570626353.db2.gz IKCHVKWFHGAZMZ-FQEVSTJZSA-N 0 1 391.471 3.497 10 0 GGAEMN CCCCCN(CCC(=O)N1CCNCC1)C(=O)c1ccc(C(C)(C)C)cc1 ZINC000045966670 570649971 /nfs/dbraw/zinc/64/99/71/570649971.db2.gz WBYPJEFKTRDXGP-UHFFFAOYSA-N 0 1 387.568 3.438 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)c2ccc(Oc3ccccc3)cc2)CC1 ZINC000239366890 570683117 /nfs/dbraw/zinc/68/31/17/570683117.db2.gz AGONIMNQMLJPTE-GOSISDBHSA-N 0 1 382.460 3.490 10 0 GGAEMN Cn1cc(-c2csc(CNc3ccc(CCN4CCOCC4)cc3)n2)cn1 ZINC000239367283 570683148 /nfs/dbraw/zinc/68/31/48/570683148.db2.gz AHYZCTKMBVDQCQ-UHFFFAOYSA-N 0 1 383.521 3.030 10 0 GGAEMN Cc1ccccc1CN1CCN(c2nnc([C@H]3CCO[C@@H]3C(C)(C)C)n2C)CC1 ZINC000239667656 570684006 /nfs/dbraw/zinc/68/40/06/570684006.db2.gz BRAWWVLVJACBOI-PMACEKPBSA-N 0 1 397.567 3.364 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)c2ccccc2Oc2ccccc2)CC1 ZINC000241644496 570687642 /nfs/dbraw/zinc/68/76/42/570687642.db2.gz PRGWPVHHLLTOEC-QGZVFWFLSA-N 0 1 382.460 3.490 10 0 GGAEMN CCN(CC)CC(=O)N1N=C(c2cccs2)C[C@@H]1c1cccc(O)c1OC ZINC000242047940 570688725 /nfs/dbraw/zinc/68/87/25/570688725.db2.gz VRKVEOYGCIGZMA-MRXNPFEDSA-N 0 1 387.505 3.482 10 0 GGAEMN CCc1cc(C(=O)N2CCC3(C[C@H]3N(Cc3ccsc3)C(C)=O)CC2)n[nH]1 ZINC000275773320 570699877 /nfs/dbraw/zinc/69/98/77/570699877.db2.gz SILRBPWFZGUEMP-GOSISDBHSA-N 0 1 386.521 3.077 10 0 GGAEMN CC(=O)c1cc2c(cc1NC(=O)CN[C@H](C)c1ccc(F)c(F)c1)OCO2 ZINC000058172525 570715410 /nfs/dbraw/zinc/71/54/10/570715410.db2.gz JZOZBCHKOQLXGA-SNVBAGLBSA-N 0 1 376.359 3.185 10 0 GGAEMN O=C(CN1CCC[C@H]1c1cccs1)N1CCN(Cc2ccccc2F)CC1 ZINC000012983416 570736667 /nfs/dbraw/zinc/73/66/67/570736667.db2.gz PNJVPTZSYPVACN-IBGZPJMESA-N 0 1 387.524 3.369 10 0 GGAEMN O=C(NC[C@@H](c1ccco1)N1CCCC1)c1ccc(N2CCCCC2=O)cc1 ZINC000012984111 570736773 /nfs/dbraw/zinc/73/67/73/570736773.db2.gz QBZHTFMKJQODOI-IBGZPJMESA-N 0 1 381.476 3.363 10 0 GGAEMN COCCCNC(=O)C1CCN(Cc2nc(-c3cccc(C)c3)oc2C)CC1 ZINC000007006615 570738574 /nfs/dbraw/zinc/73/85/74/570738574.db2.gz FAXHKLKYOJPPRN-UHFFFAOYSA-N 0 1 385.508 3.323 10 0 GGAEMN COc1ccc(OC)c(NC(=O)NCCc2n[nH]c(Cc3ccc(C)cc3)n2)c1 ZINC000033062545 570748516 /nfs/dbraw/zinc/74/85/16/570748516.db2.gz YPYRCBFPGVNGIT-UHFFFAOYSA-N 0 1 395.463 3.085 10 0 GGAEMN CCN1CCN(c2nnc(-c3nc(-c4ccccc4)no3)c3ccccc32)CC1 ZINC000065258318 570759838 /nfs/dbraw/zinc/75/98/38/570759838.db2.gz NFEKWKIGDXJLRI-UHFFFAOYSA-N 0 1 386.459 3.489 10 0 GGAEMN COc1cc(NC(=O)CSc2nc(-c3ccc(F)cc3)n[nH]2)cc(OC)c1 ZINC000021943215 570773856 /nfs/dbraw/zinc/77/38/56/570773856.db2.gz RBWBKFZVBAMGAB-UHFFFAOYSA-N 0 1 388.424 3.359 10 0 GGAEMN COc1ccc(CN(Cc2cc(=O)n3ccsc3n2)CC(C)C)cc1OC ZINC000033068968 570774322 /nfs/dbraw/zinc/77/43/22/570774322.db2.gz WPKKXRJWPOOLKI-UHFFFAOYSA-N 0 1 387.505 3.431 10 0 GGAEMN c1sc2c(c1CN1CCN(c3cnn4c(c3)nnc4C3CC3)CC1)CCCC2 ZINC000065282642 570780194 /nfs/dbraw/zinc/78/01/94/570780194.db2.gz PQLLYDIJYLCZPA-UHFFFAOYSA-N 0 1 394.548 3.264 10 0 GGAEMN COc1ccccc1CNC(=O)[C@H]1CCCN(c2nc3ccc(C)cc3[nH]2)C1 ZINC000033072051 570803550 /nfs/dbraw/zinc/80/35/50/570803550.db2.gz DUBVIWRQPPATNV-KRWDZBQOSA-N 0 1 378.476 3.413 10 0 GGAEMN COc1ccccc1CNC(=O)[C@@H]1CCCN(c2nc3ccc(C)cc3[nH]2)C1 ZINC000033072049 570803821 /nfs/dbraw/zinc/80/38/21/570803821.db2.gz DUBVIWRQPPATNV-QGZVFWFLSA-N 0 1 378.476 3.413 10 0 GGAEMN COc1ccccc1N1CCN(C(=O)CN2CCC[C@@H]2c2cccs2)CC1 ZINC000007216193 570816770 /nfs/dbraw/zinc/81/67/70/570816770.db2.gz CYHZBRNAPAIJAZ-GOSISDBHSA-N 0 1 385.533 3.242 10 0 GGAEMN O=C(c1cc(C2CC2)[nH]n1)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000012544550 570845538 /nfs/dbraw/zinc/84/55/38/570845538.db2.gz PSBSBJIVEXRJOR-UHFFFAOYSA-N 0 1 379.386 3.053 10 0 GGAEMN O=C(c1ccc2c(c1)OCCO2)C1CCN(Cn2cnc3ccccc32)CC1 ZINC000012547299 570848817 /nfs/dbraw/zinc/84/88/17/570848817.db2.gz MCLATMXOYNFQEB-UHFFFAOYSA-N 0 1 377.444 3.360 10 0 GGAEMN Cc1ccccc1C(=O)NCCC(=O)NC[C@@H](c1ccco1)N1CCCCC1 ZINC000032841463 570850048 /nfs/dbraw/zinc/85/00/48/570850048.db2.gz CIDWVFNEKYECEO-IBGZPJMESA-N 0 1 383.492 3.051 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)[C@H]2C ZINC000102655038 570855961 /nfs/dbraw/zinc/85/59/61/570855961.db2.gz HWLMZMLNBPHQIG-ZDUSSCGKSA-N 0 1 386.473 3.201 10 0 GGAEMN CCn1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3ccccc3)ccc21 ZINC000022936102 570857809 /nfs/dbraw/zinc/85/78/09/570857809.db2.gz ILYIHWMMZFSDJM-UHFFFAOYSA-N 0 1 377.492 3.056 10 0 GGAEMN CCn1c(CN2CCN(C)CC2)nc2cc(NC(=O)C3CCCCC3)ccc21 ZINC000022936099 570857960 /nfs/dbraw/zinc/85/79/60/570857960.db2.gz GARUKUWNGLOKNA-UHFFFAOYSA-N 0 1 383.540 3.322 10 0 GGAEMN O=S(=O)(N[C@H]1CN(Cc2ccccc2)C[C@@H]1c1cccnc1)c1ccccc1 ZINC000097097276 570892379 /nfs/dbraw/zinc/89/23/79/570892379.db2.gz DXYJWJBWYRUUMB-YADHBBJMSA-N 0 1 393.512 3.028 10 0 GGAEMN CCOCCN1CCN(C(=O)Nc2cccc(-c3noc(C)n3)c2)C[C@@H]1CC ZINC000097164678 570901694 /nfs/dbraw/zinc/90/16/94/570901694.db2.gz LBHGZMJLMNNWGN-SFHVURJKSA-N 0 1 387.484 3.010 10 0 GGAEMN Cc1nc(NCCN2CCN(Cc3ccccc3)CC2)cc(-c2ccccn2)n1 ZINC000089708999 570910685 /nfs/dbraw/zinc/91/06/85/570910685.db2.gz WFDAMSYCSXRKFS-UHFFFAOYSA-N 0 1 388.519 3.077 10 0 GGAEMN COc1ccccc1[C@H](CNC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O)[NH+](C)C ZINC000032912165 570915586 /nfs/dbraw/zinc/91/55/86/570915586.db2.gz GXJTXTIJRWUYPW-INIZCTEOSA-N 0 1 398.488 3.039 10 0 GGAEMN O=C(Nc1c[nH]nc1-c1ccccn1)NC1CCN(Cc2ccc(F)cc2)CC1 ZINC000089883956 570918256 /nfs/dbraw/zinc/91/82/56/570918256.db2.gz RWGZEZQHLGABNL-UHFFFAOYSA-N 0 1 394.454 3.397 10 0 GGAEMN Cc1nc2nc(-c3ccco3)nn2c(N2CCN(Cc3ccccc3)CC2)c1C ZINC000046913947 570936483 /nfs/dbraw/zinc/93/64/83/570936483.db2.gz LCDZLFSBTODYOB-UHFFFAOYSA-N 0 1 388.475 3.323 10 0 GGAEMN CCc1nc(SCc2noc(CCC(=O)Nc3cc(F)ccc3C)n2)n[nH]1 ZINC000033270914 570946819 /nfs/dbraw/zinc/94/68/19/570946819.db2.gz JDXPGGZOMSSPCA-UHFFFAOYSA-N 0 1 390.444 3.061 10 0 GGAEMN CCc1n[nH]c(SCc2noc(CCC(=O)Nc3cc(F)ccc3C)n2)n1 ZINC000033270914 570946820 /nfs/dbraw/zinc/94/68/20/570946820.db2.gz JDXPGGZOMSSPCA-UHFFFAOYSA-N 0 1 390.444 3.061 10 0 GGAEMN CCOC(=O)[C@@H]1C[C@H]2CCCN2[C@]12c1ccccc1N(Cc1ccccc1)C2=O ZINC000020663854 570952331 /nfs/dbraw/zinc/95/23/31/570952331.db2.gz JSPQCGNBGKHZMJ-LJFZDNNRSA-N 0 1 390.483 3.476 10 0 GGAEMN O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000252458628 570959779 /nfs/dbraw/zinc/95/97/79/570959779.db2.gz YBWAXKXVGNZOIE-PSVOHZHUSA-N 0 1 388.817 3.351 10 0 GGAEMN Cc1nc(N(C)C)cc(Nc2ccc([N-]S(=O)(=O)c3cccs3)cc2)[nH+]1 ZINC000033326850 570980869 /nfs/dbraw/zinc/98/08/69/570980869.db2.gz QDGSSPJLPKUHCB-UHFFFAOYSA-N 0 1 389.506 3.457 10 0 GGAEMN CC(C)CCNC(=O)c1[nH]cnc1C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000033327547 570983562 /nfs/dbraw/zinc/98/35/62/570983562.db2.gz BYOBZHVQXOOCON-UHFFFAOYSA-N 0 1 382.386 3.134 10 0 GGAEMN CC(C)CCNC(=O)c1[nH]cnc1C(=O)NCc1ccccc1C(F)(F)F ZINC000033327543 570983578 /nfs/dbraw/zinc/98/35/78/570983578.db2.gz DTGADRLIPNOLAR-UHFFFAOYSA-N 0 1 382.386 3.134 10 0 GGAEMN Cc1ccc(-n2ncc(N3CC[C@@H]4CCN(C)C[C@H]43)c(Cl)c2=O)cc1Cl ZINC000108170922 570985117 /nfs/dbraw/zinc/98/51/17/570985117.db2.gz MGOCXZHGDPTDFU-SUMWQHHRSA-N 0 1 393.318 3.378 10 0 GGAEMN C[C@@H](CNC(=O)CCNC(=O)c1ccc(Cl)cc1)N1CCc2ccccc2C1 ZINC000045464649 570991429 /nfs/dbraw/zinc/99/14/29/570991429.db2.gz ROHDIEJKHBYRET-INIZCTEOSA-N 0 1 399.922 3.023 10 0 GGAEMN COc1ccccc1NC(=O)NCCCN1CCN(c2ccccc2OC)CC1 ZINC000004792374 570993547 /nfs/dbraw/zinc/99/35/47/570993547.db2.gz HNSBICOYLMIGGY-UHFFFAOYSA-N 0 1 398.507 3.038 10 0 GGAEMN Brc1ccc2ncnc(NCc3n[nH]c(C4CCOCC4)n3)c2c1 ZINC000631460421 652525268 /nfs/dbraw/zinc/52/52/68/652525268.db2.gz RWFVJJTUGJCLPB-UHFFFAOYSA-N 0 1 389.257 3.017 10 0 GGAEMN O=C(NC[C@H](c1ccco1)N1CCCC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000053534294 1406430786 /nfs/dbraw/zinc/43/07/86/1406430786.db2.gz ANBDOEFYSJOYLK-LJQANCHMSA-N 0 1 386.471 3.087 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1CNCc1cccc(OCC(=O)N(C)C)c1 ZINC000054468494 1406745051 /nfs/dbraw/zinc/74/50/51/1406745051.db2.gz BOFDPBFTAMZLLJ-UHFFFAOYSA-N 0 1 392.503 3.246 10 0 GGAEMN COc1ccccc1[C@@H](CNC(=O)N1CCO[C@@H]2CCC[C@@H]21)N1CCCCC1 ZINC000054571606 1406771482 /nfs/dbraw/zinc/77/14/82/1406771482.db2.gz CXXIJHROHMLMDN-QKNQBKEWSA-N 0 1 387.524 3.185 10 0 GGAEMN CCOc1cc(CNCc2cccc(NS(C)(=O)=O)c2)cc(Cl)c1OC ZINC000055373371 1406941795 /nfs/dbraw/zinc/94/17/95/1406941795.db2.gz BOJVHMZJEXYHAL-UHFFFAOYSA-N 0 1 398.912 3.409 10 0 GGAEMN CC[C@H]1CCCC[N@H+]1CCCn1c(=O)c2cc3c(cc2[n-]c1=S)OCO3 ZINC000002974344 1398323409 /nfs/dbraw/zinc/32/34/09/1398323409.db2.gz AXDMMWNFZCIAKA-ZDUSSCGKSA-N 0 1 375.494 3.442 10 0 GGAEMN CC[C@@H]1CCCC[N@H+]1CCCn1c(=O)c2cc3c(cc2[n-]c1=S)OCO3 ZINC000002974345 1398323680 /nfs/dbraw/zinc/32/36/80/1398323680.db2.gz AXDMMWNFZCIAKA-CYBMUJFWSA-N 0 1 375.494 3.442 10 0 GGAEMN Cc1[nH]n(-c2ccccc2)c(=O)c1C=C1NC(=O)N(Cc2cccc(F)c2)C1=O ZINC000004239307 1398384724 /nfs/dbraw/zinc/38/47/24/1398384724.db2.gz ZJXPNZNOJMXECJ-WQRHYEAKSA-N 0 1 392.390 3.118 10 0 GGAEMN Cc1ccc(CNC(=O)c2cncc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1 ZINC000004270208 1398387499 /nfs/dbraw/zinc/38/74/99/1398387499.db2.gz JZCDBNPWVVVTDR-UHFFFAOYSA-N 0 1 395.484 3.429 10 0 GGAEMN CCOc1ccccc1NS(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)[C@@H]2C ZINC000004270473 1398388070 /nfs/dbraw/zinc/38/80/70/1398388070.db2.gz GWJAUFNOEHWIBB-CYBMUJFWSA-N 0 1 386.473 3.282 10 0 GGAEMN COc1ccccc1N1CCN(CCCNC(=O)Nc2ccc(F)cc2)CC1 ZINC000009185415 1398855004 /nfs/dbraw/zinc/85/50/04/1398855004.db2.gz JPOVVXHDIJPWHW-UHFFFAOYSA-N 0 1 386.471 3.168 10 0 GGAEMN Cc1cc(C)c(CN2CCc3[nH]nc(-c4ccco4)c3C2)cc1Cn1cncn1 ZINC000019608219 1399333005 /nfs/dbraw/zinc/33/30/05/1399333005.db2.gz QABDSXSLSSFCGY-UHFFFAOYSA-N 0 1 388.475 3.485 10 0 GGAEMN Cc1n[nH]c(C)c1CNCc1ccc(-c2ccn(Cc3c(C)noc3C)n2)o1 ZINC000020455222 1399347074 /nfs/dbraw/zinc/34/70/74/1399347074.db2.gz QBTVYFAOPQTPEP-UHFFFAOYSA-N 0 1 380.452 3.426 10 0 GGAEMN CCOC(=O)C1=C(CN(C)c2ccccc2)NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000020560310 1399349224 /nfs/dbraw/zinc/34/92/24/1399349224.db2.gz FXAFZMCYAXABCI-FQEVSTJZSA-N 0 1 379.460 3.303 10 0 GGAEMN CCOc1cc2[n-]c(=S)n(CC[N@H+]3CCCC[C@@H]3C)c(=O)c2cc1OCC ZINC000020644603 1399351311 /nfs/dbraw/zinc/35/13/11/1399351311.db2.gz IULJJIUOFBTKTH-AWEZNQCLSA-N 0 1 391.537 3.357 10 0 GGAEMN O=C(c1cncc(NS(=O)(=O)c2ccc(F)cc2)c1)N1CCc2ccccc21 ZINC000021036353 1399361499 /nfs/dbraw/zinc/36/14/99/1399361499.db2.gz LPBCQPDWVAZGDI-UHFFFAOYSA-N 0 1 397.431 3.224 10 0 GGAEMN COc1ccc2nc(N3CCC[C@H](C(=O)NCCc4ccccc4)C3)[nH]c2c1 ZINC000021146071 1399366606 /nfs/dbraw/zinc/36/66/06/1399366606.db2.gz HPGKWFWARQZRHI-KRWDZBQOSA-N 0 1 378.476 3.147 10 0 biogenic GGAEMN CCNc1c(-c2nc(-c3ccc(F)cc3)n[nH]2)nnn1Cc1ccccc1F ZINC000021176715 1399367734 /nfs/dbraw/zinc/36/77/34/1399367734.db2.gz ADXKBAKQOHLQCP-UHFFFAOYSA-N 0 1 381.390 3.489 10 0 GGAEMN CCCN1CCN(C(=O)C[C@H](c2cccs2)N2Cc3ccccc3C2=O)CC1 ZINC000021530483 1399387570 /nfs/dbraw/zinc/38/75/70/1399387570.db2.gz XGJUPKCRDSZGPY-LJQANCHMSA-N 0 1 397.544 3.390 10 0 GGAEMN COc1ccc2c(c1)CCc1c-2n[nH]c1C(=O)Nc1ccc(OC)cc1OC ZINC000021634313 1399396232 /nfs/dbraw/zinc/39/62/32/1399396232.db2.gz QHEHOWFNLSMRBM-UHFFFAOYSA-N 0 1 379.416 3.453 10 0 GGAEMN COc1ccc2c(c1)CCc1c-2n[nH]c1C(=O)Nc1ccc(OC)c(OC)c1 ZINC000021634300 1399396259 /nfs/dbraw/zinc/39/62/59/1399396259.db2.gz RWYULPRPWFMNKW-UHFFFAOYSA-N 0 1 379.416 3.453 10 0 GGAEMN CCOC(=O)c1nc2ccccc2c(N2CCN(Cc3ccccc3)CC2)n1 ZINC000021644991 1399397288 /nfs/dbraw/zinc/39/72/88/1399397288.db2.gz BQZMWIKMNMAGSG-UHFFFAOYSA-N 0 1 376.460 3.129 10 0 GGAEMN COC(=O)c1cccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)c1C ZINC000028249751 1400143031 /nfs/dbraw/zinc/14/30/31/1400143031.db2.gz FKAWZCKGXFDSFB-UHFFFAOYSA-N 0 1 389.351 3.481 10 0 GGAEMN Cn1ccnc1COc1ccc(CN2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000042743397 1400408148 /nfs/dbraw/zinc/40/81/48/1400408148.db2.gz FIOKRECZWKLMNW-UHFFFAOYSA-N 0 1 380.467 3.460 10 0 GGAEMN COc1ccc(CN2CCC(NC(=O)NCc3ccc(F)cc3)CC2)cc1F ZINC000056335019 1407302479 /nfs/dbraw/zinc/30/24/79/1407302479.db2.gz XOTVTDOYYYDQHW-UHFFFAOYSA-N 0 1 389.446 3.437 10 0 GGAEMN CNC(=O)c1ccc(S(=O)(=O)Nc2ccc(Oc3ccccc3)nc2)cc1 ZINC000047212144 1404749033 /nfs/dbraw/zinc/74/90/33/1404749033.db2.gz SHGNUPWXILEQLF-UHFFFAOYSA-N 0 1 383.429 3.034 10 0 GGAEMN O=C(c1cc(-c2cccc(Cl)c2)[nH]n1)N1CCN(Cc2cccnc2)CC1 ZINC000047431893 1404834444 /nfs/dbraw/zinc/83/44/44/1404834444.db2.gz CFSBKKZNXUIDQG-UHFFFAOYSA-N 0 1 381.867 3.083 10 0 GGAEMN CS(=O)(=O)Nc1ccc(CNCc2csc(Br)c2)cc1 ZINC000047750371 1404920729 /nfs/dbraw/zinc/92/07/29/1404920729.db2.gz CDJOCROUKAELEJ-UHFFFAOYSA-N 0 1 375.313 3.172 10 0 GGAEMN NC(=O)CNC(=O)c1ccc(CNCc2ccc(-c3ccc(Cl)cc3)o2)cc1 ZINC000047798905 1404951215 /nfs/dbraw/zinc/95/12/15/1404951215.db2.gz HKBGWHXEKKUHMQ-UHFFFAOYSA-N 0 1 397.862 3.105 10 0 GGAEMN CC[C@H](C)NC(=O)c1cccc(CNCc2ccc(-n3cncn3)c(F)c2)c1 ZINC000047821922 1404963341 /nfs/dbraw/zinc/96/33/41/1404963341.db2.gz BFPPYPLTFWQAJH-HNNXBMFYSA-N 0 1 381.455 3.225 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)NC[C@@H](c2ccco2)N2CCCC2)c(OC)c1 ZINC000047871592 1404978393 /nfs/dbraw/zinc/97/83/93/1404978393.db2.gz FEKRZHIERXMBQN-QAPCUYQASA-N 0 1 387.480 3.494 10 0 GGAEMN CC(C)COc1ccccc1NC(=O)NC[C@@H](O)CN1CCc2ccccc2C1 ZINC000048118033 1405062423 /nfs/dbraw/zinc/06/24/23/1405062423.db2.gz CIPRUHBCXCDGIM-HXUWFJFHSA-N 0 1 397.519 3.262 10 0 GGAEMN O=C(Nc1cccc(CNCc2cnc(N3CCCC3)nc2)c1)c1ccco1 ZINC000048709909 1405263965 /nfs/dbraw/zinc/26/39/65/1405263965.db2.gz CVXPYJRBLFKMMB-UHFFFAOYSA-N 0 1 377.448 3.212 10 0 GGAEMN C[C@H](NCc1cnc(N2CCCC2)nc1)c1ccc(NC(=O)NC2CC2)cc1 ZINC000048714414 1405265846 /nfs/dbraw/zinc/26/58/46/1405265846.db2.gz FMYCRDLVIXFXBZ-HNNXBMFYSA-N 0 1 380.496 3.212 10 0 GGAEMN COc1cccc(CNCc2cccc(OCC(=O)N(C)C)c2)c1OC(F)F ZINC000048745664 1405279336 /nfs/dbraw/zinc/27/93/36/1405279336.db2.gz BVOOSQPMUUAZKB-UHFFFAOYSA-N 0 1 394.418 3.053 10 0 GGAEMN COc1ccc(CNCc2cc3c(c(Br)c2)OCO3)c(OC)c1 ZINC000048776751 1405287611 /nfs/dbraw/zinc/28/76/11/1405287611.db2.gz FWAAWGSAGGIAFB-UHFFFAOYSA-N 0 1 380.238 3.485 10 0 GGAEMN C[C@H](NC(=O)[C@H](C)N1CCC[C@H](C(=O)NC2CC2)C1)c1cccc2ccccc21 ZINC000051045000 1405707297 /nfs/dbraw/zinc/70/72/97/1405707297.db2.gz DKDHGMOKGWCKGR-LNLFQRSKSA-N 0 1 393.531 3.396 10 0 GGAEMN COC(=O)Nc1ccc(CNC(=O)CN2CCC(c3ccc(O)cc3)CC2)cc1 ZINC000052467841 1406060850 /nfs/dbraw/zinc/06/08/50/1406060850.db2.gz AOBZEAQPEJIZNS-UHFFFAOYSA-N 0 1 397.475 3.066 10 0 GGAEMN CN(C)[C@H](CNC(=O)NCc1cnn(Cc2ccccc2)c1)c1ccc(F)cc1 ZINC000056936397 1407477854 /nfs/dbraw/zinc/47/78/54/1407477854.db2.gz ADRKXUTUJZTMEZ-OAQYLSRUSA-N 0 1 395.482 3.173 10 0 GGAEMN O=C(NCc1ccc(OCc2ccccn2)cc1)c1c[nH]c2ccccc2c1=O ZINC000058572331 1407846181 /nfs/dbraw/zinc/84/61/81/1407846181.db2.gz BYTXMHCJUPGNBQ-UHFFFAOYSA-N 0 1 385.423 3.432 10 0 GGAEMN COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1 ZINC000060082636 1407937235 /nfs/dbraw/zinc/93/72/35/1407937235.db2.gz IENKDIPQUJVSIL-ZWKOTPCHSA-N 0 1 395.931 3.364 10 0 GGAEMN CCc1ccc(C[N@H+](C)[C@H]2CC(=O)N(c3ccc(C(=O)[O-])cc3C)C2=O)cc1 ZINC000063639056 1408385288 /nfs/dbraw/zinc/38/52/88/1408385288.db2.gz GKZRPFCYFHEWCD-IBGZPJMESA-N 0 1 380.444 3.020 10 0 GGAEMN CCc1ccc(C[N@@H+](C)[C@H]2CC(=O)N(c3ccc(C(=O)[O-])cc3C)C2=O)cc1 ZINC000063639056 1408385292 /nfs/dbraw/zinc/38/52/92/1408385292.db2.gz GKZRPFCYFHEWCD-IBGZPJMESA-N 0 1 380.444 3.020 10 0 GGAEMN FC(F)(F)COc1ccc(CNCc2cccnc2N2CCOCC2)cc1 ZINC000065890475 1408748886 /nfs/dbraw/zinc/74/88/86/1408748886.db2.gz BXJWEDRSFYAQGD-UHFFFAOYSA-N 0 1 381.398 3.149 10 0 GGAEMN C[C@@H](N[C@@H](C)c1ccccc1C(F)(F)F)C(=O)NC(=O)NCC(F)(F)F ZINC000066391045 1408828527 /nfs/dbraw/zinc/82/85/27/1408828527.db2.gz BJWLFEYUGZSUER-DTWKUNHWSA-N 0 1 385.308 3.133 10 0 GGAEMN FC(F)(F)COc1ccc(CNCc2ccccc2N2CCOCC2)cn1 ZINC000066972482 1408969602 /nfs/dbraw/zinc/96/96/02/1408969602.db2.gz GDTATEXIDXHFTO-UHFFFAOYSA-N 0 1 381.398 3.149 10 0 GGAEMN CCOc1cc(CN[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OC ZINC000067010813 1408979892 /nfs/dbraw/zinc/97/98/92/1408979892.db2.gz DDMXYXMROXYPJF-HNNXBMFYSA-N 0 1 392.521 3.195 10 0 GGAEMN CC[C@@H](C)NC(=O)c1cccc(CNCc2cn(C)nc2-c2ccncc2)c1 ZINC000067212804 1409045052 /nfs/dbraw/zinc/04/50/52/1409045052.db2.gz DBNLGIJFPWWFOH-MRXNPFEDSA-N 0 1 377.492 3.300 10 0 GGAEMN O[C@H](CNCc1cccc2c1OCCO2)COc1ccc(C(F)(F)F)cc1 ZINC000067255016 1409054954 /nfs/dbraw/zinc/05/49/54/1409054954.db2.gz CATCRVPVFVQPGC-OAHLLOKOSA-N 0 1 383.366 3.006 10 0 GGAEMN O=C(CCn1c(=O)c2ccccc2[nH]c1=S)N[C@H]1C[C@@H]1c1cccc(F)c1 ZINC000067333319 1409078097 /nfs/dbraw/zinc/07/80/97/1409078097.db2.gz HQBAYQAUXILLKF-WBVHZDCISA-N 0 1 383.448 3.261 10 0 GGAEMN CC(C)Oc1ccccc1CNCc1ccc(C(=O)N2CCN(C)CC2)cc1 ZINC000067668639 1409203138 /nfs/dbraw/zinc/20/31/38/1409203138.db2.gz BRFJJQZPZVSEEI-UHFFFAOYSA-N 0 1 381.520 3.151 10 0 GGAEMN COc1cccc(CNC[C@@H](O)COc2c(C)cccc2C)c1OC(F)F ZINC000067977088 1409268697 /nfs/dbraw/zinc/26/86/97/1409268697.db2.gz ABSAHUBYYJWLMX-MRXNPFEDSA-N 0 1 381.419 3.443 10 0 GGAEMN C[C@@H](NCc1cc2c(c(Br)c1)OCO2)C(=O)Nc1ccccc1 ZINC000067987212 1409270434 /nfs/dbraw/zinc/27/04/34/1409270434.db2.gz BRDACNGILQAJIA-LLVKDONJSA-N 0 1 377.238 3.295 10 0 GGAEMN C[C@@H](Cc1ccccc1F)NC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000069286294 1409604957 /nfs/dbraw/zinc/60/49/57/1409604957.db2.gz DKCQQHOGFSSSGO-PGRDOPGGSA-N 0 1 398.526 3.045 10 0 GGAEMN O=S(=O)(Nc1ccc(CO)cc1)c1ccc(Br)cc1Cl ZINC000070331987 1409745602 /nfs/dbraw/zinc/74/56/02/1409745602.db2.gz YJSAHIIUSIQVSO-UHFFFAOYSA-N 0 1 376.659 3.396 10 0 GGAEMN Cc1nc([C@H](NC(=O)Nc2ccc(-n3cnc4ccccc43)nc2)C(C)C)n[nH]1 ZINC000079017862 1409950378 /nfs/dbraw/zinc/95/03/78/1409950378.db2.gz JLQMWJAJWPGILS-GOSISDBHSA-N 0 1 390.451 3.366 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)N2CCCC2)cc1F ZINC000086234464 1410043992 /nfs/dbraw/zinc/04/39/92/1410043992.db2.gz GUEJJLVMJYQMID-ROUUACIJSA-N 0 1 375.488 3.255 10 0 GGAEMN COC(=O)c1ccc(CN2CCC(C(=O)N3CCCCCC3)CC2)cc1F ZINC000089101689 1410051871 /nfs/dbraw/zinc/05/18/71/1410051871.db2.gz KQBCPVIZADKRNR-UHFFFAOYSA-N 0 1 376.472 3.227 10 0 GGAEMN NC(=O)c1cccc(CNCc2ccc(OC(F)F)c(Br)c2)c1 ZINC000092560259 1410172850 /nfs/dbraw/zinc/17/28/50/1410172850.db2.gz BJJIWGHLXRIHPI-UHFFFAOYSA-N 0 1 385.208 3.439 10 0 GGAEMN CC[C@@H](C)NC(=O)[C@H](C)NCc1ccc(OC(F)F)c(Br)c1 ZINC000092564393 1410173580 /nfs/dbraw/zinc/17/35/80/1410173580.db2.gz CTSPRALOYMFPOE-ZJUUUORDSA-N 0 1 379.245 3.443 10 0 GGAEMN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)[C@H]3C[C@H]3c3nc[nH]n3)CC2)cc1 ZINC000095465165 1410312818 /nfs/dbraw/zinc/31/28/18/1410312818.db2.gz IUXUZYFGODYFFA-MOPGFXCFSA-N 0 1 380.492 3.228 10 0 GGAEMN Cc1sc(C(N)=O)cc1S(=O)(=O)Nc1ccc2[nH]c(C3CCC3)nc2c1 ZINC000095466419 1410312859 /nfs/dbraw/zinc/31/28/59/1410312859.db2.gz JIILMEQQQYTDLX-UHFFFAOYSA-N 0 1 390.490 3.100 10 0 GGAEMN CN(C)c1nc(CN2CCC[C@@H](c3nc(C4CCCCC4)n[nH]3)C2)ns1 ZINC000095993110 1410318991 /nfs/dbraw/zinc/31/89/91/1410318991.db2.gz KZBCHKQYTNENIA-CQSZACIVSA-N 0 1 375.546 3.150 10 0 GGAEMN CN(C)c1nc(CN2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)ns1 ZINC000095993110 1410318999 /nfs/dbraw/zinc/31/89/99/1410318999.db2.gz KZBCHKQYTNENIA-CQSZACIVSA-N 0 1 375.546 3.150 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)[C@H]2CCn3c(cnc3-c3ccccc3)C2)c1 ZINC000095993244 1410319465 /nfs/dbraw/zinc/31/94/65/1410319465.db2.gz RSHBOLQJSUKPNO-SFHVURJKSA-N 0 1 375.476 3.208 10 0 GGAEMN CCNC(=O)Nc1c[nH]nc1[C@H]1CCCN(Cc2ccc(OC)c(F)c2)C1 ZINC000096000023 1410320054 /nfs/dbraw/zinc/32/00/54/1410320054.db2.gz JCWHRUVYIVTJKG-AWEZNQCLSA-N 0 1 375.448 3.078 10 0 GGAEMN CCc1ccccc1NC(=O)C1CCN(c2nc3[nH]cnc(=O)c3s2)CC1 ZINC000096331568 1410327575 /nfs/dbraw/zinc/32/75/75/1410327575.db2.gz FMIBEXWHAKRYFJ-UHFFFAOYSA-N 0 1 383.477 3.209 10 0 GGAEMN Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)c1 ZINC000096324800 1410327605 /nfs/dbraw/zinc/32/76/05/1410327605.db2.gz JACDKSSYZLIYPG-QGZVFWFLSA-N 0 1 389.459 3.271 10 0 GGAEMN Cc1cccc(NC(=O)C2CCN(c3nc4[nH]cnc(=O)c4s3)CC2)c1C ZINC000096331556 1410327765 /nfs/dbraw/zinc/32/77/65/1410327765.db2.gz ZHTNRAGCXKBTJS-UHFFFAOYSA-N 0 1 383.477 3.264 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2ccc(OC)cc2)n1 ZINC000096379778 1410329810 /nfs/dbraw/zinc/32/98/10/1410329810.db2.gz BZUQPJNGCFADHE-UHFFFAOYSA-N 0 1 376.438 3.053 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nc(C3CC3)no2)cc1 ZINC000096379831 1410329941 /nfs/dbraw/zinc/32/99/41/1410329941.db2.gz FMGOPBCPHJXRMD-UHFFFAOYSA-N 0 1 388.449 3.368 10 0 GGAEMN CCCN1CCN(C(=O)Cc2c3[nH]cccc-3c(=O)n2-c2cccc(C)c2)CC1 ZINC000096387063 1410330194 /nfs/dbraw/zinc/33/01/94/1410330194.db2.gz KCUASANRYLNSTM-FQEVSTJZSA-N 0 1 392.503 3.036 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cc(-c3cc(C)[nH]n3)oc2C)cc1OC ZINC000096386727 1410330312 /nfs/dbraw/zinc/33/03/12/1410330312.db2.gz IRXNXRBYHBWRNK-UHFFFAOYSA-N 0 1 377.422 3.105 10 0 GGAEMN CN(C)[C@H](CNC(=O)/C=C\c1ccc(N2CCCC2=O)cc1)c1cccc(F)c1 ZINC000096940649 1410338195 /nfs/dbraw/zinc/33/81/95/1410338195.db2.gz LCLIKOPIBQIIIQ-NZIDHHNMSA-N 0 1 395.478 3.385 10 0 GGAEMN C[C@H](Sc1nc(C=Cc2cccs2)n[nH]1)C(=O)NC(=O)NC(C)(C)C ZINC000096940183 1410338341 /nfs/dbraw/zinc/33/83/41/1410338341.db2.gz WDFHBCCBARDEFO-DMEOUFDRSA-N 0 1 379.511 3.142 10 0 GGAEMN COc1ccccc1CN(CCO)C[C@H](O)COc1cccc2ccccc21 ZINC000103143942 1410831365 /nfs/dbraw/zinc/83/13/65/1410831365.db2.gz BDKPWRZKNGTQHJ-FQEVSTJZSA-N 0 1 381.472 3.083 10 0 GGAEMN Cc1oc2c(c1C(=O)N1CCCN(C)CC1)CN(Cc1ccc(C)cc1)CC2 ZINC000105111476 1411030511 /nfs/dbraw/zinc/03/05/11/1411030511.db2.gz QTLJCFKXJWQKDP-UHFFFAOYSA-N 0 1 381.520 3.232 10 0 GGAEMN CCOc1cc(C)nc(N2CCN(CCCc3nc4ccccc4o3)CC2)n1 ZINC000106153409 1411175329 /nfs/dbraw/zinc/17/53/29/1411175329.db2.gz XYFWHPNGGRIHIL-UHFFFAOYSA-N 0 1 381.480 3.080 10 0 GGAEMN CC(=O)NCCCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 ZINC000109134471 1411691638 /nfs/dbraw/zinc/69/16/38/1411691638.db2.gz FTLFUDITANXANZ-UHFFFAOYSA-N 0 1 384.455 3.354 10 0 GGAEMN COc1ccc(-c2n[nH]c(CNC(=O)N[C@@H](C)c3ccc(F)c(F)c3)n2)cc1 ZINC000111789607 1412029359 /nfs/dbraw/zinc/02/93/59/1412029359.db2.gz GJOYPODGUYJOPQ-NSHDSACASA-N 0 1 387.390 3.319 10 0 GGAEMN COc1ccc(-c2nc(CNC(=O)N[C@@H](C)c3ccc(F)c(F)c3)n[nH]2)cc1 ZINC000111789607 1412029367 /nfs/dbraw/zinc/02/93/67/1412029367.db2.gz GJOYPODGUYJOPQ-NSHDSACASA-N 0 1 387.390 3.319 10 0 GGAEMN COc1cc([C@H](C)N[C@H](C)C(=O)Nc2ncccn2)ccc1OC1CCCC1 ZINC000112529029 1412163317 /nfs/dbraw/zinc/16/33/17/1412163317.db2.gz GREHBEDAEUYXHO-LSDHHAIUSA-N 0 1 384.480 3.484 10 0 GGAEMN CC(C)[C@@H](CO)N(CC(=O)Nc1ccnn1C1CCCC1)Cc1ccccc1 ZINC000112658011 1412187164 /nfs/dbraw/zinc/18/71/64/1412187164.db2.gz HZUFVJSIOKPXSY-HXUWFJFHSA-N 0 1 384.524 3.456 10 0 GGAEMN Cc1ccc(N2CCC[C@@H](NC(=O)CCc3nc4cccc(C)c4[nH]3)C2=O)cc1 ZINC000177336732 1428696651 /nfs/dbraw/zinc/69/66/51/1428696651.db2.gz RJMGBYZXJFDNKC-LJQANCHMSA-N 0 1 390.487 3.424 10 0 GGAEMN CC(=O)N(C)C1CCN([C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)CC1 ZINC000119843726 1413590488 /nfs/dbraw/zinc/59/04/88/1413590488.db2.gz HKYYRXOLPRFDNB-DLBZAZTESA-N 0 1 381.520 3.348 10 0 GGAEMN CC(=O)N(C)C1CCN([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)CC1 ZINC000119843844 1413590604 /nfs/dbraw/zinc/59/06/04/1413590604.db2.gz HKYYRXOLPRFDNB-IAGOWNOFSA-N 0 1 381.520 3.348 10 0 GGAEMN Cc1ncc(CNc2cccc(CN3CCC[C@H]3C(N)=O)c2)n1-c1ccccc1 ZINC000120037606 1413663245 /nfs/dbraw/zinc/66/32/45/1413663245.db2.gz DMVRWKVDHBQZOH-QFIPXVFZSA-N 0 1 389.503 3.243 10 0 GGAEMN Cc1ccccc1[C@@H](C)NCC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 ZINC000121314671 1414080759 /nfs/dbraw/zinc/08/07/59/1414080759.db2.gz GOXLCYVENKLWEZ-CYBMUJFWSA-N 0 1 382.432 3.281 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000121429824 1414119040 /nfs/dbraw/zinc/11/90/40/1414119040.db2.gz ICVNNXCBTMBWEU-VKJFTORMSA-N 0 1 383.467 3.390 10 0 GGAEMN COc1ccccc1S(=O)(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1 ZINC000121886875 1414291631 /nfs/dbraw/zinc/29/16/31/1414291631.db2.gz CKBJJGHPLKVRSN-HUUCEWRRSA-N 0 1 376.478 3.110 10 0 GGAEMN Brc1ccc2ncc(CNCc3ccc(N4CCCC4)nc3)n2c1 ZINC000124352368 1414947104 /nfs/dbraw/zinc/94/71/04/1414947104.db2.gz HWMJHVQCJAXART-UHFFFAOYSA-N 0 1 386.297 3.382 10 0 GGAEMN CC[C@@H](C)NC(=O)[C@@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000124545326 1414991032 /nfs/dbraw/zinc/99/10/32/1414991032.db2.gz HQPWUMNIUGOJAX-TZMCWYRMSA-N 0 1 393.329 3.336 10 0 GGAEMN CC[C@@H](C)NC(=O)[C@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000124545794 1414991190 /nfs/dbraw/zinc/99/11/90/1414991190.db2.gz HQPWUMNIUGOJAX-OCCSQVGLSA-N 0 1 393.329 3.336 10 0 GGAEMN CCC(C)(C)C1CCC2(CC1)NC(=O)N(CN(C)CC1CCOCC1)C2=O ZINC000124763892 1415039315 /nfs/dbraw/zinc/03/93/15/1415039315.db2.gz DYRBPOWMKNKOMV-UHFFFAOYSA-N 0 1 379.545 3.219 10 0 GGAEMN Cc1ccc(-c2ncc(CNCC(=O)N3CCN(c4ccccc4)CC3)s2)o1 ZINC000126235320 1415390602 /nfs/dbraw/zinc/39/06/02/1415390602.db2.gz FZUIPWKYSIWYOE-UHFFFAOYSA-N 0 1 396.516 3.150 10 0 GGAEMN C[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1cnn(Cc2ccccc2)c1 ZINC000178288136 1429043331 /nfs/dbraw/zinc/04/33/31/1429043331.db2.gz FUYFDYNAPIJLCW-KRWDZBQOSA-N 0 1 383.517 3.327 10 0 GGAEMN COc1ccccc1-c1cc(C(=O)N2CCC(C(=O)N[C@H](C)C(C)C)CC2)n[nH]1 ZINC000129276538 1416183760 /nfs/dbraw/zinc/18/37/60/1416183760.db2.gz HRKZGSXXGUPHTC-OAHLLOKOSA-N 0 1 398.507 3.098 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@@H](C)[C@@H](n3ccnc3)C2)C2CC2)cc1 ZINC000129387328 1416201048 /nfs/dbraw/zinc/20/10/48/1416201048.db2.gz CIMFADQUIBKWON-QGCDCVKKSA-N 0 1 382.508 3.042 10 0 GGAEMN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)cc1 ZINC000129460707 1416213215 /nfs/dbraw/zinc/21/32/15/1416213215.db2.gz ATRXPYDRROUYMO-ZWOKBUDYSA-N 0 1 398.507 3.358 10 0 GGAEMN Cn1c(CNC[C@@H](O)COc2ccc(F)cc2)nc2cc(C(F)(F)F)ccc21 ZINC000131147214 1416516308 /nfs/dbraw/zinc/51/63/08/1416516308.db2.gz DMSXYERWHQTSHE-CQSZACIVSA-N 0 1 397.372 3.261 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCCCC[C@H]2C[C@@H](O)c2ccccc2)[nH]1 ZINC000131705806 1416600669 /nfs/dbraw/zinc/60/06/69/1416600669.db2.gz DGBFOINVIXOHIK-ZWKOTPCHSA-N 0 1 388.537 3.490 10 0 GGAEMN Brc1cnc(-c2noc([C@@H]3CCCCN3)n2)c(Br)c1 ZINC000132548882 1416783255 /nfs/dbraw/zinc/78/32/55/1416783255.db2.gz YEBFOHSQSBKRJA-VIFPVBQESA-N 0 1 388.063 3.471 10 0 GGAEMN O=C1[C@H](NCc2ccc(N3CCCC3)nc2)CCN1CCCc1ccccc1 ZINC000133315396 1416877657 /nfs/dbraw/zinc/87/76/57/1416877657.db2.gz FHRWYQBMFMTPFY-OAQYLSRUSA-N 0 1 378.520 3.005 10 0 GGAEMN CN1CCN(c2ncccc2CNCc2ccc(F)cc2Br)CC1 ZINC000135969299 1417282338 /nfs/dbraw/zinc/28/23/38/1417282338.db2.gz DYRHFZONUCAARU-UHFFFAOYSA-N 0 1 393.304 3.025 10 0 GGAEMN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@@H](O)c1ccc(Cl)c(F)c1 ZINC000136138969 1417294762 /nfs/dbraw/zinc/29/47/62/1417294762.db2.gz IEZNAZARKYEZNI-CQSZACIVSA-N 0 1 395.784 3.285 10 0 GGAEMN Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@H](O)c1ccc(Cl)c(F)c1 ZINC000136138933 1417294984 /nfs/dbraw/zinc/29/49/84/1417294984.db2.gz IEZNAZARKYEZNI-AWEZNQCLSA-N 0 1 395.784 3.285 10 0 GGAEMN NC1(c2nc(-c3ncc(Br)cc3Br)no2)CCCC1 ZINC000139937166 1417482066 /nfs/dbraw/zinc/48/20/66/1417482066.db2.gz QRWQAPIWSWDSIT-UHFFFAOYSA-N 0 1 388.063 3.385 10 0 GGAEMN CC(C)N1CC[C@@H](NCc2ccc(Br)c(Br)c2)C1=O ZINC000150813470 1417812180 /nfs/dbraw/zinc/81/21/80/1417812180.db2.gz BZTQXBWWUYWWJV-CYBMUJFWSA-N 0 1 390.119 3.311 10 0 GGAEMN CC(C)N1CC[C@H](NCc2ccc(Br)c(Br)c2)C1=O ZINC000150813451 1417812200 /nfs/dbraw/zinc/81/22/00/1417812200.db2.gz BZTQXBWWUYWWJV-ZDUSSCGKSA-N 0 1 390.119 3.311 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2csc(Br)c2)C1=O ZINC000151540509 1418018228 /nfs/dbraw/zinc/01/82/28/1418018228.db2.gz AEHPOCMVBSWZMZ-LBPRGKRZSA-N 0 1 381.295 3.414 10 0 GGAEMN CN1CCN(Cc2cccc(NC(=O)[C@H]3C[C@@H]3c3cccc(F)c3F)c2)CC1 ZINC000152277368 1418191931 /nfs/dbraw/zinc/19/19/31/1418191931.db2.gz GZBZHRJDLKEGHR-MOPGFXCFSA-N 0 1 385.458 3.454 10 0 GGAEMN CSCc1cc(F)ccc1CNCc1ccccc1OCC(=O)N(C)C ZINC000152963758 1422309278 /nfs/dbraw/zinc/30/92/78/1422309278.db2.gz AEJQYYBOOSLADA-UHFFFAOYSA-N 0 1 376.497 3.446 10 0 GGAEMN COc1ccc2cccc(CC(=O)N3CCC(N4CCO[C@H](C)C4)CC3)c2c1 ZINC000153735825 1422730420 /nfs/dbraw/zinc/73/04/20/1422730420.db2.gz LEJVRGASCRMNGV-QGZVFWFLSA-N 0 1 382.504 3.103 10 0 GGAEMN C[C@@H](NCCS(=O)(=O)c1ccccc1)c1ccc(OCc2nccn2C)cc1 ZINC000154125301 1422843875 /nfs/dbraw/zinc/84/38/75/1422843875.db2.gz ASMQERAXUYDIRP-QGZVFWFLSA-N 0 1 399.516 3.124 10 0 GGAEMN COc1ccc([C@@H](C)NCCS(=O)(=O)c2ccccc2)cc1Cn1cccn1 ZINC000154149204 1422847264 /nfs/dbraw/zinc/84/72/64/1422847264.db2.gz BCWAUECJHOSIOV-QGZVFWFLSA-N 0 1 399.516 3.065 10 0 GGAEMN C[S@](=O)c1ccc(CNCc2cccc(NC(=O)c3ccncc3)c2)cc1 ZINC000155604617 1423441751 /nfs/dbraw/zinc/44/17/51/1423441751.db2.gz HBMDFRZJGPTLIN-HHHXNRCGSA-N 0 1 379.485 3.361 10 0 GGAEMN Cc1nc(SCCC(=O)N2CCC[C@H](c3nc4ccc(C)cc4[nH]3)C2)n[nH]1 ZINC000155761124 1423521970 /nfs/dbraw/zinc/52/19/70/1423521970.db2.gz AQHUHDFJDVMZTL-AWEZNQCLSA-N 0 1 384.509 3.186 10 0 GGAEMN CN(CC(=O)Nc1ncc(Cc2ccc(F)cc2)s1)CC1CCOCC1 ZINC000155773651 1423529182 /nfs/dbraw/zinc/52/91/82/1423529182.db2.gz BZYPJKSYFWEBBQ-UHFFFAOYSA-N 0 1 377.485 3.170 10 0 GGAEMN CC(C)(C)c1nn(Cc2ccccc2)cc1CN1CCC(N2CCNC2=O)CC1 ZINC000156619377 1423836692 /nfs/dbraw/zinc/83/66/92/1423836692.db2.gz BYEOOJPLBSPNEH-UHFFFAOYSA-N 0 1 395.551 3.219 10 0 GGAEMN C[C@@H]1CN(C2CCN(C(=O)Nc3cccnc3-c3ccccc3)CC2)CCO1 ZINC000157121068 1423931243 /nfs/dbraw/zinc/93/12/43/1423931243.db2.gz CRUSGIVFURBOFB-QGZVFWFLSA-N 0 1 380.492 3.466 10 0 GGAEMN C[C@H]1CN(c2ccc(NS(=O)(=O)c3ccc(C#N)cc3F)cc2)C[C@H](C)O1 ZINC000158105045 1424168000 /nfs/dbraw/zinc/16/80/00/1424168000.db2.gz FTAPQZSUZIMQSZ-KBPBESRZSA-N 0 1 389.452 3.112 10 0 GGAEMN O=C1[C@H](NCc2ccc(F)c(Br)c2)CCCN1CC(F)(F)F ZINC000158315677 1424224039 /nfs/dbraw/zinc/22/40/39/1424224039.db2.gz BFYYELLVSCXTJQ-GFCCVEGCSA-N 0 1 383.183 3.231 10 0 GGAEMN Cc1[nH]c2ccc(Cl)cc2c1C(=O)NCc1ccnc(N2CCN(C)CC2)c1 ZINC000158482646 1424269121 /nfs/dbraw/zinc/26/91/21/1424269121.db2.gz HKRMVNJQHWBSNB-UHFFFAOYSA-N 0 1 397.910 3.207 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3ccccc3N3CCCCCC3)CCO2)n[nH]1 ZINC000158496533 1424272326 /nfs/dbraw/zinc/27/23/26/1424272326.db2.gz WWGGQNHXBWTNRU-SFHVURJKSA-N 0 1 398.511 3.353 10 0 GGAEMN CCN1CCN(c2ccc(Cl)cc2NC(=O)N(C)CC2CCOCC2)CC1 ZINC000158876514 1424362268 /nfs/dbraw/zinc/36/22/68/1424362268.db2.gz ARDYQPAQAMPNNP-UHFFFAOYSA-N 0 1 394.947 3.372 10 0 GGAEMN CCN(C[C@H](O)c1ccc(C)cc1)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000159868477 1424546598 /nfs/dbraw/zinc/54/65/98/1424546598.db2.gz GLWJAGSIMXZXJA-KKSFZXQISA-N 0 1 383.492 3.336 10 0 GGAEMN O=C([C@H](Cc1ccccc1)NCc1cnn(Cc2ccccc2)c1)N1CCCC1 ZINC000159928614 1424553752 /nfs/dbraw/zinc/55/37/52/1424553752.db2.gz FLAIRIQGHXNICE-QHCPKHFHSA-N 0 1 388.515 3.255 10 0 GGAEMN COc1ccc(CN(C)C(=O)CN[C@@H](C)c2cc(C)ccc2OC)cc1OC ZINC000161545100 1424705847 /nfs/dbraw/zinc/70/58/47/1424705847.db2.gz HEGUKLPPIYDKAE-INIZCTEOSA-N 0 1 386.492 3.330 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)[C@@H]1COc2ccc(Cl)cc2C1 ZINC000162846307 1424896180 /nfs/dbraw/zinc/89/61/80/1424896180.db2.gz QRZGCHSIVSJTRT-HNNXBMFYSA-N 0 1 382.851 3.035 10 0 GGAEMN CCC[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)CCN1CCOC ZINC000162923075 1424906413 /nfs/dbraw/zinc/90/64/13/1424906413.db2.gz DXEJHXYWLWVAEY-GHTZIAJQSA-N 0 1 399.539 3.076 10 0 GGAEMN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1cc(F)ccc1F ZINC000163490299 1425007214 /nfs/dbraw/zinc/00/72/14/1425007214.db2.gz FRUZDYRQCZBSPC-NWDGAFQWSA-N 0 1 382.432 3.046 10 0 GGAEMN CCc1nn(C)c(CC)c1CNCc1cc2c(c(Br)c1)OCO2 ZINC000169279621 1425244451 /nfs/dbraw/zinc/24/44/51/1425244451.db2.gz GBHMDVIWWNNITB-UHFFFAOYSA-N 0 1 380.286 3.326 10 0 GGAEMN CCc1nn(C)c(CC)c1CNCc1cnc2ccc(Br)cn12 ZINC000169268197 1425244563 /nfs/dbraw/zinc/24/45/63/1425244563.db2.gz HGFCURXXYMMKJI-UHFFFAOYSA-N 0 1 376.302 3.245 10 0 GGAEMN CCC(=O)N(C1CCOCC1)C1CCN(Cc2ccc(OC)cc2OC)CC1 ZINC000169760527 1425248170 /nfs/dbraw/zinc/24/81/70/1425248170.db2.gz UUDVMGBFJBQAII-UHFFFAOYSA-N 0 1 390.524 3.086 10 0 GGAEMN COCCC(=O)N1CCOc2ccc(CN3CCc4ccccc4C3)cc2C1 ZINC000169777140 1425254483 /nfs/dbraw/zinc/25/44/83/1425254483.db2.gz IGWSVMCVIRKUAZ-UHFFFAOYSA-N 0 1 380.488 3.002 10 0 GGAEMN Cc1cnc(CC2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)n1CC1CC1 ZINC000169788085 1425257408 /nfs/dbraw/zinc/25/74/08/1425257408.db2.gz OSAOFUPUOHHRDN-NRFANRHFSA-N 0 1 395.503 3.223 10 0 GGAEMN Cc1cccnc1-c1noc(-c2cc(I)ccc2O)n1 ZINC000235805011 1433373713 /nfs/dbraw/zinc/37/37/13/1433373713.db2.gz KOGODLQNHMKFIK-UHFFFAOYSA-N 0 1 379.157 3.417 10 0 GGAEMN CCN(C)[C@@H](C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000171622172 1425761467 /nfs/dbraw/zinc/76/14/67/1425761467.db2.gz CJQPAWGPOHRIOG-IEBWSBKVSA-N 0 1 389.540 3.443 10 0 GGAEMN CC(C)(C)OC(=O)N[C@H](CNC(=O)Cc1[nH]nc2ccccc21)c1ccccc1 ZINC000172770275 1426179894 /nfs/dbraw/zinc/17/98/94/1426179894.db2.gz WBMZDDKPXMTNEI-LJQANCHMSA-N 0 1 394.475 3.488 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H](CNC(=O)Cc1[nH]nc2ccccc21)c1ccccc1 ZINC000172770271 1426179931 /nfs/dbraw/zinc/17/99/31/1426179931.db2.gz WBMZDDKPXMTNEI-IBGZPJMESA-N 0 1 394.475 3.488 10 0 GGAEMN CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)c1cc(-c2ccc(F)cc2)[nH]n1 ZINC000173624589 1426801743 /nfs/dbraw/zinc/80/17/43/1426801743.db2.gz HMOOBPWJVXMQQL-OAHLLOKOSA-N 0 1 388.443 3.345 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)[nH]1 ZINC000174207471 1427050291 /nfs/dbraw/zinc/05/02/91/1427050291.db2.gz HQKSCCHVHLOGAB-UHFFFAOYSA-N 0 1 385.449 3.388 10 0 GGAEMN CC(C)(C)OC(=O)NC[C@@H]1CCCN1Cc1ccc(C(=O)N2CCCC2)cc1 ZINC000174240127 1427064754 /nfs/dbraw/zinc/06/47/54/1427064754.db2.gz HAMBLVXJKMGMGO-IBGZPJMESA-N 0 1 387.524 3.412 10 0 GGAEMN COc1c(C)cnc(CN2CCC(N(C)C(=O)[C@H](C)c3cccnc3)CC2)c1C ZINC000174611180 1427261273 /nfs/dbraw/zinc/26/12/73/1427261273.db2.gz QUNBEECSQMMPBH-QGZVFWFLSA-N 0 1 396.535 3.329 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)no2)[nH]1 ZINC000174691530 1427311982 /nfs/dbraw/zinc/31/19/82/1427311982.db2.gz CKLFUTVBSPZCPJ-OAHLLOKOSA-N 0 1 398.492 3.399 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)[nH]1 ZINC000174719808 1427329502 /nfs/dbraw/zinc/32/95/02/1427329502.db2.gz DOMRCAQVXXMOBB-UHFFFAOYSA-N 0 1 387.490 3.292 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(OCCc3ccccc3)nc2)[nH]1 ZINC000175040918 1427514036 /nfs/dbraw/zinc/51/40/36/1427514036.db2.gz FNKXSCYTMMBWMS-UHFFFAOYSA-N 0 1 383.477 3.251 10 0 GGAEMN Cc1cc(NC(=O)C2CCN([C@@H]3CCCN(c4ccc(C)cc4)C3=O)CC2)no1 ZINC000175523137 1427802978 /nfs/dbraw/zinc/80/29/78/1427802978.db2.gz WUGBCZNKTBZUMB-LJQANCHMSA-N 0 1 396.491 3.138 10 0 GGAEMN CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2nn(-c3ccc(F)cc3C)cc2[O-])C1 ZINC000176012808 1428026890 /nfs/dbraw/zinc/02/68/90/1428026890.db2.gz HORQBQGOZWIQNH-INIZCTEOSA-N 0 1 397.454 3.262 10 0 GGAEMN COc1cc(NC(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)cc(OC)c1 ZINC000180849689 1430069139 /nfs/dbraw/zinc/06/91/39/1430069139.db2.gz DNKFFTWJEJKKDZ-HNNXBMFYSA-N 0 1 380.448 3.179 10 0 GGAEMN CCOC(=O)c1ccc(NC(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)cc1 ZINC000180854330 1430071630 /nfs/dbraw/zinc/07/16/30/1430071630.db2.gz FBNYAVLDAUVWGK-MRXNPFEDSA-N 0 1 392.459 3.338 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)COC(c2ccccc2)c2ccccc2)n[nH]1 ZINC000180932047 1430121408 /nfs/dbraw/zinc/12/14/08/1430121408.db2.gz HJURTBFGAPLINA-UHFFFAOYSA-N 0 1 379.416 3.331 10 0 GGAEMN CC(C)c1nc2n(n1)C[C@H](NC(=O)Nc1ccc3nc(C(F)F)[nH]c3c1)CC2 ZINC000181106523 1430212519 /nfs/dbraw/zinc/21/25/19/1430212519.db2.gz DRUAVKGWVBNNOB-LLVKDONJSA-N 0 1 389.410 3.352 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N(C)C[C@@H]1CCCC[C@@H]1O ZINC000181471030 1430306871 /nfs/dbraw/zinc/30/68/71/1430306871.db2.gz AWAUOGSYBUJFIE-BJLQDIEVSA-N 0 1 384.524 3.299 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)c(F)c1 ZINC000181705277 1430344467 /nfs/dbraw/zinc/34/44/67/1430344467.db2.gz OTNPYGHHHZJKIL-UHFFFAOYSA-N 0 1 399.268 3.109 10 0 GGAEMN Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N(C)C[C@@H](C)c1nn[nH]n1 ZINC000183419658 1430706865 /nfs/dbraw/zinc/70/68/65/1430706865.db2.gz NFXMHALWFNAINE-SSDOTTSWSA-N 0 1 384.387 3.012 10 0 GGAEMN CCN1C(=O)CCc2cc(NS(=O)(=O)c3ccccc3OC(F)F)ccc21 ZINC000184019842 1430830052 /nfs/dbraw/zinc/83/00/52/1430830052.db2.gz WMAAOWWMFFAEMF-UHFFFAOYSA-N 0 1 396.415 3.388 10 0 GGAEMN CS(=O)(=O)c1ccc(-c2noc(-c3cc(Br)ccc3O)n2)cc1 ZINC000184858327 1431005404 /nfs/dbraw/zinc/00/54/04/1431005404.db2.gz IFAHVFCEGWDPPN-UHFFFAOYSA-N 0 1 395.234 3.275 10 0 GGAEMN Fc1cc(CNCC2=Cc3cc(Cl)ccc3OC2)cnc1N1CCOCC1 ZINC000185072785 1431054533 /nfs/dbraw/zinc/05/45/33/1431054533.db2.gz UZJAKLQICONZCK-UHFFFAOYSA-N 0 1 389.858 3.276 10 0 GGAEMN O=S1(=O)CCCN1c1cccc(CNCc2cc(F)cc3cccnc32)c1 ZINC000185095382 1431059641 /nfs/dbraw/zinc/05/96/41/1431059641.db2.gz FWORWXRSDDQGRM-UHFFFAOYSA-N 0 1 385.464 3.204 10 0 GGAEMN O=S1(=O)CCCN1c1cccc(CNCc2ccccc2OC(F)F)c1 ZINC000185099257 1431060752 /nfs/dbraw/zinc/06/07/52/1431060752.db2.gz DQUCRDVXOBVVLF-UHFFFAOYSA-N 0 1 382.432 3.118 10 0 GGAEMN COc1ccc(/C=C(\C)C(=O)NC2CCN(Cc3ccccn3)CC2)cc1F ZINC000185196862 1431082191 /nfs/dbraw/zinc/08/21/91/1431082191.db2.gz AKBNLFGGAVZIOL-DTQAZKPQSA-N 0 1 383.467 3.413 10 0 GGAEMN COc1ccc(C[C@@H](C)CN2CCN(CC(=O)Nc3ccccc3)CC2)cc1F ZINC000186605648 1431466812 /nfs/dbraw/zinc/46/68/12/1431466812.db2.gz GCUWITALDJTPEN-GOSISDBHSA-N 0 1 399.510 3.269 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H]2CCN(c3ccccc3C(F)(F)F)C2)[nH]1 ZINC000187423899 1431725748 /nfs/dbraw/zinc/72/57/48/1431725748.db2.gz HPSXWAZFEBHESS-LBPRGKRZSA-N 0 1 399.442 3.009 10 0 GGAEMN CCN(CCc1nccs1)[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000189752349 1432223935 /nfs/dbraw/zinc/22/39/35/1432223935.db2.gz DSBGTSLQAPLKAO-QGZVFWFLSA-N 0 1 379.476 3.477 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2cc(Br)cc(Br)c2[O-])CC[C@@H]1O ZINC000190048171 1432310620 /nfs/dbraw/zinc/31/06/20/1432310620.db2.gz AFBOSVYGJYLEJA-PELKAZGASA-N 0 1 379.092 3.120 10 0 GGAEMN C[N@H+](Cc1cccnc1)C[C@@H]1CCN(C(=O)CCC(=O)c2ccc(F)cc2)C1 ZINC000190574517 1432411019 /nfs/dbraw/zinc/41/10/19/1432411019.db2.gz AOMVCXSWZRSDLX-SFHVURJKSA-N 0 1 383.467 3.164 10 0 GGAEMN CN(Cc1cccnc1)C[C@@H]1CCN(C(=O)CCC(=O)c2ccc(F)cc2)C1 ZINC000190574517 1432411020 /nfs/dbraw/zinc/41/10/20/1432411020.db2.gz AOMVCXSWZRSDLX-SFHVURJKSA-N 0 1 383.467 3.164 10 0 GGAEMN COc1cc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)ccc1F ZINC000190759836 1432469529 /nfs/dbraw/zinc/46/95/29/1432469529.db2.gz XPQVKOPZSOVKFU-DOTOQJQBSA-N 0 1 392.496 3.166 10 0 GGAEMN COc1cc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)ccc1F ZINC000190759867 1432469734 /nfs/dbraw/zinc/46/97/34/1432469734.db2.gz XPQVKOPZSOVKFU-RDJZCZTQSA-N 0 1 392.496 3.166 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cnc(Br)c(C)c2)ccc1F ZINC000191008577 1432548751 /nfs/dbraw/zinc/54/87/51/1432548751.db2.gz PRTUWKTYVJDCPX-UHFFFAOYSA-N 0 1 375.219 3.101 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2c(C)cnn2Cc2ccccc2F)ccc1F ZINC000191019646 1432551359 /nfs/dbraw/zinc/55/13/59/1432551359.db2.gz CBKPVXANZAAXLX-UHFFFAOYSA-N 0 1 393.415 3.327 10 0 GGAEMN CC(C)COc1ccc(C(C)(C)C(=O)N2CCC([N@@H+](C)CC(=O)[O-])CC2)cc1 ZINC000191735251 1432714376 /nfs/dbraw/zinc/71/43/76/1432714376.db2.gz YMAKBSVJKZTGIJ-UHFFFAOYSA-N 0 1 390.524 3.006 10 0 GGAEMN O=C(Nc1ccccc1-c1nc(-c2ccccc2)n[nH]1)[C@H]1CCCCC(=O)N1 ZINC000193863675 1433075063 /nfs/dbraw/zinc/07/50/63/1433075063.db2.gz CMCCLMKGBIIVQB-QGZVFWFLSA-N 0 1 375.432 3.136 10 0 GGAEMN C/C=C\c1ccc(OC[C@H](O)CN2CCN(Cc3ccccc3)CC2)c(OC)c1 ZINC000210122553 1433356496 /nfs/dbraw/zinc/35/64/96/1433356496.db2.gz GXTSPQLTLPKKOH-NEAHNDPRSA-N 0 1 396.531 3.286 10 0 GGAEMN COc1ccc(/C=C(/C)C(=O)NC2CCN(Cc3ccccn3)CC2)cc1F ZINC000225580785 1433367333 /nfs/dbraw/zinc/36/73/33/1433367333.db2.gz AKBNLFGGAVZIOL-SSZFMOIBSA-N 0 1 383.467 3.413 10 0 GGAEMN O=S(=O)(NC1(C(F)(F)F)CC1)c1ccc(Br)cc1Cl ZINC000229739334 1433372069 /nfs/dbraw/zinc/37/20/69/1433372069.db2.gz WULNSMNQAMYILI-UHFFFAOYSA-N 0 1 378.597 3.476 10 0 GGAEMN O=S(=O)(Nc1nccnc1Cl)c1ccc(Br)cc1Cl ZINC000230688337 1433372874 /nfs/dbraw/zinc/37/28/74/1433372874.db2.gz MLYWZRYEWXCSFN-UHFFFAOYSA-N 0 1 383.054 3.347 10 0 GGAEMN c1nc(N2CCOCC2)sc1CNCc1ccnc(OC2CCCCC2)c1 ZINC000236638533 1433374953 /nfs/dbraw/zinc/37/49/53/1433374953.db2.gz CGFCEBYIHRNSNS-UHFFFAOYSA-N 0 1 388.537 3.376 10 0 GGAEMN CC(C)n1ncc2cc(CN[C@@H](CN3CCCC3=O)c3ccccc3)cnc21 ZINC000236863353 1433381265 /nfs/dbraw/zinc/38/12/65/1433381265.db2.gz ABXQEMMXUGIABH-FQEVSTJZSA-N 0 1 377.492 3.466 10 0 GGAEMN CCOc1c(Br)cc(CNCc2c(C)nn(C)c2C)cc1OC ZINC000237028421 1433386356 /nfs/dbraw/zinc/38/63/56/1433386356.db2.gz HCCKPTMNIJNBLB-UHFFFAOYSA-N 0 1 382.302 3.497 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2cccc(OC(F)(F)F)c2)C1=O ZINC000237105460 1433389265 /nfs/dbraw/zinc/38/92/65/1433389265.db2.gz DMOGFXPSAOWSCU-HNNXBMFYSA-N 0 1 380.366 3.489 10 0 GGAEMN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)[C@@H]1Cc2ccccc2CN1 ZINC000237117598 1433389816 /nfs/dbraw/zinc/38/98/16/1433389816.db2.gz GUTKUSJUNAMYCP-QFIPXVFZSA-N 0 1 392.478 3.321 10 0 GGAEMN COc1cc(CNCc2c(OC)ccc3ccccc32)ccc1OCC(N)=O ZINC000237329553 1433397704 /nfs/dbraw/zinc/39/77/04/1433397704.db2.gz DELFCSJRCVIDBQ-UHFFFAOYSA-N 0 1 380.444 3.011 10 0 GGAEMN O[C@H](CNCc1cc(Br)ccc1F)COc1ccc(F)c(F)c1 ZINC000238127594 1433443439 /nfs/dbraw/zinc/44/34/39/1433443439.db2.gz HYULZLCAGJVEJV-GFCCVEGCSA-N 0 1 390.199 3.396 10 0 GGAEMN COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccc(N2CCCCC2)nc1 ZINC000242847586 1433447773 /nfs/dbraw/zinc/44/77/73/1433447773.db2.gz FXSPGVAGMQFBCI-UHFFFAOYSA-N 0 1 375.494 3.498 10 0 GGAEMN CCOC(=O)c1ccccc1NC(=S)Nc1ccc(N2CCN(C)CC2)cc1 ZINC000243282741 1433449226 /nfs/dbraw/zinc/44/92/26/1433449226.db2.gz LBJZWDUQXFGDHF-UHFFFAOYSA-N 0 1 398.532 3.424 10 0 GGAEMN CCCC(=O)NC[C@@H]1CCCN([C@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)C1 ZINC000245389015 1433457643 /nfs/dbraw/zinc/45/76/43/1433457643.db2.gz GGZIGRTZAOZDGG-OTWHNJEPSA-N 0 1 385.552 3.371 10 0 GGAEMN Cc1ccc(N2CCCN(C[C@@H](O)c3ccc(Cl)cc3Cl)CC2)nn1 ZINC000245668830 1433497519 /nfs/dbraw/zinc/49/75/19/1433497519.db2.gz RPCNSOMFFGJZCS-QGZVFWFLSA-N 0 1 381.307 3.338 10 0 GGAEMN CCN(C[C@H](O)c1ccc(C)cc1)[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000245749437 1433510950 /nfs/dbraw/zinc/51/09/50/1433510950.db2.gz GLWJAGSIMXZXJA-IERDGZPVSA-N 0 1 383.492 3.336 10 0 GGAEMN C[C@H](NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)C1(N2CCOCC2)CCCC1 ZINC000246108036 1433570064 /nfs/dbraw/zinc/57/00/64/1433570064.db2.gz BTLRZLCPWTXDGI-ARFHVFGLSA-N 0 1 378.463 3.218 10 0 GGAEMN C[C@@H]1CCN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1n1ccnc1 ZINC000246914998 1433686978 /nfs/dbraw/zinc/68/69/78/1433686978.db2.gz BOQYGGIQNOBAEJ-DENIHFKCSA-N 0 1 380.536 3.247 10 0 GGAEMN C[C@H]1CCN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@H]1n1ccnc1 ZINC000246915047 1433686983 /nfs/dbraw/zinc/68/69/83/1433686983.db2.gz BOQYGGIQNOBAEJ-SIKLNZKXSA-N 0 1 380.536 3.247 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@@H](C)[C@H](n3ccnc3)C2)C(C)C)cc1 ZINC000246924220 1433687844 /nfs/dbraw/zinc/68/78/44/1433687844.db2.gz BSDURJYCWWXUGE-NQSCKRDGSA-N 0 1 384.524 3.288 10 0 GGAEMN COC(=O)c1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c(F)c1 ZINC000248581629 1433809718 /nfs/dbraw/zinc/80/97/18/1433809718.db2.gz ISZIKJPFWALHQK-YXJHDRRASA-N 0 1 392.471 3.347 10 0 GGAEMN CC(=O)NC[C@@H]1CCCN([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000249810246 1433852486 /nfs/dbraw/zinc/85/24/86/1433852486.db2.gz HPIVIIBCNORQHC-LNLFQRSKSA-N 0 1 381.520 3.254 10 0 GGAEMN COc1ccc([C@@H]2CCN([C@@H](C)C(=O)Nc3cccc(NC(C)=O)c3)C2)cc1 ZINC000249860575 1433853248 /nfs/dbraw/zinc/85/32/48/1433853248.db2.gz FYJUHFTZEVYYNP-MAUKXSAKSA-N 0 1 381.476 3.470 10 0 GGAEMN Cc1ccccc1OC[C@@H](O)CN1CCCC[C@H]1CNC(=O)OC(C)(C)C ZINC000251002551 1433857610 /nfs/dbraw/zinc/85/76/10/1433857610.db2.gz ZGXJKNAWUDUMCA-ROUUACIJSA-N 0 1 378.513 3.114 10 0 GGAEMN COc1cccc(-c2cc(C(=O)N3CCC[C@H]3c3nncn3C(C)C)n[nH]2)c1 ZINC000253412265 1433867206 /nfs/dbraw/zinc/86/72/06/1433867206.db2.gz QKTZGCCHXOJZRZ-SFHVURJKSA-N 0 1 380.452 3.235 10 0 GGAEMN O=C(/C=C\C1CCCCC1)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 ZINC000255143354 1433877456 /nfs/dbraw/zinc/87/74/56/1433877456.db2.gz IAXVXEZHNNOGQB-GHXNOFRVSA-N 0 1 386.477 3.352 10 0 GGAEMN Cc1ccsc1CN1CCC(n2c(Cc3ccccc3)nn(C)c2=O)CC1 ZINC000257175029 1433893138 /nfs/dbraw/zinc/89/31/38/1433893138.db2.gz NCJGOCQSXSTZGT-UHFFFAOYSA-N 0 1 382.533 3.380 10 0 GGAEMN CC(C)CC(=O)N1CC[C@H]2CN(Cc3ccccc3C(F)(F)F)C[C@@]2(CO)C1 ZINC000257174913 1433893186 /nfs/dbraw/zinc/89/31/86/1433893186.db2.gz LVVOLJOTYHWMFZ-PXNSSMCTSA-N 0 1 398.469 3.394 10 0 GGAEMN CCN1CCC2(CC1)CN(S(=O)(=O)c1cccs1)Cc1ccccc1O2 ZINC000257183977 1433894011 /nfs/dbraw/zinc/89/40/11/1433894011.db2.gz ICFSALREUYMIJK-UHFFFAOYSA-N 0 1 392.546 3.186 10 0 GGAEMN COc1ccc(C2(C(=O)N3CC[C@@H]4C[N@@H+](Cc5ccccc5)[C@@H]4C3)CC2)cc1 ZINC000257185531 1433894140 /nfs/dbraw/zinc/89/41/40/1433894140.db2.gz JOSGIHQBDPFPCY-DENIHFKCSA-N 0 1 376.500 3.460 10 0 GGAEMN COc1ccc(C2(C(=O)N3CC[C@@H]4CN(Cc5ccccc5)[C@@H]4C3)CC2)cc1 ZINC000257185531 1433894141 /nfs/dbraw/zinc/89/41/41/1433894141.db2.gz JOSGIHQBDPFPCY-DENIHFKCSA-N 0 1 376.500 3.460 10 0 GGAEMN COc1cccc(S(=O)(=O)N2CCC(n3c(C)cnc3C3CC3)CC2)c1 ZINC000257187637 1433894289 /nfs/dbraw/zinc/89/42/89/1433894289.db2.gz BVUDWHYYEJBIOU-UHFFFAOYSA-N 0 1 375.494 3.103 10 0 GGAEMN Cc1cnc(CC2CCN(C(=O)[C@@H]3CCOC3)CC2)n1Cc1ccc(F)cc1 ZINC000257189100 1433894385 /nfs/dbraw/zinc/89/43/85/1433894385.db2.gz HOZMEPOTVJULLT-LJQANCHMSA-N 0 1 385.483 3.197 10 0 GGAEMN C[C@H]1CCCC[C@@H]1N(C)C(=O)CN1CCC(CNC(=O)OC(C)(C)C)CC1 ZINC000261379269 1433895474 /nfs/dbraw/zinc/89/54/74/1433895474.db2.gz DOBWBXMSLIONMJ-WMZOPIPTSA-N 0 1 381.561 3.260 10 0 GGAEMN CC(C)[C@H](C)N1Cc2cccc(NC(=O)C(=O)N(C)C[C@@H]3CCCCO3)c2C1 ZINC000263942462 1434051321 /nfs/dbraw/zinc/05/13/21/1434051321.db2.gz DHFDFVQUJKFMIS-WMZOPIPTSA-N 0 1 387.524 3.013 10 0 GGAEMN C[C@H](O)CN(Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)C1CCCCC1 ZINC000264141410 1434075266 /nfs/dbraw/zinc/07/52/66/1434075266.db2.gz BGNMNDNIUZQGRM-HNNXBMFYSA-N 0 1 381.480 3.037 10 0 GGAEMN CN1CCN(CCOc2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)cc2)CC1 ZINC000266297148 1434317431 /nfs/dbraw/zinc/31/74/31/1434317431.db2.gz HROKCSHQNOSNSP-YADHBBJMSA-N 0 1 397.494 3.194 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)[nH]1 ZINC000266805444 1434377285 /nfs/dbraw/zinc/37/72/85/1434377285.db2.gz HQWMEWBUHXTTQL-VIFPVBQESA-N 0 1 380.424 3.218 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2cccc(OCc3ccccc3)c2)[nH]1 ZINC000266807211 1434377384 /nfs/dbraw/zinc/37/73/84/1434377384.db2.gz GIYDZLUZLOQQDX-UHFFFAOYSA-N 0 1 382.489 3.491 10 0 GGAEMN C[C@H](c1ccncc1)N1CCC(NC(=O)N(C)C2Cc3ccccc3C2)CC1 ZINC000269612881 1434663555 /nfs/dbraw/zinc/66/35/55/1434663555.db2.gz BKMNKCQAILLIAV-QGZVFWFLSA-N 0 1 378.520 3.416 10 0 GGAEMN CCC(=O)N[C@@H](CCSC)C(=O)Nc1cccc2c1CN(CC(C)C)C2 ZINC000270997178 1434794350 /nfs/dbraw/zinc/79/43/50/1434794350.db2.gz HASNOOGHTOXREW-SFHVURJKSA-N 0 1 377.554 3.245 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@@H](C)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000271654505 1434842085 /nfs/dbraw/zinc/84/20/85/1434842085.db2.gz FTHVAHYJLXBGSE-CHWSQXEVSA-N 0 1 391.418 3.325 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)N[C@H](C)c2ccccc2OC(F)F)c1 ZINC000271654507 1434842114 /nfs/dbraw/zinc/84/21/14/1434842114.db2.gz FTHVAHYJLXBGSE-OLZOCXBDSA-N 0 1 391.418 3.325 10 0 GGAEMN Cc1cc(C2CCN(C(=O)[C@@H]3CCCCN3C(=O)OC(C)(C)C)CC2)n[nH]1 ZINC000272204342 1434877861 /nfs/dbraw/zinc/87/78/61/1434877861.db2.gz HUQQQMKMZWSNOO-KRWDZBQOSA-N 0 1 376.501 3.214 10 0 GGAEMN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000272881145 1434938491 /nfs/dbraw/zinc/93/84/91/1434938491.db2.gz CLLLNZCSTLCMMH-JNJDFRRZSA-N 0 1 388.533 3.349 10 0 GGAEMN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000272881151 1434938522 /nfs/dbraw/zinc/93/85/22/1434938522.db2.gz CLLLNZCSTLCMMH-OSLIRNSNSA-N 0 1 388.533 3.349 10 0 GGAEMN Cn1c2ccccc2nc1CCCNCc1c(Cl)cccc1S(C)(=O)=O ZINC000273368966 1434983835 /nfs/dbraw/zinc/98/38/35/1434983835.db2.gz CHCTWVJYGAVMPU-UHFFFAOYSA-N 0 1 391.924 3.353 10 0 GGAEMN Cc1c(-c2cc(CN3CCC(CNC(=O)OC(C)(C)C)CC3)on2)cnn1C ZINC000274300212 1435059458 /nfs/dbraw/zinc/05/94/58/1435059458.db2.gz BOWFAQLFGRSMOR-UHFFFAOYSA-N 0 1 389.500 3.120 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)COC3CCN(C(=O)OC(C)(C)C)CC3)ccc12 ZINC000274994326 1435108256 /nfs/dbraw/zinc/10/82/56/1435108256.db2.gz MVYBSORSANRTBZ-UHFFFAOYSA-N 0 1 388.468 3.226 10 0 GGAEMN CC(C)c1nnc(C=CC(=O)N2CCC[C@H](c3ncc(C(F)(F)F)[nH]3)C2)o1 ZINC000278541618 1435398646 /nfs/dbraw/zinc/39/86/46/1435398646.db2.gz AGHBVRULMRAKRY-QRGHLMKCSA-N 0 1 383.374 3.354 10 0 GGAEMN Cc1cc([C@@H]2CCCN(C(=O)[C@@H](NC(=O)c3cccc(C)c3)C(C)C)C2)n[nH]1 ZINC000282380225 1435845114 /nfs/dbraw/zinc/84/51/14/1435845114.db2.gz CUBUXIVKRVZBCX-QUCCMNQESA-N 0 1 382.508 3.187 10 0 GGAEMN O=C(C=Cc1ccc(Cl)c(C(F)(F)F)c1)N1CCOC[C@H]1c1nnc[nH]1 ZINC000284221089 1436005148 /nfs/dbraw/zinc/00/51/48/1436005148.db2.gz HGHBEKVIDXJUGU-OHVSUOQFSA-N 0 1 386.761 3.090 10 0 GGAEMN CC(C)c1noc(-c2ccnc(N3CCN(CCOc4ccccc4)CC3)c2)n1 ZINC000462930805 721960753 /nfs/dbraw/zinc/96/07/53/721960753.db2.gz XCQHDVSNBDLUTN-UHFFFAOYSA-N 0 1 393.491 3.456 10 0 GGAEMN CC[N@H+](CC(=O)N[C@@H](C(=O)[O-])c1ccccc1F)Cc1ccc(Cl)cc1 ZINC000095464041 939032088 /nfs/dbraw/zinc/03/20/88/939032088.db2.gz CEPVXSRSYTXYKO-GOSISDBHSA-N 0 1 378.831 3.243 10 0 GGAEMN CC[N@@H+](CC(=O)N[C@@H](C(=O)[O-])c1ccccc1F)Cc1ccc(Cl)cc1 ZINC000095464041 939032092 /nfs/dbraw/zinc/03/20/92/939032092.db2.gz CEPVXSRSYTXYKO-GOSISDBHSA-N 0 1 378.831 3.243 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@@H](C(=O)[O-])C2CCCCC2)[C@H]1c1cccs1 ZINC000780584493 939138902 /nfs/dbraw/zinc/13/89/02/939138902.db2.gz ABVIEBPVJUUUPQ-NXHRZFHOSA-N 0 1 393.553 3.464 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)N[C@H](C(=O)[O-])c2ccccc2)[C@@H]1c1cccs1 ZINC000780584838 939139555 /nfs/dbraw/zinc/13/95/55/939139555.db2.gz HMIVPYJRLMZZNH-RYQLBKOJSA-N 0 1 387.505 3.256 10 0 GGAEMN CC(C)C[N@@H+](C)CCCNC(=O)N[C@H](C(=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000908706056 939306275 /nfs/dbraw/zinc/30/62/75/939306275.db2.gz HZLBLZOQRWXBHO-HNNXBMFYSA-N 0 1 389.418 3.108 10 0 GGAEMN C[C@H](CNC(=O)N[C@@H](C(=O)[O-])c1ccc2ccccc2c1)[N@H+]1CCC[C@@H](C)C1 ZINC000908811660 939325505 /nfs/dbraw/zinc/32/55/05/939325505.db2.gz AAWACHKUEXGHPB-JXXFODFXSA-N 0 1 383.492 3.385 10 0 GGAEMN C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N[C@H](C(=O)[O-])C2CCCCCC2)C1 ZINC000908830163 939331833 /nfs/dbraw/zinc/33/18/33/939331833.db2.gz QMOUNLXPYDMNJI-SCTDSRPQSA-N 0 1 381.561 3.467 10 0 GGAEMN C[C@@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+]1CCc2sccc2C1 ZINC000908851421 939336407 /nfs/dbraw/zinc/33/64/07/939336407.db2.gz LCISRXLVOZVNOI-VBKZILBWSA-N 0 1 393.553 3.218 10 0 GGAEMN C[C@@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2sccc2C1 ZINC000908851421 939336409 /nfs/dbraw/zinc/33/64/09/939336409.db2.gz LCISRXLVOZVNOI-VBKZILBWSA-N 0 1 393.553 3.218 10 0 GGAEMN CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@]2(C(=O)[O-])CCCC(C)(C)C2)c1 ZINC000908882851 939344247 /nfs/dbraw/zinc/34/42/47/939344247.db2.gz MJQYEQYGJCEENG-OAQYLSRUSA-N 0 1 375.513 3.361 10 0 GGAEMN CC1(C)CCC[C@](NC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908924841 939354280 /nfs/dbraw/zinc/35/42/80/939354280.db2.gz MERFLCRAXFRJTA-XMSQKQJNSA-N 0 1 387.524 3.231 10 0 GGAEMN C[C@]1(CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2)CCC[N@H+]1Cc1ccccc1 ZINC000908960025 939361539 /nfs/dbraw/zinc/36/15/39/939361539.db2.gz PHXRTCJCBUPHJQ-DENIHFKCSA-N 0 1 381.476 3.166 10 0 GGAEMN C[C@](NC(=O)NC[C@@]1(C)CCC[N@H+]1Cc1ccccc1)(C(=O)[O-])c1ccccc1 ZINC000908960002 939361647 /nfs/dbraw/zinc/36/16/47/939361647.db2.gz OOAQVZUHJJNMLN-DHIUTWEWSA-N 0 1 395.503 3.340 10 0 GGAEMN C[C@]1(CNC(=O)N[C@@H](C(=O)[O-])C2CCCCC2)CCC[N@H+]1Cc1ccccc1 ZINC000908960357 939361733 /nfs/dbraw/zinc/36/17/33/939361733.db2.gz RKVIQQUGCKWTRH-DENIHFKCSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@@H]1[C@H](NC(=O)N[C@@]2(C(=O)[O-])CCCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000908999852 939369256 /nfs/dbraw/zinc/36/92/56/939369256.db2.gz CWKIXXRUSXYPAH-CDMIOBSGSA-N 0 1 387.524 3.372 10 0 GGAEMN CC1(C)CCC[C@@](NC(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)(C(=O)[O-])C1 ZINC000908999053 939369331 /nfs/dbraw/zinc/36/93/31/939369331.db2.gz WPFJXVRBENQXQV-GCJKJVERSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@@H]1[C@@H](NC(=O)N[C@]2(C(=O)[O-])CCCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000908999855 939369380 /nfs/dbraw/zinc/36/93/80/939369380.db2.gz CWKIXXRUSXYPAH-TVTNDZMWSA-N 0 1 387.524 3.372 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1 ZINC000909071783 939377441 /nfs/dbraw/zinc/37/74/41/939377441.db2.gz ZHQPHWRTNQYKEY-CDMIOBSGSA-N 0 1 387.524 3.230 10 0 GGAEMN CCCC[N@@H+](CC)Cc1cccc(CNC(=O)N[C@]2(C(=O)[O-])CCSC2)c1 ZINC000909123651 939383261 /nfs/dbraw/zinc/38/32/61/939383261.db2.gz ZJAYJBAFUYJFDI-HXUWFJFHSA-N 0 1 393.553 3.068 10 0 GGAEMN C[N@@H+]1CCc2[nH]c3ccc(C(=O)N[C@]4(C(=O)[O-])CCCC(C)(C)C4)cc3c2C1 ZINC000910217776 939753732 /nfs/dbraw/zinc/75/37/32/939753732.db2.gz GJLZYPKJIGXFCZ-JOCHJYFZSA-N 0 1 383.492 3.309 10 0 GGAEMN C[N@H+]1CCc2[nH]c3ccc(C(=O)N[C@]4(C(=O)[O-])CCCC(C)(C)C4)cc3c2C1 ZINC000910217776 939753735 /nfs/dbraw/zinc/75/37/35/939753735.db2.gz GJLZYPKJIGXFCZ-JOCHJYFZSA-N 0 1 383.492 3.309 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@@H](C(=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000911062332 939768691 /nfs/dbraw/zinc/76/86/91/939768691.db2.gz VKWQUKPQCDHQLC-MEDUHNTESA-N 0 1 383.370 3.358 10 0 GGAEMN C[C@H](NC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041078 939798890 /nfs/dbraw/zinc/79/88/90/939798890.db2.gz MJFGWUVRRQGIHT-QYWGDWMGSA-N 0 1 379.545 3.362 10 0 GGAEMN Cc1cccc(C(=O)N[C@]2(C(=O)[O-])CCC[N@@H+](Cc3ccccc3)C2)c1Cl ZINC001123269807 939818546 /nfs/dbraw/zinc/81/85/46/939818546.db2.gz AXIPVEYXEGURQE-OAQYLSRUSA-N 0 1 386.879 3.498 10 0 GGAEMN O=C([O-])[C@]1(NC(=O)c2cccc3scnc32)CCC[N@@H+](Cc2ccccc2)C1 ZINC001123278296 939820154 /nfs/dbraw/zinc/82/01/54/939820154.db2.gz VNRSHSBLUPQLNR-NRFANRHFSA-N 0 1 395.484 3.146 10 0 GGAEMN CC[N@@H+](CCCNC(=O)N[C@@](C)(C(=O)[O-])c1ccc(F)cc1)C1CCCCC1 ZINC000649529820 939834082 /nfs/dbraw/zinc/83/40/82/939834082.db2.gz AXKAYLDKCIBMKH-OAQYLSRUSA-N 0 1 393.503 3.469 10 0 GGAEMN CC[N@@H+](CCCNC(=O)N[C@](C)(C(=O)[O-])c1ccc(F)cc1)C1CCCCC1 ZINC000649529819 939834180 /nfs/dbraw/zinc/83/41/80/939834180.db2.gz AXKAYLDKCIBMKH-NRFANRHFSA-N 0 1 393.503 3.469 10 0 GGAEMN CC[N@@H+](CCCNC(=O)N[C@H](C(=O)[O-])c1cccc(OC)c1)C1CCCCC1 ZINC000656584135 939845088 /nfs/dbraw/zinc/84/50/88/939845088.db2.gz GANKESYXBGKVAO-IBGZPJMESA-N 0 1 391.512 3.165 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000663045484 939850900 /nfs/dbraw/zinc/85/09/00/939850900.db2.gz IFXUQOKAVPCZLP-GVDBMIGSSA-N 0 1 382.863 3.230 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CC2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000663045484 939850901 /nfs/dbraw/zinc/85/09/01/939850901.db2.gz IFXUQOKAVPCZLP-GVDBMIGSSA-N 0 1 382.863 3.230 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000663045485 939851014 /nfs/dbraw/zinc/85/10/14/939851014.db2.gz IFXUQOKAVPCZLP-ULQDDVLXSA-N 0 1 382.863 3.230 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000663045485 939851017 /nfs/dbraw/zinc/85/10/17/939851017.db2.gz IFXUQOKAVPCZLP-ULQDDVLXSA-N 0 1 382.863 3.230 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)[C@H](C(=O)[O-])C2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000663108741 939855769 /nfs/dbraw/zinc/85/57/69/939855769.db2.gz VSKZZDOFTRWQAD-DJIMGWMZSA-N 0 1 398.425 3.315 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)[C@@H](C(=O)[O-])C2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000663108744 939855976 /nfs/dbraw/zinc/85/59/76/939855976.db2.gz VSKZZDOFTRWQAD-PVAVHDDUSA-N 0 1 398.425 3.315 10 0 GGAEMN COc1cccc(-c2nc(CNC3(CO)Cc4ccccc4C3)cs2)c1OC ZINC000369330589 1126080191 /nfs/dbraw/zinc/08/01/91/1126080191.db2.gz SLLCZLRMIDXVEJ-UHFFFAOYSA-N 0 1 396.512 3.447 10 0 GGAEMN COc1cc(-c2nc(CNC3(CO)Cc4ccccc4C3)cs2)ccc1O ZINC000369331500 1126080276 /nfs/dbraw/zinc/08/02/76/1126080276.db2.gz XQFBSLVGBZQUKQ-UHFFFAOYSA-N 0 1 382.485 3.144 10 0 GGAEMN O=C([O-])[C@H](Cc1ccc(OC(F)F)cc1)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000426791567 1126090721 /nfs/dbraw/zinc/09/07/21/1126090721.db2.gz IUAURGYNRNVVJT-KRWDZBQOSA-N 0 1 387.386 3.464 10 0 GGAEMN O=C([O-])[C@@H](Cc1ccc(OC(F)F)cc1)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000426791570 1126090758 /nfs/dbraw/zinc/09/07/58/1126090758.db2.gz IUAURGYNRNVVJT-QGZVFWFLSA-N 0 1 387.386 3.464 10 0 GGAEMN COC(=O)c1cccc(-c2nc(CNC3(CO)Cc4ccccc4C3)cs2)c1 ZINC000436259817 1126093386 /nfs/dbraw/zinc/09/33/86/1126093386.db2.gz LNXCQLQZSLXLLX-UHFFFAOYSA-N 0 1 394.496 3.216 10 0 GGAEMN Cn1nc(C(F)(F)F)cc1CN[C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000657362539 1126104451 /nfs/dbraw/zinc/10/44/51/1126104451.db2.gz CQDKXWIKDREKOA-JSGCOSHPSA-N 0 1 381.320 3.063 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@H](Cc3ccccc3)[C@@H](O)C(F)(F)F)ccc21 ZINC000684379267 1126106456 /nfs/dbraw/zinc/10/64/56/1126106456.db2.gz XTIMUQBVSLYFFP-RHSMWYFYSA-N 0 1 396.434 3.224 10 0 GGAEMN COCc1nc(CN[C@](C)(CO)Cc2ccc(Br)cc2)cs1 ZINC000865715698 1126115219 /nfs/dbraw/zinc/11/52/19/1126115219.db2.gz YDRXOWYGLSDIDV-INIZCTEOSA-N 0 1 385.327 3.135 10 0 GGAEMN CC(C)(C)OC(=O)Nc1cnc(CN[C@](C)(CO)Cc2ccccc2F)cn1 ZINC000865716558 1126115874 /nfs/dbraw/zinc/11/58/74/1126115874.db2.gz VXPXBPXWLXNWBN-FQEVSTJZSA-N 0 1 390.459 3.046 10 0 GGAEMN COc1ccc(C[C@@](C)(CO)NCc2nc(C)c(Br)s2)cc1 ZINC000922328507 1126134607 /nfs/dbraw/zinc/13/46/07/1126134607.db2.gz OYSCYZUHHIEMEF-INIZCTEOSA-N 0 1 385.327 3.306 10 0 GGAEMN C[C@](CO)(Cc1ccc(F)cc1)NCc1ccn(-c2c(F)cccc2F)n1 ZINC001198231719 1126156109 /nfs/dbraw/zinc/15/61/09/1126156109.db2.gz WXESPRGNFDNNRI-HXUWFJFHSA-N 0 1 375.394 3.373 10 0 GGAEMN C[C@](CO)(Cc1ccccc1F)NCc1cn2cc(Br)ccc2n1 ZINC001198219910 1126154996 /nfs/dbraw/zinc/15/49/96/1126154996.db2.gz TWPUHBWIWOANIY-GOSISDBHSA-N 0 1 392.272 3.319 10 0 GGAEMN CCc1cc2c(C[NH2+][C@](C)(CO)Cc3ccc(F)cc3)cc(=O)oc2cc1[O-] ZINC001655735410 1126255906 /nfs/dbraw/zinc/25/59/06/1126255906.db2.gz DYECJKPJKUROIM-QFIPXVFZSA-N 0 1 385.435 3.283 10 0 GGAEMN COc1ccc(C[C@](C)(CO)NCc2nc3c4ccccc4oc3c(=O)[nH]2)cc1 ZINC001655736927 1126256098 /nfs/dbraw/zinc/25/60/98/1126256098.db2.gz WRHQBGXXQGOPBM-JOCHJYFZSA-N 0 1 393.443 3.174 10 0 GGAEMN COc1ccc(C[C@](C)(CO)[NH2+]Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1 ZINC001655736927 1126256099 /nfs/dbraw/zinc/25/60/99/1126256099.db2.gz WRHQBGXXQGOPBM-JOCHJYFZSA-N 0 1 393.443 3.174 10 0 GGAEMN COC(=O)c1sccc1CN[C@](C)(CO)Cc1ccc(Br)cc1 ZINC001655736987 1126256277 /nfs/dbraw/zinc/25/62/77/1126256277.db2.gz YEMCLXNWLCAQMP-KRWDZBQOSA-N 0 1 398.322 3.381 10 0 GGAEMN C[C@](CO)(Cc1ccc(F)cc1)NCc1ccn(-c2ccc(F)cc2F)n1 ZINC001656293684 1126257174 /nfs/dbraw/zinc/25/71/74/1126257174.db2.gz PVSUOXYDRYMBGZ-HXUWFJFHSA-N 0 1 375.394 3.373 10 0 GGAEMN O[C@@H]([C@@H](Cc1ccccc1)NCc1ccnc(Br)c1)C(F)(F)F ZINC001659943894 1126264013 /nfs/dbraw/zinc/26/40/13/1126264013.db2.gz MBWRRHSHKDUNKZ-HIFRSBDPSA-N 0 1 389.215 3.468 10 0 GGAEMN O[C@H]([C@@H](Cc1ccccc1)NCc1ccnc(Br)c1)C(F)(F)F ZINC001659943895 1126264046 /nfs/dbraw/zinc/26/40/46/1126264046.db2.gz MBWRRHSHKDUNKZ-UKRRQHHQSA-N 0 1 389.215 3.468 10 0 GGAEMN C[C@@](CO)(Cc1ccc(Br)cc1)NCc1cc2n(n1)CCCC2 ZINC001660390196 1126264742 /nfs/dbraw/zinc/26/47/42/1126264742.db2.gz ZOPNSRGLVHPBER-SFHVURJKSA-N 0 1 378.314 3.065 10 0 GGAEMN C[N@H+]1C[C@H]2c3cc(OS(=O)(=O)[O-])ccc3Oc3ccc(Cl)cc3[C@H]2C1 ZINC000504249865 529829991 /nfs/dbraw/zinc/82/99/91/529829991.db2.gz MFUYPKMLVSJPJJ-CABCVRRESA-N 0 1 381.837 3.440 10 0 GGAEMN C[N@@H+]1C[C@H]2c3cc(OS(=O)(=O)[O-])ccc3Oc3ccc(Cl)cc3[C@H]2C1 ZINC000504249865 529829992 /nfs/dbraw/zinc/82/99/92/529829992.db2.gz MFUYPKMLVSJPJJ-CABCVRRESA-N 0 1 381.837 3.440 10 0 GGAEMN O=C(CSc1nc2ccccc2o1)n1cc(C(=O)c2ccccc2O)cn1 ZINC000003357417 204001855 /nfs/dbraw/zinc/00/18/55/204001855.db2.gz JQWHKFKKPCFHFB-UHFFFAOYSA-N 0 1 379.397 3.393 10 0 GGAEMN CC(C)n1cc2c3c1cccc3[C@H]1C[C@@H](C(=O)O[C@@H](C)[C@@H](C)O)CN(C)[C@@H]1C2 ZINC000003873168 204021620 /nfs/dbraw/zinc/02/16/20/204021620.db2.gz JQYLIGHHVGCTPR-UNYZBHEASA-N 0 1 384.520 3.495 10 0 in-vivo GGAEMN Cc1[nH]n(-c2ccccc2)c(=O)c1C=C1NC(=O)N(Cc2ccc(C)cc2)C1=O ZINC000004239707 204034943 /nfs/dbraw/zinc/03/49/43/204034943.db2.gz NZWJGTNWTJLBGA-UNOMPAQXSA-N 0 1 388.427 3.288 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)[C@@H]2C ZINC000004270445 204035325 /nfs/dbraw/zinc/03/53/25/204035325.db2.gz HWLMZMLNBPHQIG-CYBMUJFWSA-N 0 1 386.473 3.201 10 0 GGAEMN O=C(NC(=S)NN=c1[nH]cc(C(F)(F)F)cc1Cl)c1cccs1 ZINC000004394796 204043851 /nfs/dbraw/zinc/04/38/51/204043851.db2.gz REFFHUGGSZHMHE-UHFFFAOYSA-N 0 1 380.804 3.447 10 0 GGAEMN O=C(CCNC(=O)c1ccccc1Cl)NC[C@H](c1ccco1)N1CCCC1 ZINC000005704804 204148018 /nfs/dbraw/zinc/14/80/18/204148018.db2.gz XJAMBQPEJFYNAQ-QGZVFWFLSA-N 0 1 389.883 3.006 10 0 GGAEMN CCNC(=O)NC(=O)[C@@H](Sc1nc(-c2ccc(C)cc2)n[nH]1)c1ccccc1 ZINC000005868832 204154352 /nfs/dbraw/zinc/15/43/52/204154352.db2.gz RLLCKOLXLZLYEH-INIZCTEOSA-N 0 1 395.488 3.459 10 0 GGAEMN CC(C)CCNC(=O)CSc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000005858560 204154924 /nfs/dbraw/zinc/15/49/24/204154924.db2.gz OYPXDFLQGYIOKZ-UHFFFAOYSA-N 0 1 383.315 3.489 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2)n[nH]1)Nc1ccc2c(c1)OCCCO2 ZINC000006178263 204170047 /nfs/dbraw/zinc/17/00/47/204170047.db2.gz PMPODFYVIWWGDZ-UHFFFAOYSA-N 0 1 382.445 3.364 10 0 GGAEMN CCNC(=O)NC(=O)[C@@H](Sc1nc(-c2ccccc2)n[nH]1)c1ccccc1 ZINC000006178846 204169557 /nfs/dbraw/zinc/16/95/57/204169557.db2.gz XHSQNKFSUJULBG-HNNXBMFYSA-N 0 1 381.461 3.151 10 0 GGAEMN CCOC(=O)C1CCN(C[C@@H](O)COc2ccc(C)cc2C(C)(C)C)CC1 ZINC000005559789 204140565 /nfs/dbraw/zinc/14/05/65/204140565.db2.gz ZZPVHIRPKTUVOP-GOSISDBHSA-N 0 1 377.525 3.307 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2F)n[nH]1)NC(=O)Nc1ccccc1F ZINC000006784830 204205173 /nfs/dbraw/zinc/20/51/73/204205173.db2.gz VPDQYQOALFYTQV-UHFFFAOYSA-N 0 1 389.387 3.190 10 0 GGAEMN COC(=O)C1C(C)=NC(=O)N[C@H]1c1ccc(N2CCC(c3ccccc3)=N2)cc1 ZINC000006754183 204201511 /nfs/dbraw/zinc/20/15/11/204201511.db2.gz FAVJBWXFPPFFSH-FQEVSTJZSA-N 0 1 390.443 3.102 10 0 GGAEMN CCc1ccccc1NC(=O)CSC1=Nc2ccccc2S(=O)(=O)N1 ZINC000006918531 204223506 /nfs/dbraw/zinc/22/35/06/204223506.db2.gz QGXOPVSNHHZAOZ-UHFFFAOYSA-N 0 1 375.475 3.091 10 0 GGAEMN COc1ccc2nc(SCC(=O)N3c4ccccc4NC(=O)C[C@H]3C)[nH]c2c1 ZINC000006974971 204227822 /nfs/dbraw/zinc/22/78/22/204227822.db2.gz CHZKFYMYKWQMBJ-GFCCVEGCSA-N 0 1 396.472 3.428 10 0 GGAEMN COc1cc([C@H]2NC(=N)Nc3nc4ccccc4n32)cc(Cl)c1OC(F)F ZINC000007127546 204234223 /nfs/dbraw/zinc/23/42/23/204234223.db2.gz FBVLVHYOFGFVHS-AWEZNQCLSA-N 0 1 393.781 3.396 10 0 GGAEMN O=C([C@@H](Sc1nc(-c2ccccc2)n[nH]1)c1ccccc1)N1CCOCC1 ZINC000007149363 204234713 /nfs/dbraw/zinc/23/47/13/204234713.db2.gz IPSCNSRQASRTQX-KRWDZBQOSA-N 0 1 380.473 3.164 10 0 GGAEMN CCC(=O)c1ccc(OCC(=O)Nc2ccccc2N2CCN(CC)CC2)cc1 ZINC000007268550 204237304 /nfs/dbraw/zinc/23/73/04/204237304.db2.gz GGZKFAHVACVSLY-UHFFFAOYSA-N 0 1 395.503 3.439 10 0 GGAEMN O=C(CN[C@@H](c1cccs1)c1ccccc1)N1CCN(c2ccccn2)CC1 ZINC000007750252 204248558 /nfs/dbraw/zinc/24/85/58/204248558.db2.gz HRXJNAOGUPLDEY-JOCHJYFZSA-N 0 1 392.528 3.171 10 0 GGAEMN CN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)C(=O)c1[nH]nc2ccccc21 ZINC000007942603 204255012 /nfs/dbraw/zinc/25/50/12/204255012.db2.gz TYISBOWEYQSDCL-UHFFFAOYSA-N 0 1 392.337 3.172 10 0 GGAEMN COc1cn(CC(=O)Nc2ccc(C)cc2C)c(CN2CCCCC2)cc1=O ZINC000008602113 204281091 /nfs/dbraw/zinc/28/10/91/204281091.db2.gz SDACLQFHDNZVMH-UHFFFAOYSA-N 0 1 383.492 3.098 10 0 GGAEMN COc1cn(CC(=O)Nc2c(C)cc(C)cc2C)c(CN2CCCCC2)cc1=O ZINC000008602117 204281181 /nfs/dbraw/zinc/28/11/81/204281181.db2.gz IATIWHAINVBQBK-UHFFFAOYSA-N 0 1 397.519 3.407 10 0 GGAEMN CC(C)(C)OC(=O)N1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C(=O)[O-] ZINC000008698785 204283392 /nfs/dbraw/zinc/28/33/92/204283392.db2.gz WHTXSKUHVZKEIF-CQSZACIVSA-N 0 1 388.386 3.211 10 0 GGAEMN CC(C)(C)OC(=O)N1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C[C@@H]1C(=O)[O-] ZINC000008698785 204283398 /nfs/dbraw/zinc/28/33/98/204283398.db2.gz WHTXSKUHVZKEIF-CQSZACIVSA-N 0 1 388.386 3.211 10 0 GGAEMN C[C@H](C(=O)NC(=O)NC1CCCCC1)N(C)CCOc1ccc(Cl)cc1 ZINC000008120601 204262190 /nfs/dbraw/zinc/26/21/90/204262190.db2.gz GLTNDLFWYIRHSI-CQSZACIVSA-N 0 1 381.904 3.198 10 0 GGAEMN O=C(CN1CCCCCC1)Nc1ccccc1C(=O)NCCc1ccccc1 ZINC000008327666 204271663 /nfs/dbraw/zinc/27/16/63/204271663.db2.gz NNLVTNZPMPSXQG-UHFFFAOYSA-N 0 1 379.504 3.474 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)CCOc2ccc(OC)cc2)CC1 ZINC000008404023 204275933 /nfs/dbraw/zinc/27/59/33/204275933.db2.gz KDFOTWBANFXXQF-UHFFFAOYSA-N 0 1 383.492 3.245 10 0 GGAEMN O=C(CSc1nc(-c2cccs2)n[nH]1)NCCc1c[nH]c2ccccc12 ZINC000008528261 204279553 /nfs/dbraw/zinc/27/95/53/204279553.db2.gz HRPKERNUWRJFGQ-UHFFFAOYSA-N 0 1 383.502 3.466 10 0 GGAEMN COc1cccc(N2CCN(C(=O)c3n[nH]c4c3CCc3ccccc3-4)CC2)c1 ZINC000009728228 204321636 /nfs/dbraw/zinc/32/16/36/204321636.db2.gz DODTWZXUOUQPRQ-UHFFFAOYSA-N 0 1 388.471 3.146 10 0 GGAEMN O=C(NCc1ccccc1)C1CCN(C(=O)c2cc(-c3ccccc3)[nH]n2)CC1 ZINC000009919434 204327035 /nfs/dbraw/zinc/32/70/35/204327035.db2.gz YJWROBFJOMOKSG-UHFFFAOYSA-N 0 1 388.471 3.245 10 0 GGAEMN CC[C@H](C(=O)Nc1ccccc1)N1CCC(C(=O)NCc2ccccc2)CC1 ZINC000011469241 204346207 /nfs/dbraw/zinc/34/62/07/204346207.db2.gz JLBSAQPAPDOIAK-OAQYLSRUSA-N 0 1 379.504 3.432 10 0 GGAEMN CC[C@@H](C(=O)Nc1ccccc1)N1CCC(C(=O)NCc2ccccc2)CC1 ZINC000011469232 204347090 /nfs/dbraw/zinc/34/70/90/204347090.db2.gz JLBSAQPAPDOIAK-NRFANRHFSA-N 0 1 379.504 3.432 10 0 GGAEMN O=C(C[C@@H]1C(=O)NCCN1CC1CCCCC1)N1CC=C(c2ccccc2)CC1 ZINC000011842923 204357735 /nfs/dbraw/zinc/35/77/35/204357735.db2.gz DJXRRCHXRBYHEX-JOCHJYFZSA-N 0 1 395.547 3.073 10 0 GGAEMN O=C(CSc1n[nH]c(CC2CCCC2)n1)Nc1ccccc1C(=O)NC1CC1 ZINC000011885737 204361090 /nfs/dbraw/zinc/36/10/90/204361090.db2.gz CEDQQJCKAKZTHO-UHFFFAOYSA-N 0 1 399.520 3.160 10 0 GGAEMN O=C(CSc1nc(CC2CCCC2)n[nH]1)Nc1ccccc1C(=O)NC1CC1 ZINC000011885737 204361093 /nfs/dbraw/zinc/36/10/93/204361093.db2.gz CEDQQJCKAKZTHO-UHFFFAOYSA-N 0 1 399.520 3.160 10 0 GGAEMN CCc1ncc(CN2CCC[C@@H](C(=O)Nc3ccc(-c4cc[nH]n4)cc3)C2)cn1 ZINC000011935889 204363190 /nfs/dbraw/zinc/36/31/90/204363190.db2.gz YQGRLICJADLUIV-GOSISDBHSA-N 0 1 390.491 3.280 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc(N3CCCCC3=O)cc2)c(OC)c1 ZINC000012199023 204381146 /nfs/dbraw/zinc/38/11/46/204381146.db2.gz KDJIEDYIMOMAQX-UHFFFAOYSA-N 0 1 390.461 3.022 10 0 GGAEMN O=C1CCCC(=O)N1c1ccc(S(=O)(=O)Nc2cccc3cccnc32)cc1 ZINC000012202678 204382914 /nfs/dbraw/zinc/38/29/14/204382914.db2.gz IFUVBNLLYCSUBI-UHFFFAOYSA-N 0 1 395.440 3.079 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC[C@@H](Nc2ccc3c(c2)OCCO3)C1 ZINC000012304793 204393813 /nfs/dbraw/zinc/39/38/13/204393813.db2.gz MFZGPDJNBQNNKU-OAHLLOKOSA-N 0 1 378.432 3.051 10 0 GGAEMN CN1CCN(c2ccc(C(F)(F)F)cc2NC(=O)COc2ccccc2)CC1 ZINC000012548929 204421326 /nfs/dbraw/zinc/42/13/26/204421326.db2.gz OIWYEBJXZDTKME-UHFFFAOYSA-N 0 1 393.409 3.475 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccccc2Sc2nncn2C)c(C)s1 ZINC000012774360 204446524 /nfs/dbraw/zinc/44/65/24/204446524.db2.gz MDAHIAGSGNNANT-UHFFFAOYSA-N 0 1 380.520 3.445 10 0 GGAEMN Cc1cc(N2CCCC2)nc(N2CCN(C(=O)CCC3CCCCC3)CC2)n1 ZINC000017012168 204604249 /nfs/dbraw/zinc/60/42/49/204604249.db2.gz FCKCSUXOZIMKFI-UHFFFAOYSA-N 0 1 385.556 3.394 10 0 GGAEMN Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)N[C@@H]1CCc2ccccc21 ZINC000024989764 204827579 /nfs/dbraw/zinc/82/75/79/204827579.db2.gz SBIGSAUMIMWTDR-HXUWFJFHSA-N 0 1 379.435 3.349 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cc(-c3noc(C)n3)ccc2C)c(OC)c1 ZINC000033086376 204945003 /nfs/dbraw/zinc/94/50/03/204945003.db2.gz PGGYRLADVCDNFH-UHFFFAOYSA-N 0 1 389.433 3.171 10 0 GGAEMN COCCCN(Cc1ccc(F)cc1F)C[C@H](O)COCc1ccccc1 ZINC000036099705 205004759 /nfs/dbraw/zinc/00/47/59/205004759.db2.gz HDJVYNBBLVPTMZ-FQEVSTJZSA-N 0 1 379.447 3.381 10 0 GGAEMN COc1ccc(CN(Cc2ccc3c(c2)OCO3)C[C@H](O)COC(C)C)cc1 ZINC000036102312 205006413 /nfs/dbraw/zinc/00/64/13/205006413.db2.gz ZTCMMKBWPQEFIS-IBGZPJMESA-N 0 1 387.476 3.212 10 0 GGAEMN CCOC[C@H](O)CN(Cc1cccc(F)c1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036145912 205007260 /nfs/dbraw/zinc/00/72/60/205007260.db2.gz KEHZNWMPRRYIFK-RTWAWAEBSA-N 0 1 386.467 3.218 10 0 GGAEMN CCC[C@H](O)CN[C@@H](c1nc(-c2cc(OC)c(OC)c(OC)c2)no1)C(C)C ZINC000036160516 205007561 /nfs/dbraw/zinc/00/75/61/205007561.db2.gz KCWMBFSWRQOPTD-WMLDXEAASA-N 0 1 393.484 3.210 10 0 GGAEMN COC[C@@H](O)CN(Cc1ccccc1)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000036146543 205008145 /nfs/dbraw/zinc/00/81/45/205008145.db2.gz ZJVZTHUDMZHKBW-PMACEKPBSA-N 0 1 388.895 3.343 10 0 GGAEMN CCc1nc(C)nc(N2CCN(CC(C)(C)O)CC2)c1Cc1cccc(C)c1 ZINC000036316577 205010316 /nfs/dbraw/zinc/01/03/16/205010316.db2.gz UOWJJHJSEWYFKX-UHFFFAOYSA-N 0 1 382.552 3.140 10 0 GGAEMN CC[C@H](O)CN1CCN(c2nc(C)nc(C)c2Cc2ccc(Cl)cc2)CC1 ZINC000036340266 205010495 /nfs/dbraw/zinc/01/04/95/205010495.db2.gz AUJMHOZXTMEVJU-IBGZPJMESA-N 0 1 388.943 3.231 10 0 GGAEMN CCc1nc(C)nc(N2CCN(C[C@H](C)O)CC2)c1Cc1ccc(Cl)cc1 ZINC000036340748 205011258 /nfs/dbraw/zinc/01/12/58/205011258.db2.gz GPXZYGDZMGJVHB-HNNXBMFYSA-N 0 1 388.943 3.094 10 0 GGAEMN CCCC[C@H](O)CN1CCN(c2nc(C)nc(C)c2Cc2ccccc2)CC1 ZINC000036340445 205011287 /nfs/dbraw/zinc/01/12/87/205011287.db2.gz QORZXCBRLUVTSH-NRFANRHFSA-N 0 1 382.552 3.357 10 0 GGAEMN CC[C@@H](O)CN1CCN(c2nc(C)nc(C)c2Cc2ccc(Cl)cc2)CC1 ZINC000036340267 205011408 /nfs/dbraw/zinc/01/14/08/205011408.db2.gz AUJMHOZXTMEVJU-LJQANCHMSA-N 0 1 388.943 3.231 10 0 GGAEMN Cc1ccc(CN(CCC(=O)N2CCNCC2)C(=O)c2cc(C)cc(C)c2)cc1 ZINC000035421533 204988954 /nfs/dbraw/zinc/98/89/54/204988954.db2.gz RWTYXMSLBYFFKL-UHFFFAOYSA-N 0 1 393.531 3.076 10 0 GGAEMN CC(=O)Nc1ccc(N2CCC([N@H+](C)CCCOC(C)C)CC2)c(C(=O)[O-])c1 ZINC000035450862 204989289 /nfs/dbraw/zinc/98/92/89/204989289.db2.gz WSABGOMPASLTNR-UHFFFAOYSA-N 0 1 391.512 3.059 10 0 GGAEMN COc1cc2c(cc1OC)CN(C(=O)CN(Cc1ccccc1)C(C)C)CC2 ZINC000037123795 205021221 /nfs/dbraw/zinc/02/12/21/205021221.db2.gz XCFDYZRUWBRFIN-UHFFFAOYSA-N 0 1 382.504 3.499 10 0 GGAEMN Cc1ccc(-c2nc3c(c(OCC(=O)[O-])n2)C[N@H+](Cc2ccccc2)CC3)cc1 ZINC000073696450 205031733 /nfs/dbraw/zinc/03/17/33/205031733.db2.gz LTLYNJINSQDNHP-UHFFFAOYSA-N 0 1 389.455 3.474 10 0 GGAEMN Cc1ccc(-c2nc3c(c(OCC(=O)[O-])n2)C[N@@H+](Cc2ccccc2)CC3)cc1 ZINC000073696450 205031737 /nfs/dbraw/zinc/03/17/37/205031737.db2.gz LTLYNJINSQDNHP-UHFFFAOYSA-N 0 1 389.455 3.474 10 0 GGAEMN CCOC(=O)Nc1cccc(C(=O)NC[C@H](c2cccc(OC)c2)N(C)C)c1 ZINC000040012804 205045562 /nfs/dbraw/zinc/04/55/62/205045562.db2.gz CYNUEWABORENGV-LJQANCHMSA-N 0 1 385.464 3.296 10 0 GGAEMN CCOC(=O)Nc1cccc(C(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)c1 ZINC000040012803 205045977 /nfs/dbraw/zinc/04/59/77/205045977.db2.gz CYNUEWABORENGV-IBGZPJMESA-N 0 1 385.464 3.296 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@]3(C)CC3(Cl)Cl)cc2)C[C@@H](C)O1 ZINC000040087466 205051469 /nfs/dbraw/zinc/05/14/69/205051469.db2.gz XWCNEOOMLOPCRM-LBTNJELSSA-N 0 1 385.335 3.496 10 0 GGAEMN Cn1c(Cl)c(Cl)cc1C(=O)NCc1ccccc1CN1CCN(C)CC1 ZINC000040121253 205055532 /nfs/dbraw/zinc/05/55/32/205055532.db2.gz CZSWNZVEGBYNKR-UHFFFAOYSA-N 0 1 395.334 3.009 10 0 GGAEMN Cc1ccc(NC(=O)[C@H](C)NC(=O)c2cccs2)c(-c2nnc(C3CC3)[nH]2)c1 ZINC000040150981 205058123 /nfs/dbraw/zinc/05/81/23/205058123.db2.gz RZZNWIVFVMXUQJ-LBPRGKRZSA-N 0 1 395.488 3.476 10 0 GGAEMN O=C(NCCN1CCCCC1)c1csc(NC(=O)c2cccc(Cl)c2)n1 ZINC000040355231 205062234 /nfs/dbraw/zinc/06/22/34/205062234.db2.gz FSRBLDHHYGJPFB-UHFFFAOYSA-N 0 1 392.912 3.265 10 0 GGAEMN C[C@H](CNC(=O)CCNC(=O)c1ccc(Cl)cc1)N1CCc2ccccc2C1 ZINC000045464651 205097251 /nfs/dbraw/zinc/09/72/51/205097251.db2.gz ROHDIEJKHBYRET-MRXNPFEDSA-N 0 1 399.922 3.023 10 0 GGAEMN Cn1cnnc1-c1ccccc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1 ZINC000047992069 205113098 /nfs/dbraw/zinc/11/30/98/205113098.db2.gz UZRKKSGSUVVAPS-UHFFFAOYSA-N 0 1 382.367 3.302 10 0 GGAEMN Cc1ccc(O)c(S(=O)(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)c1 ZINC000048231933 205115086 /nfs/dbraw/zinc/11/50/86/205115086.db2.gz ZUKYFTOEAYZCIT-UHFFFAOYSA-N 0 1 398.488 3.486 10 0 GGAEMN CN1CCC[C@@H]1CNC(=O)c1cc(-c2ccccc2)c(N2CCOCC2)s1 ZINC000048286302 205116436 /nfs/dbraw/zinc/11/64/36/205116436.db2.gz QRFVIWMKIYMTIK-QGZVFWFLSA-N 0 1 385.533 3.076 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N[C@@H]1CCSc2ccc(Cl)cc21 ZINC000048256521 205116466 /nfs/dbraw/zinc/11/64/66/205116466.db2.gz PJBLAFQXDJKFFZ-MRXNPFEDSA-N 0 1 383.945 3.289 10 0 GGAEMN O=C(CCc1cccc(Cl)c1Cl)N1CCC(CN2CCOCC2)CC1 ZINC000048313325 205119911 /nfs/dbraw/zinc/11/99/11/205119911.db2.gz KEOQFVCLXISPIQ-UHFFFAOYSA-N 0 1 385.335 3.497 10 0 GGAEMN O=C(NC1CCCCCC1)[C@@H]1CCCN(C(=O)c2cc(-c3ccncc3)[nH]n2)C1 ZINC000046017282 205101989 /nfs/dbraw/zinc/10/19/89/205101989.db2.gz HKIFZBXZKVPRIJ-QGZVFWFLSA-N 0 1 395.507 3.163 10 0 GGAEMN O=C(CN1CCC[C@@H]1Cc1cccc(F)c1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000052035651 205132883 /nfs/dbraw/zinc/13/28/83/205132883.db2.gz COYOGQYZBOFXBL-NZQKXSOJSA-N 0 1 395.522 3.475 10 0 GGAEMN COc1ccc(N[C@H]2CCCN(Cc3cnc(N(C)C)s3)C2)cc1OC ZINC000055284154 205148016 /nfs/dbraw/zinc/14/80/16/205148016.db2.gz UELSTDUSEUNGLW-HNNXBMFYSA-N 0 1 376.526 3.303 10 0 GGAEMN CCOC(=O)[C@H]1C[C@@H]2CCCN2[C@@]12c1ccccc1N(Cc1ccccc1)C2=O ZINC000058090320 205164070 /nfs/dbraw/zinc/16/40/70/205164070.db2.gz JSPQCGNBGKHZMJ-NRYAXDJKSA-N 0 1 390.483 3.476 10 0 GGAEMN Cc1ccc(SCCNC(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)cc1C ZINC000058145733 205164745 /nfs/dbraw/zinc/16/47/45/205164745.db2.gz CRXWUZNJWFVFSE-ROUUACIJSA-N 0 1 379.570 3.194 10 0 GGAEMN CCOC(=O)[C@H]1C[C@H]2CCCN2[C@@]12c1ccccc1N(Cc1ccccc1)C2=O ZINC000058090329 205164878 /nfs/dbraw/zinc/16/48/78/205164878.db2.gz JSPQCGNBGKHZMJ-FPGHNAPASA-N 0 1 390.483 3.476 10 0 GGAEMN COc1ccc(CNCC(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)cc1 ZINC000058170533 205167139 /nfs/dbraw/zinc/16/71/39/205167139.db2.gz HEWYOGWPHRAWJI-UHFFFAOYSA-N 0 1 395.484 3.251 10 0 GGAEMN CCCCn1nc(C(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)ccc1=O ZINC000058297946 205171833 /nfs/dbraw/zinc/17/18/33/205171833.db2.gz KPVARNPPAUEKEC-GOSISDBHSA-N 0 1 379.464 3.205 10 0 GGAEMN CC(C)n1ncc2cc(C(=O)N3CCC(c4n[nH]c(C5CC5)n4)CC3)cnc21 ZINC000058378432 205173135 /nfs/dbraw/zinc/17/31/35/205173135.db2.gz HCVZNTRLAITOFK-UHFFFAOYSA-N 0 1 379.468 3.028 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)Nc1ccc(-n2cncn2)cc1C(F)(F)F ZINC000058391158 205173947 /nfs/dbraw/zinc/17/39/47/205173947.db2.gz MRTSQNKZIRAMLA-UHFFFAOYSA-N 0 1 393.373 3.072 10 0 GGAEMN Cc1ccc(Cc2nc(CCNS(=O)(=O)c3ccc(C(C)C)cc3)n[nH]2)cc1 ZINC000064969650 205202919 /nfs/dbraw/zinc/20/29/19/205202919.db2.gz QBIDTYMHPZJWDT-UHFFFAOYSA-N 0 1 398.532 3.348 10 0 GGAEMN O=C(NCCc1nnc(-c2ccc(F)cc2)[nH]1)c1ccccc1Br ZINC000064969320 205203177 /nfs/dbraw/zinc/20/31/77/205203177.db2.gz ABNVZOUNIFVFOR-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN COc1cc(-c2cc(C)no2)ccc1S(=O)(=O)Nc1ccc2c(c1)OCO2 ZINC000064979466 205204485 /nfs/dbraw/zinc/20/44/85/205204485.db2.gz RRRMKOXTXFGZDN-UHFFFAOYSA-N 0 1 388.401 3.188 10 0 GGAEMN C[N@H+]1CCCN(c2ccc(NC(=O)c3cccc(Cl)c3)c(C(=O)[O-])c2)CC1 ZINC000064589118 205192110 /nfs/dbraw/zinc/19/21/10/205192110.db2.gz CBKBNPKWIIWGNV-UHFFFAOYSA-N 0 1 387.867 3.432 10 0 GGAEMN COC(=O)c1cccc(NS(=O)(=O)c2cn(CC(C)C)c3ncccc23)c1 ZINC000064759974 205193630 /nfs/dbraw/zinc/19/36/30/205193630.db2.gz CFDMRJIDPOTDMJ-UHFFFAOYSA-N 0 1 387.461 3.280 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2cc3n(c2)CCN(CC(C)C)C3=O)cc1C ZINC000065254815 205223149 /nfs/dbraw/zinc/22/31/49/205223149.db2.gz ITZYBCZOBJXQCZ-UHFFFAOYSA-N 0 1 375.494 3.018 10 0 GGAEMN Cc1cccc(NS(=O)(=O)c2cc3n(c2)CCN(CC(C)C)C3=O)c1C ZINC000065254809 205223207 /nfs/dbraw/zinc/22/32/07/205223207.db2.gz PCHFZPFALPHKKT-UHFFFAOYSA-N 0 1 375.494 3.018 10 0 GGAEMN Cc1cc(C)cc(NS(=O)(=O)c2cc3n(c2)CCN(CC(C)C)C3=O)c1 ZINC000065254800 205223350 /nfs/dbraw/zinc/22/33/50/205223350.db2.gz VQTWJEPTGZSIBU-UHFFFAOYSA-N 0 1 375.494 3.018 10 0 GGAEMN COc1ccc(NC(=O)N2CCc3nc[nH]c3[C@@H]2c2ccccn2)cc1OC ZINC000065307096 205228724 /nfs/dbraw/zinc/22/87/24/205228724.db2.gz ZKOVDGPGWLMZOL-IBGZPJMESA-N 0 1 379.420 3.002 10 0 GGAEMN COc1ccc(NC(=O)N2CCc3nc[nH]c3[C@H]2c2ccccn2)cc1OC ZINC000065307097 205229480 /nfs/dbraw/zinc/22/94/80/205229480.db2.gz ZKOVDGPGWLMZOL-LJQANCHMSA-N 0 1 379.420 3.002 10 0 GGAEMN Cc1cc(Br)c(O)c(C(=O)NC[C@@H]2COc3ccccc3C2)c1 ZINC000065521283 205236742 /nfs/dbraw/zinc/23/67/42/205236742.db2.gz KGNOHAZGAGDBSK-GFCCVEGCSA-N 0 1 376.250 3.444 10 0 GGAEMN CCc1noc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2cccc(F)c2)n1 ZINC000065194561 205217321 /nfs/dbraw/zinc/21/73/21/205217321.db2.gz ITRWAJYAESFPFR-UHFFFAOYSA-N 0 1 378.429 3.194 10 0 GGAEMN Cc1nnc(-c2c(C)c(S(=O)(=O)Nc3ccc(Cl)cc3)c(C)n2C)o1 ZINC000065186486 205217704 /nfs/dbraw/zinc/21/77/04/205217704.db2.gz HTUWDYGIONJQJF-UHFFFAOYSA-N 0 1 380.857 3.455 10 0 GGAEMN CCc1n[nH]c2c1CN(Cc1ccc(C(=O)Nc3c(C)noc3C)cc1)CC2 ZINC000067513982 205248989 /nfs/dbraw/zinc/24/89/89/205248989.db2.gz GZNYMBAYFUVLAO-UHFFFAOYSA-N 0 1 379.464 3.388 10 0 GGAEMN CC1=NO[C@H](C(=O)NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)C1 ZINC000067855467 205264307 /nfs/dbraw/zinc/26/43/07/205264307.db2.gz XRDFYNZTDIXKLH-INIZCTEOSA-N 0 1 379.395 3.059 10 0 GGAEMN Cc1nc[nH]c1C(=O)NCc1nc(-c2cccc(F)c2)c(-c2ccccn2)[nH]1 ZINC000067920698 205267584 /nfs/dbraw/zinc/26/75/84/205267584.db2.gz ALFSHXXBMMVLFI-UHFFFAOYSA-N 0 1 376.395 3.239 10 0 GGAEMN Cc1c(CN2CCN(c3cn[nH]c(=O)c3)CC2)c2ccccc2n1CC(C)C ZINC000067447155 205247795 /nfs/dbraw/zinc/24/77/95/205247795.db2.gz GELTUFJBCVZMTP-UHFFFAOYSA-N 0 1 379.508 3.424 10 0 GGAEMN Cc1nn(Cc2ccccc2)c(C)c1CN(C)C[C@@H](O)COc1ccccc1 ZINC000072182766 205316912 /nfs/dbraw/zinc/31/69/12/205316912.db2.gz WITPFRNFEGTONT-OAQYLSRUSA-N 0 1 379.504 3.420 10 0 GGAEMN COc1cc2c(cc1OC)C(=O)[C@H]([C@H](O)C1=CCN(Cc3ccccc3)CC1)C2 ZINC000095080113 205437830 /nfs/dbraw/zinc/43/78/30/205437830.db2.gz CCNWYZVPJNRXDT-NZQKXSOJSA-N 0 1 393.483 3.252 10 0 GGAEMN CCO[C@@H]1C[C@H](N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)C12CCC2 ZINC000096009197 205515101 /nfs/dbraw/zinc/51/51/01/205515101.db2.gz YMCHAQPYLNQVNX-RBUKOAKNSA-N 0 1 376.928 3.374 10 0 GGAEMN Cc1cccc(NC(=O)C2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)CC2)c1 ZINC000096324711 205559994 /nfs/dbraw/zinc/55/99/94/205559994.db2.gz HXCMKFRVZUCZDZ-UHFFFAOYSA-N 0 1 389.459 3.271 10 0 GGAEMN Cn1c(=O)c2ccc(C(=O)N[C@H]3CCCC[C@H]3C(F)(F)F)cc2[nH]c1=S ZINC000102832508 205636068 /nfs/dbraw/zinc/63/60/68/205636068.db2.gz CYXUEIIIUCEKFZ-NEPJUHHUSA-N 0 1 385.411 3.073 10 0 GGAEMN O=C(CN1CCC[C@@H](c2nc[nH]n2)C1)Nc1ccccc1Oc1ccccc1 ZINC000225451756 206050067 /nfs/dbraw/zinc/05/00/67/206050067.db2.gz JRFXNPXVSQPSTP-MRXNPFEDSA-N 0 1 377.448 3.415 10 0 GGAEMN O=C(CN[C@]1(CO)CCCc2ccccc21)NC1CCC(C(F)(F)F)CC1 ZINC000225648509 206064635 /nfs/dbraw/zinc/06/46/35/206064635.db2.gz KQOBROVMFSKHPL-RJYAGPCLSA-N 0 1 384.442 3.037 10 0 GGAEMN CC(C)c1ccc(NS(=O)(=O)c2cc3c(cc2Cl)n(C)c(=O)n3C)cc1 ZINC000064976653 206105280 /nfs/dbraw/zinc/10/52/80/206105280.db2.gz UOEMGLBFEIZQMU-UHFFFAOYSA-N 0 1 393.896 3.455 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cc(-c2ccc(F)cc2)on1 ZINC000064969244 206105440 /nfs/dbraw/zinc/10/54/40/206105440.db2.gz YBIITZDZQVNYJW-UHFFFAOYSA-N 0 1 377.379 3.238 10 0 GGAEMN C[C@H](NC(=O)CSc1nc(-c2cccs2)n[nH]1)c1ccc2c(c1)OCO2 ZINC000007984873 221018866 /nfs/dbraw/zinc/01/88/66/221018866.db2.gz RMJHSLSAAZORKQ-JTQLQIEISA-N 0 1 388.474 3.231 10 0 GGAEMN CCOC(=O)CC1(S(=O)(=O)c2ccc(F)cc2)CCN(CCC(C)C)CC1 ZINC000011814534 221126182 /nfs/dbraw/zinc/12/61/82/221126182.db2.gz ARFQCISGVLNWIY-UHFFFAOYSA-N 0 1 399.528 3.433 10 0 GGAEMN O=C([O-])c1cc(N2CC[NH+](Cc3ccccc3F)CC2)ccc1NC(=O)C1CC1 ZINC000064590158 136157224 /nfs/dbraw/zinc/15/72/24/136157224.db2.gz PGBCFXJDDBZBQX-UHFFFAOYSA-N 0 1 397.450 3.195 10 0 GGAEMN COc1cccc(CN2CC=C(C(=O)N3CCN(c4ccccc4)CC3)CC2)c1 ZINC000064818002 136157846 /nfs/dbraw/zinc/15/78/46/136157846.db2.gz VBFBIIGVYQYHBC-UHFFFAOYSA-N 0 1 391.515 3.176 10 0 GGAEMN O=C(Nc1ccc(N2CCOCC2)cc1)C1=CCN(Cc2ccc(F)cc2)CC1 ZINC000064818057 136157855 /nfs/dbraw/zinc/15/78/55/136157855.db2.gz ZGRZSCLOHYFJIH-UHFFFAOYSA-N 0 1 395.478 3.433 10 0 GGAEMN Cc1ccc(Cl)cc1N1CCN(C(=O)c2cc(-c3ccncc3)[nH]n2)CC1 ZINC000085690390 136175406 /nfs/dbraw/zinc/17/54/06/136175406.db2.gz KELDOOPBYDVRRA-UHFFFAOYSA-N 0 1 381.867 3.396 10 0 GGAEMN COCCN1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc32)C[C@H]1C ZINC000096006381 136183292 /nfs/dbraw/zinc/18/32/92/136183292.db2.gz IYEJEZVNFQYLQP-QGZVFWFLSA-N 0 1 392.503 3.462 10 0 GGAEMN C=CCN1C(=O)NC(=O)/C(=C\c2ccccc2OCc2ccc(F)cc2)C1=O ZINC000001064371 518839938 /nfs/dbraw/zinc/83/99/38/518839938.db2.gz CMOYQMRWMAWJPS-SFQUDFHCSA-N 0 1 380.375 3.053 10 0 GGAEMN Cc1ccc2c(=O)c(C(=O)NC[C@@H](O)c3ccc(Cl)cc3Cl)c[n-]c2[nH+]1 ZINC000303441652 534399345 /nfs/dbraw/zinc/39/93/45/534399345.db2.gz FWAQKDPMFCEDFF-OAHLLOKOSA-N 0 1 392.242 3.414 10 0 GGAEMN CCOC(=O)C1C(CNCc2ccc(Cl)cc2)=NC(=O)N[C@@H]1c1ccccc1 ZINC000058056271 520520254 /nfs/dbraw/zinc/52/02/54/520520254.db2.gz LSIRHLISMIBJTB-LJQANCHMSA-N 0 1 399.878 3.301 10 0 GGAEMN COCc1cc(Cl)nc(NCCCN2CCN(c3ccc(F)cc3)CC2)n1 ZINC000057343626 522927994 /nfs/dbraw/zinc/92/79/94/522927994.db2.gz LKMOYBJRNWFMJR-UHFFFAOYSA-N 0 1 393.894 3.040 10 0 GGAEMN COc1ccc(NC(=O)CSc2n[nH]c(CC3CCCC3)n2)c(OC)c1 ZINC000011500372 524508342 /nfs/dbraw/zinc/50/83/42/524508342.db2.gz RQTKJZTWDKPKSU-UHFFFAOYSA-N 0 1 376.482 3.285 10 0 GGAEMN COc1ccc(NC(=O)CSc2nc(CC3CCCC3)n[nH]2)c(OC)c1 ZINC000011500372 524508345 /nfs/dbraw/zinc/50/83/45/524508345.db2.gz RQTKJZTWDKPKSU-UHFFFAOYSA-N 0 1 376.482 3.285 10 0 GGAEMN CC(C)c1cc(C(=O)N2Cc3cccc(N4CCN(C)CC4)c3C2)c(O)cc1O ZINC000058582736 535359642 /nfs/dbraw/zinc/35/96/42/535359642.db2.gz BHIGZZZLNMKWKD-UHFFFAOYSA-N 0 1 395.503 3.129 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)/C=C\c2cc(C(=O)OC)c(C)o2)CC1 ZINC000096926407 535753707 /nfs/dbraw/zinc/75/37/07/535753707.db2.gz RDVOPGMMEQDNJM-KTKRTIGZSA-N 0 1 397.475 3.168 10 0 GGAEMN C[C@H](CCNCc1cc(Cl)ccc1I)[S@](C)=O ZINC000405280402 565585790 /nfs/dbraw/zinc/58/57/90/565585790.db2.gz BCJXVCAORBXWBC-XLFHBGCDSA-N 0 1 385.698 3.191 10 0 GGAEMN O=S(=O)(NCCCCF)c1scc(Br)c1Br ZINC000462114844 567774438 /nfs/dbraw/zinc/77/44/38/567774438.db2.gz YHBPEGWMRVUUNY-UHFFFAOYSA-N 0 1 395.113 3.301 10 0 GGAEMN COC(=O)c1sccc1S(=O)(=O)Nc1ccc(N2CCCCC2)cc1 ZINC000001034288 564181972 /nfs/dbraw/zinc/18/19/72/564181972.db2.gz NMIQDSOJIVJVGY-UHFFFAOYSA-N 0 1 380.491 3.326 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1cc(Cl)c(Cl)n1C ZINC000116252359 564206393 /nfs/dbraw/zinc/20/63/93/564206393.db2.gz WWQPIQWWVDLGQW-WFASDCNBSA-N 0 1 381.307 3.367 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccc(Br)cc1 ZINC000116248239 564206489 /nfs/dbraw/zinc/20/64/89/564206489.db2.gz NRHDLDSVOUUIAY-KSSFIOAISA-N 0 1 388.309 3.485 10 0 GGAEMN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CC[C@@H](c2cnn(C)c2)C1 ZINC000116316660 564207200 /nfs/dbraw/zinc/20/72/00/564207200.db2.gz ZKVBMENTOXZUCP-CQSZACIVSA-N 0 1 381.307 3.175 10 0 GGAEMN COc1ccc(CN2CC[C@@H](c3cnn(C)c3)C2)c(Br)c1OC ZINC000116318937 564207318 /nfs/dbraw/zinc/20/73/18/564207318.db2.gz FAKRFEOHYLBPMK-GFCCVEGCSA-N 0 1 380.286 3.189 10 0 GGAEMN Cc1cc(NC(=O)[C@H](C)N2CC[C@H](c3cnn(C)c3)C2)ccc1Br ZINC000116314336 564207389 /nfs/dbraw/zinc/20/73/89/564207389.db2.gz HPHNWMOYNKRFCQ-KBPBESRZSA-N 0 1 391.313 3.308 10 0 GGAEMN Cn1cc([C@@H]2CCN(Cc3nnc(-c4ccccc4Br)o3)C2)cn1 ZINC000116320036 564207784 /nfs/dbraw/zinc/20/77/84/564207784.db2.gz ZQVLHHUZVQSJEN-GFCCVEGCSA-N 0 1 388.269 3.222 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2ccc(C)cc2Br)CCN1CCOC ZINC000117436053 564227619 /nfs/dbraw/zinc/22/76/19/564227619.db2.gz IRFABFBFIJKRFQ-CQSZACIVSA-N 0 1 384.318 3.332 10 0 GGAEMN COc1cccc(CS(=O)(=O)NC[C@@H](c2cccs2)N2CCCC2)c1 ZINC000117903665 564233445 /nfs/dbraw/zinc/23/34/45/564233445.db2.gz IDNCQWJFFJJQTK-KRWDZBQOSA-N 0 1 380.535 3.013 10 0 GGAEMN COc1cccc(CS(=O)(=O)NC[C@H](c2cccs2)N2CCCC2)c1 ZINC000117903667 564233982 /nfs/dbraw/zinc/23/39/82/564233982.db2.gz IDNCQWJFFJJQTK-QGZVFWFLSA-N 0 1 380.535 3.013 10 0 GGAEMN C[C@H]1CN(Cc2ccc(CNc3ncncc3Br)cc2)C[C@H](C)O1 ZINC000473108064 564239886 /nfs/dbraw/zinc/23/98/86/564239886.db2.gz KETRSTSACOHHFK-KBPBESRZSA-N 0 1 391.313 3.460 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1cc(NC(=O)CSC)ccc1C ZINC000008294919 564248046 /nfs/dbraw/zinc/24/80/46/564248046.db2.gz CAMOGYOTMNDNFU-UHFFFAOYSA-N 0 1 380.491 3.106 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)[nH]n1 ZINC000119304912 564264714 /nfs/dbraw/zinc/26/47/14/564264714.db2.gz DEDVNBLRDXWNAN-STQMWFEESA-N 0 1 386.253 3.315 10 0 GGAEMN CC(=O)Nc1ccc(NS(=O)(=O)c2cccc(Cl)c2Cl)cc1O ZINC000012536197 564268093 /nfs/dbraw/zinc/26/80/93/564268093.db2.gz JDCRWYIKIFZMFT-UHFFFAOYSA-N 0 1 375.233 3.458 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)[nH]n1 ZINC000119390030 564269135 /nfs/dbraw/zinc/26/91/35/564269135.db2.gz YWXDGIVHQUYPHE-OLZOCXBDSA-N 0 1 386.253 3.315 10 0 GGAEMN CCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1cc(Br)ccc1F ZINC000013750392 564278471 /nfs/dbraw/zinc/27/84/71/564278471.db2.gz KODBONYZOQBXOT-CYBMUJFWSA-N 0 1 381.205 3.032 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)C[C@@H](C)c2ccc(Br)cc2)n[nH]1 ZINC000541904547 564294761 /nfs/dbraw/zinc/29/47/61/564294761.db2.gz POKIBLKOPOPLSL-SNVBAGLBSA-N 0 1 380.242 3.481 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)C[C@H](C)c2ccc(Br)cc2)n[nH]1 ZINC000541904546 564294935 /nfs/dbraw/zinc/29/49/35/564294935.db2.gz POKIBLKOPOPLSL-JTQLQIEISA-N 0 1 380.242 3.481 10 0 GGAEMN OCCCOC1CCN(Cc2cc(Br)cc3cccnc32)CC1 ZINC000119976184 564297820 /nfs/dbraw/zinc/29/78/20/564297820.db2.gz WHUMSKLMYNAKND-UHFFFAOYSA-N 0 1 379.298 3.361 10 0 GGAEMN O=C(CSc1cccc(C(F)(F)F)c1)NCCCCN1CCOCC1 ZINC000120163159 564306856 /nfs/dbraw/zinc/30/68/56/564306856.db2.gz XRFYDUZSXGTFSJ-UHFFFAOYSA-N 0 1 376.444 3.026 10 0 GGAEMN Cc1cn2c(nc(C)c(S(=O)(=O)Nc3ccc(C)c(Cl)c3)c2=O)s1 ZINC000020921810 564307404 /nfs/dbraw/zinc/30/74/04/564307404.db2.gz MMJXEIRVDMRUCA-UHFFFAOYSA-N 0 1 383.882 3.135 10 0 GGAEMN Cc1cn2c(nc(C)c(S(=O)(=O)Nc3ccc(C)cc3Cl)c2=O)s1 ZINC000020921759 564307798 /nfs/dbraw/zinc/30/77/98/564307798.db2.gz CPFARIORHIELQX-UHFFFAOYSA-N 0 1 383.882 3.135 10 0 GGAEMN COc1cc(Br)cc(CNCc2ccc3c(c2)OCO3)c1OC ZINC000020933767 564308166 /nfs/dbraw/zinc/30/81/66/564308166.db2.gz NCSMAXPIJUGYNQ-UHFFFAOYSA-N 0 1 380.238 3.485 10 0 GGAEMN CC(C)CCNC(=O)c1cncc(NS(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000021639047 564311784 /nfs/dbraw/zinc/31/17/84/564311784.db2.gz WQZOWEHYWUKQJB-UHFFFAOYSA-N 0 1 381.885 3.312 10 0 GGAEMN CCN(CC1CC1)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120507578 564323458 /nfs/dbraw/zinc/32/34/58/564323458.db2.gz RPIOVTHXMYITIV-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CCN(CC1CC1)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120507578 564323460 /nfs/dbraw/zinc/32/34/60/564323460.db2.gz RPIOVTHXMYITIV-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CC[C@H](C)CN(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120523246 564323938 /nfs/dbraw/zinc/32/39/38/564323938.db2.gz WIAOOLDELRZNNK-NSHDSACASA-N 0 1 380.290 3.422 10 0 GGAEMN CC[C@H](C)CN(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120523246 564323942 /nfs/dbraw/zinc/32/39/42/564323942.db2.gz WIAOOLDELRZNNK-NSHDSACASA-N 0 1 380.290 3.422 10 0 GGAEMN C[C@@H]1CCCCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120515953 564323981 /nfs/dbraw/zinc/32/39/81/564323981.db2.gz IOQXWCBBMIJNSL-LLVKDONJSA-N 0 1 378.274 3.318 10 0 GGAEMN C[C@@H]1CCCCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120515953 564323983 /nfs/dbraw/zinc/32/39/83/564323983.db2.gz IOQXWCBBMIJNSL-LLVKDONJSA-N 0 1 378.274 3.318 10 0 GGAEMN CN(Cc1ccco1)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120527122 564324104 /nfs/dbraw/zinc/32/41/04/564324104.db2.gz HYYAJCVYUHGEQP-UHFFFAOYSA-N 0 1 390.241 3.169 10 0 GGAEMN CN(Cc1ccco1)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120527122 564324105 /nfs/dbraw/zinc/32/41/05/564324105.db2.gz HYYAJCVYUHGEQP-UHFFFAOYSA-N 0 1 390.241 3.169 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H](C)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000023762103 564326222 /nfs/dbraw/zinc/32/62/22/564326222.db2.gz KNEJGHPVULRKOI-MRVPVSSYSA-N 0 1 381.458 3.262 10 0 GGAEMN CCCCN1C(=O)N=NC1S[C@@H](C)C(=O)N1CCSc2ccccc21 ZINC000024302300 564329457 /nfs/dbraw/zinc/32/94/57/564329457.db2.gz ZKIGYMSPPSLRHA-LBPRGKRZSA-N 0 1 378.523 3.403 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)c(Cl)cc1F ZINC000120662296 564331770 /nfs/dbraw/zinc/33/17/70/564331770.db2.gz CATVFCLOHPAEMH-SECBINFHSA-N 0 1 384.816 3.308 10 0 GGAEMN C[C@@H](O)CN1CCN(C(=O)CCCc2cc(Cl)sc2Cl)C[C@@H]1C ZINC000120678636 564332509 /nfs/dbraw/zinc/33/25/09/564332509.db2.gz XMAFGBWJJPYREM-NWDGAFQWSA-N 0 1 379.353 3.291 10 0 GGAEMN CCS(=O)(=O)c1ccc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)cc1 ZINC000120698676 564334012 /nfs/dbraw/zinc/33/40/12/564334012.db2.gz JQRVPBPXEICWDB-UHFFFAOYSA-N 0 1 391.873 3.382 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2cc(Br)cn2C)CC1 ZINC000120750400 564335551 /nfs/dbraw/zinc/33/55/51/564335551.db2.gz QQDBMHZESGAPPI-UHFFFAOYSA-N 0 1 391.313 3.182 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(Cn3cncn3)cc2)c(Cl)cc1F ZINC000120826322 564339030 /nfs/dbraw/zinc/33/90/30/564339030.db2.gz DTIHRXCCXQYRSB-UHFFFAOYSA-N 0 1 380.832 3.228 10 0 GGAEMN COc1cc(NC(=O)C2CC2)ccc1S(=O)(=O)Nc1cccc(Cl)c1 ZINC000120843926 564340103 /nfs/dbraw/zinc/34/01/03/564340103.db2.gz WPLNORIKGWJDIA-UHFFFAOYSA-N 0 1 380.853 3.498 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccccc2CS(C)(=O)=O)c(Cl)cc1F ZINC000121126574 564353870 /nfs/dbraw/zinc/35/38/70/564353870.db2.gz XQGLXQCYKUSXDF-UHFFFAOYSA-N 0 1 391.873 3.133 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000028013369 564358791 /nfs/dbraw/zinc/35/87/91/564358791.db2.gz VYSGYBKWBMMFSF-HIFRSBDPSA-N 0 1 389.323 3.234 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)CCCc3cc(Cl)sc3Cl)CCO2)n[nH]1 ZINC000121307249 564363642 /nfs/dbraw/zinc/36/36/42/564363642.db2.gz SRVYARRHMUECBW-NSHDSACASA-N 0 1 389.308 3.404 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)C(=O)Nc2ccc(Br)cc2C(C)C)C1 ZINC000121580503 564375868 /nfs/dbraw/zinc/37/58/68/564375868.db2.gz HMEGRFANIWGXLE-CQSZACIVSA-N 0 1 396.329 3.112 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(C[S@@](C)=O)c2)c(Cl)cc1F ZINC000121601646 564377556 /nfs/dbraw/zinc/37/75/56/564377556.db2.gz YXZVFCLLSWBMPH-QFIPXVFZSA-N 0 1 375.874 3.467 10 0 GGAEMN Brc1cccc(-c2noc(CN3CCCC[C@@H]3c3nnc[nH]3)n2)c1 ZINC000121674900 564380857 /nfs/dbraw/zinc/38/08/57/564380857.db2.gz SLSLQNQDUITZNO-CYBMUJFWSA-N 0 1 389.257 3.344 10 0 GGAEMN Brc1csc(-c2noc(CN3CCCC[C@H]3c3nnc[nH]3)n2)c1 ZINC000121737399 564384218 /nfs/dbraw/zinc/38/42/18/564384218.db2.gz JXDYTMNNHQCXTA-JTQLQIEISA-N 0 1 395.286 3.406 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)NCC1(N2CCSCC2)CCCC1 ZINC000032436241 564400932 /nfs/dbraw/zinc/40/09/32/564400932.db2.gz QTQSPHALHWDESI-UHFFFAOYSA-N 0 1 388.986 3.288 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H](C)Cc2ccc(F)c(Br)c2)n[nH]1 ZINC000122160429 564401921 /nfs/dbraw/zinc/40/19/21/564401921.db2.gz YJYQFEWKRWVSEL-WDEREUQCSA-N 0 1 397.292 3.481 10 0 GGAEMN CC(C)c1n[nH]c(SCc2nnc(C(=O)Nc3ccc(F)cc3)s2)n1 ZINC000032778358 564405326 /nfs/dbraw/zinc/40/53/26/564405326.db2.gz YDMCRPJYTCSJGC-UHFFFAOYSA-N 0 1 378.458 3.463 10 0 GGAEMN CC(C)c1nc(SCc2nnc(C(=O)Nc3ccc(F)cc3)s2)n[nH]1 ZINC000032778358 564405330 /nfs/dbraw/zinc/40/53/30/564405330.db2.gz YDMCRPJYTCSJGC-UHFFFAOYSA-N 0 1 378.458 3.463 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2cncc(Br)c2)CC1 ZINC000036774010 564418606 /nfs/dbraw/zinc/41/86/06/564418606.db2.gz HLDAPFUQRJHBKC-UHFFFAOYSA-N 0 1 389.297 3.238 10 0 GGAEMN O=C(c1ccc(O)c(Cl)c1)N1CCN(c2ccc(Br)cn2)CC1 ZINC000041348402 564431856 /nfs/dbraw/zinc/43/18/56/564431856.db2.gz DEZQVFOYUOKOPO-UHFFFAOYSA-N 0 1 396.672 3.166 10 0 GGAEMN C[C@@H](NC[C@@H]1COCCO1)c1ccc(Br)cc1Br ZINC000041660416 564436008 /nfs/dbraw/zinc/43/60/08/564436008.db2.gz HQVINFRCYIEZJG-MWLCHTKSSA-N 0 1 379.092 3.278 10 0 GGAEMN O=C(NCCCCN1CCOCC1)NC(c1cccs1)c1cccs1 ZINC000123891612 564465475 /nfs/dbraw/zinc/46/54/75/564465475.db2.gz ACBVYMMDPAIAQF-UHFFFAOYSA-N 0 1 379.551 3.311 10 0 GGAEMN C[C@H](NCc1cc(Cl)ccc1OC(F)F)c1ccc(S(N)(=O)=O)cc1 ZINC000124423318 564481417 /nfs/dbraw/zinc/48/14/17/564481417.db2.gz TUUFJNVPUXBGKJ-JTQLQIEISA-N 0 1 390.839 3.440 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)Nc2cccc(-c3nc[nH]n3)c2)c1 ZINC000124559478 564485402 /nfs/dbraw/zinc/48/54/02/564485402.db2.gz WRMLPWJKOIPQIG-UHFFFAOYSA-N 0 1 393.266 3.343 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N(C)Cc2cc(Br)ccc2F)n[nH]1 ZINC000124566467 564485665 /nfs/dbraw/zinc/48/56/65/564485665.db2.gz UDSJMHINQGQSJK-JTQLQIEISA-N 0 1 383.265 3.392 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N(C)CCc2ccc(Br)cc2)n[nH]1 ZINC000124660590 564489709 /nfs/dbraw/zinc/48/97/09/564489709.db2.gz JQOLZGAGFOITCP-GFCCVEGCSA-N 0 1 379.302 3.296 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2CCc3c2cccc3Br)n[nH]1 ZINC000124759557 564491643 /nfs/dbraw/zinc/49/16/43/564491643.db2.gz BFKCPHHKMRBVAB-MGPLVRAMSA-N 0 1 377.286 3.398 10 0 GGAEMN CCOC(=O)C1CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000046345358 564501286 /nfs/dbraw/zinc/50/12/86/564501286.db2.gz UWDKUVPNKOOTDW-CYBMUJFWSA-N 0 1 376.280 3.008 10 0 GGAEMN Cc1ccc(-c2nsc(NC(=O)c3cc(S(C)(=O)=O)cs3)n2)s1 ZINC000125146374 564504992 /nfs/dbraw/zinc/50/49/92/564504992.db2.gz DDXNYDPKWPFWNI-UHFFFAOYSA-N 0 1 385.517 3.292 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)CSCc2cscn2)CC1 ZINC000125306507 564510432 /nfs/dbraw/zinc/51/04/32/564510432.db2.gz PQLMXZJBNDBOSO-UHFFFAOYSA-N 0 1 376.551 3.157 10 0 GGAEMN CC(C)[C@@H](CNC(=O)NCc1ccc(Cl)cc1Cl)N1CCN(C)CC1 ZINC000125325362 564511111 /nfs/dbraw/zinc/51/11/11/564511111.db2.gz UYWHHZRTHLEQLD-QGZVFWFLSA-N 0 1 387.355 3.065 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SCc2nsc(N(C)C)n2)n1 ZINC000125353070 564512244 /nfs/dbraw/zinc/51/22/44/564512244.db2.gz LXVYXUWXHSVFFB-UHFFFAOYSA-N 0 1 382.902 3.344 10 0 GGAEMN O=C(CSc1cc(Cl)ccc1Cl)NCCCCN1CCOCC1 ZINC000048284896 564535738 /nfs/dbraw/zinc/53/57/38/564535738.db2.gz WLXORGSRARWCAN-UHFFFAOYSA-N 0 1 377.337 3.314 10 0 GGAEMN COCCN1CCCN(C(=O)CCCOc2ccc(Cl)cc2Cl)CC1 ZINC000048426866 564539145 /nfs/dbraw/zinc/53/91/45/564539145.db2.gz KCRNTQMOSCZDPT-UHFFFAOYSA-N 0 1 389.323 3.333 10 0 GGAEMN COCCN1CCCN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000048427614 564539352 /nfs/dbraw/zinc/53/93/52/564539352.db2.gz ZWTJTWZYIDRZRF-UHFFFAOYSA-N 0 1 379.913 3.258 10 0 GGAEMN COCCN1CCCN(C(=O)c2csc(-c3cccc(Cl)c3)n2)CC1 ZINC000048425946 564539595 /nfs/dbraw/zinc/53/95/95/564539595.db2.gz DAAKDSXUODMCCW-UHFFFAOYSA-N 0 1 379.913 3.258 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)Nc2cncc(Br)c2)ccc1F ZINC000126285868 564543632 /nfs/dbraw/zinc/54/36/32/564543632.db2.gz ZPJPVQODKUGABY-UHFFFAOYSA-N 0 1 381.249 3.367 10 0 GGAEMN CN(C)C[C@H](NC(=O)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000049379343 564551393 /nfs/dbraw/zinc/55/13/93/564551393.db2.gz NMPHIPHBTRNKDP-INIZCTEOSA-N 0 1 380.275 3.351 10 0 GGAEMN CN(C)C[C@H](NC(=O)C(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000049379589 564551611 /nfs/dbraw/zinc/55/16/11/564551611.db2.gz PXNRPQPWRPCSGQ-HNNXBMFYSA-N 0 1 380.275 3.351 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ccncc2Br)CC1 ZINC000126559396 564553531 /nfs/dbraw/zinc/55/35/31/564553531.db2.gz ARESGVYQOHARRG-UHFFFAOYSA-N 0 1 389.297 3.238 10 0 GGAEMN COC(=O)[C@@H]1CCCCN1C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000050606006 564558933 /nfs/dbraw/zinc/55/89/33/564558933.db2.gz BWTHBGHKOIURJL-LBPRGKRZSA-N 0 1 392.253 3.007 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)N[C@H]1CCN(C2CC2)C1 ZINC000051380792 564564051 /nfs/dbraw/zinc/56/40/51/564564051.db2.gz IKIJISSDNDXRON-ZDUSSCGKSA-N 0 1 387.318 3.174 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@@H](C)c1ccc2ccccc2c1 ZINC000127049155 564571473 /nfs/dbraw/zinc/57/14/73/564571473.db2.gz RULLNHWHNPRFBF-NSHDSACASA-N 0 1 376.459 3.122 10 0 GGAEMN Cc1cc(C(=O)N2[C@H](C)CN(C)C[C@@H]2C)c2cc(Br)ccc2n1 ZINC000127235159 564577942 /nfs/dbraw/zinc/57/79/42/564577942.db2.gz XZLDNAIVYLJBQN-BETUJISGSA-N 0 1 376.298 3.470 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000054815104 564609764 /nfs/dbraw/zinc/60/97/64/564609764.db2.gz ADYORDZKVGXCDD-OAHLLOKOSA-N 0 1 393.285 3.236 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000128539639 564622187 /nfs/dbraw/zinc/62/21/87/564622187.db2.gz XNKZPHWIGFCODB-NSHDSACASA-N 0 1 382.507 3.267 10 0 GGAEMN Cc1cc(Br)ccc1S(=O)(=O)[N-]c1cc(-c2ccncc2)n[nH]1 ZINC000128907413 564633283 /nfs/dbraw/zinc/63/32/83/564633283.db2.gz VZGGKTPZCUYMEL-UHFFFAOYSA-N 0 1 393.266 3.343 10 0 GGAEMN CCc1nc([C@H]2CN(Cc3cc(Cl)ccc3Br)CCO2)n[nH]1 ZINC000129143201 564639857 /nfs/dbraw/zinc/63/98/57/564639857.db2.gz MNFWXXJQLSCBRV-CYBMUJFWSA-N 0 1 385.693 3.357 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(I)cc1)N1CCCSCC1 ZINC000129430020 564648397 /nfs/dbraw/zinc/64/83/97/564648397.db2.gz CBQUEZOTUPFSAQ-LLVKDONJSA-N 0 1 390.290 3.057 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccccc3Br)[nH]c21 ZINC000129971845 564666091 /nfs/dbraw/zinc/66/60/91/564666091.db2.gz QQCKQAGEMXYEPO-UHFFFAOYSA-N 0 1 380.267 3.112 10 0 GGAEMN COc1cc(Br)c(CNC[C@H]2COc3ccccc3O2)cc1OC ZINC000057681582 564671435 /nfs/dbraw/zinc/67/14/35/564671435.db2.gz WSCVVUXKTOSBQR-ZDUSSCGKSA-N 0 1 394.265 3.396 10 0 GGAEMN CC(C)n1cc(Br)cc1C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1 ZINC000130407708 564680125 /nfs/dbraw/zinc/68/01/25/564680125.db2.gz IVYZOKNGVLMEKU-UHFFFAOYSA-N 0 1 390.241 3.059 10 0 GGAEMN C[C@@H](Cc1ccc(Br)cc1)C(=O)Nc1cc(-c2nccn2C)n[nH]1 ZINC000130435522 564680945 /nfs/dbraw/zinc/68/09/45/564680945.db2.gz BATYIEKNLZIUIZ-NSHDSACASA-N 0 1 388.269 3.390 10 0 GGAEMN Cc1cccc2nc(CN[C@@H](C(N)=O)c3ccc(Br)cc3F)[nH]c21 ZINC000130517617 564684943 /nfs/dbraw/zinc/68/49/43/564684943.db2.gz UMNKPRXUINDGEF-MRXNPFEDSA-N 0 1 391.244 3.089 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000058561946 564685302 /nfs/dbraw/zinc/68/53/02/564685302.db2.gz BVJNEXOXPLAZGK-NSHDSACASA-N 0 1 382.860 3.094 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)N2CCC[C@H](C)C2)c2cccs2)CC1 ZINC000058723693 564687667 /nfs/dbraw/zinc/68/76/67/564687667.db2.gz YDJMMRLQHWLCNQ-DLBZAZTESA-N 0 1 385.599 3.087 10 0 GGAEMN CC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cccc(-c3nc[nH]n3)c2)c1 ZINC000130664758 564689216 /nfs/dbraw/zinc/68/92/16/564689216.db2.gz CVCXECZUXYHHIA-UHFFFAOYSA-N 0 1 376.825 3.129 10 0 GGAEMN C[C@H]1CN(CCCNC(=O)CCOc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC000058841098 564690014 /nfs/dbraw/zinc/69/00/14/564690014.db2.gz ZUDHGWQPVOOIHA-KBPBESRZSA-N 0 1 389.323 3.378 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCN(Cc2ccc(Br)cc2)CC1 ZINC000060363121 564697447 /nfs/dbraw/zinc/69/74/47/564697447.db2.gz HTQJVPOFLDZEAN-UHFFFAOYSA-N 0 1 399.292 3.283 10 0 GGAEMN CN1CCN(Cc2ccc(NC(=O)c3coc(Br)c3)cc2)CC1 ZINC000061570196 564706784 /nfs/dbraw/zinc/70/67/84/564706784.db2.gz ADEBICUUIQNPMC-UHFFFAOYSA-N 0 1 378.270 3.042 10 0 GGAEMN CCCN1C(=O)N=NC1SCCC(=O)Nc1ccc(Br)cc1 ZINC000131323862 564708180 /nfs/dbraw/zinc/70/81/80/564708180.db2.gz KXVWCYWXSCSJJX-UHFFFAOYSA-N 0 1 385.287 3.277 10 0 GGAEMN COC(=O)c1cc(C)ccc1S(=O)(=O)Nc1cccc(Br)c1 ZINC000131427407 564711334 /nfs/dbraw/zinc/71/13/34/564711334.db2.gz OUIAPBOIRNHDFJ-UHFFFAOYSA-N 0 1 384.251 3.345 10 0 GGAEMN O=C(c1csc(-c2ccc(Cl)s2)n1)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000132706464 564750802 /nfs/dbraw/zinc/75/08/02/564750802.db2.gz GCHXCOSTOICGBS-QMMMGPOBSA-N 0 1 380.886 3.058 10 0 GGAEMN CN(C)CCN(Cc1cccs1)S(=O)(=O)c1c(F)cccc1Cl ZINC000133016460 564760001 /nfs/dbraw/zinc/76/00/01/564760001.db2.gz CXYPVOWPEGFCEU-UHFFFAOYSA-N 0 1 376.906 3.293 10 0 GGAEMN O=S(=O)(c1c(F)cccc1Cl)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000133210131 564766328 /nfs/dbraw/zinc/76/63/28/564766328.db2.gz IMEMPHYZSSRYNJ-LLVKDONJSA-N 0 1 384.864 3.043 10 0 GGAEMN C[NH+](C)C[C@H](Cc1ccccc1)NC(=O)c1ccc(Br)c([O-])c1 ZINC000133227795 564766945 /nfs/dbraw/zinc/76/69/45/564766945.db2.gz GKQVEIVXTXPPTF-HNNXBMFYSA-N 0 1 377.282 3.057 10 0 GGAEMN C[C@H](NCc1ccc(Br)c(F)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000133290419 564769224 /nfs/dbraw/zinc/76/92/24/564769224.db2.gz CDUZOWGRALHDMQ-JTQLQIEISA-N 0 1 387.274 3.086 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000133548568 564777924 /nfs/dbraw/zinc/77/79/24/564777924.db2.gz INYYWXWOCAWWOR-WMLDXEAASA-N 0 1 390.281 3.192 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCO[C@@H](c2ccc(Br)cc2)C1 ZINC000133548107 564777961 /nfs/dbraw/zinc/77/79/61/564777961.db2.gz INYYWXWOCAWWOR-RHSMWYFYSA-N 0 1 390.281 3.192 10 0 GGAEMN CC(=O)NCc1ccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)s1 ZINC000067140138 564786053 /nfs/dbraw/zinc/78/60/53/564786053.db2.gz APDJRRODOYEYNI-OAHLLOKOSA-N 0 1 377.535 3.013 10 0 GGAEMN CN(C)c1ncc(NS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)cn1 ZINC000134036251 564791520 /nfs/dbraw/zinc/79/15/20/564791520.db2.gz OOOZCZGBDIDACF-UHFFFAOYSA-N 0 1 380.779 3.016 10 0 GGAEMN COc1cc(Br)c(CN[C@H]2CCCc3[nH]c(=O)ccc32)cc1OC ZINC000067504595 564794025 /nfs/dbraw/zinc/79/40/25/564794025.db2.gz SQWZDNGMBHKCDI-AWEZNQCLSA-N 0 1 393.281 3.322 10 0 GGAEMN COc1cc(Br)c(CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc1OC ZINC000067504594 564794078 /nfs/dbraw/zinc/79/40/78/564794078.db2.gz SQWZDNGMBHKCDI-CQSZACIVSA-N 0 1 393.281 3.322 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000067653606 564797194 /nfs/dbraw/zinc/79/71/94/564797194.db2.gz GHUHREAHBONCCM-GOEBONIOSA-N 0 1 389.323 3.066 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2cccnc2Br)CC1 ZINC000134284295 564799420 /nfs/dbraw/zinc/79/94/20/564799420.db2.gz MPEOYQCAWYUZOK-UHFFFAOYSA-N 0 1 389.297 3.238 10 0 GGAEMN C[C@H](CNC(=O)[C@@H]1CCCc2[nH]ncc21)Oc1ccccc1Br ZINC000134467998 564804631 /nfs/dbraw/zinc/80/46/31/564804631.db2.gz ICSANHWQQAOALP-VXGBXAGGSA-N 0 1 378.270 3.176 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)[C@@H]1COc2ccc(Br)cc21 ZINC000134703137 564812425 /nfs/dbraw/zinc/81/24/25/564812425.db2.gz VHKOADUVGBOIDJ-CQSZACIVSA-N 0 1 385.221 3.349 10 0 GGAEMN CN(C)C1CN(C(=O)c2cccnc2Oc2ccc(F)cc2Br)C1 ZINC000134929866 564819495 /nfs/dbraw/zinc/81/94/95/564819495.db2.gz RWHKTQDYHAEJJY-UHFFFAOYSA-N 0 1 394.244 3.162 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1oc2ccc(Br)cc2c1C ZINC000069531170 564840443 /nfs/dbraw/zinc/84/04/43/564840443.db2.gz BBVCUPBPXQJTOT-CQSZACIVSA-N 0 1 395.297 3.344 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1oc2ccc(Br)cc2c1C ZINC000069531168 564840765 /nfs/dbraw/zinc/84/07/65/564840765.db2.gz BBVCUPBPXQJTOT-AWEZNQCLSA-N 0 1 395.297 3.344 10 0 GGAEMN C[C@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1nnc2ccccn21 ZINC000070869436 564851967 /nfs/dbraw/zinc/85/19/67/564851967.db2.gz APGGXUAUCBOGQD-NWDGAFQWSA-N 0 1 381.263 3.127 10 0 GGAEMN CCc1cc(C(=O)N(CCc2ccc(Cl)cc2Cl)CC(=O)OC)n[nH]1 ZINC000136698406 564854750 /nfs/dbraw/zinc/85/47/50/564854750.db2.gz KTQNGHNSHOGQGS-UHFFFAOYSA-N 0 1 384.263 3.137 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)CCOc2cccc(Cl)c2Cl)C[C@@H](C)O1 ZINC000072012746 564860331 /nfs/dbraw/zinc/86/03/31/564860331.db2.gz ZUDHGWQPVOOIHA-ZIAGYGMSSA-N 0 1 389.323 3.378 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc3nc(C)oc3c2)cc1Cl ZINC000137238782 564860569 /nfs/dbraw/zinc/86/05/69/564860569.db2.gz UCJJVBPVATXLBH-UHFFFAOYSA-N 0 1 380.809 3.377 10 0 GGAEMN Cc1cc(C)n(C[C@H](C)CNC(=O)c2cc(C)cc(Br)c2O)n1 ZINC000084074618 564868901 /nfs/dbraw/zinc/86/89/01/564868901.db2.gz CWLXPRVFVGCPSX-LLVKDONJSA-N 0 1 380.286 3.343 10 0 GGAEMN CN1C(=O)C[C@@H](NC(=O)c2ccc(O)c(Cl)c2)[C@@H]1c1ccc(Cl)cc1 ZINC000091770773 564872688 /nfs/dbraw/zinc/87/26/88/564872688.db2.gz CNWCZXHKOKOBIL-PBHICJAKSA-N 0 1 379.243 3.401 10 0 GGAEMN O=C(Nc1ccc(Br)cn1)[C@H]1CCCN(Cc2cncs2)C1 ZINC000091841663 564872755 /nfs/dbraw/zinc/87/27/55/564872755.db2.gz TUUOJMSYPJRFNK-NSHDSACASA-N 0 1 381.299 3.151 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000144474875 564877126 /nfs/dbraw/zinc/87/71/26/564877126.db2.gz LDENQQOOMWPGKL-GFCCVEGCSA-N 0 1 376.092 3.036 10 0 GGAEMN CCOc1c(Br)cc(CN2CCCC[C@@H]2CC(N)=O)cc1OC ZINC000092588385 564878195 /nfs/dbraw/zinc/87/81/95/564878195.db2.gz DTRHAFABWBKZAB-CYBMUJFWSA-N 0 1 385.302 3.086 10 0 GGAEMN NC(=O)c1c(F)cc(Br)cc1N1CCN(Cc2ccccc2)CC1 ZINC000092826372 564882297 /nfs/dbraw/zinc/88/22/97/564882297.db2.gz ILMFDZUQFHCJJY-UHFFFAOYSA-N 0 1 392.272 3.009 10 0 GGAEMN Cc1nc(C[C@@H]2CCCN(CCOc3ccccc3Br)C2)no1 ZINC000093789535 564888897 /nfs/dbraw/zinc/88/88/97/564888897.db2.gz OSBUWIKCDKNFOJ-AWEZNQCLSA-N 0 1 380.286 3.474 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2cc(F)cc(Cl)c2)cc1 ZINC000150749525 564889435 /nfs/dbraw/zinc/88/94/35/564889435.db2.gz CZNGDFWUDGQELT-UHFFFAOYSA-N 0 1 377.846 3.074 10 0 GGAEMN Brc1ccccc1OCCN1CCCC[C@H]1CN1CCOCC1 ZINC000093792337 564890544 /nfs/dbraw/zinc/89/05/44/564890544.db2.gz ASVAYPYDHXWVMV-INIZCTEOSA-N 0 1 383.330 3.015 10 0 GGAEMN CNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2C(F)(F)F)cc1 ZINC000150829576 564893253 /nfs/dbraw/zinc/89/32/53/564893253.db2.gz YPHBASHIUFMKOG-UHFFFAOYSA-N 0 1 376.331 3.005 10 0 GGAEMN CCOC(=O)c1cc2cc(O)c(Br)nc2n1C(=O)OC(C)(C)C ZINC000095937053 564900192 /nfs/dbraw/zinc/90/01/92/564900192.db2.gz HDIKAJKBHUFMFS-UHFFFAOYSA-N 0 1 385.214 3.464 10 0 GGAEMN Cc1nnc(-c2cc(S(=O)(=O)Nc3ccc(Br)c(C)c3)c[nH]2)o1 ZINC000096321585 564901134 /nfs/dbraw/zinc/90/11/34/564901134.db2.gz MTGLUMXFBYQHNR-UHFFFAOYSA-N 0 1 397.254 3.245 10 0 GGAEMN COc1ccc(CCN[C@@H](C(N)=O)c2ccc(Br)cc2)c(Cl)c1 ZINC000151035549 564902720 /nfs/dbraw/zinc/90/27/20/564902720.db2.gz VTNOWCKIDQHJAO-MRXNPFEDSA-N 0 1 397.700 3.470 10 0 GGAEMN CC[C@](O)(CNC(=O)[C@@H]1CCCc2[nH]ncc21)c1ccc(Br)cc1 ZINC000151161630 564907910 /nfs/dbraw/zinc/90/79/10/564907910.db2.gz CYDYGHFAGVXHTM-KDOFPFPSSA-N 0 1 392.297 3.006 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)COc2ccc(Br)cc2)ccc1F ZINC000097572696 564908558 /nfs/dbraw/zinc/90/85/58/564908558.db2.gz UDSHHSFSYKACFU-UHFFFAOYSA-N 0 1 395.272 3.345 10 0 GGAEMN C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000151191392 564909304 /nfs/dbraw/zinc/90/93/04/564909304.db2.gz FFYFYKIWYKILCF-WDEREUQCSA-N 0 1 382.835 3.216 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000101564081 564917674 /nfs/dbraw/zinc/91/76/74/564917674.db2.gz BLGRZGASDWCLAB-KGLIPLIRSA-N 0 1 389.323 3.114 10 0 GGAEMN CC(C)(C)NC(=O)CN1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000101916692 564923676 /nfs/dbraw/zinc/92/36/76/564923676.db2.gz XXABJAVAUOJHRZ-UHFFFAOYSA-N 0 1 396.329 3.014 10 0 GGAEMN O=C(CCCc1ccccc1Br)NCCCCN1CCOCC1 ZINC000151949056 564941689 /nfs/dbraw/zinc/94/16/89/564941689.db2.gz XHPUOKBYWCYMAK-UHFFFAOYSA-N 0 1 383.330 3.000 10 0 GGAEMN Cc1cccc(CS(=O)(=O)c2nc3cc(Br)c(C)[nH]c-3n2)c1 ZINC000152022375 564944041 /nfs/dbraw/zinc/94/40/41/564944041.db2.gz NDSRORWCFFSOKG-UHFFFAOYSA-N 0 1 380.267 3.311 10 0 GGAEMN Cc1[nH]c2nc(S(=O)(=O)Cc3cccc(F)c3)nc-2cc1Br ZINC000152022271 564944058 /nfs/dbraw/zinc/94/40/58/564944058.db2.gz JENQIEWIRPIQMC-UHFFFAOYSA-N 0 1 384.230 3.142 10 0 GGAEMN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000103283411 564945312 /nfs/dbraw/zinc/94/53/12/564945312.db2.gz QXWVYWIDPQXQOP-DGCLKSJQSA-N 0 1 378.270 3.190 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3ccc(SC)c(Cl)c3)CCO2)n[nH]1 ZINC000152058118 564945837 /nfs/dbraw/zinc/94/58/37/564945837.db2.gz QQXGITBKENEXSS-GFCCVEGCSA-N 0 1 381.889 3.348 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Cc2cccc(Br)c2)c2ccccc2)n[nH]1 ZINC000103280451 564945861 /nfs/dbraw/zinc/94/58/61/564945861.db2.gz JIQQVHTXZKNKQE-KRWDZBQOSA-N 0 1 385.265 3.324 10 0 GGAEMN CC[C@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccccc1 ZINC000152140406 564947825 /nfs/dbraw/zinc/94/78/25/564947825.db2.gz YBFOOACIDSHBOH-KRWDZBQOSA-N 0 1 380.535 3.010 10 0 GGAEMN Cn1nccc1CN[C@H]1CCCOc2ccc(I)cc21 ZINC000152196041 564949986 /nfs/dbraw/zinc/94/99/86/564949986.db2.gz VCMYYZDWMANMME-AWEZNQCLSA-N 0 1 383.233 3.028 10 0 GGAEMN COc1ccccc1CCN(C)[C@H](C(N)=O)c1ccc(Br)cc1 ZINC000104711350 564958132 /nfs/dbraw/zinc/95/81/32/564958132.db2.gz BTMVPZSRXDTKEY-KRWDZBQOSA-N 0 1 377.282 3.159 10 0 GGAEMN COc1cc(Br)c(NC(=O)N2CCN3CCCC[C@@H]3C2)cc1OC ZINC000105015534 564962602 /nfs/dbraw/zinc/96/26/02/564962602.db2.gz LPGRCBOVXPXHCE-GFCCVEGCSA-N 0 1 398.301 3.168 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)Cc2c[nH]c3cccc(Br)c23)[nH]n1 ZINC000152680131 564968946 /nfs/dbraw/zinc/96/89/46/564968946.db2.gz NPTJMXZDFFAVJF-UHFFFAOYSA-N 0 1 399.252 3.235 10 0 GGAEMN CC[C@H](C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)N(C)C ZINC000152865510 564975771 /nfs/dbraw/zinc/97/57/71/564975771.db2.gz APEJHHUBAKFZBE-MRXNPFEDSA-N 0 1 382.291 3.482 10 0 GGAEMN CC[C@@H]1CN([C@@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)CCN1CCOC ZINC000106114367 564977785 /nfs/dbraw/zinc/97/77/85/564977785.db2.gz MJEUEFFCBPTFQD-DZGCQCFKSA-N 0 1 388.339 3.363 10 0 GGAEMN CC[C@@H]1CN([C@@H](C)C(=O)Nc2cc(Cl)ccc2Cl)CCN1CCOC ZINC000106116227 564978360 /nfs/dbraw/zinc/97/83/60/564978360.db2.gz WAUZWBDTVRSMPT-DZGCQCFKSA-N 0 1 388.339 3.363 10 0 GGAEMN Cc1nc(C)n(C[C@H]2CCCN(C[C@H](O)c3ccccc3Br)C2)n1 ZINC000152954134 564978986 /nfs/dbraw/zinc/97/89/86/564978986.db2.gz VAFDDSNJDZDNNR-YJBOKZPZSA-N 0 1 393.329 3.103 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3ccc(F)c(Br)c3)CC2)cn1 ZINC000106154500 564979614 /nfs/dbraw/zinc/97/96/14/564979614.db2.gz RDOKNWHUTKVPRR-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc(Br)cc1)N1CCC(Cn2cccn2)CC1 ZINC000106185631 564980295 /nfs/dbraw/zinc/98/02/95/564980295.db2.gz FJSNPFAJLXNXOM-AWEZNQCLSA-N 0 1 391.313 3.385 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Br)cc1)N1CCC(Cn2cccn2)CC1 ZINC000106185635 564980814 /nfs/dbraw/zinc/98/08/14/564980814.db2.gz FJSNPFAJLXNXOM-CQSZACIVSA-N 0 1 391.313 3.385 10 0 GGAEMN C[C@H](CN1CCN(C)CC1)NC(=O)N[C@H](C)c1c(Cl)ccc(F)c1Cl ZINC000106539700 564984735 /nfs/dbraw/zinc/98/47/35/564984735.db2.gz MVCQQFSOSLFRIY-VXGBXAGGSA-N 0 1 391.318 3.129 10 0 GGAEMN COc1ccc(CNC(=O)[C@H](Cc2ccccc2)N(C)C)cc1Br ZINC000106914920 564992012 /nfs/dbraw/zinc/99/20/12/564992012.db2.gz LXVMUYDAEMBWCC-KRWDZBQOSA-N 0 1 391.309 3.247 10 0 GGAEMN C[C@H](CC(=O)N1CCN(C2CCOCC2)CC1)c1ccc(Br)cc1 ZINC000154146585 565027646 /nfs/dbraw/zinc/02/76/46/565027646.db2.gz JNSRMMFJJKAXIW-OAHLLOKOSA-N 0 1 395.341 3.266 10 0 GGAEMN O=C(CC[C@@H]1CCCCO1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000110688884 565044295 /nfs/dbraw/zinc/04/42/95/565044295.db2.gz ARIHWSDAZOEKPK-AWEZNQCLSA-N 0 1 393.285 3.200 10 0 GGAEMN O=C(CC[C@@H]1CCCCO1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000110688884 565044297 /nfs/dbraw/zinc/04/42/97/565044297.db2.gz ARIHWSDAZOEKPK-AWEZNQCLSA-N 0 1 393.285 3.200 10 0 GGAEMN Cc1[nH+]ccn1C[C@@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000154575600 565044815 /nfs/dbraw/zinc/04/48/15/565044815.db2.gz PTTFGFTXXSWINK-GUYCJALGSA-N 0 1 391.313 3.446 10 0 GGAEMN CCCC(=O)NCC(=O)Nc1[nH]nc(-c2ccc(Br)cc2)c1CC ZINC000111148347 565051029 /nfs/dbraw/zinc/05/10/29/565051029.db2.gz VRAUZAIAMUBNCC-UHFFFAOYSA-N 0 1 393.285 3.256 10 0 GGAEMN CCOCCOCC(=O)Nc1[nH]nc(-c2ccc(Br)cc2)c1CC ZINC000111148334 565051397 /nfs/dbraw/zinc/05/13/97/565051397.db2.gz XENMGLJIGQYXKC-UHFFFAOYSA-N 0 1 396.285 3.393 10 0 GGAEMN CS(=O)(=O)c1ccc([C@H](O)CN2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000111305511 565051764 /nfs/dbraw/zinc/05/17/64/565051764.db2.gz VFTLUMGSTSRRBY-QFBILLFUSA-N 0 1 379.909 3.266 10 0 GGAEMN O=S1(=O)NC(CN2CC[C@H](c3ccc(Cl)cc3)C2)=Nc2ccccc21 ZINC000111305917 565052117 /nfs/dbraw/zinc/05/21/17/565052117.db2.gz RSSLPQKVRJZLOA-AWEZNQCLSA-N 0 1 375.881 3.151 10 0 GGAEMN COC(=O)c1cccc2nc(NC(=O)c3csc(Br)c3)[nH]c21 ZINC000154870782 565055559 /nfs/dbraw/zinc/05/55/59/565055559.db2.gz NNBMEQDNKYTQCN-UHFFFAOYSA-N 0 1 380.223 3.426 10 0 GGAEMN COCC[N@H+]1CCC[C@@H]1CNC(=O)N(C)[C@@H](C)c1ccccc1Br ZINC000111864421 565058341 /nfs/dbraw/zinc/05/83/41/565058341.db2.gz BUFLZNYUBBEWFA-LSDHHAIUSA-N 0 1 398.345 3.262 10 0 GGAEMN COCC[N@H+]1CCC[C@H]1CNC(=O)N(C)[C@H](C)c1ccccc1Br ZINC000111864418 565058448 /nfs/dbraw/zinc/05/84/48/565058448.db2.gz BUFLZNYUBBEWFA-CABCVRRESA-N 0 1 398.345 3.262 10 0 GGAEMN CCOc1c(Br)cc(C(=O)N2[C@@H](C)CN(C)C[C@@H]2C)cc1OC ZINC000155481232 565068119 /nfs/dbraw/zinc/06/81/19/565068119.db2.gz FXUOULDSZZIYLM-RYUDHWBXSA-N 0 1 385.302 3.021 10 0 GGAEMN CCOc1c(Br)cc(C(=O)N2[C@H](C)CN(C)C[C@H]2C)cc1OC ZINC000155481333 565068163 /nfs/dbraw/zinc/06/81/63/565068163.db2.gz FXUOULDSZZIYLM-VXGBXAGGSA-N 0 1 385.302 3.021 10 0 GGAEMN CCOc1c(Br)cc(C(=O)N2[C@H](C)CN(C)C[C@@H]2C)cc1OC ZINC000155481126 565068269 /nfs/dbraw/zinc/06/82/69/565068269.db2.gz FXUOULDSZZIYLM-TXEJJXNPSA-N 0 1 385.302 3.021 10 0 GGAEMN C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000113305302 565069389 /nfs/dbraw/zinc/06/93/89/565069389.db2.gz UJYVVFCJSWPYIP-CMPLNLGQSA-N 0 1 382.835 3.216 10 0 GGAEMN C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000113305624 565069421 /nfs/dbraw/zinc/06/94/21/565069421.db2.gz PJCXYTLMKSCUNS-GHMZBOCLSA-N 0 1 382.835 3.216 10 0 GGAEMN CN(C)[C@H](CNC(=O)C(=O)c1ccc(Br)cc1)c1ccccc1 ZINC000114222178 565072891 /nfs/dbraw/zinc/07/28/91/565072891.db2.gz YTNQBQBHQVUTNA-MRXNPFEDSA-N 0 1 375.266 3.051 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NCCN1CCc2ccccc2C1 ZINC000114232065 565072900 /nfs/dbraw/zinc/07/29/00/565072900.db2.gz YNBHUECLYAMUHV-UHFFFAOYSA-N 0 1 379.323 3.228 10 0 GGAEMN CNS(=O)(=O)c1ccc([C@@H](C)NCc2sc(C)nc2C(F)(F)F)cc1 ZINC000183642970 565084775 /nfs/dbraw/zinc/08/47/75/565084775.db2.gz DGGMCDKCIUFBAH-SECBINFHSA-N 0 1 393.456 3.229 10 0 GGAEMN CNS(=O)(=O)c1ccc([C@H](C)NCc2sc(C)nc2C(F)(F)F)cc1 ZINC000183642953 565084788 /nfs/dbraw/zinc/08/47/88/565084788.db2.gz DGGMCDKCIUFBAH-VIFPVBQESA-N 0 1 393.456 3.229 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CC2(CCOCC2)O1 ZINC000369313327 565087067 /nfs/dbraw/zinc/08/70/67/565087067.db2.gz ZGDMOEDRDGYOGR-GFCCVEGCSA-N 0 1 380.286 3.095 10 0 GGAEMN C[C@H](Oc1ccccc1Br)C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000369408525 565090812 /nfs/dbraw/zinc/09/08/12/565090812.db2.gz POVKQJMTFLYTQY-LBPRGKRZSA-N 0 1 378.270 3.346 10 0 GGAEMN COc1ccc(Br)c(CN2CCC(c3nnc4n3CCC4)CC2)c1 ZINC000369407870 565091021 /nfs/dbraw/zinc/09/10/21/565091021.db2.gz JAIJPMJNCXBMLI-UHFFFAOYSA-N 0 1 391.313 3.375 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCc2c(Br)ccc(F)c2C1 ZINC000183771028 565095266 /nfs/dbraw/zinc/09/52/66/565095266.db2.gz VXAGCYYWTFBJLI-NSHDSACASA-N 0 1 378.245 3.316 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000183958610 565107143 /nfs/dbraw/zinc/10/71/43/565107143.db2.gz RHMLANBXCFPULO-LBPRGKRZSA-N 0 1 379.291 3.485 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)Nc1ccncc1F ZINC000184164786 565117874 /nfs/dbraw/zinc/11/78/74/565117874.db2.gz DVUQEWQTYKMDNT-UHFFFAOYSA-N 0 1 391.204 3.090 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)Nc1ccncc1F ZINC000184164786 565117878 /nfs/dbraw/zinc/11/78/78/565117878.db2.gz DVUQEWQTYKMDNT-UHFFFAOYSA-N 0 1 391.204 3.090 10 0 GGAEMN O=C(Cc1cscc1Br)NC1CCN(Cc2ccccn2)CC1 ZINC000292519294 565120061 /nfs/dbraw/zinc/12/00/61/565120061.db2.gz HMZWEUVEZITGGL-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCC[C@H]2c2ccc(Br)cc2)[nH]1 ZINC000369951145 565120170 /nfs/dbraw/zinc/12/01/70/565120170.db2.gz LOBVODAYSSVHNO-ZDUSSCGKSA-N 0 1 381.299 3.331 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CCC[C@H]2c2ccc(Br)cc2)n1 ZINC000369951145 565120174 /nfs/dbraw/zinc/12/01/74/565120174.db2.gz LOBVODAYSSVHNO-ZDUSSCGKSA-N 0 1 381.299 3.331 10 0 GGAEMN O=C(CN[C@H](c1nnc[nH]1)c1ccccc1)Nc1c(Cl)cccc1Cl ZINC000370070996 565126167 /nfs/dbraw/zinc/12/61/67/565126167.db2.gz FCEHOEYHNRXBFQ-HNNXBMFYSA-N 0 1 376.247 3.429 10 0 GGAEMN O=C(Cc1cscc1Br)NC1CCN(Cc2ccncc2)CC1 ZINC000292651791 565126647 /nfs/dbraw/zinc/12/66/47/565126647.db2.gz NPKVWZLKQONDSL-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)[nH]1 ZINC000184326062 565129629 /nfs/dbraw/zinc/12/96/29/565129629.db2.gz TWRXKHLFNFBXEH-LBPRGKRZSA-N 0 1 380.342 3.293 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCc2c(Br)ccc(F)c2C1 ZINC000184444886 565136130 /nfs/dbraw/zinc/13/61/30/565136130.db2.gz LJAGKGVZQOGLIZ-UHFFFAOYSA-N 0 1 378.245 3.248 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C)[nH]1 ZINC000292907278 565141067 /nfs/dbraw/zinc/14/10/67/565141067.db2.gz CPXVVJUIGCHVEM-UHFFFAOYSA-N 0 1 376.873 3.382 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000268153656 565141946 /nfs/dbraw/zinc/14/19/46/565141946.db2.gz NAICFXHKCXLLRU-LLVKDONJSA-N 0 1 381.217 3.381 10 0 GGAEMN COC(=O)c1sccc1S(=O)(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F ZINC000157716563 565142597 /nfs/dbraw/zinc/14/25/97/565142597.db2.gz MVRWQZWHPDBBDX-GFCCVEGCSA-N 0 1 397.371 3.256 10 0 GGAEMN C[C@H](Oc1ccc(F)cc1Br)C(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184570021 565145761 /nfs/dbraw/zinc/14/57/61/565145761.db2.gz LMNIVWAXBQJMIV-QMMMGPOBSA-N 0 1 383.221 3.380 10 0 GGAEMN C[C@H](Oc1ccc(F)cc1Br)C(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184570021 565145768 /nfs/dbraw/zinc/14/57/68/565145768.db2.gz LMNIVWAXBQJMIV-QMMMGPOBSA-N 0 1 383.221 3.380 10 0 GGAEMN CC(C)C[C@H](CO)N(C)C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000184619973 565147905 /nfs/dbraw/zinc/14/79/05/565147905.db2.gz MLHPFGIUWNXVDW-CYBMUJFWSA-N 0 1 380.286 3.318 10 0 GGAEMN COc1ccc(Br)c(NC(=O)N2CCCC[C@H]2c2nnc[nH]2)c1 ZINC000184701683 565152567 /nfs/dbraw/zinc/15/25/67/565152567.db2.gz SPWZSSPFSKHBNI-ZDUSSCGKSA-N 0 1 380.246 3.335 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Nc2ccc(I)cc2C)n[nH]1 ZINC000158006939 565152749 /nfs/dbraw/zinc/15/27/49/565152749.db2.gz USQWQMWCDCVRDW-JTQLQIEISA-N 0 1 398.248 3.384 10 0 GGAEMN COc1cc(Br)c(NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1OC ZINC000158054030 565153878 /nfs/dbraw/zinc/15/38/78/565153878.db2.gz AXJNYBSLOAYGHM-VIFPVBQESA-N 0 1 397.273 3.251 10 0 GGAEMN COc1cc(Br)c(NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1OC ZINC000158053888 565154515 /nfs/dbraw/zinc/15/45/15/565154515.db2.gz AXJNYBSLOAYGHM-SECBINFHSA-N 0 1 397.273 3.251 10 0 GGAEMN O=C(Nc1ccc(Br)cc1)C1CCN(C[C@@H](O)C(F)(F)F)CC1 ZINC000158190745 565160600 /nfs/dbraw/zinc/16/06/00/565160600.db2.gz ZTUSTUNORKHHBA-CYBMUJFWSA-N 0 1 395.219 3.023 10 0 GGAEMN C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1cccc(Br)c1 ZINC000158266059 565162361 /nfs/dbraw/zinc/16/23/61/565162361.db2.gz NDJWNVQKWUCJOF-GFCCVEGCSA-N 0 1 383.311 3.290 10 0 GGAEMN CC(C)C(=O)NC[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000184962289 565167343 /nfs/dbraw/zinc/16/73/43/565167343.db2.gz YOUNNOKDBPPWAW-ZDUSSCGKSA-N 0 1 393.329 3.310 10 0 GGAEMN O=C(NCC1CC1)[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000184948058 565167758 /nfs/dbraw/zinc/16/77/58/565167758.db2.gz CXENTSSZTDVLJP-ZDUSSCGKSA-N 0 1 391.313 3.064 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(Cc3nc4ccc(Br)cc4[nH]3)[C@@H]2C1 ZINC000184989935 565170121 /nfs/dbraw/zinc/17/01/21/565170121.db2.gz IAIAHNYOKZJVHG-WQVCFCJDSA-N 0 1 380.286 3.094 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)CSCc2ccc(Br)cc2)n[nH]1 ZINC000269061299 565176586 /nfs/dbraw/zinc/17/65/86/565176586.db2.gz BGJXRMWJAYTHLV-NSHDSACASA-N 0 1 382.327 3.461 10 0 GGAEMN Cc1cc(CNCc2cnc(N3CCOCC3)c(F)c2)ccc1Br ZINC000185075057 565176572 /nfs/dbraw/zinc/17/65/72/565176572.db2.gz ZOPWBNRDYBORAG-UHFFFAOYSA-N 0 1 394.288 3.418 10 0 GGAEMN O=S(=O)(Nc1cccc(-c2ncon2)c1)c1ccc(F)cc1Br ZINC000158756010 565181361 /nfs/dbraw/zinc/18/13/61/565181361.db2.gz LHNVQMVIUCZXJL-UHFFFAOYSA-N 0 1 398.213 3.439 10 0 GGAEMN CCc1c(NC(=O)c2cnn(CC)n2)[nH]nc1-c1ccc(Br)cc1 ZINC000293742064 565182668 /nfs/dbraw/zinc/18/26/68/565182668.db2.gz NOSGJPWJIISMIN-UHFFFAOYSA-N 0 1 389.257 3.265 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC2(CCC2)C1 ZINC000158807175 565183936 /nfs/dbraw/zinc/18/39/36/565183936.db2.gz IHMZATSFWRFJGG-UHFFFAOYSA-N 0 1 381.217 3.184 10 0 GGAEMN O=C(CCCOc1ccccc1Br)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371280194 565184341 /nfs/dbraw/zinc/18/43/41/565184341.db2.gz NZOCKNGKXUEILP-GFCCVEGCSA-N 0 1 378.270 3.005 10 0 GGAEMN O=C(CCCOc1ccccc1Br)N[C@H]1CCc2nc[nH]c2C1 ZINC000371280195 565184758 /nfs/dbraw/zinc/18/47/58/565184758.db2.gz NZOCKNGKXUEILP-LBPRGKRZSA-N 0 1 378.270 3.005 10 0 GGAEMN CCN1CC[C@H]2OCCN(C(=O)c3sc(-c4cccs4)nc3C)[C@H]2C1 ZINC000293825702 565186324 /nfs/dbraw/zinc/18/63/24/565186324.db2.gz GQZSHVCMXXXRDH-UONOGXRCSA-N 0 1 377.535 3.115 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@H]1CCOC2(CCSCC2)C1)c1cccs1 ZINC000269381881 565188227 /nfs/dbraw/zinc/18/82/27/565188227.db2.gz VKTJHIZILWPVOE-GJZGRUSLSA-N 0 1 383.583 3.095 10 0 GGAEMN COCc1c(Br)cccc1NC(=O)N[C@@H](C)Cc1cc(C)[nH]n1 ZINC000159020966 565191941 /nfs/dbraw/zinc/19/19/41/565191941.db2.gz MROHFONSOOQOMJ-JTQLQIEISA-N 0 1 381.274 3.380 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159155901 565196437 /nfs/dbraw/zinc/19/64/37/565196437.db2.gz ACLSMGYRGPINKX-CYBMUJFWSA-N 0 1 379.302 3.206 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCc2cc(Br)cc(F)c2C1 ZINC000371541819 565198860 /nfs/dbraw/zinc/19/88/60/565198860.db2.gz FNWPTCKKYXTGHZ-LBPRGKRZSA-N 0 1 378.245 3.316 10 0 GGAEMN O=C(COc1cc(Cl)ccc1Cl)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000371562073 565199411 /nfs/dbraw/zinc/19/94/11/565199411.db2.gz KVQXFUADZGKVME-MRXNPFEDSA-N 0 1 377.231 3.396 10 0 GGAEMN O=C(COc1ccc(Cl)c(Cl)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000371552461 565199861 /nfs/dbraw/zinc/19/98/61/565199861.db2.gz JJYUFIMJNSQMQO-INIZCTEOSA-N 0 1 377.231 3.396 10 0 GGAEMN CC(C)n1cc(Br)cc1C(=O)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000371561463 565200117 /nfs/dbraw/zinc/20/01/17/565200117.db2.gz IYKVOUZGFGZVLM-OAHLLOKOSA-N 0 1 388.269 3.469 10 0 GGAEMN COc1ccc(Br)c(C(=O)N[C@H](c2nnc[nH]2)c2ccccc2)c1 ZINC000371564270 565200154 /nfs/dbraw/zinc/20/01/54/565200154.db2.gz ZRGQEEHGMUCLQF-HNNXBMFYSA-N 0 1 387.237 3.095 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cccc(-c3nc[nH]n3)c2)c(Br)c1 ZINC000371679013 565204149 /nfs/dbraw/zinc/20/41/49/565204149.db2.gz INYCURBEDHPVNL-UHFFFAOYSA-N 0 1 393.266 3.343 10 0 GGAEMN COc1cc(Br)cc(S(=O)(=O)Nc2cc(O)cc(F)c2)c1 ZINC000185603136 565211112 /nfs/dbraw/zinc/21/11/12/565211112.db2.gz VNGJDPKISTXKGC-UHFFFAOYSA-N 0 1 376.203 3.103 10 0 GGAEMN O=C(Cc1cc(F)ccc1Br)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000371840446 565211789 /nfs/dbraw/zinc/21/17/89/565211789.db2.gz HZWUNJUVGVUYKK-MRXNPFEDSA-N 0 1 389.228 3.155 10 0 GGAEMN O=C(Nc1cc(F)cc(F)c1F)c1sccc1S(=O)(=O)N1CCCC1 ZINC000294437815 565212266 /nfs/dbraw/zinc/21/22/66/565212266.db2.gz GRYRAOUMRUKEDJ-UHFFFAOYSA-N 0 1 390.408 3.202 10 0 GGAEMN OCc1nnc(SCc2nc3ccc(Br)cc3[nH]2)n1C1CC1 ZINC000185638382 565212348 /nfs/dbraw/zinc/21/23/48/565212348.db2.gz VEFYTMBSNAVKDP-UHFFFAOYSA-N 0 1 380.271 3.036 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(-c3ncn(C)n3)cc2)c(Cl)cc1F ZINC000185637921 565212404 /nfs/dbraw/zinc/21/24/04/565212404.db2.gz OQFKVXRDCWDIJF-UHFFFAOYSA-N 0 1 380.832 3.384 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccccc2C[S@@](C)=O)c(Cl)cc1F ZINC000185653949 565213590 /nfs/dbraw/zinc/21/35/90/565213590.db2.gz DSVNGKKDLJVUPP-JOCHJYFZSA-N 0 1 375.874 3.467 10 0 GGAEMN O[C@@H](COC1CCOCC1)CN1CCC[C@@H]1c1ccc(Br)cc1 ZINC000371896938 565214104 /nfs/dbraw/zinc/21/41/04/565214104.db2.gz DLOWSNSHVQZJBL-SJLPKXTDSA-N 0 1 384.314 3.143 10 0 GGAEMN CN(Cc1cc(Br)cc(Br)c1N)C[C@@H]1CCCO1 ZINC000185719661 565218230 /nfs/dbraw/zinc/21/82/30/565218230.db2.gz PNJGYBFZPHIWOD-NSHDSACASA-N 0 1 378.108 3.405 10 0 GGAEMN O=S1(=O)CCC(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC1 ZINC000270426000 565218536 /nfs/dbraw/zinc/21/85/36/565218536.db2.gz HCMCRFXVPNEJSC-UHFFFAOYSA-N 0 1 382.913 3.485 10 0 GGAEMN O=C(Cc1cscc1Br)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000294651302 565221202 /nfs/dbraw/zinc/22/12/02/565221202.db2.gz SHKQZDWHRAIPJC-LLVKDONJSA-N 0 1 395.326 3.455 10 0 GGAEMN CCOc1c(Br)cc(CNCc2n[nH]c(C3CC3)n2)cc1OC ZINC000294713383 565224700 /nfs/dbraw/zinc/22/47/00/565224700.db2.gz DUOAZTMHWBMCEU-UHFFFAOYSA-N 0 1 381.274 3.142 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)NCc2cc(F)cc(Br)c2)n[nH]1 ZINC000270666827 565224918 /nfs/dbraw/zinc/22/49/18/565224918.db2.gz KYWWSTFGOULCDC-SECBINFHSA-N 0 1 384.253 3.390 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCc2cc3cc(Br)ccc3[nH]2)n[nH]1 ZINC000185880356 565226411 /nfs/dbraw/zinc/22/64/11/565226411.db2.gz GEXLWORQVCMJBR-SNVBAGLBSA-N 0 1 390.285 3.392 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000270769922 565228626 /nfs/dbraw/zinc/22/86/26/565228626.db2.gz RQCASKXMFJZKIT-BXKDBHETSA-N 0 1 394.273 3.014 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C[C@@H](C)O ZINC000185912058 565228598 /nfs/dbraw/zinc/22/85/98/565228598.db2.gz ZDZDKZRIQAATIF-DGCLKSJQSA-N 0 1 378.822 3.276 10 0 GGAEMN O[C@H](CN1CCC(c2nnc3n2CCC3)CC1)c1ccc(Cl)cc1Cl ZINC000372288544 565229940 /nfs/dbraw/zinc/22/99/40/565229940.db2.gz SASSPUBDMVJKPW-MRXNPFEDSA-N 0 1 381.307 3.444 10 0 GGAEMN CS(=O)(=O)Cc1cccc(CNCc2cccc(Br)c2F)c1 ZINC000294971251 565238044 /nfs/dbraw/zinc/23/80/44/565238044.db2.gz GJUDLRASIIHVPP-UHFFFAOYSA-N 0 1 386.286 3.423 10 0 GGAEMN O=C(Nc1cccc(Br)c1)C1CCN(Cc2cncnc2)CC1 ZINC000271155739 565239903 /nfs/dbraw/zinc/23/99/03/565239903.db2.gz GZUFNUOHTBISST-UHFFFAOYSA-N 0 1 375.270 3.090 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000372459560 565240103 /nfs/dbraw/zinc/24/01/03/565240103.db2.gz GEMVTINCIBXVRZ-HNNXBMFYSA-N 0 1 397.287 3.321 10 0 GGAEMN CC[C@H](C)NC(=O)CCN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186133652 565242150 /nfs/dbraw/zinc/24/21/50/565242150.db2.gz XAAFJNBULMCKIH-UGSOOPFHSA-N 0 1 391.313 3.223 10 0 GGAEMN CC[C@@H](C)NC(=O)CCN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186133633 565242236 /nfs/dbraw/zinc/24/22/36/565242236.db2.gz XAAFJNBULMCKIH-ACJLOTCBSA-N 0 1 391.313 3.223 10 0 GGAEMN C[C@@H](CO)[C@@H](C)NCc1coc(-c2ccc(I)cc2)n1 ZINC000295071405 565243104 /nfs/dbraw/zinc/24/31/04/565243104.db2.gz AHXXSEGIKLTKSS-WDEREUQCSA-N 0 1 386.233 3.053 10 0 GGAEMN OCCCSCCN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186179061 565244737 /nfs/dbraw/zinc/24/47/37/565244737.db2.gz JZDFVZIAMNGLNL-MRXNPFEDSA-N 0 1 382.327 3.034 10 0 GGAEMN O=S(=O)(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(Cl)ccc1Cl ZINC000372591179 565246101 /nfs/dbraw/zinc/24/61/01/565246101.db2.gz HAHHCZQMEFJZFZ-AWEZNQCLSA-N 0 1 383.260 3.179 10 0 GGAEMN CS[C@H](CO)[C@H](C)N[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186205306 565246304 /nfs/dbraw/zinc/24/63/04/565246304.db2.gz FMRFCCWKYBHIDR-XZJROXQQSA-N 0 1 382.327 3.031 10 0 GGAEMN CC(C)(C)c1ccc(S(=O)(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)s1 ZINC000372602556 565246406 /nfs/dbraw/zinc/24/64/06/565246406.db2.gz XBEYSIDGWVHDGP-OAHLLOKOSA-N 0 1 376.507 3.232 10 0 GGAEMN O=S1(=O)CC[C@@H](N[C@@H]2CCN(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000186238774 565248508 /nfs/dbraw/zinc/24/85/08/565248508.db2.gz DXLRKXUQPNDMSO-CRAIPNDOSA-N 0 1 376.909 3.427 10 0 GGAEMN O=C1[C@@H](N[C@H]2CCOc3c(Br)cccc32)CCN1CC(F)(F)F ZINC000271435766 565252839 /nfs/dbraw/zinc/25/28/39/565252839.db2.gz FLBYEMYEECYRJR-RYUDHWBXSA-N 0 1 393.203 3.026 10 0 GGAEMN CCn1nccc1S(=O)(=O)Nc1ncc(C2CCC2)cc1Br ZINC000295245316 565253743 /nfs/dbraw/zinc/25/37/43/565253743.db2.gz VROPQZNWENFJOP-UHFFFAOYSA-N 0 1 385.287 3.129 10 0 GGAEMN COc1cc(Br)c(CN[C@H](c2nnc[nH]2)c2ccccc2)cc1O ZINC000372919537 565259983 /nfs/dbraw/zinc/25/99/83/565259983.db2.gz CPPIRPKCQDZKNL-INIZCTEOSA-N 0 1 389.253 3.161 10 0 GGAEMN COc1ccc(Br)c(CN(C)C(=O)[C@@H]2CCCc3[nH]ncc32)c1 ZINC000372939202 565261372 /nfs/dbraw/zinc/26/13/72/565261372.db2.gz DGFSSOYSSRRWKJ-CYBMUJFWSA-N 0 1 378.270 3.259 10 0 GGAEMN COCCCn1cc(C)c(NC(=O)c2cc(Br)cc3nc[nH]c32)n1 ZINC000295382400 565262238 /nfs/dbraw/zinc/26/22/38/565262238.db2.gz FFLHUHIUJLYIOF-UHFFFAOYSA-N 0 1 392.257 3.119 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@@H]2CCCc3[nH]ncc32)ccc1Br ZINC000271655300 565262538 /nfs/dbraw/zinc/26/25/38/565262538.db2.gz IYWGXYCMUPTFEJ-SNVBAGLBSA-N 0 1 378.226 3.017 10 0 GGAEMN CN1CCC[C@@H](NC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)C1 ZINC000617915794 565267505 /nfs/dbraw/zinc/26/75/05/565267505.db2.gz XCRARHCYNPKJNY-CYBMUJFWSA-N 0 1 381.502 3.185 10 0 GGAEMN O=C(CCCC(=O)c1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000373093560 565268877 /nfs/dbraw/zinc/26/88/77/565268877.db2.gz WUGDBBQGVWOANB-AWEZNQCLSA-N 0 1 390.281 3.199 10 0 GGAEMN O=c1ccccn1Cc1ccc(CNCc2cncc(Br)c2)cc1 ZINC000186604345 565271298 /nfs/dbraw/zinc/27/12/98/565271298.db2.gz RGRKRONMJOAYIW-UHFFFAOYSA-N 0 1 384.277 3.344 10 0 GGAEMN Nc1c(Br)cc(Br)cc1CN1CCN(C2CC2)CC1 ZINC000186608499 565271850 /nfs/dbraw/zinc/27/18/50/565271850.db2.gz ZWJSHDJYAKSIDO-UHFFFAOYSA-N 0 1 389.135 3.074 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)CC1 ZINC000186626901 565273382 /nfs/dbraw/zinc/27/33/82/565273382.db2.gz AYZIEBYOBKQMKC-CVEARBPZSA-N 0 1 385.291 3.104 10 0 GGAEMN O=C(N[C@@H]1CCCN(CCCO)C1)c1sc2ccccc2c1Br ZINC000295588840 565275188 /nfs/dbraw/zinc/27/51/88/565275188.db2.gz WIXKMUDIOXLZRY-GFCCVEGCSA-N 0 1 397.338 3.240 10 0 GGAEMN COc1cc(C(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)sc1Br ZINC000373267528 565276662 /nfs/dbraw/zinc/27/66/62/565276662.db2.gz SGPRJZDRNRDOFP-GFCCVEGCSA-N 0 1 393.266 3.157 10 0 GGAEMN CCC1(CC)CN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC[S@@]1=O ZINC000186733695 565281700 /nfs/dbraw/zinc/28/17/00/565281700.db2.gz QVVUDSCJNOSQEU-VWLOTQADSA-N 0 1 379.913 3.493 10 0 GGAEMN CCC1(CC)CN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC[S@]1=O ZINC000186733713 565281999 /nfs/dbraw/zinc/28/19/99/565281999.db2.gz QVVUDSCJNOSQEU-RUZDIDTESA-N 0 1 379.913 3.493 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOc2c(Br)cccc2C1 ZINC000373414907 565283740 /nfs/dbraw/zinc/28/37/40/565283740.db2.gz BHYZCTZCPMLUNG-GFCCVEGCSA-N 0 1 376.254 3.013 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)COc2ccc(Br)cc2Cl)n[nH]1 ZINC000161517567 565286854 /nfs/dbraw/zinc/28/68/54/565286854.db2.gz WGEYRMLVGMNTMW-VIFPVBQESA-N 0 1 386.677 3.260 10 0 GGAEMN O=C(NCc1cc(F)cc(Br)c1)c1cccc(-c2nnc[nH]2)c1 ZINC000161573168 565287274 /nfs/dbraw/zinc/28/72/74/565287274.db2.gz ABQOBNNDQFSYOY-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)[C@@H](C)CC(=O)c2cccc(Br)c2)n[nH]1 ZINC000161698189 565291248 /nfs/dbraw/zinc/29/12/48/565291248.db2.gz RARQMBYENZKXAX-NWDGAFQWSA-N 0 1 392.297 3.437 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Cc2c[nH]c3cc(Br)ccc23)n[nH]1 ZINC000161714046 565291376 /nfs/dbraw/zinc/29/13/76/565291376.db2.gz GHLGUVYONQEMOD-JTQLQIEISA-N 0 1 375.270 3.252 10 0 GGAEMN CN(C)C(=O)CC1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000161710352 565291521 /nfs/dbraw/zinc/29/15/21/565291521.db2.gz YXZDAPPPERBQMO-UHFFFAOYSA-N 0 1 379.302 3.016 10 0 GGAEMN Cn1ccnc1[C@H]1N(C(=O)c2[nH]nc3ccc(Br)cc32)CC1(C)C ZINC000295901897 565293011 /nfs/dbraw/zinc/29/30/11/565293011.db2.gz NKNPXIBZTKDZNW-CQSZACIVSA-N 0 1 388.269 3.282 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2[nH]nc(-c3ccccc3)c2Br)n[nH]1 ZINC000161795799 565294034 /nfs/dbraw/zinc/29/40/34/565294034.db2.gz JNUBOALCIZSIGP-JTQLQIEISA-N 0 1 388.269 3.232 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)Nc2ccncc2Br)ccc1F ZINC000272703320 565295305 /nfs/dbraw/zinc/29/53/05/565295305.db2.gz VEHLXHZNPXPMJM-UHFFFAOYSA-N 0 1 381.249 3.367 10 0 GGAEMN CN(CC1(O)CCCCCC1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000186908609 565295363 /nfs/dbraw/zinc/29/53/63/565295363.db2.gz IICOEXOFFJGBST-UHFFFAOYSA-N 0 1 380.286 3.483 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCc2c(Cl)cc(F)cc2C1 ZINC000296078573 565301538 /nfs/dbraw/zinc/30/15/38/565301538.db2.gz OLQGITAWYOBUJO-UHFFFAOYSA-N 0 1 375.903 3.296 10 0 GGAEMN CC(C)(CC(=O)N[C@H](c1nn[nH]n1)c1ccc(Cl)c(F)c1)C(F)(F)F ZINC000373819133 565305097 /nfs/dbraw/zinc/30/50/97/565305097.db2.gz JQPPOOZNSKPFKU-NSHDSACASA-N 0 1 379.745 3.176 10 0 GGAEMN C[C@H](CC(=O)NCCCCN1CCOCC1)c1ccc(Br)cc1 ZINC000162121046 565305340 /nfs/dbraw/zinc/30/53/40/565305340.db2.gz YMZVZZQJBBDTDG-OAHLLOKOSA-N 0 1 383.330 3.171 10 0 GGAEMN Cc1nnc(SCCC(=O)N2C[C@H](c3cccc(Cl)c3)OC[C@H]2C)[nH]1 ZINC000187049394 565305517 /nfs/dbraw/zinc/30/55/17/565305517.db2.gz FMYWRPAAYKREOG-IAQYHMDHSA-N 0 1 380.901 3.237 10 0 GGAEMN COC(=O)c1ccc(CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cc1Cl ZINC000296235329 565307480 /nfs/dbraw/zinc/30/74/80/565307480.db2.gz HXBHVUQKVZTCOL-LBPRGKRZSA-N 0 1 381.881 3.381 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C ZINC000187177213 565314885 /nfs/dbraw/zinc/31/48/85/565314885.db2.gz ISHQLGLNAUAUGL-ZWNOBZJWSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@]2(CCO[C@H](C)C2)O1 ZINC000374017445 565316503 /nfs/dbraw/zinc/31/65/03/565316503.db2.gz KYZBCWLSSQKIJM-SNUQEOBHSA-N 0 1 394.313 3.484 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)CCOc2ccc(C)cc2Br)n[nH]1 ZINC000162456339 565317696 /nfs/dbraw/zinc/31/76/96/565317696.db2.gz WDKLYTOYHLHKKU-LBPRGKRZSA-N 0 1 380.286 3.305 10 0 GGAEMN C[C@@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1ncc(Br)cc1F ZINC000187248768 565318987 /nfs/dbraw/zinc/31/89/87/565318987.db2.gz PMCSKMMOPUBWQC-DGCLKSJQSA-N 0 1 382.281 3.036 10 0 GGAEMN CS(=O)(=O)c1cccc(Cl)c1CN[C@H]1CCOC2(CCSCC2)C1 ZINC000273461454 565321470 /nfs/dbraw/zinc/32/14/70/565321470.db2.gz MYRVKGZNURMXRD-ZDUSSCGKSA-N 0 1 389.970 3.278 10 0 GGAEMN CN(C)Cc1cc(CNCc2c(Cl)cccc2S(C)(=O)=O)ccc1F ZINC000273503921 565323644 /nfs/dbraw/zinc/32/36/44/565323644.db2.gz ZCVYDFADGBJKQF-UHFFFAOYSA-N 0 1 384.904 3.234 10 0 GGAEMN C[C@@H](N[C@@H]1CCCN(c2cccnn2)C1)c1ncc(Br)cc1F ZINC000187344567 565325444 /nfs/dbraw/zinc/32/54/44/565325444.db2.gz JOYVKTBAXQXIJP-DGCLKSJQSA-N 0 1 380.265 3.093 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(F)cc1Br ZINC000162845133 565329900 /nfs/dbraw/zinc/32/99/00/565329900.db2.gz LDIKRWUOOYPBEA-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cc(F)ccc1Br ZINC000162858362 565330237 /nfs/dbraw/zinc/33/02/37/565330237.db2.gz VWNRFBYRDLSTBQ-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN O=C(NCC[C@H]1C(=O)Nc2ccccc21)c1cc(Br)cc2nc[nH]c21 ZINC000374302291 565330799 /nfs/dbraw/zinc/33/07/99/565330799.db2.gz MQVHVHOGLNPEKK-GFCCVEGCSA-N 0 1 399.248 3.181 10 0 GGAEMN CC(C)S(=O)(=O)CCCN[C@@H]1CCOc2c(Br)cccc21 ZINC000374302923 565331396 /nfs/dbraw/zinc/33/13/96/565331396.db2.gz PZCCOFUIDLCECK-CQSZACIVSA-N 0 1 376.316 3.076 10 0 GGAEMN CC(C)S(=O)(=O)CCCN[C@H]1CCOc2c(Br)cccc21 ZINC000374302922 565331560 /nfs/dbraw/zinc/33/15/60/565331560.db2.gz PZCCOFUIDLCECK-AWEZNQCLSA-N 0 1 376.316 3.076 10 0 GGAEMN Cc1ccc(Cl)cc1NC(=O)CN[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000163062077 565334697 /nfs/dbraw/zinc/33/46/97/565334697.db2.gz YQUWKSNCOUXGCM-CYBMUJFWSA-N 0 1 380.897 3.341 10 0 GGAEMN Cc1ccc(NC(=O)CN[C@H](C)c2ccc(S(C)(=O)=O)cc2)cc1Cl ZINC000163069255 565336651 /nfs/dbraw/zinc/33/66/51/565336651.db2.gz CJULDACDWDXPKZ-CYBMUJFWSA-N 0 1 380.897 3.341 10 0 GGAEMN CSc1cccc(NC(=O)CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c1 ZINC000163129544 565338011 /nfs/dbraw/zinc/33/80/11/565338011.db2.gz XJXKYWNVAWEJRU-ZDUSSCGKSA-N 0 1 378.519 3.101 10 0 GGAEMN Cc1cc(F)cc([C@]2(F)CCN(C(=O)CSc3n[nH]c(=S)s3)C2)c1 ZINC000374483381 565341706 /nfs/dbraw/zinc/34/17/06/565341706.db2.gz HDDACHNNXJHUHF-HNNXBMFYSA-N 0 1 387.502 3.464 10 0 GGAEMN COc1cc(Br)ccc1CN[C@H](C)c1ccc(-n2cnnn2)cc1 ZINC000187574174 565343136 /nfs/dbraw/zinc/34/31/36/565343136.db2.gz WZHNSEXINYOTJM-GFCCVEGCSA-N 0 1 388.269 3.284 10 0 GGAEMN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccccc1Cl ZINC000163470489 565346668 /nfs/dbraw/zinc/34/66/68/565346668.db2.gz DWVGHZGCYILNNE-STQMWFEESA-N 0 1 380.897 3.421 10 0 GGAEMN CC(C)c1nc(CNC(=O)N[C@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000296957247 565347793 /nfs/dbraw/zinc/34/77/93/565347793.db2.gz AUVPJPVQBSKUFL-LLVKDONJSA-N 0 1 380.290 3.121 10 0 GGAEMN O=C(Cc1cccc(Br)c1)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000163690882 565349479 /nfs/dbraw/zinc/34/94/79/565349479.db2.gz JMSDGRJRRHDHCB-UHFFFAOYSA-N 0 1 385.265 3.136 10 0 GGAEMN CS(=O)(=O)N1CC[C@@H](CN2CCc3sccc3[C@H]2c2cccs2)C1 ZINC000374774572 565354748 /nfs/dbraw/zinc/35/47/48/565354748.db2.gz BFRFWKQDHDWBNU-GUYCJALGSA-N 0 1 382.576 3.039 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(F)ccc1Br ZINC000374827022 565357101 /nfs/dbraw/zinc/35/71/01/565357101.db2.gz MQLPCKPPNVMEQG-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894631 565358893 /nfs/dbraw/zinc/35/88/93/565358893.db2.gz LTBXZSHDMYBWET-PBHICJAKSA-N 0 1 388.309 3.488 10 0 GGAEMN O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894855 565359054 /nfs/dbraw/zinc/35/90/54/565359054.db2.gz LTBXZSHDMYBWET-YOEHRIQHSA-N 0 1 388.309 3.488 10 0 GGAEMN C[C@@H]1CC[C@](CO)(N(C)Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000187938389 565364617 /nfs/dbraw/zinc/36/46/17/565364617.db2.gz KUUJYQHROCLIHL-PXAZEXFGSA-N 0 1 380.286 3.482 10 0 GGAEMN CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1csc(Cl)n1 ZINC000274398549 565370283 /nfs/dbraw/zinc/37/02/83/565370283.db2.gz CYHLOSMANNHVNE-UHFFFAOYSA-N 0 1 380.901 3.199 10 0 GGAEMN C[C@H]1CC[C@@](CO)(N(C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1 ZINC000188021700 565372023 /nfs/dbraw/zinc/37/20/23/565372023.db2.gz KRICNTFGPKTEAM-APPDUMDISA-N 0 1 376.831 3.363 10 0 GGAEMN C[C@@H]1CC[C@@](CO)(N(C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1 ZINC000188021678 565372595 /nfs/dbraw/zinc/37/25/95/565372595.db2.gz KRICNTFGPKTEAM-PIGZYNQJSA-N 0 1 376.831 3.363 10 0 GGAEMN Cc1nc([C@H](NC(=O)Nc2ccc(Br)nc2)c2ccccc2)n[nH]1 ZINC000166388815 565374709 /nfs/dbraw/zinc/37/47/09/565374709.db2.gz KWKXWUNLXPUKMF-CQSZACIVSA-N 0 1 387.241 3.182 10 0 GGAEMN COC(=O)c1cncc(NS(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)c1 ZINC000188092187 565377680 /nfs/dbraw/zinc/37/76/80/565377680.db2.gz YRTWLXNFHPSMBR-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN CC(C)c1nc(CNC(=O)N[C@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000297588058 565377860 /nfs/dbraw/zinc/37/78/60/565377860.db2.gz CXLDGVHBTAWNEO-LBPRGKRZSA-N 0 1 394.273 3.014 10 0 GGAEMN CC(C)c1nc(CNC(=O)N[C@@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000297588050 565377983 /nfs/dbraw/zinc/37/79/83/565377983.db2.gz CXLDGVHBTAWNEO-GFCCVEGCSA-N 0 1 394.273 3.014 10 0 GGAEMN NCc1cc(C(=O)N2CCC[C@H]2c2ccccc2I)co1 ZINC000375252729 565378348 /nfs/dbraw/zinc/37/83/48/565378348.db2.gz LZPCMSQDAGMDPU-HNNXBMFYSA-N 0 1 396.228 3.320 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC[C@]2(C1)CCCOC2 ZINC000375266973 565378439 /nfs/dbraw/zinc/37/84/39/565378439.db2.gz HOILDFLGDPMQDU-SFHVURJKSA-N 0 1 390.281 3.482 10 0 GGAEMN CO[C@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)CC[C@H]1C ZINC000188106365 565378933 /nfs/dbraw/zinc/37/89/33/565378933.db2.gz JBLKAOYAODNRPK-YPMHNXCESA-N 0 1 378.270 3.336 10 0 GGAEMN Fc1ccc(CNCc2cccc(N3CCOCC3)n2)cc1Br ZINC000274790511 565381474 /nfs/dbraw/zinc/38/14/74/565381474.db2.gz MLAYGMMZVXVBQM-UHFFFAOYSA-N 0 1 380.261 3.110 10 0 GGAEMN CN1CCN(c2ccc(Cl)cc2NS(=O)(=O)CCc2cccs2)CC1 ZINC000170609259 565383736 /nfs/dbraw/zinc/38/37/36/565383736.db2.gz SALOJMONHFAPHM-UHFFFAOYSA-N 0 1 399.969 3.138 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)C2(c3ccccc3Br)CC2)[nH]n1 ZINC000188161924 565384951 /nfs/dbraw/zinc/38/49/51/565384951.db2.gz XFAATKMHXHTWSD-UHFFFAOYSA-N 0 1 386.253 3.243 10 0 GGAEMN O=C(CN[C@@H](c1nnc[nH]1)c1ccccc1)Nc1ccc(Cl)cc1Cl ZINC000375544233 565394552 /nfs/dbraw/zinc/39/45/52/565394552.db2.gz DGBDLRVGARUHHZ-MRXNPFEDSA-N 0 1 376.247 3.429 10 0 GGAEMN CCOc1cc(CN[C@H]2CCCc3nn(C)cc32)cc(Br)c1O ZINC000298134242 565400272 /nfs/dbraw/zinc/40/02/72/565400272.db2.gz QGVFMEZVXODRDM-AWEZNQCLSA-N 0 1 380.286 3.454 10 0 GGAEMN CCCn1cc(CN2CCCN(Cc3cncc(Br)c3)CC2)cn1 ZINC000170944288 565401005 /nfs/dbraw/zinc/40/10/05/565401005.db2.gz REORVNPGAZXXDM-UHFFFAOYSA-N 0 1 392.345 3.159 10 0 GGAEMN Cc1noc(Cl)c1CC(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171099452 565409192 /nfs/dbraw/zinc/40/91/92/565409192.db2.gz ZZPIYDQBBUKPCK-UHFFFAOYSA-N 0 1 396.632 3.365 10 0 GGAEMN CN(C(=O)c1nc(Br)cs1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000275417266 565409761 /nfs/dbraw/zinc/40/97/61/565409761.db2.gz BUMJKMFALPHQNY-CYBMUJFWSA-N 0 1 380.311 3.252 10 0 GGAEMN CN(Cc1ccc(F)cc1Br)C1CCN(c2cnccn2)CC1 ZINC000375907810 565412929 /nfs/dbraw/zinc/41/29/29/565412929.db2.gz ZHJMBUHDSBWUEG-UHFFFAOYSA-N 0 1 379.277 3.479 10 0 GGAEMN O=C(c1cc(Br)cc(Br)c1)N1CCN2CCC1CC2 ZINC000188620463 565414225 /nfs/dbraw/zinc/41/42/25/565414225.db2.gz HAWQFAFCULLBAR-UHFFFAOYSA-N 0 1 388.103 3.132 10 0 GGAEMN Cc1c(Br)cccc1NC(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000171152923 565414645 /nfs/dbraw/zinc/41/46/45/565414645.db2.gz ZEKRHYDUONOGHA-ZDUSSCGKSA-N 0 1 396.329 3.475 10 0 GGAEMN O=C(CCN1CCC[C@H]1c1cc[nH]n1)Nc1ccc(Br)cc1F ZINC000298470371 565415633 /nfs/dbraw/zinc/41/56/33/565415633.db2.gz IQCWFUGBARAEFS-HNNXBMFYSA-N 0 1 381.249 3.477 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc(F)cc(F)c1 ZINC000171223020 565418606 /nfs/dbraw/zinc/41/86/06/565418606.db2.gz JWBORFCUVFRZIY-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc(F)cc(F)c1 ZINC000171223020 565418610 /nfs/dbraw/zinc/41/86/10/565418610.db2.gz JWBORFCUVFRZIY-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN Cc1ccccc1CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223825 565419333 /nfs/dbraw/zinc/41/93/33/565419333.db2.gz LRZOLKZESBJNQH-UHFFFAOYSA-N 0 1 385.265 3.402 10 0 GGAEMN Cc1ccccc1CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223825 565419341 /nfs/dbraw/zinc/41/93/41/565419341.db2.gz LRZOLKZESBJNQH-UHFFFAOYSA-N 0 1 385.265 3.402 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc(Cl)ccn1 ZINC000171223145 565419599 /nfs/dbraw/zinc/41/95/99/565419599.db2.gz OUXDWOPXAFWQRX-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc(Cl)ccn1 ZINC000171223145 565419604 /nfs/dbraw/zinc/41/96/04/565419604.db2.gz OUXDWOPXAFWQRX-UHFFFAOYSA-N 0 1 392.644 3.213 10 0 GGAEMN CN(Cc1ccco1)C(=O)CN[C@H]1CCOc2c(Br)cccc21 ZINC000298556553 565420237 /nfs/dbraw/zinc/42/02/37/565420237.db2.gz OUDSQIYVZYWJGI-HNNXBMFYSA-N 0 1 379.254 3.114 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)Nc1cc(Br)c[nH]c1=O)C2 ZINC000376056606 565420429 /nfs/dbraw/zinc/42/04/29/565420429.db2.gz OBIGDYDFZGJNSR-SECBINFHSA-N 0 1 379.258 3.140 10 0 GGAEMN CS(=O)(=O)c1cccc(Br)c1NC1CC(N2CCCCC2)C1 ZINC000376390450 565434183 /nfs/dbraw/zinc/43/41/83/565434183.db2.gz CQRSJOZUYCGEKO-UHFFFAOYSA-N 0 1 387.343 3.281 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)c(C)c1CN(C)CC1(CO)CC1 ZINC000188961400 565435666 /nfs/dbraw/zinc/43/56/66/565435666.db2.gz PRULDILVTKCAHE-UHFFFAOYSA-N 0 1 378.314 3.456 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCN(c2ccccc2)CC1 ZINC000171770930 565449077 /nfs/dbraw/zinc/44/90/77/565449077.db2.gz NIOCMEBGORBASL-UHFFFAOYSA-N 0 1 385.265 3.288 10 0 GGAEMN O=S(=O)(NCCc1nnc(-c2ccccc2)[nH]1)c1cc(Cl)ccc1Cl ZINC000189166757 565449038 /nfs/dbraw/zinc/44/90/38/565449038.db2.gz AMCMYJJBYILVEJ-UHFFFAOYSA-N 0 1 397.287 3.300 10 0 GGAEMN Cc1cnn([C@H]2CCCN(C(=O)c3[nH]nc4ccc(Br)cc43)C2)c1 ZINC000171810539 565451663 /nfs/dbraw/zinc/45/16/63/565451663.db2.gz SUFYFIDDDQTTDQ-ZDUSSCGKSA-N 0 1 388.269 3.308 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)Nc1ccccc1 ZINC000171822829 565453264 /nfs/dbraw/zinc/45/32/64/565453264.db2.gz ZVYFVPCWLWCPHK-SNVBAGLBSA-N 0 1 387.237 3.082 10 0 GGAEMN CN(Cc1nc2ccccc2n1C)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000171884530 565456319 /nfs/dbraw/zinc/45/63/19/565456319.db2.gz GENFAICMKNAWCE-UHFFFAOYSA-N 0 1 398.264 3.484 10 0 GGAEMN CC(=O)Nc1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cc1 ZINC000171951636 565458750 /nfs/dbraw/zinc/45/87/50/565458750.db2.gz JGNYPWUQINTSCD-UHFFFAOYSA-N 0 1 387.237 3.214 10 0 GGAEMN CN(Cc1nccn1C(F)F)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000171954746 565459207 /nfs/dbraw/zinc/45/92/07/565459207.db2.gz CSQKGCLEFPHCTI-UHFFFAOYSA-N 0 1 384.184 3.189 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1ccc2c(c1)CC(=O)N2 ZINC000171962018 565460488 /nfs/dbraw/zinc/46/04/88/565460488.db2.gz YXIPEJRGRGTBKY-VIFPVBQESA-N 0 1 399.248 3.311 10 0 GGAEMN O=C(Nc1ccccc1CN1CCC(O)CC1)c1ncc(Br)s1 ZINC000189363358 565460987 /nfs/dbraw/zinc/46/09/87/565460987.db2.gz DNJZUCZICPCBSG-UHFFFAOYSA-N 0 1 396.310 3.115 10 0 GGAEMN CCc1nc(CN2CCC(CN=c3nc([C@H](C)OC)[n-]s3)CC2)cs1 ZINC000377309017 565474733 /nfs/dbraw/zinc/47/47/33/565474733.db2.gz OUIOKNUVJLKVJB-LBPRGKRZSA-N 0 1 381.571 3.010 10 0 GGAEMN CCc1nc(C[NH+]2CCC(CN=c3[n-]c([C@H](C)OC)ns3)CC2)cs1 ZINC000377309017 565474736 /nfs/dbraw/zinc/47/47/36/565474736.db2.gz OUIOKNUVJLKVJB-LBPRGKRZSA-N 0 1 381.571 3.010 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCCC[C@@H]1c1ncon1 ZINC000189600869 565476333 /nfs/dbraw/zinc/47/63/33/565476333.db2.gz VJVZAQNDNVYKJA-CYBMUJFWSA-N 0 1 390.241 3.466 10 0 GGAEMN Cc1ccc([C@H]2COCCN2C(=O)c2[nH]nc3ccc(Br)cc32)o1 ZINC000172325505 565477810 /nfs/dbraw/zinc/47/78/10/565477810.db2.gz UKXXYXLNVNCXJC-CQSZACIVSA-N 0 1 390.237 3.441 10 0 GGAEMN Cc1cc(C[C@@H](C)N2C(=O)[C@H](c3cccc(Br)c3)N(C)C2=O)n[nH]1 ZINC000277258920 565486128 /nfs/dbraw/zinc/48/61/28/565486128.db2.gz IOHTYYUUPJNXNG-ABAIWWIYSA-N 0 1 391.269 3.047 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@@H]1CC=CCC1 ZINC000172485453 565488077 /nfs/dbraw/zinc/48/80/77/565488077.db2.gz ZERNRPDYQRSMMC-CYBMUJFWSA-N 0 1 376.258 3.142 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@@H]1CC=CCC1 ZINC000172485453 565488081 /nfs/dbraw/zinc/48/80/81/565488081.db2.gz ZERNRPDYQRSMMC-CYBMUJFWSA-N 0 1 376.258 3.142 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cc(Br)cs1 ZINC000189795267 565488830 /nfs/dbraw/zinc/48/88/30/565488830.db2.gz RMZWVKUUFVIJSH-UHFFFAOYSA-N 0 1 377.267 3.268 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)C2(c3ccccc3Br)CC2)C[C@H](C)O1 ZINC000189847768 565492129 /nfs/dbraw/zinc/49/21/29/565492129.db2.gz AFCYOXKJGVYIRC-GASCZTMLSA-N 0 1 395.341 3.096 10 0 GGAEMN CCCN(C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000172660226 565497911 /nfs/dbraw/zinc/49/79/11/565497911.db2.gz XKTZBLZEZVEBQQ-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN CCCN(C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000172660226 565497916 /nfs/dbraw/zinc/49/79/16/565497916.db2.gz XKTZBLZEZVEBQQ-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@@H](C)C(=O)NCC(F)(F)F ZINC000189971368 565499269 /nfs/dbraw/zinc/49/92/69/565499269.db2.gz VWXDGHHHNIZWNG-IUCAKERBSA-N 0 1 383.208 3.175 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@H](C)C(=O)NCC(F)(F)F ZINC000189971419 565499439 /nfs/dbraw/zinc/49/94/39/565499439.db2.gz VWXDGHHHNIZWNG-RKDXNWHRSA-N 0 1 383.208 3.175 10 0 GGAEMN CCOCCCNC(=O)[C@H](C)N[C@@H](C)c1ccc(Br)cc1OC ZINC000189976062 565499591 /nfs/dbraw/zinc/49/95/91/565499591.db2.gz ORNAINJSWRFEBP-STQMWFEESA-N 0 1 387.318 3.040 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@H](C)Cc1cc(C)[nH]n1 ZINC000189965762 565499642 /nfs/dbraw/zinc/49/96/42/565499642.db2.gz DWNHZNNIMWJYNR-ZYHUDNBSSA-N 0 1 395.301 3.481 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@H]1CCN(CC(F)(F)F)C1=O ZINC000189976257 565500732 /nfs/dbraw/zinc/50/07/32/565500732.db2.gz DMNQYOWXADCVLD-SKDRFNHKSA-N 0 1 395.219 3.272 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCCC[C@@H]3C2)c(Br)c1 ZINC000172801984 565505222 /nfs/dbraw/zinc/50/52/22/565505222.db2.gz YUDYCWNXCVQZRN-HUUCEWRRSA-N 0 1 380.330 3.255 10 0 GGAEMN Cc1cc(C[C@H](C)N2C(=O)N[C@@H](Cc3cc(Cl)cc(Cl)c3)C2=O)n[nH]1 ZINC000277563343 565506806 /nfs/dbraw/zinc/50/68/06/565506806.db2.gz ZXYILDRSQKXAOT-BONVTDFDSA-N 0 1 381.263 3.119 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N[C@@H]1COc2c1ccc(Cl)c2Cl ZINC000377971594 565506958 /nfs/dbraw/zinc/50/69/58/565506958.db2.gz WUUWOJBEZYAMLU-SSDOTTSWSA-N 0 1 394.330 3.476 10 0 GGAEMN O=C(N[C@@H]1CCc2c1cccc2Br)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378051243 565510154 /nfs/dbraw/zinc/51/01/54/565510154.db2.gz HJDXFQKBAHAHPT-QMTHXVAHSA-N 0 1 375.270 3.016 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)NC1(c2ccc(Br)cc2)CC1 ZINC000378113380 565513111 /nfs/dbraw/zinc/51/31/11/565513111.db2.gz PNTMPEFJYWLTHN-ZDUSSCGKSA-N 0 1 375.270 3.018 10 0 GGAEMN CC[C@H](Cc1cccc(Br)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378200158 565515848 /nfs/dbraw/zinc/51/58/48/565515848.db2.gz JZDCQNSYEHSUGD-UKRRQHHQSA-N 0 1 376.298 3.415 10 0 GGAEMN CCc1cnc(CCNC(=O)c2n[nH]c3ccc(Br)cc32)s1 ZINC000173032510 565521156 /nfs/dbraw/zinc/52/11/56/565521156.db2.gz RZQFBEQIDSKOCO-UHFFFAOYSA-N 0 1 379.283 3.317 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378310073 565521502 /nfs/dbraw/zinc/52/15/02/565521502.db2.gz NZDHCKOLPYZBGF-OCCSQVGLSA-N 0 1 376.298 3.415 10 0 GGAEMN OCCCN1CCN(c2ccc3cc(Br)cc(Cl)c3n2)CC1 ZINC000302018979 565525435 /nfs/dbraw/zinc/52/54/35/565525435.db2.gz MWLUQRROQFNMOE-UHFFFAOYSA-N 0 1 384.705 3.155 10 0 GGAEMN Cc1c(Br)c2ccccc2n1CC(=O)NC1(c2nnc[nH]2)CCC1 ZINC000190370992 565527058 /nfs/dbraw/zinc/52/70/58/565527058.db2.gz RWVOHOMWNMJCQN-UHFFFAOYSA-N 0 1 388.269 3.026 10 0 GGAEMN O=C(CCc1ccccc1Br)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000378530580 565532734 /nfs/dbraw/zinc/53/27/34/565532734.db2.gz RINKPTSUPJODTQ-QGZVFWFLSA-N 0 1 385.265 3.406 10 0 GGAEMN COc1cccc([C@H](C)N2CCC(NS(=O)(=O)c3cccs3)CC2)c1 ZINC000173186999 565535031 /nfs/dbraw/zinc/53/50/31/565535031.db2.gz YEYGLYHTQNBLJX-AWEZNQCLSA-N 0 1 380.535 3.261 10 0 GGAEMN COc1cc(Br)ccc1CN1CCC[C@@H]1C[C@H](O)c1cnn(C)c1 ZINC000378611334 565536494 /nfs/dbraw/zinc/53/64/94/565536494.db2.gz OYZQJJOZSCBXNM-SJORKVTESA-N 0 1 394.313 3.279 10 0 GGAEMN Cn1ncc(Br)c1CNC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000379632507 565538344 /nfs/dbraw/zinc/53/83/44/565538344.db2.gz NTFVCLDUFOMLOW-MRXNPFEDSA-N 0 1 377.330 3.327 10 0 GGAEMN CC[C@@H]1CN(c2nnc(Cc3ccc(Cl)cc3)s2)CCN1C[C@@H](C)O ZINC000302402657 565540704 /nfs/dbraw/zinc/54/07/04/565540704.db2.gz FXYNGQKLXOAURD-CZUORRHYSA-N 0 1 380.945 3.064 10 0 GGAEMN C[C@H]1CN(c2ccc3cc(Br)cc(Cl)c3n2)CCN1CCO ZINC000302409819 565541301 /nfs/dbraw/zinc/54/13/01/565541301.db2.gz LJDXZPAQKPOHLA-NSHDSACASA-N 0 1 384.705 3.154 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Br)cc2Cl)CCN1C ZINC000173269831 565542137 /nfs/dbraw/zinc/54/21/37/565542137.db2.gz PUBOOBQSTJJYGJ-PWSUYJOCSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CCN1C ZINC000173272724 565543231 /nfs/dbraw/zinc/54/32/31/565543231.db2.gz HYBJPSIASSRXPA-CMPLNLGQSA-N 0 1 384.851 3.462 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)cc1Cl ZINC000173274487 565543331 /nfs/dbraw/zinc/54/33/31/565543331.db2.gz XYLCTXOYTYUUCB-GHMZBOCLSA-N 0 1 381.325 3.105 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)cc1Cl ZINC000173274499 565543504 /nfs/dbraw/zinc/54/35/04/565543504.db2.gz XYLCTXOYTYUUCB-WDEREUQCSA-N 0 1 381.325 3.105 10 0 GGAEMN CN1CCN([C@H]2CCCCN(C(=O)CSc3ccccc3Cl)C2)CC1 ZINC000173283707 565544590 /nfs/dbraw/zinc/54/45/90/565544590.db2.gz FVBSNDXYLLKLOJ-INIZCTEOSA-N 0 1 381.973 3.061 10 0 GGAEMN CC[C@H]1CN(C)CCCN1S(=O)(=O)c1c(Cl)cccc1Br ZINC000386147380 565546993 /nfs/dbraw/zinc/54/69/93/565546993.db2.gz ZFMGCVGAOGRGAN-NSHDSACASA-N 0 1 395.750 3.207 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2ccc(Cl)nc2)[C@@H]1c1cccs1 ZINC000173323477 565547759 /nfs/dbraw/zinc/54/77/59/565547759.db2.gz FBVGAWAHKHZRQB-WMLDXEAASA-N 0 1 399.969 3.299 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2cccc(F)c2)[C@@H]1c1cccs1 ZINC000173322900 565547944 /nfs/dbraw/zinc/54/79/44/565547944.db2.gz OZUJXFWOVSOZJW-MAUKXSAKSA-N 0 1 382.526 3.390 10 0 GGAEMN COc1ccccc1S(=O)(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 ZINC000173323110 565548242 /nfs/dbraw/zinc/54/82/42/565548242.db2.gz OIKCNPWSRBVSBK-KBXCAEBGSA-N 0 1 380.535 3.118 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2cc(F)ccc2F)[C@@H]1c1cccs1 ZINC000173324954 565549197 /nfs/dbraw/zinc/54/91/97/565549197.db2.gz JWFYOMSIABNIJA-SJKOYZFVSA-N 0 1 386.489 3.388 10 0 GGAEMN CCc1n[nH]c(C2CCN(CC(=O)Nc3ccc(Cl)c(Cl)c3)CC2)n1 ZINC000190721211 565553842 /nfs/dbraw/zinc/55/38/42/565553842.db2.gz GLSAJIGKNAJYNY-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN CCc1nnc(C2CCN(CC(=O)Nc3ccc(Cl)c(Cl)c3)CC2)[nH]1 ZINC000190721211 565553843 /nfs/dbraw/zinc/55/38/43/565553843.db2.gz GLSAJIGKNAJYNY-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN Cc1csc(C(C)(C)NC[C@@H](O)COc2cccc(Br)c2)n1 ZINC000173425694 565557466 /nfs/dbraw/zinc/55/74/66/565557466.db2.gz GDNAUFAGFICONY-CYBMUJFWSA-N 0 1 385.327 3.479 10 0 GGAEMN CCn1cc([C@H]2CN(Cc3nc4ccc(Br)cc4[nH]3)CCO2)cn1 ZINC000190832214 565562059 /nfs/dbraw/zinc/56/20/59/565562059.db2.gz RSORXASEBQBMDO-MRXNPFEDSA-N 0 1 390.285 3.115 10 0 GGAEMN Cn1ncc(Br)c1CNCCc1nc(-c2cccc(Cl)c2)no1 ZINC000278486979 565562248 /nfs/dbraw/zinc/56/22/48/565562248.db2.gz LOMYNGLOXFIRNF-UHFFFAOYSA-N 0 1 396.676 3.218 10 0 GGAEMN COCCN(C)c1ccc(CNCc2cc(F)cc(Br)c2)cn1 ZINC000190842336 565562784 /nfs/dbraw/zinc/56/27/84/565562784.db2.gz WAVNUMKNHCNRIB-UHFFFAOYSA-N 0 1 382.277 3.356 10 0 GGAEMN Cc1csc(C(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c1Br ZINC000190892683 565568306 /nfs/dbraw/zinc/56/83/06/565568306.db2.gz ULDQXDDKGYUOSV-GFCCVEGCSA-N 0 1 387.343 3.144 10 0 GGAEMN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173660691 565574510 /nfs/dbraw/zinc/57/45/10/565574510.db2.gz WACHWZHZXKQZSM-WCQYABFASA-N 0 1 378.270 3.190 10 0 GGAEMN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000173660468 565574974 /nfs/dbraw/zinc/57/49/74/565574974.db2.gz JPAUVNKFKXMLGQ-WCQYABFASA-N 0 1 378.270 3.190 10 0 GGAEMN FC(F)(F)c1cnc(CNC[C@@H](c2cccs2)N2CCOCC2)s1 ZINC000278767737 565576805 /nfs/dbraw/zinc/57/68/05/565576805.db2.gz YAVNMIKIQSOPTL-NSHDSACASA-N 0 1 377.457 3.387 10 0 GGAEMN OC[C@H]1CCC[C@H](NCc2ncc(Br)cc2Br)C1 ZINC000310710417 565579462 /nfs/dbraw/zinc/57/94/62/565579462.db2.gz CBSKYMXGNFCZPA-ONGXEEELSA-N 0 1 378.108 3.247 10 0 GGAEMN Brc1cccnc1N1CCO[C@@H]2CCN(Cc3ccccc3)C[C@@H]21 ZINC000404170425 565582921 /nfs/dbraw/zinc/58/29/21/565582921.db2.gz XOTKQUYJINJMDN-ZWKOTPCHSA-N 0 1 388.309 3.324 10 0 GGAEMN COCCN(Cc1cccnc1)C[C@H](O)COc1c(Cl)cccc1Cl ZINC000191107097 565583229 /nfs/dbraw/zinc/58/32/29/565583229.db2.gz VNPSCTJNXGLTQU-HNNXBMFYSA-N 0 1 385.291 3.277 10 0 GGAEMN C[C@H]1[C@H](NC(=O)c2nscc2Br)CCN1Cc1ccccc1 ZINC000404939382 565583587 /nfs/dbraw/zinc/58/35/87/565583587.db2.gz LKIIDWPMOUFQJR-SMDDNHRTSA-N 0 1 380.311 3.298 10 0 GGAEMN C[C@@H]1[C@@H](NC(=O)c2nscc2Br)CCN1Cc1ccccc1 ZINC000404939381 565583940 /nfs/dbraw/zinc/58/39/40/565583940.db2.gz LKIIDWPMOUFQJR-RISCZKNCSA-N 0 1 380.311 3.298 10 0 GGAEMN C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2nscc2Br)C1 ZINC000404700918 565584513 /nfs/dbraw/zinc/58/45/13/565584513.db2.gz FDWZUCSWQFCEEK-ZDUSSCGKSA-N 0 1 394.338 3.500 10 0 GGAEMN C[C@@H](CN1CCCCC1)NS(=O)(=O)c1c(Cl)cccc1Br ZINC000314242192 565585726 /nfs/dbraw/zinc/58/57/26/565585726.db2.gz RNSUHKVBCVFUKS-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN C[C@@H](CCNCc1cc(Cl)ccc1I)[S@@](C)=O ZINC000405280398 565585836 /nfs/dbraw/zinc/58/58/36/565585836.db2.gz BCJXVCAORBXWBC-HUTHGQBESA-N 0 1 385.698 3.191 10 0 GGAEMN C[C@@H](NCCN1CCCC1=O)c1ccc(Br)cc1Br ZINC000405371460 565587054 /nfs/dbraw/zinc/58/70/54/565587054.db2.gz CJQYSYVDMSLIHN-SNVBAGLBSA-N 0 1 390.119 3.485 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3ccc(Br)s3)C2)n[nH]1 ZINC000407975269 565588146 /nfs/dbraw/zinc/58/81/46/565588146.db2.gz FWSQOMANPKBUCI-JTQLQIEISA-N 0 1 390.328 3.110 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2cccc(Cl)c2Cl)n[nH]1 ZINC000407975033 565588220 /nfs/dbraw/zinc/58/82/20/565588220.db2.gz FOCZTRFNDIVVCU-NSHDSACASA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2ccc(Cl)c(F)c2Cl)n[nH]1 ZINC000407974806 565588252 /nfs/dbraw/zinc/58/82/52/565588252.db2.gz DEBGZAHEXLSVLM-JTQLQIEISA-N 0 1 393.271 3.475 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3cc(C)cc(Br)c3)C2)n[nH]1 ZINC000407974982 565588633 /nfs/dbraw/zinc/58/86/33/565588633.db2.gz DWRZZCMSIOWEGM-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3ccc(C)c(Br)c3)C2)n[nH]1 ZINC000407977835 565589142 /nfs/dbraw/zinc/58/91/42/565589142.db2.gz UOTDSPIMXSABSD-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2ccc(Br)cc2C)n[nH]1 ZINC000407977976 565589320 /nfs/dbraw/zinc/58/93/20/565589320.db2.gz UUDNBCDABJPROH-ZDUSSCGKSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3cccc(C)c3Br)C2)n[nH]1 ZINC000407978389 565589401 /nfs/dbraw/zinc/58/94/01/565589401.db2.gz XWBHTSJPCMROAY-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3ccc(C)c(Br)c3)C2)n[nH]1 ZINC000407977836 565589847 /nfs/dbraw/zinc/58/98/47/565589847.db2.gz UOTDSPIMXSABSD-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@H]2CCC[C@@H]21 ZINC000408098479 565594245 /nfs/dbraw/zinc/59/42/45/565594245.db2.gz VAXNZYJQLWOLHZ-STQMWFEESA-N 0 1 376.254 3.233 10 0 GGAEMN COc1ccc(-c2n[nH]c(SCC(=O)NC(C)(C)C)n2)cc1Br ZINC000191313299 565595697 /nfs/dbraw/zinc/59/56/97/565595697.db2.gz CUHMMSFSOMJPFA-UHFFFAOYSA-N 0 1 399.314 3.250 10 0 GGAEMN CCc1[nH]ncc1C(=O)Nc1cc(Br)cc(C(=O)N2CCCC2)c1 ZINC000279127393 565596917 /nfs/dbraw/zinc/59/69/17/565596917.db2.gz DOHOFKQVQBOJRG-UHFFFAOYSA-N 0 1 391.269 3.223 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000408145646 565597061 /nfs/dbraw/zinc/59/70/61/565597061.db2.gz JUOPSGJWPHBTFJ-CYBMUJFWSA-N 0 1 399.314 3.100 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCO[C@H]2CCCC[C@@H]21 ZINC000408195148 565598449 /nfs/dbraw/zinc/59/84/49/565598449.db2.gz LLBWBDYYDHMLGI-HOTGVXAUSA-N 0 1 391.265 3.074 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCO[C@@H]2CCCC[C@@H]21 ZINC000408195150 565598525 /nfs/dbraw/zinc/59/85/25/565598525.db2.gz LLBWBDYYDHMLGI-JKSUJKDBSA-N 0 1 391.265 3.074 10 0 GGAEMN CC(C)(C)[C@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@@H]1O ZINC000408211917 565599519 /nfs/dbraw/zinc/59/95/19/565599519.db2.gz SAMPNHMTUJLFIZ-JSGCOSHPSA-N 0 1 380.286 3.195 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)C[C@@H]1C ZINC000408209893 565599748 /nfs/dbraw/zinc/59/97/48/565599748.db2.gz WSPZDXSLCJDRFQ-MKBNYLNASA-N 0 1 386.323 3.077 10 0 GGAEMN CC(C)(C)[C@@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@H]1O ZINC000408211919 565599763 /nfs/dbraw/zinc/59/97/63/565599763.db2.gz SAMPNHMTUJLFIZ-TZMCWYRMSA-N 0 1 380.286 3.195 10 0 GGAEMN O=S(=O)(N[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Br)o1 ZINC000408216061 565599828 /nfs/dbraw/zinc/59/98/28/565599828.db2.gz SSORVSRBCOVDGG-SFYZADRCSA-N 0 1 376.194 3.442 10 0 GGAEMN Cc1nc2c(n1[C@H]1CCN(C(=O)c3ncccc3Br)C1)CCCC2 ZINC000408320486 565604280 /nfs/dbraw/zinc/60/42/80/565604280.db2.gz OIYPKHCGPKBEJP-ZDUSSCGKSA-N 0 1 389.297 3.315 10 0 GGAEMN Cc1nc2c(n1[C@@H]1CCN(C(=O)c3ncccc3Br)C1)CCCC2 ZINC000408320485 565604303 /nfs/dbraw/zinc/60/43/03/565604303.db2.gz OIYPKHCGPKBEJP-CYBMUJFWSA-N 0 1 389.297 3.315 10 0 GGAEMN Cc1nn(C)c(C)c1C[C@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000174003987 565605405 /nfs/dbraw/zinc/60/54/05/565605405.db2.gz RDXQDXYXNLJHRC-VIFPVBQESA-N 0 1 390.285 3.037 10 0 GGAEMN C[C@H]1CCSCCN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000408443011 565609792 /nfs/dbraw/zinc/60/97/92/565609792.db2.gz OAWRFEKIZJXHMK-JTQLQIEISA-N 0 1 381.295 3.258 10 0 GGAEMN C[C@H]1CSCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C1 ZINC000408440733 565609894 /nfs/dbraw/zinc/60/98/94/565609894.db2.gz FSUWZRKKKRRGKJ-SNVBAGLBSA-N 0 1 381.295 3.116 10 0 GGAEMN CNC(=O)C[C@@H](C)N[C@@H](C)c1ccc(Br)cc1Br ZINC000323078955 565612370 /nfs/dbraw/zinc/61/23/70/565612370.db2.gz YITVZEKDKOEGHT-BDAKNGLRSA-N 0 1 378.108 3.387 10 0 GGAEMN CNC(=O)C[C@@H](C)N[C@H](C)c1ccc(Br)cc1Br ZINC000323078962 565613144 /nfs/dbraw/zinc/61/31/44/565613144.db2.gz YITVZEKDKOEGHT-RKDXNWHRSA-N 0 1 378.108 3.387 10 0 GGAEMN CNC(=O)C[C@H](C)N[C@@H](C)c1ccc(Br)cc1Br ZINC000323078959 565613236 /nfs/dbraw/zinc/61/32/36/565613236.db2.gz YITVZEKDKOEGHT-IUCAKERBSA-N 0 1 378.108 3.387 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc3cc(Br)ccc3c2)CC1 ZINC000325482056 565621726 /nfs/dbraw/zinc/62/17/26/565621726.db2.gz IECWOXYQQLYGQA-UHFFFAOYSA-N 0 1 391.309 3.397 10 0 GGAEMN Cc1cc(C)cc(CS(=O)(=O)NCC2(N3CCSCC3)CCCC2)c1 ZINC000409567207 565624297 /nfs/dbraw/zinc/62/42/97/565624297.db2.gz KKMLJZUIFGPLPB-UHFFFAOYSA-N 0 1 382.595 3.084 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)[C@H]2COc3ccc(Br)cc32)n[nH]1 ZINC000328664203 565637284 /nfs/dbraw/zinc/63/72/84/565637284.db2.gz BKQYKYZVHJADKI-KBPBESRZSA-N 0 1 391.269 3.105 10 0 GGAEMN Cc1csc([C@@H]2CCCCN2CC2=Nc3ccccc3S(=O)(=O)N2)n1 ZINC000328860509 565644812 /nfs/dbraw/zinc/64/48/12/565644812.db2.gz LKUWWXJQYQHMPG-AWEZNQCLSA-N 0 1 376.507 3.001 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2cc3sc(N4CCCC4)nc3s2)n[nH]1 ZINC000280025873 565646854 /nfs/dbraw/zinc/64/68/54/565646854.db2.gz UMBVUYOSJBDXFR-JTQLQIEISA-N 0 1 375.523 3.351 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)CCN1C[C@@H](C)O ZINC000174624569 565648249 /nfs/dbraw/zinc/64/82/49/565648249.db2.gz MMQLCUWDJVDUPZ-DTZQCDIJSA-N 0 1 385.335 3.401 10 0 GGAEMN CC[N@H+]1CC[C@@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)[C@H](C)C1 ZINC000174774061 565657472 /nfs/dbraw/zinc/65/74/72/565657472.db2.gz WNKKKCAEURTFFP-CZUORRHYSA-N 0 1 393.380 3.429 10 0 GGAEMN O=C1[C@H]([N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235704 565659680 /nfs/dbraw/zinc/65/96/80/565659680.db2.gz IUCQIJGWKMRBJU-IAQYHMDHSA-N 0 1 380.279 3.096 10 0 GGAEMN O=C1[C@@H]([N@@H+]2CCC[C@H](c3nnc[nH]3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235705 565659724 /nfs/dbraw/zinc/65/97/24/565659724.db2.gz IUCQIJGWKMRBJU-NHYWBVRUSA-N 0 1 380.279 3.096 10 0 GGAEMN C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000329299961 565661952 /nfs/dbraw/zinc/66/19/52/565661952.db2.gz VHWFPNVSFPFBDZ-SWLSCSKDSA-N 0 1 397.953 3.321 10 0 GGAEMN C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000329299959 565662119 /nfs/dbraw/zinc/66/21/19/565662119.db2.gz VHWFPNVSFPFBDZ-IUODEOHRSA-N 0 1 397.953 3.321 10 0 GGAEMN COC(=O)c1ccc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000192159519 565664235 /nfs/dbraw/zinc/66/42/35/565664235.db2.gz YUHFTMJAUTTYFD-YOEHRIQHSA-N 0 1 378.881 3.250 10 0 GGAEMN COC(=O)c1ccc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000192159506 565664405 /nfs/dbraw/zinc/66/44/05/565664405.db2.gz YUHFTMJAUTTYFD-PBHICJAKSA-N 0 1 378.881 3.250 10 0 GGAEMN Clc1cc(CNCc2cccnc2-n2cncn2)ccc1Br ZINC000192165941 565664923 /nfs/dbraw/zinc/66/49/23/565664923.db2.gz JNYHSOXYCNIIMA-UHFFFAOYSA-N 0 1 378.661 3.368 10 0 GGAEMN O=C(Cn1c(=O)[nH]c2ccccc21)Nc1cc(Cl)cc(Br)c1O ZINC000174913336 565666290 /nfs/dbraw/zinc/66/62/90/565666290.db2.gz TVSHSUHGABTHCT-UHFFFAOYSA-N 0 1 396.628 3.090 10 0 GGAEMN Cc1ccn2ncc(C(=O)Nc3cc(Cl)cc(Br)c3O)c2n1 ZINC000174915241 565666461 /nfs/dbraw/zinc/66/64/61/565666461.db2.gz KEXQTHMPZAWLDF-UHFFFAOYSA-N 0 1 381.617 3.412 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)[C@H]1C ZINC000174922290 565667419 /nfs/dbraw/zinc/66/74/19/565667419.db2.gz XETPODSNAKRDTG-QWRGUYRKSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)[C@H]1C ZINC000174922290 565667422 /nfs/dbraw/zinc/66/74/22/565667422.db2.gz XETPODSNAKRDTG-QWRGUYRKSA-N 0 1 378.274 3.174 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000329548885 565669586 /nfs/dbraw/zinc/66/95/86/565669586.db2.gz BJDVRCAUFJOUOZ-HOCLYGCPSA-N 0 1 390.281 3.499 10 0 GGAEMN CC1(C)[C@H](NC(=O)c2n[nH]c3ccc(Br)cc32)[C@@H]2CCCO[C@@H]21 ZINC000329733486 565677714 /nfs/dbraw/zinc/67/77/14/565677714.db2.gz QUHIJJWMJMTNSD-VQISRLSMSA-N 0 1 378.270 3.259 10 0 GGAEMN CC1(C)CN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C[C@]2(CCOC2)O1 ZINC000280542357 565678521 /nfs/dbraw/zinc/67/85/21/565678521.db2.gz NDQQROQPWUMONK-KRWDZBQOSA-N 0 1 381.885 3.202 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)NCCc1coc(-c2ccc(F)cc2)n1 ZINC000175099758 565679051 /nfs/dbraw/zinc/67/90/51/565679051.db2.gz HJHPSKQSAPSVAM-UHFFFAOYSA-N 0 1 396.494 3.446 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2cc(F)c(Br)cc2Cl)c1 ZINC000410400055 565682940 /nfs/dbraw/zinc/68/29/40/565682940.db2.gz YDYIDHHEEVGMGL-UHFFFAOYSA-N 0 1 382.642 3.259 10 0 GGAEMN C[C@@H]1C(=O)NCCCN1C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1 ZINC000329935387 565685980 /nfs/dbraw/zinc/68/59/80/565685980.db2.gz KICXRCLMRLVDGP-SNVBAGLBSA-N 0 1 377.242 3.030 10 0 GGAEMN O=C(NCCCCN1CCOCC1)NCCCc1ccc(Cl)cc1Cl ZINC000175288884 565690561 /nfs/dbraw/zinc/69/05/61/565690561.db2.gz GWODQAWAULITLU-UHFFFAOYSA-N 0 1 388.339 3.338 10 0 GGAEMN O=C1C[C@]2(CCN(Cc3ccc(OC(F)(F)F)c(Br)c3)C2)CN1 ZINC000280731885 565691089 /nfs/dbraw/zinc/69/10/89/565691089.db2.gz YVZRMBGGRFXMRR-CQSZACIVSA-N 0 1 393.203 3.060 10 0 GGAEMN CC[C@@H]1CN(C[C@@H](O)COc2c(Cl)cccc2Cl)C[C@]2(CCOC2)O1 ZINC000330083010 565691046 /nfs/dbraw/zinc/69/10/46/565691046.db2.gz BEZAHNRFVXMCCA-LBTNJELSSA-N 0 1 390.307 3.003 10 0 GGAEMN C[C@@H](N[C@@H]1CCCc2occc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280777991 565694466 /nfs/dbraw/zinc/69/44/66/565694466.db2.gz SBZZHZOJRHOUNJ-QMTHXVAHSA-N 0 1 399.310 3.418 10 0 GGAEMN CCN1CCC[C@@H]1CN(C)S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000175400637 565697760 /nfs/dbraw/zinc/69/77/60/565697760.db2.gz DPJFPIJZCVXELL-LLVKDONJSA-N 0 1 384.851 3.464 10 0 GGAEMN CN1CC[C@H]2OCCN(C(=O)c3cc(Cl)c4cc(Cl)ccc4n3)[C@@H]2C1 ZINC000410844751 565698022 /nfs/dbraw/zinc/69/80/22/565698022.db2.gz CONCCVDXLSYKOW-IAGOWNOFSA-N 0 1 380.275 3.087 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NCC(F)(F)F)cc2)c(C)s1 ZINC000192552186 565699398 /nfs/dbraw/zinc/69/93/98/565699398.db2.gz JQXRVTMHUYTDBP-UHFFFAOYSA-N 0 1 392.424 3.458 10 0 GGAEMN Brc1ccc(-c2nc(CNCc3cnn4ccccc34)n[nH]2)cc1 ZINC000175717161 565719190 /nfs/dbraw/zinc/71/91/90/565719190.db2.gz YDQXRAOLRTURFD-UHFFFAOYSA-N 0 1 383.253 3.172 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNCc3cnn4ccccc34)n2)cc1 ZINC000175717161 565719194 /nfs/dbraw/zinc/71/91/94/565719194.db2.gz YDQXRAOLRTURFD-UHFFFAOYSA-N 0 1 383.253 3.172 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)CN1CCC[C@H](C(F)(F)F)C1 ZINC000192924629 565719839 /nfs/dbraw/zinc/71/98/39/565719839.db2.gz CKHSMYFKNWSPAA-WCQYABFASA-N 0 1 382.220 3.463 10 0 GGAEMN C[C@@H](C(=O)OC(C)(C)C)N(C)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000175732066 565720162 /nfs/dbraw/zinc/72/01/62/565720162.db2.gz XWHAPWWHBUAQJO-VIFPVBQESA-N 0 1 382.258 3.128 10 0 GGAEMN O=S(=O)([N-]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1c(F)cccc1Cl ZINC000192979664 565722431 /nfs/dbraw/zinc/72/24/31/565722431.db2.gz VEQVWFUDCVVBFU-OAHLLOKOSA-N 0 1 382.888 3.280 10 0 GGAEMN O=S(=O)([N-]C[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(F)cccc1Cl ZINC000192979664 565722435 /nfs/dbraw/zinc/72/24/35/565722435.db2.gz VEQVWFUDCVVBFU-OAHLLOKOSA-N 0 1 382.888 3.280 10 0 GGAEMN CC(C)COC1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2O)CC1 ZINC000330802342 565723630 /nfs/dbraw/zinc/72/36/30/565723630.db2.gz HIHYWBSORWFBLW-UHFFFAOYSA-N 0 1 381.416 3.237 10 0 GGAEMN C[C@@H]1CC[C@@H](CCC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)O1 ZINC000175911366 565733833 /nfs/dbraw/zinc/73/38/33/565733833.db2.gz WKBXOJOHOGFICA-RISCZKNCSA-N 0 1 393.285 3.198 10 0 GGAEMN C[C@@H]1CC[C@@H](CCC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)O1 ZINC000175911366 565733837 /nfs/dbraw/zinc/73/38/37/565733837.db2.gz WKBXOJOHOGFICA-RISCZKNCSA-N 0 1 393.285 3.198 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1CCC(=O)Nc1ccccc1Br ZINC000411612792 565739849 /nfs/dbraw/zinc/73/98/49/565739849.db2.gz FAUOYHCXYDKTHV-XNJGSVPQSA-N 0 1 395.297 3.051 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCC(=O)Nc1ccccc1Br ZINC000411612787 565740258 /nfs/dbraw/zinc/74/02/58/565740258.db2.gz FAUOYHCXYDKTHV-DCGLDWPTSA-N 0 1 395.297 3.051 10 0 GGAEMN COC(=O)c1cc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)cs1 ZINC000411630799 565741133 /nfs/dbraw/zinc/74/11/33/565741133.db2.gz KFIOUBAJEBMCCR-PBHICJAKSA-N 0 1 378.881 3.250 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000281813019 565750347 /nfs/dbraw/zinc/75/03/47/565750347.db2.gz GZNOUWDIOVHPBC-MEBBXXQBSA-N 0 1 393.285 3.235 10 0 GGAEMN Cc1nnc([C@H](C)N2CC[C@@H](Cc3cccc(I)c3)C2)[nH]1 ZINC000411776819 565751274 /nfs/dbraw/zinc/75/12/74/565751274.db2.gz XYZXHZJYVLVXSY-FZMZJTMJSA-N 0 1 396.276 3.343 10 0 GGAEMN Cc1nnc([C@@H](C)N2CC[C@@H](Cc3cccc(I)c3)C2)[nH]1 ZINC000411776820 565751494 /nfs/dbraw/zinc/75/14/94/565751494.db2.gz XYZXHZJYVLVXSY-RISCZKNCSA-N 0 1 396.276 3.343 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@@H](C)C(=O)N1CCC(C(N)=O)CC1 ZINC000331283072 565752044 /nfs/dbraw/zinc/75/20/44/565752044.db2.gz DPUZESUGZMRXFH-ZDUSSCGKSA-N 0 1 396.329 3.352 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@H](C)C(=O)N1CCC(C(N)=O)CC1 ZINC000331283071 565752234 /nfs/dbraw/zinc/75/22/34/565752234.db2.gz DPUZESUGZMRXFH-CYBMUJFWSA-N 0 1 396.329 3.352 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@@H](C)C(=O)N1CCC[C@@H](C(N)=O)C1 ZINC000331292644 565752557 /nfs/dbraw/zinc/75/25/57/565752557.db2.gz LNBZACBZYFFWDN-DZGCQCFKSA-N 0 1 396.329 3.352 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@@H](C)C(=O)N1CCC[C@H](C(N)=O)C1 ZINC000331293237 565753148 /nfs/dbraw/zinc/75/31/48/565753148.db2.gz LNBZACBZYFFWDN-ZFWWWQNUSA-N 0 1 396.329 3.352 10 0 GGAEMN NC(=O)CCN(Cc1ccc(Br)cn1)[C@H]1CCOc2ccccc21 ZINC000411792248 565753950 /nfs/dbraw/zinc/75/39/50/565753950.db2.gz QXMLRUNZGJFAQT-INIZCTEOSA-N 0 1 390.281 3.045 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)cc2Br)CCN1C ZINC000281939799 565756182 /nfs/dbraw/zinc/75/61/82/565756182.db2.gz QOCDFIZDTFYZKI-ZYHUDNBSSA-N 0 1 395.750 3.206 10 0 GGAEMN O=S(=O)(NCCC[C@@H]1CCCC[C@H]1O)c1cc(C(F)(F)F)ccc1O ZINC000331352282 565756664 /nfs/dbraw/zinc/75/66/64/565756664.db2.gz ZHBKMTWUHFDOEI-WCQYABFASA-N 0 1 381.416 3.021 10 0 GGAEMN O=c1nc(CNC2(CO)CCSCC2)[nH]c2scc(-c3ccco3)c21 ZINC000411827239 565757576 /nfs/dbraw/zinc/75/75/76/565757576.db2.gz UAGQOXFWWKKFHO-UHFFFAOYSA-N 0 1 377.491 3.005 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000281977012 565758516 /nfs/dbraw/zinc/75/85/16/565758516.db2.gz RVJUTLGSMCQJMQ-OAHLLOKOSA-N 0 1 393.285 3.236 10 0 GGAEMN C[C@@H](c1ccncc1)N1CCC(NC(=O)N2CCC=C(Br)C2)CC1 ZINC000282055865 565762384 /nfs/dbraw/zinc/76/23/84/565762384.db2.gz AQJMGBOIRSTCIH-AWEZNQCLSA-N 0 1 393.329 3.301 10 0 GGAEMN CC(C)N(C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000176308570 565763016 /nfs/dbraw/zinc/76/30/16/565763016.db2.gz YGHPVYBTNGLPCS-UHFFFAOYSA-N 0 1 378.274 3.317 10 0 GGAEMN CC(C)N(C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000176308570 565763018 /nfs/dbraw/zinc/76/30/18/565763018.db2.gz YGHPVYBTNGLPCS-UHFFFAOYSA-N 0 1 378.274 3.317 10 0 GGAEMN CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc(Cl)cc(Br)c1[O-] ZINC000176316546 565764309 /nfs/dbraw/zinc/76/43/09/565764309.db2.gz SGXSWJWYYZDPME-NSHDSACASA-N 0 1 375.694 3.364 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000282129522 565765696 /nfs/dbraw/zinc/76/56/96/565765696.db2.gz FICZJLWSWWGLDL-CABZTGNLSA-N 0 1 394.273 3.014 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000282129531 565765745 /nfs/dbraw/zinc/76/57/45/565765745.db2.gz FICZJLWSWWGLDL-SKDRFNHKSA-N 0 1 394.273 3.014 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000282129518 565765880 /nfs/dbraw/zinc/76/58/80/565765880.db2.gz FICZJLWSWWGLDL-BXKDBHETSA-N 0 1 394.273 3.014 10 0 GGAEMN C[C@H]1CN(C2CCN(C(=O)/C=C/c3ccc(Br)cc3)CC2)CCO1 ZINC000193669580 565768817 /nfs/dbraw/zinc/76/88/17/565768817.db2.gz KSPIMTQUVZMJHG-SZTZYQKNSA-N 0 1 393.325 3.174 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(Cc2cc(Br)cc3cccnc32)C1 ZINC000412076601 565769845 /nfs/dbraw/zinc/76/98/45/565769845.db2.gz NJTLWTJHPKTHBZ-AWEZNQCLSA-N 0 1 395.322 3.335 10 0 GGAEMN CC(C)N(CC[S@@](=O)c1cc(Cl)ccc1Cl)C[C@H]1CCC(=O)N1 ZINC000412092256 565771031 /nfs/dbraw/zinc/77/10/31/565771031.db2.gz VSIPVSGEYWTHHW-JCQPUDPBSA-N 0 1 377.337 3.090 10 0 GGAEMN CC(C)N(CC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)C[C@@H]1CCC(=O)N1 ZINC000412095600 565771056 /nfs/dbraw/zinc/77/10/56/565771056.db2.gz YAJRBCOGUNDIIJ-JSGCOSHPSA-N 0 1 386.323 3.160 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCC[C@H]1C[C@H](O)c1ccccc1 ZINC000176487175 565776925 /nfs/dbraw/zinc/77/69/25/565776925.db2.gz DMFBMMFCQIILMJ-STQMWFEESA-N 0 1 381.548 3.407 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)[C@H](C)Oc2ccc(Br)cc2)n[nH]1 ZINC000331723101 565779236 /nfs/dbraw/zinc/77/92/36/565779236.db2.gz KTYAATSHZJLKPF-XHDPSFHLSA-N 0 1 393.285 3.397 10 0 GGAEMN CN(C[C@H](c1cccs1)N1CCOCC1)C(=O)c1ccc(O)c(Cl)c1 ZINC000176527719 565781495 /nfs/dbraw/zinc/78/14/95/565781495.db2.gz WYEGDQFVQBRPHE-OAHLLOKOSA-N 0 1 380.897 3.253 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NCCc1nc2ccc(F)cc2[nH]1 ZINC000176538335 565782629 /nfs/dbraw/zinc/78/26/29/565782629.db2.gz GVMVPLGPBCCDIW-UHFFFAOYSA-N 0 1 382.258 3.427 10 0 GGAEMN O=C(N[C@@H]1CCCC12CCOCC2)c1cc(Br)cc2nc[nH]c21 ZINC000282585228 565786904 /nfs/dbraw/zinc/78/69/04/565786904.db2.gz SSTQEKGAMDPSCH-CQSZACIVSA-N 0 1 378.270 3.405 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)[C@H]1CCCc2[nH]ncc21 ZINC000282719358 565793938 /nfs/dbraw/zinc/79/39/38/565793938.db2.gz HDUUFISUNNLTGQ-HZMBPMFUSA-N 0 1 376.254 3.232 10 0 GGAEMN O[C@H]1[C@H](CNCc2c(F)ccc(Br)c2F)CCC12CCOCC2 ZINC000282841807 565799172 /nfs/dbraw/zinc/79/91/72/565799172.db2.gz OVRIDBNWWHGLDO-ZBEGNZNMSA-N 0 1 390.268 3.385 10 0 GGAEMN COCCn1cc(CN[C@@H]2CCCOc3ccc(Br)cc32)cn1 ZINC000282855219 565800986 /nfs/dbraw/zinc/80/09/86/565800986.db2.gz UHCFGEXQGHHSDY-MRXNPFEDSA-N 0 1 380.286 3.296 10 0 GGAEMN O=C(N[C@H]1CCCc2cn[nH]c21)N[C@H]1CCOc2c(Br)cccc21 ZINC000282905745 565803142 /nfs/dbraw/zinc/80/31/42/565803142.db2.gz RPAUBOQJNNOYQL-KBPBESRZSA-N 0 1 391.269 3.373 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2Br)CCN1C ZINC000282964000 565804817 /nfs/dbraw/zinc/80/48/17/565804817.db2.gz KSBOMDGOCRZBKC-MNOVXSKESA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1C[NH+](Cc2ccccc2NC(=O)c2s[n-]c(=O)c2Cl)C[C@H](C)O1 ZINC000283009995 565806746 /nfs/dbraw/zinc/80/67/46/565806746.db2.gz LFKCDCLQZHXFPP-QWRGUYRKSA-N 0 1 381.885 3.364 10 0 GGAEMN COC(=O)c1ccnc(NS(=O)(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000194585320 565824199 /nfs/dbraw/zinc/82/41/99/565824199.db2.gz MJVSZVXREYCZNL-UHFFFAOYSA-N 0 1 375.233 3.117 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCOc3ccc(Br)cc3C2)n[nH]1 ZINC000283692646 565825686 /nfs/dbraw/zinc/82/56/86/565825686.db2.gz VXRBWOCYZPOZAQ-LLVKDONJSA-N 0 1 393.285 3.016 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000177095433 565828877 /nfs/dbraw/zinc/82/88/77/565828877.db2.gz YRHIIOBHIOADJH-GFCCVEGCSA-N 0 1 379.810 3.279 10 0 GGAEMN CN1CC[C@H](N[C@@H](C(N)=O)c2cccc(Br)c2)[C@@H]1c1ccccc1 ZINC000283885836 565833643 /nfs/dbraw/zinc/83/36/43/565833643.db2.gz DZQGPVYAYCWMPI-KSZLIROESA-N 0 1 388.309 3.011 10 0 GGAEMN COc1ccc(CN(C)C[C@@H](O)COc2cccc(Br)c2)cc1O ZINC000177226169 565837432 /nfs/dbraw/zinc/83/74/32/565837432.db2.gz VQGMQJKWHPLURP-OAHLLOKOSA-N 0 1 396.281 3.035 10 0 GGAEMN Cn1cc(CNCc2cccc(I)c2)c(C(F)(F)F)n1 ZINC000283991209 565838655 /nfs/dbraw/zinc/83/86/55/565838655.db2.gz OTBJWPRGRZYHEI-UHFFFAOYSA-N 0 1 395.166 3.333 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)[C@@H]2CCCc3[nH]ncc32)cc1Br ZINC000177280391 565840581 /nfs/dbraw/zinc/84/05/81/565840581.db2.gz NDVGXUFTDAKEOJ-ZYHUDNBSSA-N 0 1 378.270 3.478 10 0 GGAEMN CC(C)(C)c1nc(CNc2ccc(Br)c(C(F)(F)F)n2)n[nH]1 ZINC000413420201 565851769 /nfs/dbraw/zinc/85/17/69/565851769.db2.gz UOAXDNKUIUVKOT-UHFFFAOYSA-N 0 1 378.196 3.313 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3cc(F)cc(Br)c3)CC2)cn1 ZINC000177711745 565868681 /nfs/dbraw/zinc/86/86/81/565868681.db2.gz RFLQHOBGHWUCIZ-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN O=C(CN1CCN2CCCC[C@@H]2C1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000177778752 565873299 /nfs/dbraw/zinc/87/32/99/565873299.db2.gz KMZQYTMCBKOMRB-CYBMUJFWSA-N 0 1 375.822 3.467 10 0 GGAEMN CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(C(=O)C=Cc2cc(Cl)ccc2Cl)C1 ZINC000284894223 565875618 /nfs/dbraw/zinc/87/56/18/565875618.db2.gz GROUEDJUIFADQR-ROAXPNGRSA-N 0 1 381.263 3.422 10 0 GGAEMN Cc1csc([C@H]2CCCN(Cc3cccc(S(=O)(=O)N(C)C)c3)C2)n1 ZINC000195335544 565877254 /nfs/dbraw/zinc/87/72/54/565877254.db2.gz HMZJHSIFRAGQFX-INIZCTEOSA-N 0 1 379.551 3.081 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)[nH]n1 ZINC000629974383 565877512 /nfs/dbraw/zinc/87/75/12/565877512.db2.gz ILIANUCEILJKFU-XFBWCDHKSA-N 0 1 398.264 3.097 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCCc2ccc(F)c(Br)c2)n[nH]1 ZINC000177885511 565878948 /nfs/dbraw/zinc/87/89/48/565878948.db2.gz ONIKTJWEHWRFCL-SNVBAGLBSA-N 0 1 383.265 3.093 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3cccc(Br)c3C2)n[nH]1 ZINC000177891737 565880007 /nfs/dbraw/zinc/88/00/07/565880007.db2.gz IRXPSKNZZQOHNV-NSHDSACASA-N 0 1 377.286 3.180 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000177945881 565882236 /nfs/dbraw/zinc/88/22/36/565882236.db2.gz HHJLKWMICYYAFK-PIGZYNQJSA-N 0 1 378.270 3.093 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000177945899 565882587 /nfs/dbraw/zinc/88/25/87/565882587.db2.gz HHJLKWMICYYAFK-DIFFPNOSSA-N 0 1 378.270 3.093 10 0 GGAEMN CN(C)c1cc(NC(=O)N2CCN(C3CCCC3)CC2)ncc1Br ZINC000333602635 565889334 /nfs/dbraw/zinc/88/93/34/565889334.db2.gz CYFAILSGUKIRKI-UHFFFAOYSA-N 0 1 396.333 3.002 10 0 GGAEMN C[C@@H](C(=O)Nc1ccccc1Br)N1CCC(c2ccn[nH]2)CC1 ZINC000195505156 565889532 /nfs/dbraw/zinc/88/95/32/565889532.db2.gz CQTQVONLMHQQBW-LBPRGKRZSA-N 0 1 377.286 3.379 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)NCc1cn2cc(Cl)ccc2n1 ZINC000414073516 565891835 /nfs/dbraw/zinc/89/18/35/565891835.db2.gz VXWGKIYWTORTDB-LLVKDONJSA-N 0 1 395.688 3.090 10 0 GGAEMN C[C@H](NCc1cccnc1-n1cncn1)c1cc(Br)ccc1F ZINC000178053882 565893336 /nfs/dbraw/zinc/89/33/36/565893336.db2.gz XWHDOGOKWJDIGM-NSHDSACASA-N 0 1 376.233 3.415 10 0 GGAEMN C[C@@H](O)c1cc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)ccc1F ZINC000285240609 565896195 /nfs/dbraw/zinc/89/61/95/565896195.db2.gz YWVORESXCSVSEO-SECBINFHSA-N 0 1 387.816 3.104 10 0 GGAEMN C[C@@H](NC(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)c1cccs1 ZINC000285248151 565897285 /nfs/dbraw/zinc/89/72/85/565897285.db2.gz AILPTYNWWDYEIO-PXAZEXFGSA-N 0 1 397.338 3.185 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3cc(Cl)ccc3SC)CCO2)n[nH]1 ZINC000178180827 565903924 /nfs/dbraw/zinc/90/39/24/565903924.db2.gz FPXIPZXKYZDBLJ-LBPRGKRZSA-N 0 1 381.889 3.348 10 0 GGAEMN C[C@@H](N[C@@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccs1 ZINC000178174020 565904330 /nfs/dbraw/zinc/90/43/30/565904330.db2.gz NDEQQIFEUSLADM-LSDHHAIUSA-N 0 1 380.535 3.181 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](c2cncc(Br)c2)C2CC2)n[nH]1 ZINC000285438719 565907105 /nfs/dbraw/zinc/90/71/05/565907105.db2.gz OGNWCXLLFOORIB-QFYYESIMSA-N 0 1 392.301 3.257 10 0 GGAEMN COC[C@@H](CCO)N[C@H](C)c1ccc(Br)cc1Br ZINC000223952535 565910398 /nfs/dbraw/zinc/91/03/98/565910398.db2.gz JDRMLIAEIPQKDJ-MWLCHTKSSA-N 0 1 381.108 3.260 10 0 GGAEMN NS(=O)(=O)c1ccc(CNC2(c3cccc(F)c3)CC2)cc1Br ZINC000414355418 565914319 /nfs/dbraw/zinc/91/43/19/565914319.db2.gz BVJYMCJPXNARBK-UHFFFAOYSA-N 0 1 399.285 3.015 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](NCc2cncnc2)C1=O ZINC000285573079 565914350 /nfs/dbraw/zinc/91/43/50/565914350.db2.gz ULNFMVYXBRDBAO-MRXNPFEDSA-N 0 1 389.297 3.141 10 0 GGAEMN Cc1cc(C[C@@H](C)Nc2ncnc3ccc(I)cc32)[nH]n1 ZINC000178372384 565914876 /nfs/dbraw/zinc/91/48/76/565914876.db2.gz RJVFFXHTPMXWCP-SECBINFHSA-N 0 1 393.232 3.309 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cc(OC)c(OC)cc2OC)ccc1Cl ZINC000414374119 565917528 /nfs/dbraw/zinc/91/75/28/565917528.db2.gz NXVWEOCFLAEVFA-UHFFFAOYSA-N 0 1 387.841 3.175 10 0 GGAEMN CN1C(=O)N([C@@H]2CCc3nc[nH]c3C2)C(=O)[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000348983290 565920368 /nfs/dbraw/zinc/92/03/68/565920368.db2.gz HSOVESJJSWOXFG-MEBBXXQBSA-N 0 1 379.247 3.209 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccc(OC)c(OC)c2OC)ccc1Cl ZINC000414387690 565920802 /nfs/dbraw/zinc/92/08/02/565920802.db2.gz ZGOAOFAZSLVREJ-UHFFFAOYSA-N 0 1 387.841 3.175 10 0 GGAEMN OC[C@@H]1CCCC[C@@H]1NCc1ncc(Br)cc1Br ZINC000229603564 565927097 /nfs/dbraw/zinc/92/70/97/565927097.db2.gz NVNRJYQILJJYMV-CABZTGNLSA-N 0 1 378.108 3.247 10 0 GGAEMN OC[C@H]1CCCC[C@@H]1NCc1ncc(Br)cc1Br ZINC000229603574 565927550 /nfs/dbraw/zinc/92/75/50/565927550.db2.gz NVNRJYQILJJYMV-SKDRFNHKSA-N 0 1 378.108 3.247 10 0 GGAEMN C[C@H](CC(=O)N1CCN(C[C@@H]2CCOC2)CC1)c1ccc(Br)cc1 ZINC000178601784 565927868 /nfs/dbraw/zinc/92/78/68/565927868.db2.gz NFUICMGSJXVXSP-CVEARBPZSA-N 0 1 395.341 3.123 10 0 GGAEMN Cc1cc(CN2CCC[C@H](N3CCCS3(=O)=O)C2)ccc1C(F)(F)F ZINC000414428479 565930849 /nfs/dbraw/zinc/93/08/49/565930849.db2.gz BGXCIBNGXFJMPD-HNNXBMFYSA-N 0 1 376.444 3.014 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000178688742 565934164 /nfs/dbraw/zinc/93/41/64/565934164.db2.gz VMQOLTYELVGVOV-RYUDHWBXSA-N 0 1 379.302 3.342 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)Cc2cccc(Br)c2)n[nH]1 ZINC000178697819 565934229 /nfs/dbraw/zinc/93/42/29/565934229.db2.gz XIPJPVJHQQYSEY-NEPJUHHUSA-N 0 1 379.302 3.342 10 0 GGAEMN COc1cc(CN(C)C(=O)c2[nH]nc3ccc(Br)cc32)ccc1O ZINC000178705770 565934338 /nfs/dbraw/zinc/93/43/38/565934338.db2.gz RMPLEIVYGJDQQZ-UHFFFAOYSA-N 0 1 390.237 3.312 10 0 GGAEMN Cc1nn(C)c(S(=O)(=O)[N-]c2ccc(C[NH+](C)C)c(Cl)c2)c1C(F)F ZINC000414448465 565934378 /nfs/dbraw/zinc/93/43/78/565934378.db2.gz AFMZULXIADYMHA-UHFFFAOYSA-N 0 1 392.859 3.182 10 0 GGAEMN Brc1ccn2cc(-c3nc(-c4ccn5cncc5c4)no3)nc2c1 ZINC000350308556 565935007 /nfs/dbraw/zinc/93/50/07/565935007.db2.gz MNYVWTQCUXQGRB-UHFFFAOYSA-N 0 1 381.193 3.462 10 0 GGAEMN CNC(=O)c1cc(Cl)c(C)c(S(=O)(=O)Nc2c(C)cc(C)nc2C)c1 ZINC000414454557 565935876 /nfs/dbraw/zinc/93/58/76/565935876.db2.gz GKUKWOAZUWBGMD-UHFFFAOYSA-N 0 1 381.885 3.129 10 0 GGAEMN Cc1cc(CN2CCC(N3CCCS3(=O)=O)CC2)ccc1C(F)(F)F ZINC000414466770 565938948 /nfs/dbraw/zinc/93/89/48/565938948.db2.gz CLTVGJBQBQKRAZ-UHFFFAOYSA-N 0 1 376.444 3.014 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)Cc2ccccc2C(F)(F)F)c1Br ZINC000414473060 565940303 /nfs/dbraw/zinc/94/03/03/565940303.db2.gz UKMGKJUCVUUXKJ-UHFFFAOYSA-N 0 1 398.204 3.441 10 0 GGAEMN CCCOc1c(Br)cc(CNC2(C(=O)N(C)C)CC2)cc1OCC ZINC000414488028 565941416 /nfs/dbraw/zinc/94/14/16/565941416.db2.gz QAXMOENEKJBWNV-UHFFFAOYSA-N 0 1 399.329 3.347 10 0 GGAEMN Brc1ccc(-c2nccc(CN3CCC[C@H](n4cncn4)C3)n2)cc1 ZINC000178861139 565941777 /nfs/dbraw/zinc/94/17/77/565941777.db2.gz HSQVAOCBTPKALO-KRWDZBQOSA-N 0 1 399.296 3.335 10 0 GGAEMN C[C@@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccc(=O)[nH]n1 ZINC000286165890 565946014 /nfs/dbraw/zinc/94/60/14/565946014.db2.gz PNDQSODYVGJWOU-MRVPVSSYSA-N 0 1 376.176 3.402 10 0 GGAEMN CC[C@H](C)[N@@H+](CCCOc1cccc(I)c1)CC(=O)[O-] ZINC000236969515 565947559 /nfs/dbraw/zinc/94/75/59/565947559.db2.gz UUVLYBJOGKIQPJ-LBPRGKRZSA-N 0 1 391.249 3.245 10 0 GGAEMN COc1cc(-c2noc(C34CCC[NH+]3CCC4)n2)cc(Br)c1[O-] ZINC000351216986 565947857 /nfs/dbraw/zinc/94/78/57/565947857.db2.gz IZADSROKPMKXEA-UHFFFAOYSA-N 0 1 380.242 3.298 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(Cc2cn(-c3ccc(Cl)cc3)nc2C)C1 ZINC000414562634 565949367 /nfs/dbraw/zinc/94/93/67/565949367.db2.gz AVBXUINPCYXXTL-HNNXBMFYSA-N 0 1 379.913 3.172 10 0 GGAEMN CCOc1cc(CN2CCSC[C@H](C(=O)OC)C2)ccc1OC(F)F ZINC000414573566 565949378 /nfs/dbraw/zinc/94/93/78/565949378.db2.gz ZDNNUUCYZFUGKX-CYBMUJFWSA-N 0 1 375.437 3.025 10 0 GGAEMN COC(=O)[C@H]1CSCCN(Cc2cn(-c3ccc(Cl)cc3)nc2C)C1 ZINC000414562635 565950184 /nfs/dbraw/zinc/95/01/84/565950184.db2.gz AVBXUINPCYXXTL-OAHLLOKOSA-N 0 1 379.913 3.172 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)[C@@H](O)Cc1ccccc1 ZINC000178984291 565951248 /nfs/dbraw/zinc/95/12/48/565951248.db2.gz MQHWIPSXDROHQX-BZNIZROVSA-N 0 1 388.265 3.047 10 0 GGAEMN COC(=O)c1cncc(NS(=O)(=O)c2ccc(Cl)c3ccccc32)c1 ZINC000179008177 565952462 /nfs/dbraw/zinc/95/24/62/565952462.db2.gz CVYBBJVXUZIQRY-UHFFFAOYSA-N 0 1 376.821 3.476 10 0 GGAEMN CC1(C)CN(C(=O)Nc2ccc(Br)cc2Br)CCN1 ZINC000414687128 565955782 /nfs/dbraw/zinc/95/57/82/565955782.db2.gz BOTWVLCGKLUHOM-UHFFFAOYSA-N 0 1 391.107 3.427 10 0 GGAEMN CC1(C)CN(C(=O)Nc2cc(Br)ccc2Br)CCN1 ZINC000414777083 565958758 /nfs/dbraw/zinc/95/87/58/565958758.db2.gz GCSAOZFLZBOWPI-UHFFFAOYSA-N 0 1 391.107 3.427 10 0 GGAEMN COCc1cccc(CN2CCN(c3ccc(Br)cn3)CC2)c1 ZINC000179190126 565964253 /nfs/dbraw/zinc/96/42/53/565964253.db2.gz QAVIYLMYZUVMOJ-UHFFFAOYSA-N 0 1 376.298 3.313 10 0 GGAEMN Cc1noc([C@H]2CCCCN2C(=O)c2[nH]nc3ccc(Br)cc32)n1 ZINC000286524017 565964811 /nfs/dbraw/zinc/96/48/11/565964811.db2.gz UNDBRGZZTZUCTO-CYBMUJFWSA-N 0 1 390.241 3.384 10 0 GGAEMN CN(C)C(=O)Sc1ccc(CN2CC[C@H](C(F)(F)F)[C@@H](CO)C2)cc1 ZINC000286540575 565965809 /nfs/dbraw/zinc/96/58/09/565965809.db2.gz ODGAAKLAUQXBIT-HIFRSBDPSA-N 0 1 376.444 3.453 10 0 GGAEMN CN(C)C(=O)Sc1ccc(CN2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)cc1 ZINC000286540578 565966202 /nfs/dbraw/zinc/96/62/02/565966202.db2.gz ODGAAKLAUQXBIT-UKRRQHHQSA-N 0 1 376.444 3.453 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)c2[nH]nc3ccc(Br)cc32)no1 ZINC000361466712 565970071 /nfs/dbraw/zinc/97/00/71/565970071.db2.gz WOVZNUHXCKUXMB-ZDUSSCGKSA-N 0 1 390.241 3.384 10 0 GGAEMN CCc1nn(C)c(CC)c1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000179318091 565972404 /nfs/dbraw/zinc/97/24/04/565972404.db2.gz SQAYSIUZBGZQNV-UHFFFAOYSA-N 0 1 390.285 3.114 10 0 GGAEMN Brc1ccc(-n2cc(CN3CCC[C@@H](n4cncn4)C3)cn2)cc1 ZINC000179466895 565982109 /nfs/dbraw/zinc/98/21/09/565982109.db2.gz UFPGDNIEFCOQKA-QGZVFWFLSA-N 0 1 387.285 3.063 10 0 GGAEMN O=C(N[C@@H]1COc2c1ccc(Cl)c2Cl)N1CCC[C@@H](c2nc[nH]n2)C1 ZINC000363136570 565992122 /nfs/dbraw/zinc/99/21/22/565992122.db2.gz KLCFPMUDZUGRQX-BXKDBHETSA-N 0 1 382.251 3.134 10 0 GGAEMN O=C(N[C@@H]1COc2c1ccc(Cl)c2Cl)N1CCC[C@H](c2nc[nH]n2)C1 ZINC000363136572 565992525 /nfs/dbraw/zinc/99/25/25/565992525.db2.gz KLCFPMUDZUGRQX-JOYOIKCWSA-N 0 1 382.251 3.134 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000363138282 565992608 /nfs/dbraw/zinc/99/26/08/565992608.db2.gz SAGAZVDGEDXKTG-JTQLQIEISA-N 0 1 381.504 3.011 10 0 GGAEMN O=C(N[C@H]1COc2c1ccc(Cl)c2Cl)N1CCC[C@H](c2nc[nH]n2)C1 ZINC000363136571 565992672 /nfs/dbraw/zinc/99/26/72/565992672.db2.gz KLCFPMUDZUGRQX-CABZTGNLSA-N 0 1 382.251 3.134 10 0 GGAEMN Cn1cc([C@@H]2CCN([C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)C2)cn1 ZINC000245539718 565994272 /nfs/dbraw/zinc/99/42/72/565994272.db2.gz HVFNRBFNKWTDSH-PXAZEXFGSA-N 0 1 379.291 3.322 10 0 GGAEMN C[NH+](C)CC(=O)Nc1ccc(NC(=O)c2ccc(Cl)c(Cl)c2[O-])cc1 ZINC000179691293 565999605 /nfs/dbraw/zinc/99/96/05/565999605.db2.gz NWPRRICJHYLRPI-UHFFFAOYSA-N 0 1 382.247 3.451 10 0 GGAEMN O=S(=O)(c1ccc(Cl)cc1C(F)(F)F)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000179678806 566000509 /nfs/dbraw/zinc/00/05/09/566000509.db2.gz KPKLRMGYWAXREK-LLVKDONJSA-N 0 1 394.806 3.393 10 0 GGAEMN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(OC(F)F)c(Br)c1 ZINC000179720036 566002625 /nfs/dbraw/zinc/00/26/25/566002625.db2.gz RFLXHKOCEMXALA-GXSJLCMTSA-N 0 1 377.229 3.136 10 0 GGAEMN O[C@@]12CCCC[C@H]1CN(Cc1cc(Br)c3c(c1)OCCO3)CC2 ZINC000245725189 566002763 /nfs/dbraw/zinc/00/27/63/566002763.db2.gz IRVVNVSYQSBMRS-KBXCAEBGSA-N 0 1 382.298 3.347 10 0 GGAEMN Cc1nc([C@@H]2CN([C@H]3CCCc4ccc(Br)cc43)CCO2)n[nH]1 ZINC000245735139 566004858 /nfs/dbraw/zinc/00/48/58/566004858.db2.gz FOQIGJBOHZANBX-HOTGVXAUSA-N 0 1 377.286 3.327 10 0 GGAEMN COC(=O)[C@@H]1CCCN(Cc2cnn(-c3ccc(Br)cc3)c2)C1 ZINC000179852212 566013574 /nfs/dbraw/zinc/01/35/74/566013574.db2.gz JPDMCBFLWUJEOG-CQSZACIVSA-N 0 1 378.270 3.020 10 0 GGAEMN CC[C@@H]1CN(C(=O)C[C@@H](C)c2ccc(Br)cc2)CCN1C[C@H](C)O ZINC000245990847 566013868 /nfs/dbraw/zinc/01/38/68/566013868.db2.gz LVVYDSMNKZIQEA-RVKKMQEKSA-N 0 1 397.357 3.246 10 0 GGAEMN CCOc1cc(-c2noc(CC3CC[NH+](C)CC3)n2)cc(Br)c1[O-] ZINC000287399862 566015958 /nfs/dbraw/zinc/01/59/58/566015958.db2.gz QTEQWIBZWBGNDF-UHFFFAOYSA-N 0 1 396.285 3.488 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2cc(F)ccc2F)[C@H]1c1cccs1 ZINC000246135501 566018966 /nfs/dbraw/zinc/01/89/66/566018966.db2.gz JWFYOMSIABNIJA-SJCJKPOMSA-N 0 1 386.489 3.388 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC([C@H]2CCOC2)CC1 ZINC000363746507 566019748 /nfs/dbraw/zinc/01/97/48/566019748.db2.gz KKVMSKWQIYMTDG-LBPRGKRZSA-N 0 1 378.270 3.214 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC([C@@H]2CCOC2)CC1 ZINC000363746506 566019849 /nfs/dbraw/zinc/01/98/49/566019849.db2.gz KKVMSKWQIYMTDG-GFCCVEGCSA-N 0 1 378.270 3.214 10 0 GGAEMN Fc1cc(Br)cc(OCCN[C@H](c2nnc[nH]2)c2ccccc2)c1 ZINC000363883639 566025463 /nfs/dbraw/zinc/02/54/63/566025463.db2.gz QCAWBLYKOCFCKQ-INIZCTEOSA-N 0 1 391.244 3.464 10 0 GGAEMN C[C@@H](c1ccccc1Br)N(C)C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000246302384 566025622 /nfs/dbraw/zinc/02/56/22/566025622.db2.gz LQGHYEBBIYFFOS-UONOGXRCSA-N 0 1 389.359 3.114 10 0 GGAEMN C[C@@H](c1ccc(Br)cc1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000246557203 566032351 /nfs/dbraw/zinc/03/23/51/566032351.db2.gz JYSAAVGLXWGPJP-GOEBONIOSA-N 0 1 381.314 3.081 10 0 GGAEMN COCCN1CCN(Cc2ccc(Br)c3cccnc23)C[C@@H]1C ZINC000180099983 566032769 /nfs/dbraw/zinc/03/27/69/566032769.db2.gz QDPRERWMRQWNIK-AWEZNQCLSA-N 0 1 378.314 3.150 10 0 GGAEMN COCCN1CCN(Cc2ccc(Br)c3cccnc23)C[C@H]1C ZINC000180099964 566032783 /nfs/dbraw/zinc/03/27/83/566032783.db2.gz QDPRERWMRQWNIK-CQSZACIVSA-N 0 1 378.314 3.150 10 0 GGAEMN O[C@@H](COc1cc(Cl)ccc1Cl)CN1CC[C@H](Oc2cccnc2)C1 ZINC000246713004 566038746 /nfs/dbraw/zinc/03/87/46/566038746.db2.gz NVJRGLSHVPSAPG-ZBFHGGJFSA-N 0 1 383.275 3.281 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CC[N@@H+](C)C[C@@H]1C ZINC000246754894 566039940 /nfs/dbraw/zinc/03/99/40/566039940.db2.gz ZOFCRKUNBCOGQP-VBQJREDUSA-N 0 1 382.346 3.362 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Cl)ccc2Br)CC[N@H+]1C[C@H](C)O ZINC000246753822 566040113 /nfs/dbraw/zinc/04/01/13/566040113.db2.gz HFOCZYMKYVWMFM-AAEUAGOBSA-N 0 1 389.721 3.020 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Cl)ccc2Br)CCN1C[C@H](C)O ZINC000246753822 566040117 /nfs/dbraw/zinc/04/01/17/566040117.db2.gz HFOCZYMKYVWMFM-AAEUAGOBSA-N 0 1 389.721 3.020 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cccc(Br)c2Cl)CCN1C[C@@H](C)O ZINC000180175369 566040405 /nfs/dbraw/zinc/04/04/05/566040405.db2.gz NBONBDPONREMBL-VXGBXAGGSA-N 0 1 389.721 3.020 10 0 GGAEMN COc1ccc(Br)cc1C1(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)CC1 ZINC000416177316 566041937 /nfs/dbraw/zinc/04/19/37/566041937.db2.gz LOWMLPVIUSFZRN-LLVKDONJSA-N 0 1 392.297 3.268 10 0 GGAEMN O=C(Nc1ccc(I)cc1)N1CCC(c2cnc[nH]2)CC1 ZINC000364294634 566043869 /nfs/dbraw/zinc/04/38/69/566043869.db2.gz GOPWEKMYUNVMIA-UHFFFAOYSA-N 0 1 396.232 3.426 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Br)ccc2Cl)CCN1C[C@H](C)O ZINC000247022116 566050661 /nfs/dbraw/zinc/05/06/61/566050661.db2.gz WUJWUYYVABZAMX-AAEUAGOBSA-N 0 1 389.721 3.020 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N1CCN2CCCC[C@H]2C1 ZINC000247076858 566051790 /nfs/dbraw/zinc/05/17/90/566051790.db2.gz OOVCGKYWXVKFLX-ZFWWWQNUSA-N 0 1 383.305 3.464 10 0 GGAEMN C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000247054233 566052226 /nfs/dbraw/zinc/05/22/26/566052226.db2.gz HBDLBULIPSKRTD-JQWIXIFHSA-N 0 1 382.835 3.216 10 0 GGAEMN C[C@H]1CN(C(=O)CCCCc2ccc(Br)cc2)[C@@H](C)CN1CCO ZINC000416294319 566052637 /nfs/dbraw/zinc/05/26/37/566052637.db2.gz KUOPJJHOAUDHJF-HOTGVXAUSA-N 0 1 397.357 3.075 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1nc(Cl)ccc1Cl ZINC000247137576 566052927 /nfs/dbraw/zinc/05/29/27/566052927.db2.gz HOHKIEURMVTEJJ-SWLSCSKDSA-N 0 1 379.291 3.424 10 0 GGAEMN Cc1csc2nc(CN3CCC[C@H]3C[C@@H](O)c3cccs3)cc(=O)n12 ZINC000247260437 566056759 /nfs/dbraw/zinc/05/67/59/566056759.db2.gz VGLBIRFTGFCEKY-LSDHHAIUSA-N 0 1 375.519 3.214 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1cc(Cl)c(Cl)n1C ZINC000247318844 566057740 /nfs/dbraw/zinc/05/77/40/566057740.db2.gz WWQPIQWWVDLGQW-IUODEOHRSA-N 0 1 381.307 3.367 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1cc(Cl)c(Cl)n1C ZINC000247318856 566058062 /nfs/dbraw/zinc/05/80/62/566058062.db2.gz WWQPIQWWVDLGQW-SWLSCSKDSA-N 0 1 381.307 3.367 10 0 GGAEMN C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000247493146 566061032 /nfs/dbraw/zinc/06/10/32/566061032.db2.gz UJYVVFCJSWPYIP-PWSUYJOCSA-N 0 1 382.835 3.216 10 0 GGAEMN Brc1cc2c(c(CN[C@@H](c3nnc[nH]3)c3ccccc3)c1)OCC2 ZINC000364680237 566063630 /nfs/dbraw/zinc/06/36/30/566063630.db2.gz WETZUXKODDAOTG-MRXNPFEDSA-N 0 1 385.265 3.381 10 0 GGAEMN Brc1cc2c(c(CN[C@H](c3nnc[nH]3)c3ccccc3)c1)OCC2 ZINC000364680236 566064530 /nfs/dbraw/zinc/06/45/30/566064530.db2.gz WETZUXKODDAOTG-INIZCTEOSA-N 0 1 385.265 3.381 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)Nc3cc(F)ccc3Br)cn21 ZINC000416414107 566065053 /nfs/dbraw/zinc/06/50/53/566065053.db2.gz FKWWKLXICRWDCE-VIFPVBQESA-N 0 1 388.262 3.483 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@@H](Cn2cncn2)C1 ZINC000247778029 566066670 /nfs/dbraw/zinc/06/66/70/566066670.db2.gz RFHRQSYBPCNODX-CHWSQXEVSA-N 0 1 382.295 3.324 10 0 GGAEMN CC[C@@H]1CN([C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)CCN1CCOC ZINC000247808897 566066730 /nfs/dbraw/zinc/06/67/30/566066730.db2.gz UETBPNDQZBJCSU-UKRRQHHQSA-N 0 1 388.339 3.363 10 0 GGAEMN O=C(NCc1ccccc1Br)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000364740874 566067846 /nfs/dbraw/zinc/06/78/46/566067846.db2.gz SOXICSHWLUEBBZ-OAHLLOKOSA-N 0 1 386.253 3.156 10 0 GGAEMN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)c1Br ZINC000248140000 566073108 /nfs/dbraw/zinc/07/31/08/566073108.db2.gz YHNHBAMUUQKCSO-DYVFJYSZSA-N 0 1 391.313 3.471 10 0 GGAEMN CC[C@H](C)N[C@@H](CNS(=O)(=O)c1ccc(Cl)c(OC)c1)c1ccco1 ZINC000416481608 566074291 /nfs/dbraw/zinc/07/42/91/566074291.db2.gz VORKTZMMXJNUCQ-WFASDCNBSA-N 0 1 386.901 3.349 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(Br)c1)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000248198297 566075263 /nfs/dbraw/zinc/07/52/63/566075263.db2.gz XUPYBKYLZOYUFF-GLJUWKHASA-N 0 1 381.314 3.403 10 0 GGAEMN O=C1[C@H](N=c2ccc3c(Cl)ccc(Cl)c3[nH]2)CCN1C1CCOCC1 ZINC000364910681 566075459 /nfs/dbraw/zinc/07/54/59/566075459.db2.gz RWFRTBGCDSITCK-OAHLLOKOSA-N 0 1 380.275 3.155 10 0 GGAEMN Cc1c(Cl)cc(NS(=O)(=O)c2cc(C(=O)N(C)C)n(C)c2)cc1Cl ZINC000180624387 566078123 /nfs/dbraw/zinc/07/81/23/566078123.db2.gz GXIBWLYELMANFR-UHFFFAOYSA-N 0 1 390.292 3.143 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(Br)ccc1F ZINC000365021645 566079350 /nfs/dbraw/zinc/07/93/50/566079350.db2.gz ZVTMEDAWVCECHW-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ncsc2Br)CC1 ZINC000288627897 566083711 /nfs/dbraw/zinc/08/37/11/566083711.db2.gz MCEJRSJPWVDVAH-UHFFFAOYSA-N 0 1 395.326 3.300 10 0 GGAEMN CN(C(=O)c1ncsc1Br)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000288636478 566084501 /nfs/dbraw/zinc/08/45/01/566084501.db2.gz SJUPPARUIMGFLO-CYBMUJFWSA-N 0 1 380.311 3.252 10 0 GGAEMN CN(C(=O)c1ncsc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000288636478 566084508 /nfs/dbraw/zinc/08/45/08/566084508.db2.gz SJUPPARUIMGFLO-CYBMUJFWSA-N 0 1 380.311 3.252 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccoc1Br ZINC000248845069 566089683 /nfs/dbraw/zinc/08/96/83/566089683.db2.gz SVJJTROOGNRVKB-IUODEOHRSA-N 0 1 378.270 3.078 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000248881571 566090947 /nfs/dbraw/zinc/09/09/47/566090947.db2.gz XATDPXCPYDUXFK-PKWAYOAASA-N 0 1 378.270 3.099 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)CNC(=O)c3ccc(Br)s3)ccc12 ZINC000180870159 566095333 /nfs/dbraw/zinc/09/53/33/566095333.db2.gz RDSOIXCZHXONTJ-UHFFFAOYSA-N 0 1 393.266 3.064 10 0 GGAEMN Cc1[nH]ncc1CCCNS(=O)(=O)C=Cc1ccc(Br)cc1 ZINC000288928034 566096803 /nfs/dbraw/zinc/09/68/03/566096803.db2.gz MRXGNXVAIGJWRP-CSKARUKUSA-N 0 1 384.299 3.004 10 0 GGAEMN Cc1c(Cl)cc(S(=O)(=O)N2CCCC[C@H]2c2nnc[nH]2)cc1Cl ZINC000180930629 566100472 /nfs/dbraw/zinc/10/04/72/566100472.db2.gz HDRCJXPFHHBEKK-ZDUSSCGKSA-N 0 1 375.281 3.336 10 0 GGAEMN O=S(=O)(C=Cc1cccc(Br)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000180938413 566101176 /nfs/dbraw/zinc/10/11/76/566101176.db2.gz PXZYDXOUHCRZBQ-RCQQVGEISA-N 0 1 397.298 3.095 10 0 GGAEMN O=C1[C@H](N2C[C@@H](c3ccsc3)[C@H](CO)C2)CCN1c1cccc(Cl)c1 ZINC000249549317 566103503 /nfs/dbraw/zinc/10/35/03/566103503.db2.gz HIFXTIDUHKARQJ-JCGIZDLHSA-N 0 1 376.909 3.215 10 0 GGAEMN OC[C@@H]1CN(Cc2cc3c(c(Br)c2)OCO3)C[C@H]1c1ccsc1 ZINC000249570416 566105005 /nfs/dbraw/zinc/10/50/05/566105005.db2.gz OBJXLOVYFFAXJP-KBPBESRZSA-N 0 1 396.306 3.447 10 0 GGAEMN CO[C@@H]1CN([C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC[C@@H]1C ZINC000251518176 566110389 /nfs/dbraw/zinc/11/03/89/566110389.db2.gz CMOLDTPNTRFKPD-JJRVBVJISA-N 0 1 383.330 3.153 10 0 GGAEMN C[C@@H]1CN(C(=O)Nc2ccc(Br)c(Cl)c2)[C@@H](C)CN1CCO ZINC000416941688 566114203 /nfs/dbraw/zinc/11/42/03/566114203.db2.gz IJPOMYJRKPPLHL-MNOVXSKESA-N 0 1 390.709 3.021 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1ccc(Br)cc1 ZINC000181106515 566115871 /nfs/dbraw/zinc/11/58/71/566115871.db2.gz MNOSYDKOSNNVPQ-COXVUDFISA-N 0 1 381.314 3.270 10 0 GGAEMN CC(C)c1cc(Br)ccc1NC(=O)N1C[C@H](C)N(CCO)C[C@H]1C ZINC000416969015 566116712 /nfs/dbraw/zinc/11/67/12/566116712.db2.gz ZRXOXGYIBPUSSI-UONOGXRCSA-N 0 1 398.345 3.491 10 0 GGAEMN CCOc1c(Cl)cc(NC(=O)N2C[C@@H](C)N(CCO)C[C@@H]2C)cc1Cl ZINC000416995657 566118108 /nfs/dbraw/zinc/11/81/08/566118108.db2.gz LQGCBMYWCCXXJZ-NEPJUHHUSA-N 0 1 390.311 3.311 10 0 GGAEMN CCOc1c(Cl)cc(NC(=O)N2C[C@@H](C)N(CCO)C[C@H]2C)cc1Cl ZINC000416995660 566118474 /nfs/dbraw/zinc/11/84/74/566118474.db2.gz LQGCBMYWCCXXJZ-VXGBXAGGSA-N 0 1 390.311 3.311 10 0 GGAEMN COc1ccc2c(c1)CCN2C(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261690917 566129320 /nfs/dbraw/zinc/12/93/20/566129320.db2.gz HOYZZLABEGCJOA-SFHVURJKSA-N 0 1 375.266 3.221 10 0 GGAEMN CCOCc1nc([C@@H](C)NS(=O)(=O)c2c(Cl)cc(F)cc2Cl)no1 ZINC000289572547 566130558 /nfs/dbraw/zinc/13/05/58/566130558.db2.gz ONCJRNPBDMKUSI-SSDOTTSWSA-N 0 1 398.243 3.092 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1ccc(Br)cc1F ZINC000261748414 566131953 /nfs/dbraw/zinc/13/19/53/566131953.db2.gz UMWUKWFGKBUMJR-VQISRLSMSA-N 0 1 399.260 3.244 10 0 GGAEMN C[C@@H]1OCC[C@@]12CN(Cc1nc3ccc(Br)cc3[nH]1)C[C@@H](C)O2 ZINC000366072762 566133919 /nfs/dbraw/zinc/13/39/19/566133919.db2.gz LIVGVDCZWWDHIR-BWACUDIHSA-N 0 1 380.286 3.094 10 0 GGAEMN C[C@@H]1OCC[C@]12CN(Cc1nc3ccc(Br)cc3[nH]1)C[C@@H](C)O2 ZINC000366072866 566134149 /nfs/dbraw/zinc/13/41/49/566134149.db2.gz LIVGVDCZWWDHIR-PEBVRCNWSA-N 0 1 380.286 3.094 10 0 GGAEMN C[C@](N)(C(=O)N1CCC[C@@]2(CCCOC2)C1)c1ccc(Br)cc1 ZINC000261823907 566136542 /nfs/dbraw/zinc/13/65/42/566136542.db2.gz SWYNYPHQOSQXLO-QZTJIDSGSA-N 0 1 381.314 3.042 10 0 GGAEMN C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000181395079 566138440 /nfs/dbraw/zinc/13/84/40/566138440.db2.gz FABNXGLBRWBCKW-SJCJKPOMSA-N 0 1 398.322 3.237 10 0 GGAEMN COCCc1nc(C)c([C@@H](C)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)s1 ZINC000181395236 566138513 /nfs/dbraw/zinc/13/85/13/566138513.db2.gz IYNVTRMDDCJGER-CHWSQXEVSA-N 0 1 382.551 3.456 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)C(=O)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181388964 566138664 /nfs/dbraw/zinc/13/86/64/566138664.db2.gz RHYCIUAWMTYYAV-IUODEOHRSA-N 0 1 377.286 3.500 10 0 GGAEMN C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ncsc1Br ZINC000289912072 566146984 /nfs/dbraw/zinc/14/69/84/566146984.db2.gz NKBGPCFBOLJDBX-DGCLKSJQSA-N 0 1 380.311 3.156 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)Nc3cccc4c3OCC[C@H]4O)cc2s1 ZINC000366356854 566147998 /nfs/dbraw/zinc/14/79/98/566147998.db2.gz HCEZZNRKCKTFOZ-OAHLLOKOSA-N 0 1 376.459 3.221 10 0 GGAEMN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)nc1 ZINC000289953977 566150706 /nfs/dbraw/zinc/15/07/06/566150706.db2.gz WQGADJJXLDLLCI-BBRMVZONSA-N 0 1 376.298 3.194 10 0 GGAEMN CSc1ccccc1NC(=O)CCN1CCCC[C@H]1CCS(C)(=O)=O ZINC000366437096 566151543 /nfs/dbraw/zinc/15/15/43/566151543.db2.gz LXOHDULNRKMTSV-HNNXBMFYSA-N 0 1 384.567 3.026 10 0 GGAEMN CS(=O)(=O)CC[C@@H]1CCCCN1CCC(=O)Nc1ccc(Cl)cc1F ZINC000366445127 566153209 /nfs/dbraw/zinc/15/32/09/566153209.db2.gz VTYOYMFJQWKYBS-AWEZNQCLSA-N 0 1 390.908 3.097 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C[C@]2(CCOC2)O1 ZINC000366520720 566155774 /nfs/dbraw/zinc/15/57/74/566155774.db2.gz KIOSJKHKUMYLQP-GTNSWQLSSA-N 0 1 381.885 3.202 10 0 GGAEMN Cc1cc(Br)ccc1CC(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000181671790 566157337 /nfs/dbraw/zinc/15/73/37/566157337.db2.gz KPAFHZIBOHMZKZ-HNNXBMFYSA-N 0 1 395.341 3.012 10 0 GGAEMN CN(C)C(=O)c1ccccc1CN(C)[C@H](CO)c1cccc(Br)c1 ZINC000417804436 566175383 /nfs/dbraw/zinc/17/53/83/566175383.db2.gz CGTSZNYKIGYRRV-GOSISDBHSA-N 0 1 391.309 3.316 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417904582 566180293 /nfs/dbraw/zinc/18/02/93/566180293.db2.gz WBHXDCMCZXLCEC-BNOWGMLFSA-N 0 1 384.293 3.055 10 0 GGAEMN O=C(CCSc1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000367046202 566181979 /nfs/dbraw/zinc/18/19/79/566181979.db2.gz UJFHJMACLMFFMJ-GFCCVEGCSA-N 0 1 380.311 3.328 10 0 GGAEMN OCC1(NCc2ccc(F)cc2I)Cc2ccccc2C1 ZINC000417944241 566183792 /nfs/dbraw/zinc/18/37/92/566183792.db2.gz VZOMRRQTGUOHDY-UHFFFAOYSA-N 0 1 397.231 3.050 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CC(NC(=O)N[C@H]2CCCc3sc(Cl)cc32)C1 ZINC000263415236 566184818 /nfs/dbraw/zinc/18/48/18/566184818.db2.gz VVYQEMMFQWYLRP-XIVSLSHWSA-N 0 1 385.917 3.016 10 0 GGAEMN COc1cc(Br)ccc1CN1CCC[C@H](CN2CCOCC2)C1 ZINC000182155523 566185360 /nfs/dbraw/zinc/18/53/60/566185360.db2.gz NFYCNCBFYCYPOC-OAHLLOKOSA-N 0 1 383.330 3.002 10 0 GGAEMN C[C@H](NC[C@H]1CCC2(CCOCC2)[C@H]1O)c1ncc(Br)s1 ZINC000367125308 566186620 /nfs/dbraw/zinc/18/66/20/566186620.db2.gz DNULMKWJKNFREZ-LOWVWBTDSA-N 0 1 375.332 3.124 10 0 GGAEMN CC(C)c1nc(C(=O)N2CC[C@H](C)[C@H](NC(=O)C(F)(F)F)[C@@H]2C)cs1 ZINC000290764124 566187745 /nfs/dbraw/zinc/18/77/45/566187745.db2.gz ZZINQGQDQDHSRZ-NHCYSSNCSA-N 0 1 377.432 3.184 10 0 GGAEMN COC(=O)c1ccc(C[N@@H+]2[C@@H]3CCCC[C@H]3C[C@H]2C(=O)[O-])c(Br)c1 ZINC000263534641 566188573 /nfs/dbraw/zinc/18/85/73/566188573.db2.gz YMZZANZDMXZTON-XZJROXQQSA-N 0 1 396.281 3.453 10 0 GGAEMN C[C@@H](CS(C)(=O)=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000367163565 566188881 /nfs/dbraw/zinc/18/88/81/566188881.db2.gz KOZGWQZBXDWCIQ-YQCLPMHJSA-N 0 1 384.973 3.277 10 0 GGAEMN Cc1sc(NC(=O)CN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(C)c1C ZINC000182197028 566189015 /nfs/dbraw/zinc/18/90/15/566189015.db2.gz HPXDDPOOGUUEGZ-ZDUSSCGKSA-N 0 1 380.535 3.366 10 0 GGAEMN COc1cc(Br)c(C[N@@H+]2[C@H](C(=O)[O-])C[C@H]3CCCC[C@@H]32)cc1O ZINC000263521394 566189151 /nfs/dbraw/zinc/18/91/51/566189151.db2.gz RDTHQTSWWNUHHN-SWHYSGLUSA-N 0 1 384.270 3.381 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](CCOc2ccccc2Br)C[C@H]1C(F)(F)F ZINC000263561745 566190790 /nfs/dbraw/zinc/19/07/90/566190790.db2.gz CIWFOBKUPFQLNL-NXEZZACHSA-N 0 1 382.176 3.023 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(c2nccc3cc(Br)ccc32)CC1 ZINC000263546588 566190566 /nfs/dbraw/zinc/19/05/66/566190566.db2.gz HLDCYPHAELCZOD-OAHLLOKOSA-N 0 1 392.297 3.373 10 0 GGAEMN O=C([O-])[C@@H]1C[N@H+](CCOc2ccccc2Br)C[C@H]1C(F)(F)F ZINC000263561745 566190785 /nfs/dbraw/zinc/19/07/85/566190785.db2.gz CIWFOBKUPFQLNL-NXEZZACHSA-N 0 1 382.176 3.023 10 0 GGAEMN O=C(NCCc1c[nH]c2cccc(Br)c12)[C@H]1CCCc2[nH]ncc21 ZINC000290837579 566191531 /nfs/dbraw/zinc/19/15/31/566191531.db2.gz HAEDJSLKDTYJQE-LBPRGKRZSA-N 0 1 387.281 3.432 10 0 GGAEMN Cn1cc([C@H]2CCN(Cc3cc4c(cc3Br)OCCCO4)C2)cn1 ZINC000182313537 566196648 /nfs/dbraw/zinc/19/66/48/566196648.db2.gz ZZEITEKCDQKMOT-ZDUSSCGKSA-N 0 1 392.297 3.333 10 0 GGAEMN CCC[C@H]1CNCCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000418152120 566201569 /nfs/dbraw/zinc/20/15/69/566201569.db2.gz HHVPRSOJUIFZNA-WFASDCNBSA-N 0 1 382.302 3.056 10 0 GGAEMN Clc1ccc(-n2cc(CN3CCCC[C@H]3c3nnc[nH]3)nn2)cc1Cl ZINC000182395814 566202079 /nfs/dbraw/zinc/20/20/79/566202079.db2.gz SCDGVVRMEBDAHE-HNNXBMFYSA-N 0 1 378.267 3.419 10 0 GGAEMN COc1cc(CNCc2cn(C)nc2C(F)F)cc(Br)c1OC ZINC000291159229 566207986 /nfs/dbraw/zinc/20/79/86/566207986.db2.gz IELXBOYZAYYELC-UHFFFAOYSA-N 0 1 390.228 3.427 10 0 GGAEMN CN1CC[C@@H](NCc2ncc(I)s2)[C@@H]1c1ccccc1 ZINC000367603363 566208893 /nfs/dbraw/zinc/20/88/93/566208893.db2.gz ZIFHXJSGCBFJFQ-DOMZBBRYSA-N 0 1 399.301 3.283 10 0 GGAEMN CN1CC[C@H](NCc2ncc(I)s2)[C@H]1c1ccccc1 ZINC000367603365 566209303 /nfs/dbraw/zinc/20/93/03/566209303.db2.gz ZIFHXJSGCBFJFQ-SWLSCSKDSA-N 0 1 399.301 3.283 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)C1(c2cc(F)cc(Br)c2)CC1 ZINC000367607801 566209583 /nfs/dbraw/zinc/20/95/83/566209583.db2.gz PIEFWMCYGOHYBN-CYBMUJFWSA-N 0 1 378.245 3.017 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1cccc(Br)c1 ZINC000182568999 566212858 /nfs/dbraw/zinc/21/28/58/566212858.db2.gz GWJUJLZYLAFGKL-JQFCIGGWSA-N 0 1 381.314 3.270 10 0 GGAEMN C[C@H](NCC(=O)NC(=O)NCc1cccs1)c1cccc(Br)c1 ZINC000182578507 566213059 /nfs/dbraw/zinc/21/30/59/566213059.db2.gz PRKRSZIKZYDBGP-NSHDSACASA-N 0 1 396.310 3.187 10 0 GGAEMN O=S(=O)(CCN1CCCC[C@H]1c1nnc[nH]1)c1cc(Cl)ccc1Cl ZINC000182679373 566218650 /nfs/dbraw/zinc/21/86/50/566218650.db2.gz FOAQLGKSWDCWCF-ZDUSSCGKSA-N 0 1 389.308 3.112 10 0 GGAEMN CC(C)(NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1 ZINC000367848718 566220310 /nfs/dbraw/zinc/22/03/10/566220310.db2.gz KTZZLJRQYBRASW-ZDUSSCGKSA-N 0 1 377.286 3.264 10 0 GGAEMN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN1CCCC[C@@H]1c1nnc[nH]1 ZINC000182726044 566220769 /nfs/dbraw/zinc/22/07/69/566220769.db2.gz IVCJOANWDZXLRT-OAHLLOKOSA-N 0 1 382.295 3.297 10 0 GGAEMN NC(=O)[C@@H]1CCCCC[C@H]1Nc1nc(C(F)(F)F)c(Br)s1 ZINC000418886228 566226631 /nfs/dbraw/zinc/22/66/31/566226631.db2.gz KKOXJQIEJQNELF-RNFRBKRXSA-N 0 1 386.237 3.192 10 0 GGAEMN NC(=O)[C@H]1CCCCC[C@@H]1Nc1nc(C(F)(F)F)c(Br)s1 ZINC000418886225 566226708 /nfs/dbraw/zinc/22/67/08/566226708.db2.gz KKOXJQIEJQNELF-BQBZGAKWSA-N 0 1 386.237 3.192 10 0 GGAEMN CC(C)n1cnc(S(=O)(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)c1 ZINC000182875673 566227879 /nfs/dbraw/zinc/22/78/79/566227879.db2.gz PGEHIOOIIIDYER-ZDUSSCGKSA-N 0 1 383.342 3.324 10 0 GGAEMN Cc1ccc(NC(=O)[C@H](C)N[C@@H](CO)c2ccccc2)c(Br)c1 ZINC000182922855 566230116 /nfs/dbraw/zinc/23/01/16/566230116.db2.gz LQGIHTAERWBBGP-GUYCJALGSA-N 0 1 377.282 3.408 10 0 GGAEMN O=C(NC1CCN(Cc2cccnc2)CC1)c1csc(Br)c1 ZINC000265135544 566231320 /nfs/dbraw/zinc/23/13/20/566231320.db2.gz GWTTWQXNFLOMGF-UHFFFAOYSA-N 0 1 380.311 3.300 10 0 GGAEMN C[C@@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1F ZINC000368188804 566233009 /nfs/dbraw/zinc/23/30/09/566233009.db2.gz FARUXVDCBNBBEN-MWLCHTKSSA-N 0 1 381.249 3.229 10 0 GGAEMN Cc1noc(C2CCC(NCc3c(Cl)cccc3S(C)(=O)=O)CC2)n1 ZINC000368278861 566235004 /nfs/dbraw/zinc/23/50/04/566235004.db2.gz ABQZGJVHKALASA-UHFFFAOYSA-N 0 1 383.901 3.251 10 0 GGAEMN CC[C@H](NCc1csc(Br)c1)c1cccc(S(N)(=O)=O)c1 ZINC000183031522 566235621 /nfs/dbraw/zinc/23/56/21/566235621.db2.gz JLHVYWSRTPUHGN-ZDUSSCGKSA-N 0 1 389.340 3.399 10 0 GGAEMN COc1cc(NC(=O)N2CCCC[C@@H]2c2nnc[nH]2)ccc1Br ZINC000183085617 566236991 /nfs/dbraw/zinc/23/69/91/566236991.db2.gz YCXGEWYSBILGMU-GFCCVEGCSA-N 0 1 380.246 3.335 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2sccc2Cl)C1 ZINC000419553848 566238096 /nfs/dbraw/zinc/23/80/96/566238096.db2.gz ATYFZASVPAMCGO-CYBMUJFWSA-N 0 1 376.975 3.108 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCC2CCC(F)(F)CC2)C1 ZINC000419599129 566239422 /nfs/dbraw/zinc/23/94/22/566239422.db2.gz DPKYGGFGEWIXJL-INIZCTEOSA-N 0 1 378.529 3.018 10 0 GGAEMN O=C(Cc1cc(Br)ccc1F)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000368820290 566245825 /nfs/dbraw/zinc/24/58/25/566245825.db2.gz DBIPTWFRAWPYEA-MRXNPFEDSA-N 0 1 389.228 3.155 10 0 GGAEMN O=C(CN[C@@H](c1nnc[nH]1)c1ccccc1)Nc1ccc(Cl)c(Cl)c1 ZINC000368936544 566248034 /nfs/dbraw/zinc/24/80/34/566248034.db2.gz BYPOYVUDRGLNEN-MRXNPFEDSA-N 0 1 376.247 3.429 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCO[C@@H](c2ccccc2Br)C1 ZINC000183491503 566248209 /nfs/dbraw/zinc/24/82/09/566248209.db2.gz MJGFMUJXHVQLMB-QGZVFWFLSA-N 0 1 390.281 3.124 10 0 GGAEMN Cc1ccc(-c2n[nH]c(NC(=O)Cc3ccc(Br)cc3O)n2)o1 ZINC000444744421 566250567 /nfs/dbraw/zinc/25/05/67/566250567.db2.gz PECKCXRUUUNSKX-UHFFFAOYSA-N 0 1 377.198 3.022 10 0 GGAEMN O=C(Nc1cc(-c2ccc(Br)o2)no1)[C@@H]1CCCc2[nH]ncc21 ZINC000419943850 566253490 /nfs/dbraw/zinc/25/34/90/566253490.db2.gz JDWRNKJVRGFLGH-MRVPVSSYSA-N 0 1 377.198 3.479 10 0 GGAEMN Cc1c(Cl)cc(F)c(NC(=O)N2CCN(CC(C)(C)O)[C@@H](C)C2)c1F ZINC000444872244 566255201 /nfs/dbraw/zinc/25/52/01/566255201.db2.gz KNYXRWBUMDOTSW-JTQLQIEISA-N 0 1 375.847 3.236 10 0 GGAEMN CN(Cc1cc(Br)ccc1F)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000575172622 566255798 /nfs/dbraw/zinc/25/57/98/566255798.db2.gz SWADFNIPKPIVIC-GFCCVEGCSA-N 0 1 381.249 3.010 10 0 GGAEMN CNC(=O)C[C@@H](NCc1cnc2ccc(Br)cn12)c1ccccc1 ZINC000481819892 566255697 /nfs/dbraw/zinc/25/56/97/566255697.db2.gz RNYWIEKKFHIKBI-MRXNPFEDSA-N 0 1 387.281 3.064 10 0 GGAEMN [O-]c1c(Br)cc(C[N@@H+]2CC[C@@H]3COC[C@H]3C2)cc1Br ZINC000668705216 566258365 /nfs/dbraw/zinc/25/83/65/566258365.db2.gz HBPDGPLAZGODIY-GHMZBOCLSA-N 0 1 391.103 3.386 10 0 GGAEMN [O-]c1c(Br)cc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)cc1Br ZINC000668705216 566258369 /nfs/dbraw/zinc/25/83/69/566258369.db2.gz HBPDGPLAZGODIY-GHMZBOCLSA-N 0 1 391.103 3.386 10 0 GGAEMN CNC(=O)c1cc(NS(=O)(=O)c2cc(C)cc(C)c2OC)ccc1Cl ZINC000509074340 566258635 /nfs/dbraw/zinc/25/86/35/566258635.db2.gz IRSFQAKHAJNIIJ-UHFFFAOYSA-N 0 1 382.869 3.126 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)NC[C@H](C)N(C)Cc1ccccc1 ZINC000624964629 566264056 /nfs/dbraw/zinc/26/40/56/566264056.db2.gz ZDQUKLXSEBWSLR-HNNXBMFYSA-N 0 1 376.513 3.498 10 0 GGAEMN Cc1ccn2ncc(C(=O)Nc3cc(Br)cc(Cl)c3O)c2n1 ZINC000534941052 566265814 /nfs/dbraw/zinc/26/58/14/566265814.db2.gz NCKFDTKCCVNMFC-UHFFFAOYSA-N 0 1 381.617 3.412 10 0 GGAEMN COC(=O)[C@@H]1CN(Cc2ccncc2Br)C[C@H]1c1ccccc1 ZINC000599450908 566266623 /nfs/dbraw/zinc/26/66/23/566266623.db2.gz PGXHQPFLSHWRBN-JKSUJKDBSA-N 0 1 375.266 3.233 10 0 GGAEMN CCc1nc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C)o1 ZINC000509164909 566270264 /nfs/dbraw/zinc/27/02/64/566270264.db2.gz JAWHFPBLKJJSOB-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN CCc1nc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)o1 ZINC000509164909 566270273 /nfs/dbraw/zinc/27/02/73/566270273.db2.gz JAWHFPBLKJJSOB-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN CC(C)(C)n1cnc(=NC(=O)c2cc3c(cncc3Br)s2)[nH]1 ZINC000648352412 566270298 /nfs/dbraw/zinc/27/02/98/566270298.db2.gz FTHLNMPNMIYFFZ-UHFFFAOYSA-N 0 1 380.271 3.080 10 0 GGAEMN Fc1c(Br)ccc(CN2CCN(C[C@H]3CCCO3)CC2)c1F ZINC000625045490 566270732 /nfs/dbraw/zinc/27/07/32/566270732.db2.gz LLWGYJWGWBTCGN-CYBMUJFWSA-N 0 1 375.257 3.024 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)CCCOc2ccc(Cl)cc2Cl)CC1 ZINC000535000727 566270982 /nfs/dbraw/zinc/27/09/82/566270982.db2.gz TZEUIWNMBJBFMU-OAHLLOKOSA-N 0 1 389.323 3.068 10 0 GGAEMN C[C@H](C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1)c1cccc(Br)c1 ZINC000462272676 566272276 /nfs/dbraw/zinc/27/22/76/566272276.db2.gz PFWZNMCFIRDQTF-VIFPVBQESA-N 0 1 387.237 3.167 10 0 GGAEMN CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C[C@@H](O)CC1(O)CCC1 ZINC000625071503 566272578 /nfs/dbraw/zinc/27/25/78/566272578.db2.gz ZOAQTBJGMVDULM-AWEZNQCLSA-N 0 1 389.323 3.310 10 0 GGAEMN CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C[C@@H](O)CC1(O)CCC1 ZINC000625061220 566272694 /nfs/dbraw/zinc/27/26/94/566272694.db2.gz SPEYPMMTPFKRQG-AWEZNQCLSA-N 0 1 389.323 3.310 10 0 GGAEMN C[C@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(F)(F)F ZINC000625115317 566277606 /nfs/dbraw/zinc/27/76/06/566277606.db2.gz MKBMHUFTRYSYSD-MRVPVSSYSA-N 0 1 391.191 3.439 10 0 GGAEMN C[C@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(F)(F)F ZINC000625115317 566277612 /nfs/dbraw/zinc/27/76/12/566277612.db2.gz MKBMHUFTRYSYSD-MRVPVSSYSA-N 0 1 391.191 3.439 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1 ZINC000462302372 566278486 /nfs/dbraw/zinc/27/84/86/566278486.db2.gz XVFWJBGINCEQFL-UKRRQHHQSA-N 0 1 389.359 3.169 10 0 GGAEMN CCO[C@@H](CN1CCN(C(=O)c2ccc(Br)cc2)CC1)C1CC1 ZINC000625130633 566279911 /nfs/dbraw/zinc/27/99/11/566279911.db2.gz VEYZVEXRENFHLD-KRWDZBQOSA-N 0 1 381.314 3.022 10 0 GGAEMN COCC(C)(C)N1CCN(C(=O)[C@H]2CCc3cc(Br)ccc32)CC1 ZINC000648425450 566283575 /nfs/dbraw/zinc/28/35/75/566283575.db2.gz VFBRUOCPDYEBKT-KRWDZBQOSA-N 0 1 395.341 3.048 10 0 GGAEMN C[C@@H]1CN(C)C[C@@H](C)N1C(=O)c1ccc(Cl)c(I)c1 ZINC000535226579 566286254 /nfs/dbraw/zinc/28/62/54/566286254.db2.gz QGZMATFVAXQVNN-NXEZZACHSA-N 0 1 392.668 3.109 10 0 GGAEMN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000669104385 566286364 /nfs/dbraw/zinc/28/63/64/566286364.db2.gz ZLPYHLNEJGOPGK-ZDUSSCGKSA-N 0 1 388.309 3.467 10 0 GGAEMN COC(=O)[C@@H]1C[C@@H](C)N(Cc2nc3ccc(Br)cc3[nH]2)[C@@H](C)C1 ZINC000599699825 566287682 /nfs/dbraw/zinc/28/76/82/566287682.db2.gz ZJTASMJNLWTPJJ-ZSBIGDGJSA-N 0 1 380.286 3.487 10 0 GGAEMN CN(C(=O)c1c(F)c(F)c(Br)c(F)c1F)[C@H]1CCCN(C)C1 ZINC000669177778 566287944 /nfs/dbraw/zinc/28/79/44/566287944.db2.gz NTFXNWNTYBJUTP-ZETCQYMHSA-N 0 1 383.183 3.172 10 0 GGAEMN Cc1cc(Cl)c2ccccc2c1NS(=O)(=O)c1cc(C(N)=O)n(C)c1 ZINC000462352779 566289898 /nfs/dbraw/zinc/28/98/98/566289898.db2.gz PEPBSNYMMYPIPZ-UHFFFAOYSA-N 0 1 377.853 3.040 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccccc2Br)n[nH]1 ZINC000648517804 566292153 /nfs/dbraw/zinc/29/21/53/566292153.db2.gz ZINFRZQEECUNFF-AAEUAGOBSA-N 0 1 379.258 3.378 10 0 GGAEMN CC(C)(C)N1CCc2nc(NC(=O)c3csc(NC4CC4)n3)sc2C1 ZINC000575863153 566292984 /nfs/dbraw/zinc/29/29/84/566292984.db2.gz PBWBWLWEGUZAHO-UHFFFAOYSA-N 0 1 377.539 3.005 10 0 GGAEMN CCN([C@@H]1CCN([C@H](C)c2ccccc2)C1)S(=O)(=O)CCC(F)(F)F ZINC000556378243 566294725 /nfs/dbraw/zinc/29/47/25/566294725.db2.gz KVCNGULTNOWLKL-GDBMZVCRSA-N 0 1 378.460 3.426 10 0 GGAEMN CCCn1c(=O)[nH]nc1SCCOc1cc(F)cc(Br)c1 ZINC000445565707 566296354 /nfs/dbraw/zinc/29/63/54/566296354.db2.gz LUPCPPVSBXDSIL-UHFFFAOYSA-N 0 1 376.251 3.466 10 0 GGAEMN CC(C)[C@H](NCC(F)(F)F)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000669348258 566297257 /nfs/dbraw/zinc/29/72/57/566297257.db2.gz KZXXKUMDYAYDSZ-NSHDSACASA-N 0 1 393.207 3.440 10 0 GGAEMN COc1cc(NC(=O)[C@H]2Cc3ccccc3CN2)cc(OC)c1Br ZINC000575923785 566298778 /nfs/dbraw/zinc/29/87/78/566298778.db2.gz HKZNYVNBYCYIDB-CQSZACIVSA-N 0 1 391.265 3.119 10 0 GGAEMN CCS(=O)(=O)c1ccc(CNC(=O)c2n[nH]c3ccc(Cl)cc32)s1 ZINC000509407732 566302192 /nfs/dbraw/zinc/30/21/92/566302192.db2.gz RWKBNSHSVYCWJN-UHFFFAOYSA-N 0 1 383.882 3.001 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)N1CCc2nc[nH]c2C1 ZINC000599953082 566306339 /nfs/dbraw/zinc/30/63/39/566306339.db2.gz UXXUJZKNGFGQRQ-UHFFFAOYSA-N 0 1 384.274 3.129 10 0 GGAEMN O=S(=O)(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(Cl)cc(Cl)c1 ZINC000445715392 566307240 /nfs/dbraw/zinc/30/72/40/566307240.db2.gz DDSLLQIYJKKDGA-AWEZNQCLSA-N 0 1 383.260 3.179 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@@H]1CCc2cc(Br)ccc2NC1=O ZINC000625332358 566309708 /nfs/dbraw/zinc/30/97/08/566309708.db2.gz IROTYQLVLUKYRM-HUUCEWRRSA-N 0 1 395.322 3.396 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@H]1CCc2cc(Br)ccc2NC1=O ZINC000625332357 566309870 /nfs/dbraw/zinc/30/98/70/566309870.db2.gz IROTYQLVLUKYRM-GJZGRUSLSA-N 0 1 395.322 3.396 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@@H]1CCc2cc(Br)ccc2NC1=O ZINC000625332356 566310029 /nfs/dbraw/zinc/31/00/29/566310029.db2.gz IROTYQLVLUKYRM-CABCVRRESA-N 0 1 395.322 3.396 10 0 GGAEMN O=C([O-])C[N@@H+](CCOc1ccc(Br)cc1)CCc1ccccc1 ZINC000576046286 566310264 /nfs/dbraw/zinc/31/02/64/566310264.db2.gz GXYOWFXBQYDVHH-UHFFFAOYSA-N 0 1 378.266 3.457 10 0 GGAEMN O=S(=O)(CCN[C@H](c1cccnc1)C1CC1)c1ccc(Br)cc1 ZINC000445820917 566313010 /nfs/dbraw/zinc/31/30/10/566313010.db2.gz VJIHJLQJEVERCA-KRWDZBQOSA-N 0 1 395.322 3.359 10 0 GGAEMN CN(C(=O)c1cc2c(cncc2Br)s1)[C@@H]1CN2CCC1CC2 ZINC000648779197 566313267 /nfs/dbraw/zinc/31/32/67/566313267.db2.gz DZYUPVCHZUEXBW-CYBMUJFWSA-N 0 1 380.311 3.225 10 0 GGAEMN O=S(=O)(CCN[C@H](c1cccnc1)C1CC1)c1cccc(Br)c1 ZINC000445819692 566314000 /nfs/dbraw/zinc/31/40/00/566314000.db2.gz RKWJIZQTZOGJCX-KRWDZBQOSA-N 0 1 395.322 3.359 10 0 GGAEMN C[C@H](CC(=O)NCc1ccc(F)c(CN(C)C)c1)n1cc(Br)cn1 ZINC000648785793 566314202 /nfs/dbraw/zinc/31/42/02/566314202.db2.gz BDPYHNGJECFZQU-GFCCVEGCSA-N 0 1 397.292 3.114 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](C)c1cc(F)c(Br)cc1F ZINC000625378318 566315034 /nfs/dbraw/zinc/31/50/34/566315034.db2.gz IMPKWWINTMRBOK-SNVBAGLBSA-N 0 1 399.301 3.050 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](C)c1cc(F)c(Br)cc1F ZINC000625378317 566315116 /nfs/dbraw/zinc/31/51/16/566315116.db2.gz IMPKWWINTMRBOK-JTQLQIEISA-N 0 1 399.301 3.050 10 0 GGAEMN COc1nc(C)cc(C)c1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000600109044 566315669 /nfs/dbraw/zinc/31/56/69/566315669.db2.gz NLMVSEJFDOVKOR-UHFFFAOYSA-N 0 1 389.253 3.276 10 0 GGAEMN CCO[C@@H](CN(CCNC(C)=O)Cc1ccc(Br)s1)C1CC1 ZINC000625398938 566316163 /nfs/dbraw/zinc/31/61/63/566316163.db2.gz XKJZJCFJEAOPTG-HNNXBMFYSA-N 0 1 389.359 3.264 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC(c3ccc(Br)cc3)CC2)C1 ZINC000669653919 566317151 /nfs/dbraw/zinc/31/71/51/566317151.db2.gz HRIXHOIOBJZWGI-KRWDZBQOSA-N 0 1 380.330 3.432 10 0 GGAEMN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc2c(cncc2Br)s1 ZINC000648822077 566318793 /nfs/dbraw/zinc/31/87/93/566318793.db2.gz KERWTSHPTDVVBG-RNCFNFMXSA-N 0 1 380.311 3.271 10 0 GGAEMN CCc1nc([C@@H](C)Nc2ncnc3ccc(I)cc32)n[nH]1 ZINC000535684733 566318890 /nfs/dbraw/zinc/31/88/90/566318890.db2.gz AVESIHGWSKEYLH-MRVPVSSYSA-N 0 1 394.220 3.088 10 0 GGAEMN COc1cc(NS(=O)(=O)c2ccc(F)cc2C)ncc1Br ZINC000535688990 566319122 /nfs/dbraw/zinc/31/91/22/566319122.db2.gz BVPPMFITGWOSJB-UHFFFAOYSA-N 0 1 375.219 3.101 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc2c(cncc2Br)s1 ZINC000648835495 566320777 /nfs/dbraw/zinc/32/07/77/566320777.db2.gz URWWXHWXDWQWRE-QMMMGPOBSA-N 0 1 377.267 3.069 10 0 GGAEMN CCCN(C)[C@@H](CNS(=O)(=O)Cc1cc(C)on1)c1ccc(Cl)cc1 ZINC000509618991 566320972 /nfs/dbraw/zinc/32/09/72/566320972.db2.gz DTFFVWRODQDLSW-KRWDZBQOSA-N 0 1 385.917 3.139 10 0 GGAEMN CC(C)Oc1ncccc1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000669695585 566322460 /nfs/dbraw/zinc/32/24/60/566322460.db2.gz QAYDPDOCDRKWCQ-UHFFFAOYSA-N 0 1 389.253 3.438 10 0 GGAEMN COC(=O)Cc1ccc(CNCc2ccc(OC)cc2Br)cc1 ZINC000600185527 566322652 /nfs/dbraw/zinc/32/26/52/566322652.db2.gz OWEKWBWBSXFIHN-UHFFFAOYSA-N 0 1 378.266 3.463 10 0 GGAEMN O=C(Nc1cnn(Cc2ccccn2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000669698715 566322612 /nfs/dbraw/zinc/32/26/12/566322612.db2.gz BNHKFZQTKNKGOJ-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1cc(Br)cc2[nH]cnc21 ZINC000669699761 566322760 /nfs/dbraw/zinc/32/27/60/566322760.db2.gz HJBONUKNRLIUHJ-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000669699761 566322767 /nfs/dbraw/zinc/32/27/67/566322767.db2.gz HJBONUKNRLIUHJ-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN COc1ccc(-c2n[nH]c(Sc3nc([C@H](C)OC)ns3)n2)c(OC)c1 ZINC000509638862 566322813 /nfs/dbraw/zinc/32/28/13/566322813.db2.gz KDWZSXOPJUNUMP-QMMMGPOBSA-N 0 1 379.467 3.199 10 0 GGAEMN COC(=O)Cc1ccc(CNCc2cc(Br)ccc2OC)cc1 ZINC000600187286 566323360 /nfs/dbraw/zinc/32/33/60/566323360.db2.gz MNUICVKFOXICAF-UHFFFAOYSA-N 0 1 378.266 3.463 10 0 GGAEMN CC(C)[C@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)c1ccnn1C ZINC000669721337 566324668 /nfs/dbraw/zinc/32/46/68/566324668.db2.gz MTBZUCGHOZPZTG-ZDUSSCGKSA-N 0 1 390.285 3.229 10 0 GGAEMN COc1cc(CCNC(=O)c2cc(Br)cc3nc[nH]c32)ccc1O ZINC000669711424 566324694 /nfs/dbraw/zinc/32/46/94/566324694.db2.gz HTIHOKCREIMPQF-UHFFFAOYSA-N 0 1 390.237 3.012 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Br)[C@H](C)[C@H](C)O1 ZINC000446073155 566327566 /nfs/dbraw/zinc/32/75/66/566327566.db2.gz RZCFRRNUAOIOLK-NMKXLXIOSA-N 0 1 392.721 3.340 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Br)[C@@H](C)[C@H](C)O1 ZINC000446073156 566327594 /nfs/dbraw/zinc/32/75/94/566327594.db2.gz RZCFRRNUAOIOLK-UHXUPSOCSA-N 0 1 392.721 3.340 10 0 GGAEMN CCc1c(NC(=O)c2cc[nH]c(=O)c2Br)[nH]nc1-c1ccncc1 ZINC000446095518 566329113 /nfs/dbraw/zinc/32/91/13/566329113.db2.gz NPBYAZZZYRSHLZ-UHFFFAOYSA-N 0 1 388.225 3.150 10 0 GGAEMN O=S(=O)(NC[C@H]1CCN1C1CCCC1)c1ccc(F)cc1C(F)(F)F ZINC000625533957 566332056 /nfs/dbraw/zinc/33/20/56/566332056.db2.gz XAUJLSUKGXJSTE-CYBMUJFWSA-N 0 1 380.407 3.140 10 0 GGAEMN CNC(=O)[C@H]1CCN(Cc2csc(-c3ccc(Br)cc3)n2)C1 ZINC000420978546 566334545 /nfs/dbraw/zinc/33/45/45/566334545.db2.gz RVWXWXKSOVOILC-LBPRGKRZSA-N 0 1 380.311 3.141 10 0 GGAEMN C/C=C\CNS(=O)(=O)c1scc(Br)c1Br ZINC000625556988 566335475 /nfs/dbraw/zinc/33/54/75/566335475.db2.gz DZTWAMKJRPLFIV-IHWYPQMZSA-N 0 1 375.107 3.128 10 0 GGAEMN Cn1nc2c(c1CNC(=O)c1cn[nH]c1-c1ccc(Cl)s1)CCCC2 ZINC000462641275 566335476 /nfs/dbraw/zinc/33/54/76/566335476.db2.gz BAJRXMXLEKKCRA-UHFFFAOYSA-N 0 1 375.885 3.334 10 0 GGAEMN CN(C)C[C@H](Cc1ccccc1)NS(=O)(=O)Cc1ccc(F)c(Cl)c1 ZINC000535912396 566339048 /nfs/dbraw/zinc/33/90/48/566339048.db2.gz BNLXZBDCAQHRFL-INIZCTEOSA-N 0 1 384.904 3.071 10 0 GGAEMN CN(C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)[C@H]1CN2CCC1CC2 ZINC000600516801 566343233 /nfs/dbraw/zinc/34/32/33/566343233.db2.gz ONBYGVJJKTVQPU-KRWDZBQOSA-N 0 1 379.291 3.345 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)CN1[C@H](C)CC[C@@H]1C ZINC000482957797 566344594 /nfs/dbraw/zinc/34/45/94/566344594.db2.gz IWFSTYFXCOZHNJ-BETUJISGSA-N 0 1 389.359 3.358 10 0 GGAEMN COc1ccc(Br)c(CNC[C@H]2CS(=O)(=O)c3ccccc32)c1 ZINC000576430706 566344915 /nfs/dbraw/zinc/34/49/15/566344915.db2.gz DGMVPHKQWFBKCU-ZDUSSCGKSA-N 0 1 396.306 3.118 10 0 GGAEMN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccccc1OC(F)(F)F ZINC000556923058 566345095 /nfs/dbraw/zinc/34/50/95/566345095.db2.gz HYQNMHYCYFVKHX-STQMWFEESA-N 0 1 380.432 3.050 10 0 GGAEMN C[C@@]1(CNC(=O)c2cc(Br)cc3nc[nH]c32)CCO[C@@H]1C1CC1 ZINC000556918785 566345196 /nfs/dbraw/zinc/34/51/96/566345196.db2.gz LJDGTYOLBJIBIH-WBVHZDCISA-N 0 1 378.270 3.260 10 0 GGAEMN CC(C)[C@H]1CCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000446389386 566347552 /nfs/dbraw/zinc/34/75/52/566347552.db2.gz XFHBENPKYZPMTH-JTQLQIEISA-N 0 1 383.233 3.286 10 0 GGAEMN CC(C)[C@@H]1CCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000446389391 566347990 /nfs/dbraw/zinc/34/79/90/566347990.db2.gz XFHBENPKYZPMTH-SNVBAGLBSA-N 0 1 383.233 3.286 10 0 GGAEMN C[C@@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)CC2(CCCC2)O1 ZINC000649178388 566348999 /nfs/dbraw/zinc/34/89/99/566348999.db2.gz SVYBDYIDDXESRB-LLVKDONJSA-N 0 1 378.270 3.499 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)[C@@H](C)Cc1cnc[nH]1 ZINC000576478398 566349949 /nfs/dbraw/zinc/34/99/49/566349949.db2.gz YEWLPOIOZGCZBY-NSHDSACASA-N 0 1 382.258 3.015 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@H](NCc2sccc2Br)C1 ZINC000509944549 566350523 /nfs/dbraw/zinc/35/05/23/566350523.db2.gz PCJDIGLHPNPVAB-ZDUSSCGKSA-N 0 1 395.322 3.280 10 0 GGAEMN CNS(=O)(=O)C1CCN(C/C(C)=C\c2cccc(C(F)(F)F)c2)CC1 ZINC000576487227 566351847 /nfs/dbraw/zinc/35/18/47/566351847.db2.gz BRXJPKFMXBWNCD-RAXLEYEMSA-N 0 1 376.444 3.122 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)c1cc2c(cncc2Br)s1 ZINC000649210603 566353712 /nfs/dbraw/zinc/35/37/12/566353712.db2.gz BTFUNIBLLYKBEU-UHFFFAOYSA-N 0 1 379.283 3.453 10 0 GGAEMN O[C@H]([C@@H]1CCCN1C[C@H](O)COc1c(Cl)cccc1Cl)C(F)(F)F ZINC000600652147 566353939 /nfs/dbraw/zinc/35/39/39/566353939.db2.gz YUSZJEQNBVJIQV-DUFXMDAXSA-N 0 1 388.213 3.121 10 0 GGAEMN CO[C@@H](Cc1ccccc1)CS(=O)(=O)Nc1cc(Cl)c(Cl)cn1 ZINC000421225196 566355959 /nfs/dbraw/zinc/35/59/59/566355959.db2.gz JRCCWSGEEDZXTK-LBPRGKRZSA-N 0 1 375.277 3.388 10 0 GGAEMN CN(Cc1nc2ccc(Br)cc2[nH]1)[C@@H](CC(N)=O)c1ccccc1 ZINC000483112397 566359500 /nfs/dbraw/zinc/35/95/00/566359500.db2.gz SDDYNHSOJPHHTB-INIZCTEOSA-N 0 1 387.281 3.374 10 0 GGAEMN COc1cc(Br)ccc1[C@@H]1CCCN1CCCN1CCOCC1 ZINC000625795082 566359665 /nfs/dbraw/zinc/35/96/65/566359665.db2.gz QMTNVBULUHNLRB-KRWDZBQOSA-N 0 1 383.330 3.317 10 0 GGAEMN OC[C@@]1(NCc2nnc(C3CC3)s2)CCc2cc(Br)ccc2C1 ZINC000625796285 566360572 /nfs/dbraw/zinc/36/05/72/566360572.db2.gz JCOZZGJWYJZCEA-QGZVFWFLSA-N 0 1 394.338 3.188 10 0 GGAEMN CC(C)c1nnc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000625796636 566360800 /nfs/dbraw/zinc/36/08/00/566360800.db2.gz KPICBQCXDJEENZ-QGZVFWFLSA-N 0 1 396.354 3.434 10 0 GGAEMN OC[C@]1(NCc2nnc(C3CC3)s2)CCc2cc(Br)ccc2C1 ZINC000625796284 566360893 /nfs/dbraw/zinc/36/08/93/566360893.db2.gz JCOZZGJWYJZCEA-KRWDZBQOSA-N 0 1 394.338 3.188 10 0 GGAEMN CCn1cc(Br)cc1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000536264829 566361590 /nfs/dbraw/zinc/36/15/90/566361590.db2.gz QJKLVAIUMPBMPH-WBVHZDCISA-N 0 1 376.298 3.446 10 0 GGAEMN O=C(NC[C@@H]1CN2CCN1CCC2)c1sc2cc(Cl)ccc2c1Cl ZINC000670446769 566362316 /nfs/dbraw/zinc/36/23/16/566362316.db2.gz KQNPIRDRQBYNFC-GFCCVEGCSA-N 0 1 384.332 3.328 10 0 GGAEMN O=C(NC[C@H]1CN2CCN1CCC2)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000670446697 566362997 /nfs/dbraw/zinc/36/29/97/566362997.db2.gz AGYNBWDLJLRUEE-INIZCTEOSA-N 0 1 375.925 3.188 10 0 GGAEMN CCN1C(=O)N=NC1C1CCN(Cc2cc(Br)ccc2C)CC1 ZINC000649390368 566363235 /nfs/dbraw/zinc/36/32/35/566363235.db2.gz DTWHBHRDNQXLTG-UHFFFAOYSA-N 0 1 379.302 3.454 10 0 GGAEMN Cn1cnnc1-c1ccnc(NS(=O)(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000446762549 566366579 /nfs/dbraw/zinc/36/65/79/566366579.db2.gz UPHOPBSMKDCQKS-UHFFFAOYSA-N 0 1 398.275 3.126 10 0 GGAEMN O=S(=O)(Cc1ccc(Br)cc1)Nc1ccc(C(F)(F)F)nn1 ZINC000446773847 566366619 /nfs/dbraw/zinc/36/66/19/566366619.db2.gz BIBROWHFNWRENA-UHFFFAOYSA-N 0 1 396.188 3.200 10 0 GGAEMN CN(CC(=O)NCc1cc(Cl)ccc1I)C1CCC1 ZINC000600828299 566369170 /nfs/dbraw/zinc/36/91/70/566369170.db2.gz LCOYYGPVRBUZQW-UHFFFAOYSA-N 0 1 392.668 3.045 10 0 GGAEMN CCN1CCCC[C@@H]1CNS(=O)(=O)c1c(Cl)cccc1Br ZINC000510185978 566369467 /nfs/dbraw/zinc/36/94/67/566369467.db2.gz PYJYXWYHGNRCFP-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN CCCOc1c(Br)cc(CN2CC[C@H](C(=O)NC)C2)cc1OCC ZINC000421386950 566370236 /nfs/dbraw/zinc/37/02/36/566370236.db2.gz OLGWTMUXTKDVCI-AWEZNQCLSA-N 0 1 399.329 3.205 10 0 GGAEMN Cc1c(Cl)c(CNC[C@@H](CO)Cc2ccc(Br)cc2)nn1C ZINC000421399204 566370806 /nfs/dbraw/zinc/37/08/06/566370806.db2.gz UBOSJCLPIBRQLU-ZDUSSCGKSA-N 0 1 386.721 3.085 10 0 GGAEMN Cc1c(Cl)c(CNC[C@H](CO)Cc2ccc(Br)cc2)nn1C ZINC000421399203 566371018 /nfs/dbraw/zinc/37/10/18/566371018.db2.gz UBOSJCLPIBRQLU-CYBMUJFWSA-N 0 1 386.721 3.085 10 0 GGAEMN CC(=O)N[C@H]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000421397268 566371110 /nfs/dbraw/zinc/37/11/10/566371110.db2.gz XPFNGYKXMZEKON-AWEZNQCLSA-N 0 1 380.311 3.283 10 0 GGAEMN CCc1ccc(CN2CCN(C(=O)c3sccc3CN(C)C)CC2)s1 ZINC000446919072 566371870 /nfs/dbraw/zinc/37/18/70/566371870.db2.gz QUFJAFWIEVPBSK-UHFFFAOYSA-N 0 1 377.579 3.392 10 0 GGAEMN CC[C@@H](c1ccc(Br)cc1)N1CCC(CNS(C)(=O)=O)CC1 ZINC000510265421 566372832 /nfs/dbraw/zinc/37/28/32/566372832.db2.gz FBFMUXKBFSPKLC-INIZCTEOSA-N 0 1 389.359 3.161 10 0 GGAEMN Cc1cc(S(=O)(=O)N[C@H](c2cnn(C)c2)C(F)(F)F)c(Cl)cc1F ZINC000446955746 566373472 /nfs/dbraw/zinc/37/34/72/566373472.db2.gz BJBURCDPVJPQJE-GFCCVEGCSA-N 0 1 385.770 3.103 10 0 GGAEMN CSc1ccc(OC[C@H](O)CNCc2cn3cc(Cl)ccc3n2)cc1 ZINC000576749897 566374887 /nfs/dbraw/zinc/37/48/87/566374887.db2.gz ZJPIROOBSIWTSJ-OAHLLOKOSA-N 0 1 377.897 3.239 10 0 GGAEMN Cc1cc(NC(=O)[C@H](C)N2C[C@@H]3CCC[C@]3(CO)C2)ccc1Br ZINC000626014275 566377162 /nfs/dbraw/zinc/37/71/62/566377162.db2.gz XNYNZNPARMWLJW-SUNYJGFJSA-N 0 1 381.314 3.179 10 0 GGAEMN C[C@@H](C(=O)Nc1ncccn1)N1C[C@@H](c2ccc(Br)cc2)C[C@H]1C ZINC000626040948 566377940 /nfs/dbraw/zinc/37/79/40/566377940.db2.gz OMHOUAFAETVKPQ-IPYPFGDCSA-N 0 1 389.297 3.444 10 0 GGAEMN COCCc1noc(CN2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)n1 ZINC000626040939 566378344 /nfs/dbraw/zinc/37/83/44/566378344.db2.gz OHSFXMKTXXXSGM-JSGCOSHPSA-N 0 1 380.286 3.399 10 0 GGAEMN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CCC(c2cnc[nH]2)CC1 ZINC000626025347 566378432 /nfs/dbraw/zinc/37/84/32/566378432.db2.gz UNEHDAKIOCYPTH-FHLIZLRMSA-N 0 1 386.293 3.464 10 0 GGAEMN C[C@H]1C[C@H](c2ccc(Br)cc2)CN1CC(=O)NCc1cccnc1 ZINC000626041094 566378496 /nfs/dbraw/zinc/37/84/96/566378496.db2.gz QNEYNGDUROGBCV-YOEHRIQHSA-N 0 1 388.309 3.338 10 0 GGAEMN C[C@H]1C[C@@H](c2ccc(Br)cc2)CN1CC1(CS(C)(=O)=O)CC1 ZINC000626040865 566378784 /nfs/dbraw/zinc/37/87/84/566378784.db2.gz NFHMPPGHHMRWMG-DZGCQCFKSA-N 0 1 386.355 3.452 10 0 GGAEMN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1Cc1coc(S(N)(=O)=O)c1 ZINC000626040724 566378933 /nfs/dbraw/zinc/37/89/33/566378933.db2.gz KVBIABPSQQTYGG-RISCZKNCSA-N 0 1 399.310 3.068 10 0 GGAEMN C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2nscc2Br)C1 ZINC000649641000 566380196 /nfs/dbraw/zinc/38/01/96/566380196.db2.gz XHMVHBWXWQAEMS-WCQYABFASA-N 0 1 380.311 3.471 10 0 GGAEMN O=S(=O)(NC1CC1)c1ccc(CN2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000649631677 566380668 /nfs/dbraw/zinc/38/06/68/566380668.db2.gz IPQWVSZWGHGYOD-CQSZACIVSA-N 0 1 376.444 3.292 10 0 GGAEMN CNC(=O)C[C@@H](NCc1ccc(I)cc1)c1ccccc1 ZINC000483403857 566380733 /nfs/dbraw/zinc/38/07/33/566380733.db2.gz OEFSFOHWJPCKIC-MRXNPFEDSA-N 0 1 394.256 3.258 10 0 GGAEMN CC[C@@H](C)N[C@@H](CNS(=O)(=O)c1ccc2ncsc2c1)c1ccco1 ZINC000510415642 566381774 /nfs/dbraw/zinc/38/17/74/566381774.db2.gz RAZYVVDNZKQIQE-DOMZBBRYSA-N 0 1 379.507 3.297 10 0 GGAEMN Cc1cc(NC(=O)CCNC2(c3ccccc3Br)CCC2)no1 ZINC000649645969 566381970 /nfs/dbraw/zinc/38/19/70/566381970.db2.gz OOMMKKXJGWEBQK-UHFFFAOYSA-N 0 1 378.270 3.165 10 0 GGAEMN CCCC[N@H+]1CCCC[C@H]1CNS(=O)(=O)c1cccnc1C(F)(F)F ZINC000576847015 566382809 /nfs/dbraw/zinc/38/28/09/566382809.db2.gz PMPPQQGBRQHZBT-ZDUSSCGKSA-N 0 1 379.448 3.033 10 0 GGAEMN FCCCN1CCN(Cc2cc3c(cc2Br)OCCCO3)CC1 ZINC000626070277 566382881 /nfs/dbraw/zinc/38/28/81/566382881.db2.gz GYVZCBVDUBVEMD-UHFFFAOYSA-N 0 1 387.293 3.088 10 0 GGAEMN O=C([C@@H]1CCCN(Cc2cc3c(cc2Br)OCO3)C1)N1CCCC1 ZINC000601073605 566388520 /nfs/dbraw/zinc/38/85/20/566388520.db2.gz KQZRDKKDCLFXQY-CYBMUJFWSA-N 0 1 395.297 3.012 10 0 GGAEMN O=C(NCCC1CCS(=O)(=O)CC1)c1cc(Cl)c2ccccc2c1O ZINC000536642412 566390746 /nfs/dbraw/zinc/39/07/46/566390746.db2.gz BQXHISQCUSUXRN-UHFFFAOYSA-N 0 1 381.881 3.144 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1nc2ccc(Br)cc2o1 ZINC000463216805 566391066 /nfs/dbraw/zinc/39/10/66/566391066.db2.gz YDNRQVRRYGBHPL-CYBMUJFWSA-N 0 1 380.286 3.471 10 0 GGAEMN CC1(C)[C@@H](O)CCN1Cc1coc(-c2ccc(I)cc2)n1 ZINC000463221235 566392662 /nfs/dbraw/zinc/39/26/62/566392662.db2.gz JZLNVALJEVSJCO-AWEZNQCLSA-N 0 1 398.244 3.291 10 0 GGAEMN Clc1ccc(OCCN2CCC(Cn3cnnc3)CC2)c(Br)c1 ZINC000649789667 566393244 /nfs/dbraw/zinc/39/32/44/566393244.db2.gz BILWXQYTZGVIBC-UHFFFAOYSA-N 0 1 399.720 3.485 10 0 GGAEMN CC(C)CN(C(=O)c1[nH]nc2ccc(I)cc21)C1CC1 ZINC000463301170 566398821 /nfs/dbraw/zinc/39/88/21/566398821.db2.gz OMYNINKXQXVWOO-UHFFFAOYSA-N 0 1 383.233 3.428 10 0 GGAEMN COCc1cnc(CNC[C@@H](c2ccccc2Cl)N2CCOCC2)s1 ZINC000536763208 566399554 /nfs/dbraw/zinc/39/95/54/566399554.db2.gz VRCFTLIKVJREON-KRWDZBQOSA-N 0 1 381.929 3.106 10 0 GGAEMN COc1cc(Br)ccc1CCCN1CCO[C@]2(CCCOC2)C1 ZINC000510641322 566400811 /nfs/dbraw/zinc/40/08/11/566400811.db2.gz PXTWRLBTSZVWMB-GOSISDBHSA-N 0 1 384.314 3.272 10 0 GGAEMN CC(C)(C(=O)Nc1nnc(COc2ccc(Cl)cc2)s1)c1cnc[nH]1 ZINC000577075591 566403305 /nfs/dbraw/zinc/40/33/05/566403305.db2.gz HECRIEXMGDBNBM-UHFFFAOYSA-N 0 1 377.857 3.410 10 0 GGAEMN O=C(NCCCC1CC1)c1c[nH]c2ccc(I)cc2c1=O ZINC000536813115 566403579 /nfs/dbraw/zinc/40/35/79/566403579.db2.gz AHVVCZGAVKGTQH-UHFFFAOYSA-N 0 1 396.228 3.053 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@H]2CCCOc3cc(Br)ccc32)CC1=O ZINC000536868687 566406918 /nfs/dbraw/zinc/40/69/18/566406918.db2.gz HIEOMCFBDCNCOY-OYNZBZHQSA-N 0 1 379.298 3.262 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](N[C@@H]2CCCOc3c(Br)cccc32)CC1=O ZINC000536875353 566407431 /nfs/dbraw/zinc/40/74/31/566407431.db2.gz IBCFCRAGNPCZAW-KOZAUXTDSA-N 0 1 379.298 3.262 10 0 GGAEMN C[C@H](CNC(=O)C(=O)c1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000510715749 566407536 /nfs/dbraw/zinc/40/75/36/566407536.db2.gz MZDQIHRUPOFZPS-CQSZACIVSA-N 0 1 389.293 3.269 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](N(C)CC2(CO)CC2)C1=O ZINC000510775106 566411711 /nfs/dbraw/zinc/41/17/11/566411711.db2.gz BLPOCYOTPHQYGV-INIZCTEOSA-N 0 1 395.341 3.266 10 0 GGAEMN O=C(NCc1cccs1)c1n[nH]c2ccc(I)cc21 ZINC000463467143 566412628 /nfs/dbraw/zinc/41/26/28/566412628.db2.gz UFIUXQHUBDIKQC-UHFFFAOYSA-N 0 1 383.214 3.159 10 0 GGAEMN O=S(=O)(Nc1csc2ccccc12)c1ccc2c(c1)S(=O)(=O)CC2 ZINC000484115314 566416201 /nfs/dbraw/zinc/41/62/01/566416201.db2.gz MAJSKLBWSAWKBB-UHFFFAOYSA-N 0 1 379.484 3.032 10 0 GGAEMN Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)Nc1csc2ccccc12 ZINC000484086451 566416607 /nfs/dbraw/zinc/41/66/07/566416607.db2.gz FCRHFBKMMJHFCC-UHFFFAOYSA-N 0 1 381.500 3.414 10 0 GGAEMN O=C(Nc1cc(Cl)cc(Br)c1O)C1CN(CC(F)(F)F)C1 ZINC000484195645 566418564 /nfs/dbraw/zinc/41/85/64/566418564.db2.gz WXZBYPKZPRQJQD-UHFFFAOYSA-N 0 1 387.583 3.241 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CCS1 ZINC000484206581 566419292 /nfs/dbraw/zinc/41/92/92/566419292.db2.gz WARKXYDEHJTWRE-LLVKDONJSA-N 0 1 381.295 3.258 10 0 GGAEMN CC[C@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CCS1 ZINC000484206583 566419610 /nfs/dbraw/zinc/41/96/10/566419610.db2.gz WARKXYDEHJTWRE-NSHDSACASA-N 0 1 381.295 3.258 10 0 GGAEMN CCC[C@@H](NCCNS(=O)(=O)c1ccc(F)cc1Cl)c1ccccn1 ZINC000510959384 566423426 /nfs/dbraw/zinc/42/34/26/566423426.db2.gz OQSXIBNQOWLEMR-OAHLLOKOSA-N 0 1 385.892 3.283 10 0 GGAEMN CSCCCCNC(=O)c1n[nH]c2ccc(I)cc21 ZINC000463665326 566424530 /nfs/dbraw/zinc/42/45/30/566424530.db2.gz MMIIZAHLZUJSTL-UHFFFAOYSA-N 0 1 389.262 3.041 10 0 GGAEMN C[C@@H](N[C@H](CO)CC1CCCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000510994925 566426045 /nfs/dbraw/zinc/42/60/45/566426045.db2.gz CBBTZBJPEULNGY-PWSUYJOCSA-N 0 1 395.352 3.233 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1Cc1ccc(OC(F)F)c(Br)c1 ZINC000537165103 566427323 /nfs/dbraw/zinc/42/73/23/566427323.db2.gz HZQGGWGCZZZQGS-NSHDSACASA-N 0 1 377.229 3.280 10 0 GGAEMN O=S(=O)(NCCCN1CCc2ccccc2C1)c1c(F)cccc1Cl ZINC000463694782 566427559 /nfs/dbraw/zinc/42/75/59/566427559.db2.gz FBLNNVOBDCFWCA-UHFFFAOYSA-N 0 1 382.888 3.206 10 0 GGAEMN NC(=O)[C@@H]1CCCN1CCCNC(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000626597790 566428350 /nfs/dbraw/zinc/42/83/50/566428350.db2.gz FSZRMRGPIGQZAO-LBPRGKRZSA-N 0 1 393.702 3.108 10 0 GGAEMN CCCN(Cc1nc2ccc(Br)cc2[nH]1)[C@H](COC)C(=O)OCC ZINC000484397689 566428508 /nfs/dbraw/zinc/42/85/08/566428508.db2.gz ZIUUCWUFXHSRPW-OAHLLOKOSA-N 0 1 398.301 3.116 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCc3cc(Br)cc(C)c3C2)[nH]1 ZINC000537177792 566428712 /nfs/dbraw/zinc/42/87/12/566428712.db2.gz WAAWONUKZVDTIB-UHFFFAOYSA-N 0 1 395.326 3.251 10 0 GGAEMN CN(CC(=O)NC1(c2ccccc2Br)CCC1)[C@@H]1CCSC1 ZINC000650165480 566429603 /nfs/dbraw/zinc/42/96/03/566429603.db2.gz GKPFIGFRKOYDRN-CYBMUJFWSA-N 0 1 383.355 3.382 10 0 GGAEMN C[C@H](c1ccncc1)N1CCC(NC(=O)c2ncsc2Br)CC1 ZINC000557876981 566431617 /nfs/dbraw/zinc/43/16/17/566431617.db2.gz LQTIAOHWHPHMNU-LLVKDONJSA-N 0 1 395.326 3.256 10 0 GGAEMN COc1ncccc1NS(=O)(=O)c1cc(Br)cc2cccnc21 ZINC000577534800 566444094 /nfs/dbraw/zinc/44/40/94/566444094.db2.gz XZXOXCCZMKXAHA-UHFFFAOYSA-N 0 1 394.250 3.202 10 0 GGAEMN CN1CCN(c2cc(C(=O)NCc3c(Cl)cccc3Cl)ccn2)CC1 ZINC000602087305 566445606 /nfs/dbraw/zinc/44/56/06/566445606.db2.gz XILYKZXEYZNUIL-UHFFFAOYSA-N 0 1 379.291 3.070 10 0 GGAEMN C[C@H]1CCCN(C(=O)c2[nH]nc3ccc(I)cc32)[C@H]1C ZINC000464074497 566446569 /nfs/dbraw/zinc/44/65/69/566446569.db2.gz VCIKICWIRRBRQB-UWVGGRQHSA-N 0 1 383.233 3.428 10 0 GGAEMN O=c1[nH]nc2n1CCN(Cc1ccc(-c3ccc(Br)cc3)s1)C2 ZINC000484743614 566451544 /nfs/dbraw/zinc/45/15/44/566451544.db2.gz QBARSIOUSVFRHR-UHFFFAOYSA-N 0 1 391.294 3.491 10 0 GGAEMN COc1ccc(NC(=O)c2ccc(Br)c(O)c2)c(OC)c1OC ZINC000484853754 566460216 /nfs/dbraw/zinc/46/02/16/566460216.db2.gz YWDJDQWOOQEFGA-UHFFFAOYSA-N 0 1 382.210 3.433 10 0 GGAEMN CN(C)C(=O)CCN1CCN(c2ccc3c(Cl)ccc(Cl)c3n2)CC1 ZINC000484969510 566466534 /nfs/dbraw/zinc/46/65/34/566466534.db2.gz INOMXJLYWZNTTP-UHFFFAOYSA-N 0 1 381.307 3.142 10 0 GGAEMN O=C(NCC/C=C/c1ccc(Br)cc1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000627122433 566468212 /nfs/dbraw/zinc/46/82/12/566468212.db2.gz GIEBUGGHZWWJBE-IJZWSDQOSA-N 0 1 378.314 3.388 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN1C/C(C)=C\c1cccc(C(F)(F)F)c1 ZINC000558400562 566469017 /nfs/dbraw/zinc/46/90/17/566469017.db2.gz UJEOUPIEQOZGFI-OVHOFWQVSA-N 0 1 376.444 3.122 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN1C/C(C)=C\c1cccc(C(F)(F)F)c1 ZINC000558400563 566469066 /nfs/dbraw/zinc/46/90/66/566469066.db2.gz UJEOUPIEQOZGFI-RCBBPTIPSA-N 0 1 376.444 3.122 10 0 GGAEMN O=C(N[C@H](CO)c1c(F)cccc1F)c1n[nH]c2ccc(Br)cc21 ZINC000537768541 566469297 /nfs/dbraw/zinc/46/92/97/566469297.db2.gz MHBPEXMLSTZZOT-CYBMUJFWSA-N 0 1 396.191 3.067 10 0 GGAEMN O=C(N[C@@H](CO)c1c(F)cccc1F)c1n[nH]c2ccc(Br)cc21 ZINC000537768542 566469463 /nfs/dbraw/zinc/46/94/63/566469463.db2.gz MHBPEXMLSTZZOT-ZDUSSCGKSA-N 0 1 396.191 3.067 10 0 GGAEMN C[C@@H]1CO[C@@H](C(F)(F)F)CN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000672175258 566470061 /nfs/dbraw/zinc/47/00/61/566470061.db2.gz HKGZWQBHZOEYBH-RDDDGLTNSA-N 0 1 392.175 3.117 10 0 GGAEMN CN(C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)C1CCCCC1 ZINC000511545262 566470174 /nfs/dbraw/zinc/47/01/74/566470174.db2.gz KLKAYYSVBVIRBJ-SFHVURJKSA-N 0 1 383.330 3.037 10 0 GGAEMN C[C@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1cncc(Br)c1 ZINC000558424047 566470412 /nfs/dbraw/zinc/47/04/12/566470412.db2.gz UDOOAXFHPGPESP-BEFAXECRSA-N 0 1 391.309 3.386 10 0 GGAEMN C[C@@](CO)(NCc1ccc2c(c1)OCCO2)c1ccc(Br)cc1 ZINC000511548621 566471000 /nfs/dbraw/zinc/47/10/00/566471000.db2.gz ZGFQHWOJXJHADV-SFHVURJKSA-N 0 1 378.266 3.218 10 0 GGAEMN C[C@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1cncc(Br)c1 ZINC000558424048 566471420 /nfs/dbraw/zinc/47/14/20/566471420.db2.gz UDOOAXFHPGPESP-DNVCBOLYSA-N 0 1 391.309 3.386 10 0 GGAEMN CCN(C(=O)CN[C@](C)(CO)c1ccc(Br)cc1)C1CCCCC1 ZINC000511556915 566471927 /nfs/dbraw/zinc/47/19/27/566471927.db2.gz RUYGWFQQRYGPCS-LJQANCHMSA-N 0 1 397.357 3.427 10 0 GGAEMN CCSc1ccc(CC(=O)N[C@H](C)c2n[nH]c(C)n2)c(Br)c1 ZINC000627207401 566472889 /nfs/dbraw/zinc/47/28/89/566472889.db2.gz PCIIIKSEMNLAAX-SECBINFHSA-N 0 1 383.315 3.408 10 0 GGAEMN C[C@@](CO)(NCC(=O)Nc1ccc(F)c(F)c1)c1ccc(Br)cc1 ZINC000511572074 566472926 /nfs/dbraw/zinc/47/29/26/566472926.db2.gz DBBQFFZPXKSHGP-KRWDZBQOSA-N 0 1 399.235 3.163 10 0 GGAEMN Cc1nn(C)c2ncc(CN[C@](C)(CO)c3ccc(Br)cc3)cc12 ZINC000511567857 566473579 /nfs/dbraw/zinc/47/35/79/566473579.db2.gz QZSQCIAYEQFPOE-GOSISDBHSA-N 0 1 389.297 3.037 10 0 GGAEMN Cc1nn(C)c2ncc(CN[C@@](C)(CO)c3ccc(Br)cc3)cc12 ZINC000511567858 566473843 /nfs/dbraw/zinc/47/38/43/566473843.db2.gz QZSQCIAYEQFPOE-SFHVURJKSA-N 0 1 389.297 3.037 10 0 GGAEMN CC(C)N(C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)C1CCCC1 ZINC000511574851 566473926 /nfs/dbraw/zinc/47/39/26/566473926.db2.gz LJHPFBCFOWOGKI-IBGZPJMESA-N 0 1 397.357 3.426 10 0 GGAEMN CC[C@@H]1CCCCN1C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511604410 566475522 /nfs/dbraw/zinc/47/55/22/566475522.db2.gz LRGVUPWTIWGGHA-AEFFLSMTSA-N 0 1 383.330 3.037 10 0 GGAEMN CC1CCC(N(C)C(=O)CN[C@](C)(CO)c2ccc(Br)cc2)CC1 ZINC000511604240 566475645 /nfs/dbraw/zinc/47/56/45/566475645.db2.gz DYLWBCARWNUNDA-ITXXBFQVSA-N 0 1 397.357 3.283 10 0 GGAEMN CCc1cccc(NC(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511607088 566475692 /nfs/dbraw/zinc/47/56/92/566475692.db2.gz RVXUCGGPQYGQJB-IBGZPJMESA-N 0 1 391.309 3.447 10 0 GGAEMN CC(C)C[C@H](C)N(C)C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511628189 566476587 /nfs/dbraw/zinc/47/65/87/566476587.db2.gz XWCWHQSMZQJSNR-KSSFIOAISA-N 0 1 385.346 3.139 10 0 GGAEMN CC(C)C[C@@H](C)N(C)C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511628187 566476674 /nfs/dbraw/zinc/47/66/74/566476674.db2.gz XWCWHQSMZQJSNR-KDOFPFPSSA-N 0 1 385.346 3.139 10 0 GGAEMN Cc1ccc(CC[C@H](C)NS(=O)(=O)c2nc(C)c(Br)s2)o1 ZINC000537875086 566477106 /nfs/dbraw/zinc/47/71/06/566477106.db2.gz MYNCHDJDIWHSHW-QMMMGPOBSA-N 0 1 393.328 3.415 10 0 GGAEMN CCc1ccc(NC(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511622826 566477527 /nfs/dbraw/zinc/47/75/27/566477527.db2.gz LTGUSOCLISRLBP-IBGZPJMESA-N 0 1 391.309 3.447 10 0 GGAEMN CC[C@@H](C(=O)[O-])[N@@H+](C)Cc1cc(Br)c(OC(F)F)c(OC)c1 ZINC000650807604 566478694 /nfs/dbraw/zinc/47/86/94/566478694.db2.gz CJWCEACZIJWCKY-JTQLQIEISA-N 0 1 382.201 3.354 10 0 GGAEMN COCCN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)C(C)(C)C1 ZINC000650828829 566481137 /nfs/dbraw/zinc/48/11/37/566481137.db2.gz WLFXPCSCSCVWLT-DLBZAZTESA-N 0 1 395.341 3.122 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC(N3CCOC[C@H]3C)CC2)c1 ZINC000627427418 566481414 /nfs/dbraw/zinc/48/14/14/566481414.db2.gz DTNZRYOAORFJQM-CYBMUJFWSA-N 0 1 399.304 3.222 10 0 GGAEMN CC(C)CN1CCN(C(=O)c2cc3c(Br)cccc3cn2)CC1 ZINC000448599911 566481978 /nfs/dbraw/zinc/48/19/78/566481978.db2.gz AOAOKRVOWRRPBQ-UHFFFAOYSA-N 0 1 376.298 3.411 10 0 GGAEMN CC[C@H](C)Oc1ccc(NS(=O)(=O)c2ccccc2S(C)(=O)=O)cc1 ZINC000511698831 566483180 /nfs/dbraw/zinc/48/31/80/566483180.db2.gz CUVYWJXFGTZTNS-ZDUSSCGKSA-N 0 1 383.491 3.068 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](N[C@@H]2CCCOc3ccc(Br)cc32)CC1=O ZINC000537988432 566483744 /nfs/dbraw/zinc/48/37/44/566483744.db2.gz XBIVJEOSNUBJBN-JMGFVUJMSA-N 0 1 379.298 3.262 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)[C@@H]1CCCN1c1nccs1 ZINC000464553438 566484419 /nfs/dbraw/zinc/48/44/19/566484419.db2.gz CEUPGKMMEAQBKJ-LBPRGKRZSA-N 0 1 392.282 3.389 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NC1CC2(CCC2)C1 ZINC000650904400 566485490 /nfs/dbraw/zinc/48/54/90/566485490.db2.gz QHYKYURMQDMTNV-UHFFFAOYSA-N 0 1 390.285 3.366 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NC1CC2(CCC2)C1 ZINC000650904400 566485493 /nfs/dbraw/zinc/48/54/93/566485493.db2.gz QHYKYURMQDMTNV-UHFFFAOYSA-N 0 1 390.285 3.366 10 0 GGAEMN Cc1ccc(-c2nc(NC(=O)c3cc(Br)cc4nc[nH]c43)n[nH]2)o1 ZINC000578103829 566491343 /nfs/dbraw/zinc/49/13/43/566491343.db2.gz UJCHCZKZCHZBQH-UHFFFAOYSA-N 0 1 387.197 3.264 10 0 GGAEMN CCCOc1ccc(Br)cc1CN[C@]1(CC(=O)OC)CCOC1 ZINC000464619336 566491884 /nfs/dbraw/zinc/49/18/84/566491884.db2.gz OEHQEELLVSUQDG-KRWDZBQOSA-N 0 1 386.286 3.050 10 0 GGAEMN O=C1C[C@@H](c2cccc(NS(=O)(=O)c3ccc(Cl)cc3Cl)c2)CN1 ZINC000485390443 566494219 /nfs/dbraw/zinc/49/42/19/566494219.db2.gz MMYODJNUZRGELH-LLVKDONJSA-N 0 1 385.272 3.398 10 0 GGAEMN COC(=O)COc1cccc(NS(=O)(=O)c2ccc(Cl)cc2Cl)c1 ZINC000485385012 566494243 /nfs/dbraw/zinc/49/42/43/566494243.db2.gz HOYQJNOQHUBXSL-UHFFFAOYSA-N 0 1 390.244 3.346 10 0 GGAEMN COc1cccc(C[C@H](C)NCc2ncc(I)s2)c1 ZINC000512052515 566508756 /nfs/dbraw/zinc/50/87/56/566508756.db2.gz MQTIGACZKRZCPL-JTQLQIEISA-N 0 1 388.274 3.477 10 0 GGAEMN COC(=O)c1csc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000558631547 566494815 /nfs/dbraw/zinc/49/48/15/566494815.db2.gz ZWMUEAHHXCNLTA-UHFFFAOYSA-N 0 1 380.223 3.426 10 0 GGAEMN O=C(NC1CCN(Cc2ccc(F)cc2)CC1)c1nscc1Br ZINC000651138779 566497856 /nfs/dbraw/zinc/49/78/56/566497856.db2.gz RBEKTEFYXOMSFE-UHFFFAOYSA-N 0 1 398.301 3.439 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3c[nH]c(=O)c(Br)c3)cccc21 ZINC000558688377 566498494 /nfs/dbraw/zinc/49/84/94/566498494.db2.gz FVVBWUHSLFZVKS-AWEZNQCLSA-N 0 1 392.253 3.187 10 0 GGAEMN CC1(C)CCC[C@](O)(CNCc2ncc(I)s2)C1 ZINC000511955093 566499589 /nfs/dbraw/zinc/49/95/89/566499589.db2.gz MLRGJAMLKZEKGZ-CYBMUJFWSA-N 0 1 380.295 3.169 10 0 GGAEMN CC[C@H](CSC)NC(=O)c1n[nH]c2ccc(I)cc21 ZINC000538263538 566501802 /nfs/dbraw/zinc/50/18/02/566501802.db2.gz WLPDHOIULHSEII-SECBINFHSA-N 0 1 389.262 3.039 10 0 GGAEMN CCN1CCN(c2ccc(Cl)cc2NC(=O)N[C@@H]2CSC2(C)C)CC1 ZINC000558763990 566505531 /nfs/dbraw/zinc/50/55/31/566505531.db2.gz CBQSMPJDCNYERE-MRXNPFEDSA-N 0 1 382.961 3.497 10 0 GGAEMN Cc1ccc2nc(CNCc3ncc(I)s3)[nH]c2c1 ZINC000512011046 566505701 /nfs/dbraw/zinc/50/57/01/566505701.db2.gz VBHAUBMEPICOCM-UHFFFAOYSA-N 0 1 384.246 3.222 10 0 GGAEMN Fc1ccc2c(Br)cnc(N3CCN(C[C@@H]4CCCO4)CC3)c2c1 ZINC000651292515 566506895 /nfs/dbraw/zinc/50/68/95/566506895.db2.gz NORZSTATTCLCHK-AWEZNQCLSA-N 0 1 394.288 3.437 10 0 GGAEMN O[C@H]1CCCC[C@H]1CCCNCc1ncc(I)s1 ZINC000512067511 566510231 /nfs/dbraw/zinc/51/02/31/566510231.db2.gz LQSNHJOFKSUGKJ-QWRGUYRKSA-N 0 1 380.295 3.169 10 0 GGAEMN Cc1cc([C@H](C)N[C@@H]2CCN(C3CCOCC3)C2=O)sc1Br ZINC000512059613 566510897 /nfs/dbraw/zinc/51/08/97/566510897.db2.gz SIRQPEWOQQVUEE-WCQYABFASA-N 0 1 387.343 3.250 10 0 GGAEMN CCn1c(-c2ccc(Br)cc2)nnc1N1CCN(C2CC2)CC1 ZINC000558872335 566511768 /nfs/dbraw/zinc/51/17/68/566511768.db2.gz JDUCNRYLOQQNFT-UHFFFAOYSA-N 0 1 376.302 3.012 10 0 GGAEMN C[C@@H]1CC[C@H](C)N(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000464933629 566511876 /nfs/dbraw/zinc/51/18/76/566511876.db2.gz HRVQIIJPPYSUSE-ZJUUUORDSA-N 0 1 383.233 3.428 10 0 GGAEMN CCSc1ccc(CC(=O)N2CC[C@@H](c3nc[nH]n3)C2)c(Br)c1 ZINC000627836700 566512117 /nfs/dbraw/zinc/51/21/17/566512117.db2.gz DJNLGIZFDQATIS-GFCCVEGCSA-N 0 1 395.326 3.238 10 0 GGAEMN Fc1ccc2c(Br)cnc(N3CC[C@@H](CN4CCOCC4)C3)c2c1 ZINC000651322271 566512126 /nfs/dbraw/zinc/51/21/26/566512126.db2.gz KYPADNVONDGTIQ-ZDUSSCGKSA-N 0 1 394.288 3.295 10 0 GGAEMN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CCN(C2CCC2)CC1 ZINC000651339755 566513571 /nfs/dbraw/zinc/51/35/71/566513571.db2.gz SQQQAAQKGQHTTK-OAHLLOKOSA-N 0 1 379.298 3.012 10 0 GGAEMN CN(C(=O)c1cc(Cl)c(Br)cc1F)[C@@H]1CN2CCC1CC2 ZINC000448954692 566515621 /nfs/dbraw/zinc/51/56/21/566515621.db2.gz KSHGMYCZOXEQAX-CQSZACIVSA-N 0 1 375.669 3.408 10 0 GGAEMN CCn1c([C@H]2CCCS2)nnc1N1CCN(CCc2cccs2)CC1 ZINC000424164025 566515868 /nfs/dbraw/zinc/51/58/68/566515868.db2.gz WFOALFIPADMNQL-MRXNPFEDSA-N 0 1 377.583 3.292 10 0 GGAEMN CN(C)C[C@@H](NC(=O)C(=O)Nc1ccsc1)c1ccc(Cl)c(Cl)c1 ZINC000627910676 566516446 /nfs/dbraw/zinc/51/64/46/566516446.db2.gz MUWCRIAZEVRTMV-CQSZACIVSA-N 0 1 386.304 3.413 10 0 GGAEMN CC(C)n1cncc1CN[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000424190871 566517585 /nfs/dbraw/zinc/51/75/85/566517585.db2.gz MYKJHPKNGZXDNT-MRXNPFEDSA-N 0 1 377.286 3.122 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC(c2ncco2)CC1 ZINC000627948074 566520153 /nfs/dbraw/zinc/52/01/53/566520153.db2.gz FBVPIHHQRLFZDE-UHFFFAOYSA-N 0 1 375.226 3.333 10 0 GGAEMN COC[C@H]1CCN1C(=O)c1ccsc1NC(=O)c1ccc(Cl)cc1O ZINC000578444744 566524042 /nfs/dbraw/zinc/52/40/42/566524042.db2.gz DLQXYYLRPYCISA-LLVKDONJSA-N 0 1 380.853 3.220 10 0 GGAEMN C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)[C@@H]1C(=O)[O-] ZINC000424268523 566525256 /nfs/dbraw/zinc/52/52/56/566525256.db2.gz NLVPASQCEFNAGX-BMIGLBTASA-N 0 1 387.249 3.102 10 0 GGAEMN CSc1cc(NC(=O)C(=O)NC[C@H](c2cccs2)N(C)C)ccc1C ZINC000651494388 566526306 /nfs/dbraw/zinc/52/63/06/566526306.db2.gz CHJJETWSPSMHGS-CQSZACIVSA-N 0 1 377.535 3.136 10 0 GGAEMN C[C@@H](N[C@@H]1CCC(=O)N(C)C1=O)c1ccc(Br)cc1C(F)(F)F ZINC000424313806 566526774 /nfs/dbraw/zinc/52/67/74/566526774.db2.gz JNAONKITPMZVLU-PRHODGIISA-N 0 1 393.203 3.266 10 0 GGAEMN CC[C@@H]1C[C@H](C)CN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000465291497 566527028 /nfs/dbraw/zinc/52/70/28/566527028.db2.gz WJQYOPASDXMVRZ-GXSJLCMTSA-N 0 1 383.233 3.428 10 0 GGAEMN C[C@H](N[C@@H]1CCC(=O)N(C)C1=O)c1ccc(Br)cc1C(F)(F)F ZINC000424313809 566527643 /nfs/dbraw/zinc/52/76/43/566527643.db2.gz JNAONKITPMZVLU-QPUJVOFHSA-N 0 1 393.203 3.266 10 0 GGAEMN Cc1cc(Br)c(C(=O)N(C)CC2CN(C)C2)cc1Br ZINC000628077197 566528724 /nfs/dbraw/zinc/52/87/24/566528724.db2.gz SORMFIFOGJTEJD-UHFFFAOYSA-N 0 1 390.119 3.154 10 0 GGAEMN COc1cccc(S(=O)(=O)CCN[C@@H](C)c2ccc3ncsc3c2)c1 ZINC000485811250 566529215 /nfs/dbraw/zinc/52/92/15/566529215.db2.gz HBFVJJBUTFPSSH-ZDUSSCGKSA-N 0 1 376.503 3.429 10 0 GGAEMN C[C@@H]1C[C@H](NC(=O)c2ncsc2Br)CN1Cc1ccccc1 ZINC000673230554 566529662 /nfs/dbraw/zinc/52/96/62/566529662.db2.gz VJDMUGINMXUMGA-YPMHNXCESA-N 0 1 380.311 3.298 10 0 GGAEMN O=C(CCNCc1cc(Cl)sc1Cl)N1CCN(c2ccccn2)CC1 ZINC000449104186 566530190 /nfs/dbraw/zinc/53/01/90/566530190.db2.gz DWTXEVHQTUJCNM-UHFFFAOYSA-N 0 1 399.347 3.278 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@H](NCc2cscc2Br)C1 ZINC000512389647 566530466 /nfs/dbraw/zinc/53/04/66/566530466.db2.gz PKPYFRONSVWJPS-AWEZNQCLSA-N 0 1 395.322 3.280 10 0 GGAEMN Cc1ccc2nc(CN[C@H](C(N)=O)c3ccc(Br)cc3F)[nH]c2c1 ZINC000465407259 566531327 /nfs/dbraw/zinc/53/13/27/566531327.db2.gz SFKNTLWFCBZKIQ-INIZCTEOSA-N 0 1 391.244 3.089 10 0 GGAEMN COc1ccc(Br)c(CN2CCC[C@@H](C(=O)N3CCCC3)C2)c1 ZINC000538733349 566531483 /nfs/dbraw/zinc/53/14/83/566531483.db2.gz JEFXWLWKUWUTRW-CQSZACIVSA-N 0 1 381.314 3.292 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)cc3)c[nH]2)C[C@@H]1C(=O)[O-] ZINC000578532613 566531956 /nfs/dbraw/zinc/53/19/56/566531956.db2.gz WBEGGBKWWLLIQX-FZMZJTMJSA-N 0 1 378.270 3.382 10 0 GGAEMN CN(C)C(=O)[C@H](Cc1ccccc1)NCc1cc(F)cc(Br)c1 ZINC000449123964 566532133 /nfs/dbraw/zinc/53/21/33/566532133.db2.gz OSRWEICWWTWAQJ-KRWDZBQOSA-N 0 1 379.273 3.377 10 0 GGAEMN O=C1[C@H](N[C@@H]2CCc3c2ccc(F)c3Br)CCN1CC(F)(F)F ZINC000449147303 566533027 /nfs/dbraw/zinc/53/30/27/566533027.db2.gz QEEILGQWUNJIHR-VXGBXAGGSA-N 0 1 395.194 3.328 10 0 GGAEMN COc1nccc(CNC2(c3ccc(Br)cc3)CCOCC2)n1 ZINC000449151054 566533378 /nfs/dbraw/zinc/53/33/78/566533378.db2.gz VKJGVRLKDBVHGC-UHFFFAOYSA-N 0 1 378.270 3.043 10 0 GGAEMN C[C@H]1CCC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)[C@H]1C(=O)[O-] ZINC000424417939 566533948 /nfs/dbraw/zinc/53/39/48/566533948.db2.gz MPTBMNMDEFIZHV-XHDPSFHLSA-N 0 1 384.270 3.296 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@@H](C)[C@@H](C)CO ZINC000449165025 566533903 /nfs/dbraw/zinc/53/39/03/566533903.db2.gz SNUMPYMJAZTENQ-QWRGUYRKSA-N 0 1 386.279 3.072 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)N1CC[C@H](N2CCCCC2)C1 ZINC000651553769 566534429 /nfs/dbraw/zinc/53/44/29/566534429.db2.gz DHENINUPWZOHMM-LBPRGKRZSA-N 0 1 383.366 3.445 10 0 GGAEMN CCOC(=O)c1nc(CN[C@H](C)C2CCN(CC(F)(F)F)CC2)cs1 ZINC000559232644 566534585 /nfs/dbraw/zinc/53/45/85/566534585.db2.gz DVWYVLUIVWGBML-LLVKDONJSA-N 0 1 379.448 3.072 10 0 GGAEMN CCOC(=O)c1nc(CN[C@@H](C)C2CCN(CC(F)(F)F)CC2)cs1 ZINC000559232648 566534658 /nfs/dbraw/zinc/53/46/58/566534658.db2.gz DVWYVLUIVWGBML-NSHDSACASA-N 0 1 379.448 3.072 10 0 GGAEMN COCCCN(C)Cc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000628156492 566535918 /nfs/dbraw/zinc/53/59/18/566535918.db2.gz QYBHQNFYMAEAMZ-UHFFFAOYSA-N 0 1 391.339 3.173 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CNC(C)(C)[C@H](C)O ZINC000449200437 566537856 /nfs/dbraw/zinc/53/78/56/566537856.db2.gz DZMDJDKALKCWRB-JTQLQIEISA-N 0 1 386.279 3.215 10 0 GGAEMN O[C@H](COc1ccc(F)cc1Br)CN1CCc2ccccc2C1 ZINC000559282868 566538447 /nfs/dbraw/zinc/53/84/47/566538447.db2.gz CHHCLSIMKQURDK-INIZCTEOSA-N 0 1 380.257 3.386 10 0 GGAEMN CNC(=O)[C@@H](C)CN(C)Cc1cc(Br)c(C)cc1Br ZINC000628189389 566539709 /nfs/dbraw/zinc/53/97/09/566539709.db2.gz ZNGUGQXWJANZNI-JTQLQIEISA-N 0 1 392.135 3.334 10 0 GGAEMN COC(=O)c1cc(Br)ccc1NS(=O)(=O)c1cccc(C)c1 ZINC000603778497 566539803 /nfs/dbraw/zinc/53/98/03/566539803.db2.gz AGKYQFFGVNNXOJ-UHFFFAOYSA-N 0 1 384.251 3.345 10 0 GGAEMN O=C(Cc1noc2ccc(Br)cc21)N1CCN(C2CCCC2)CC1 ZINC000424565392 566540600 /nfs/dbraw/zinc/54/06/00/566540600.db2.gz HEYSAZRGJNFTAI-UHFFFAOYSA-N 0 1 392.297 3.220 10 0 GGAEMN COc1c(Br)ccc(C)c1C(=O)N1CCN(C2CCCC2)CC1 ZINC000424575761 566542483 /nfs/dbraw/zinc/54/24/83/566542483.db2.gz RURIAXIIKLVXRJ-UHFFFAOYSA-N 0 1 381.314 3.467 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651609886 566542597 /nfs/dbraw/zinc/54/25/97/566542597.db2.gz OVLIABQZFPNAJN-JQWIXIFHSA-N 0 1 393.285 3.434 10 0 GGAEMN CO[C@H](C)CN(C)Cc1cc(Cl)cc(Cl)c1OCCN1CCOCC1 ZINC000628276045 566543250 /nfs/dbraw/zinc/54/32/50/566543250.db2.gz OVTYNYHOHUYUJR-CQSZACIVSA-N 0 1 391.339 3.171 10 0 GGAEMN CC(C)c1nc([C@@H](C)NS(=O)(=O)Cc2cc(Cl)sc2Cl)n[nH]1 ZINC000651620639 566543773 /nfs/dbraw/zinc/54/37/73/566543773.db2.gz LMADGHNBVBNXBQ-SSDOTTSWSA-N 0 1 383.326 3.477 10 0 GGAEMN COc1ncc(C(=O)NC[C@@H](c2ccc(F)cc2)N(C)C)cc1Br ZINC000424596374 566543892 /nfs/dbraw/zinc/54/38/92/566543892.db2.gz OOENLPJFEOCQAU-HNNXBMFYSA-N 0 1 396.260 3.025 10 0 GGAEMN CC(C)c1nc([C@H](C)NS(=O)(=O)Cc2cc(Cl)sc2Cl)n[nH]1 ZINC000651620640 566544124 /nfs/dbraw/zinc/54/41/24/566544124.db2.gz LMADGHNBVBNXBQ-ZETCQYMHSA-N 0 1 383.326 3.477 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)Nc3cccc(Br)c3)cn2)CC1 ZINC000485990517 566547671 /nfs/dbraw/zinc/54/76/71/566547671.db2.gz NPYOHFGTVNCZEZ-UHFFFAOYSA-N 0 1 390.285 3.240 10 0 GGAEMN CN(CC(=O)NCC/C=C\c1ccc(Br)cc1)[C@@H]1CCSC1 ZINC000628335250 566547831 /nfs/dbraw/zinc/54/78/31/566547831.db2.gz HVLNWHWMIANISS-ZENLRNHISA-N 0 1 383.355 3.406 10 0 GGAEMN O=C(NCC/C=C/c1ccc(Br)cc1)[C@@H]1CCCc2n[nH]nc21 ZINC000628336827 566549121 /nfs/dbraw/zinc/54/91/21/566549121.db2.gz PZYIMYDUGUFKHD-KHZFFFCDSA-N 0 1 375.270 3.207 10 0 GGAEMN CCOC(=O)c1cc(CN[C@](C)(CO)c2ccc(Br)cc2)[nH]c1C ZINC000449324754 566550404 /nfs/dbraw/zinc/55/04/04/566550404.db2.gz ZLIXTMRUBBCGCP-GOSISDBHSA-N 0 1 395.297 3.260 10 0 GGAEMN Cn1nc2c(c1CNCc1ccc(I)cc1)CCCC2 ZINC000449336266 566550478 /nfs/dbraw/zinc/55/04/78/566550478.db2.gz MJHWAQXICHILEG-UHFFFAOYSA-N 0 1 381.261 3.193 10 0 GGAEMN COc1cc(Br)ccc1CNCc1ccc2c(c1)oc(=O)n2C ZINC000512705434 566551639 /nfs/dbraw/zinc/55/16/39/566551639.db2.gz JWIBDYKWFYDBJH-UHFFFAOYSA-N 0 1 377.238 3.192 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2ccc(Br)cc2F)c2ccccc21 ZINC000449356417 566551867 /nfs/dbraw/zinc/55/18/67/566551867.db2.gz HSQSKNGMIMDLPK-LBPRGKRZSA-N 0 1 384.270 3.249 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2cc(Br)ccc2F)c2ccccc21 ZINC000449362879 566551993 /nfs/dbraw/zinc/55/19/93/566551993.db2.gz NXZMDZNWNRIAJT-LBPRGKRZSA-N 0 1 384.270 3.249 10 0 GGAEMN Cc1ccnc([C@@H]2CC[N@@H+](Cc3cc(=O)n4cc(Br)ccc4n3)C2)c1 ZINC000578761282 566552305 /nfs/dbraw/zinc/55/23/05/566552305.db2.gz AMOKAFWFIMWOMM-CQSZACIVSA-N 0 1 399.292 3.150 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2cccc(F)c2Br)c2ccccc21 ZINC000449359399 566552412 /nfs/dbraw/zinc/55/24/12/566552412.db2.gz QAOBJQJYSKISSJ-GFCCVEGCSA-N 0 1 384.270 3.249 10 0 GGAEMN C[C@@](CO)(NCC1=Cc2cc(Br)ccc2OC1)c1cccc(O)c1 ZINC000628373942 566552714 /nfs/dbraw/zinc/55/27/14/566552714.db2.gz OOMGEWWDJINWHM-IBGZPJMESA-N 0 1 390.277 3.428 10 0 GGAEMN Cc1n[nH]c(C(F)(F)F)c1C(=O)NCCc1ccccc1Br ZINC000673737764 566554318 /nfs/dbraw/zinc/55/43/18/566554318.db2.gz SVBBANOHTWAMKK-UHFFFAOYSA-N 0 1 376.176 3.472 10 0 GGAEMN CN(C)[C@H](CNC(=O)CN(C)c1ccc(Cl)cn1)c1ccc(Cl)cc1 ZINC000673749436 566554448 /nfs/dbraw/zinc/55/44/48/566554448.db2.gz NTUGQWMFMCCAPO-MRXNPFEDSA-N 0 1 381.307 3.244 10 0 GGAEMN C[C@@H]1CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@H]1C ZINC000465986702 566554631 /nfs/dbraw/zinc/55/46/31/566554631.db2.gz WYNQFCUOHGCANC-GHMZBOCLSA-N 0 1 378.274 3.032 10 0 GGAEMN C[C@@H]1CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@H]1C ZINC000465986702 566554634 /nfs/dbraw/zinc/55/46/34/566554634.db2.gz WYNQFCUOHGCANC-GHMZBOCLSA-N 0 1 378.274 3.032 10 0 GGAEMN COc1ncc(C(=O)N2CCN(C3CCC(C)CC3)CC2)cc1Br ZINC000424672235 566554938 /nfs/dbraw/zinc/55/49/38/566554938.db2.gz IAIHHRMAUDHASM-UHFFFAOYSA-N 0 1 396.329 3.189 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)s1 ZINC000466072832 566556830 /nfs/dbraw/zinc/55/68/30/566556830.db2.gz DLSUIDNEPWADBI-IUODEOHRSA-N 0 1 379.555 3.179 10 0 GGAEMN OC[C@]12CCC[C@H]1CN(Cc1cc(Br)c3c(c1)OCCCO3)C2 ZINC000628461077 566558094 /nfs/dbraw/zinc/55/80/94/566558094.db2.gz HVWJJOKYCJSMBK-KBXCAEBGSA-N 0 1 382.298 3.205 10 0 GGAEMN Cc1cc(N2CCC[C@H](N3CCC([C@H](C)O)CC3)C2=O)ccc1Br ZINC000466198329 566558281 /nfs/dbraw/zinc/55/82/81/566558281.db2.gz BKTVCJKHWBEZBY-KSSFIOAISA-N 0 1 395.341 3.346 10 0 GGAEMN COC(=O)[C@@H]1CCCCC[C@@H]1NCc1ccc(OC)c(O)c1Br ZINC000449413096 566560702 /nfs/dbraw/zinc/56/07/02/566560702.db2.gz FKSNUXGASNDEDV-OLZOCXBDSA-N 0 1 386.286 3.375 10 0 GGAEMN Cc1n[nH]c(C(=O)NCC2(c3ccc(Br)cc3)CCOCC2)c1C ZINC000604323220 566560768 /nfs/dbraw/zinc/56/07/68/566560768.db2.gz WICQGKDBBKHXRR-UHFFFAOYSA-N 0 1 392.297 3.267 10 0 GGAEMN O=C(Cc1noc2ccc(Br)cc12)N[C@@H]1CCCc2cn[nH]c21 ZINC000578860932 566561055 /nfs/dbraw/zinc/56/10/55/566561055.db2.gz QUBRFZWSAIKHGU-GFCCVEGCSA-N 0 1 375.226 3.050 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1CC[C@H](CO)[C@@H]1CC ZINC000449425254 566561338 /nfs/dbraw/zinc/56/13/38/566561338.db2.gz PVQKAFRQQSVRJI-PBHICJAKSA-N 0 1 386.330 3.457 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN(Cc2ccc(-c3ccccc3Cl)o2)C1 ZINC000628495765 566561575 /nfs/dbraw/zinc/56/15/75/566561575.db2.gz ZYQJBPCVIMDQMI-AWEZNQCLSA-N 0 1 382.913 3.361 10 0 GGAEMN O=C(NCc1sccc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000673861398 566561630 /nfs/dbraw/zinc/56/16/30/566561630.db2.gz GUCHUESABNMBEZ-UHFFFAOYSA-N 0 1 378.255 3.413 10 0 GGAEMN Cc1cnc(N)c(S(=O)(=O)Nc2cccc(OCC(F)(F)F)c2C)c1 ZINC000539117812 566561588 /nfs/dbraw/zinc/56/15/88/566561588.db2.gz RAFMBUSNFPCSPH-UHFFFAOYSA-N 0 1 375.372 3.023 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN(Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000628496493 566561725 /nfs/dbraw/zinc/56/17/25/566561725.db2.gz RUTGWYSNJQOYLG-CYBMUJFWSA-N 0 1 399.969 3.225 10 0 GGAEMN O=C(NCc1cc(Br)cs1)Nc1cnn(-c2ccncc2)c1 ZINC000673861933 566561819 /nfs/dbraw/zinc/56/18/19/566561819.db2.gz PTHTYAYDOBLBCS-UHFFFAOYSA-N 0 1 378.255 3.413 10 0 GGAEMN COc1ccc(Cl)cc1[C@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000578891060 566562039 /nfs/dbraw/zinc/56/20/39/566562039.db2.gz DENTUFAKGZFPTB-GXTWGEPZSA-N 0 1 381.881 3.234 10 0 GGAEMN CN(Cc1ccc(Br)o1)C(=O)Nc1cnn(-c2ccncc2)c1 ZINC000673862191 566562027 /nfs/dbraw/zinc/56/20/27/566562027.db2.gz VPQBVKGRGVUCKE-UHFFFAOYSA-N 0 1 376.214 3.287 10 0 GGAEMN CN(C(=O)c1cc(Cl)cc(F)c1Br)[C@@H]1CN2CCC1CC2 ZINC000578889540 566562219 /nfs/dbraw/zinc/56/22/19/566562219.db2.gz LBBFUSAEZGFCED-CYBMUJFWSA-N 0 1 375.669 3.408 10 0 GGAEMN Nc1c(Br)cc(Br)cc1CNC1(CF)CCOCC1 ZINC000449447416 566562345 /nfs/dbraw/zinc/56/23/45/566562345.db2.gz ZKPUIBQASMJGNM-UHFFFAOYSA-N 0 1 396.098 3.402 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN(CCCc2c(Cl)cccc2Cl)C1 ZINC000628496061 566562230 /nfs/dbraw/zinc/56/22/30/566562230.db2.gz HZRWNCFKOWXUIL-CYBMUJFWSA-N 0 1 379.353 3.187 10 0 GGAEMN CN(C(=O)c1cc(Cl)cc(F)c1Br)[C@H]1CN2CCC1CC2 ZINC000578889541 566562525 /nfs/dbraw/zinc/56/25/25/566562525.db2.gz LBBFUSAEZGFCED-ZDUSSCGKSA-N 0 1 375.669 3.408 10 0 GGAEMN O=C(NCc1cc(Br)ccc1F)Nc1cnn(-c2ccncc2)c1 ZINC000673863963 566562520 /nfs/dbraw/zinc/56/25/20/566562520.db2.gz MOWRMSZZUDKEQL-UHFFFAOYSA-N 0 1 390.216 3.491 10 0 GGAEMN O=C(NCc1ccc(Br)c(F)c1)Nc1cnn(-c2ccncc2)c1 ZINC000673862422 566562689 /nfs/dbraw/zinc/56/26/89/566562689.db2.gz KRPWSCTUVXTUAC-UHFFFAOYSA-N 0 1 390.216 3.491 10 0 GGAEMN COc1ccc(Cl)cc1[C@@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000578891066 566562801 /nfs/dbraw/zinc/56/28/01/566562801.db2.gz DENTUFAKGZFPTB-TZMCWYRMSA-N 0 1 381.881 3.234 10 0 GGAEMN COc1c(Br)ccc(C)c1C(=O)N[C@H](C)c1n[nH]c(C(C)C)n1 ZINC000424738813 566564520 /nfs/dbraw/zinc/56/45/20/566564520.db2.gz BAMPPPFIAYKCMH-SNVBAGLBSA-N 0 1 381.274 3.499 10 0 GGAEMN Cc1cc(C)n2c(CN[C@](C)(CO)c3ccc(Br)cc3)cnc2n1 ZINC000512874009 566566268 /nfs/dbraw/zinc/56/62/68/566566268.db2.gz IWXOMWLORHOSHM-GOSISDBHSA-N 0 1 389.297 3.106 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1ccccc1Sc1ccc(Br)cn1 ZINC000673928548 566566938 /nfs/dbraw/zinc/56/69/38/566566938.db2.gz OETBBPBCYPFEAW-UHFFFAOYSA-N 0 1 390.266 3.043 10 0 GGAEMN COc1ncc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cc1Br ZINC000424747413 566566899 /nfs/dbraw/zinc/56/68/99/566566899.db2.gz GDIVJOZRFMYUJX-CVEARBPZSA-N 0 1 390.281 3.028 10 0 GGAEMN OCC1(CCNCc2c(Br)cncc2Br)CCC1 ZINC000652036761 566586390 /nfs/dbraw/zinc/58/63/90/566586390.db2.gz VJDLKBQSSLPJMG-UHFFFAOYSA-N 0 1 378.108 3.249 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1ccccc1OCc1ccccc1Br ZINC000673918847 566567640 /nfs/dbraw/zinc/56/76/40/566567640.db2.gz PRTFCXDPHQUMAX-UHFFFAOYSA-N 0 1 387.237 3.076 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@](O)(C(F)F)C1 ZINC000449474424 566567753 /nfs/dbraw/zinc/56/77/53/566567753.db2.gz RVGOLQLLAFEUCU-MRXNPFEDSA-N 0 1 386.240 3.145 10 0 GGAEMN COc1cc(CN[C@](C)(CO)c2ccc(Br)cc2)cc2c1OCO2 ZINC000512909379 566568156 /nfs/dbraw/zinc/56/81/56/566568156.db2.gz XRTDIECCBYZUJF-GOSISDBHSA-N 0 1 394.265 3.184 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1cccc(OCc2ccccc2Br)c1 ZINC000673951726 566568354 /nfs/dbraw/zinc/56/83/54/566568354.db2.gz UPWYWJQVRQCNLS-UHFFFAOYSA-N 0 1 387.237 3.076 10 0 GGAEMN CC(C)(C)C[C@@H](O)CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000486210488 566568730 /nfs/dbraw/zinc/56/87/30/566568730.db2.gz OTFGPHCMOHPZNL-ZDUSSCGKSA-N 0 1 395.301 3.038 10 0 GGAEMN CC(C)(C)C[C@@H](O)CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000486210488 566568737 /nfs/dbraw/zinc/56/87/37/566568737.db2.gz OTFGPHCMOHPZNL-ZDUSSCGKSA-N 0 1 395.301 3.038 10 0 GGAEMN C[S@](=O)c1ccc(CNCc2cc(Cl)ccc2N2CCOCC2)cc1 ZINC000466362660 566569543 /nfs/dbraw/zinc/56/95/43/566569543.db2.gz PIIWGODROYSSCJ-VWLOTQADSA-N 0 1 378.925 3.204 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1ccc(Br)cc1 ZINC000539243894 566570363 /nfs/dbraw/zinc/57/03/63/566570363.db2.gz MNOSYDKOSNNVPQ-XYPHTWIQSA-N 0 1 381.314 3.270 10 0 GGAEMN Cc1nnc(SCC(=O)N2CC3(CC3)c3ccc(Br)cc32)[nH]1 ZINC000628658433 566573161 /nfs/dbraw/zinc/57/31/61/566573161.db2.gz IGQYDRFHXIFDMT-UHFFFAOYSA-N 0 1 379.283 3.046 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CC3(CC3)c3ccc(Br)cc32)n1 ZINC000628658433 566573165 /nfs/dbraw/zinc/57/31/65/566573165.db2.gz IGQYDRFHXIFDMT-UHFFFAOYSA-N 0 1 379.283 3.046 10 0 GGAEMN CCC[C@@H](C)[C@@H](CO)NCc1ncc(Br)cc1Br ZINC000651893939 566573271 /nfs/dbraw/zinc/57/32/71/566573271.db2.gz LUMSEASQTGWXCA-NOZJJQNGSA-N 0 1 380.124 3.493 10 0 GGAEMN CS(=O)(=O)N1CCC[C@@H](CNC2(c3c(Cl)cccc3Cl)CC2)C1 ZINC000539333567 566573834 /nfs/dbraw/zinc/57/38/34/566573834.db2.gz GZHCMJDSEHNRFT-LBPRGKRZSA-N 0 1 377.337 3.244 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc(Cl)ccc1OCC1CC1 ZINC000513026759 566574145 /nfs/dbraw/zinc/57/41/45/566574145.db2.gz FPTVSENFMFSSAW-QGZVFWFLSA-N 0 1 386.945 3.033 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CNCc1cc(C(F)(F)F)ccc1Cl ZINC000513028137 566574601 /nfs/dbraw/zinc/57/46/01/566574601.db2.gz VRUFQAJOTWTKGZ-ZDUSSCGKSA-N 0 1 384.851 3.263 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H]1COc2ccc(Cl)cc21 ZINC000559920646 566576460 /nfs/dbraw/zinc/57/64/60/566576460.db2.gz DOFCEBGQFZFGNV-QMTHXVAHSA-N 0 1 383.673 3.376 10 0 GGAEMN COC[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccc(F)cc1 ZINC000539377163 566577288 /nfs/dbraw/zinc/57/72/88/566577288.db2.gz OVTUYJFGHUMKMK-WMZOPIPTSA-N 0 1 398.272 3.305 10 0 GGAEMN O=C(NC[C@H]1CN(c2ccc(Cl)cc2)CCO1)c1ccc(O)c(Cl)c1 ZINC000628745733 566582860 /nfs/dbraw/zinc/58/28/60/566582860.db2.gz ZJTWATVMAVRXBA-HNNXBMFYSA-N 0 1 381.259 3.334 10 0 GGAEMN CC1(C)C(=O)N[C@H]1C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000579137425 566582892 /nfs/dbraw/zinc/58/28/92/566582892.db2.gz BSEVUCZIGNEBQV-INIZCTEOSA-N 0 1 391.313 3.062 10 0 GGAEMN C[C@H](CC(=O)NC1(c2nn[nH]n2)CCCC1)c1ccc(F)c(Br)c1 ZINC000486401125 566586038 /nfs/dbraw/zinc/58/60/38/566586038.db2.gz JLRGRJJNMYMGID-SNVBAGLBSA-N 0 1 396.264 3.181 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC[C@@]3(C2)OCc2ccccc23)c1Br ZINC000579184444 566586661 /nfs/dbraw/zinc/58/66/61/566586661.db2.gz CMBMNFZSWGZPBJ-SFHVURJKSA-N 0 1 390.281 3.396 10 0 GGAEMN COc1ccc(CN[C@@H]2CCCc3c2ccc(=O)n3C)c(Br)c1 ZINC000652049546 566587089 /nfs/dbraw/zinc/58/70/89/566587089.db2.gz JKTKSFWYRBVGSZ-MRXNPFEDSA-N 0 1 377.282 3.324 10 0 GGAEMN O[C@@H]([C@H]1CCN(CC2=Cc3cc(Br)ccc3OC2)C1)C(F)(F)F ZINC000449669327 566587902 /nfs/dbraw/zinc/58/79/02/566587902.db2.gz HRTPGEFLDDGTEC-NHYWBVRUSA-N 0 1 392.215 3.470 10 0 GGAEMN COCc1cnc(CNC[C@H](CO)Cc2cccc(Br)c2C)s1 ZINC000449683263 566590814 /nfs/dbraw/zinc/59/08/14/566590814.db2.gz NAPJFMQONHGGBC-CYBMUJFWSA-N 0 1 399.354 3.301 10 0 GGAEMN Brc1ccc(CN2CCC[C@]3(CCOC3)C2)c(N2CCOCC2)c1 ZINC000449684063 566591197 /nfs/dbraw/zinc/59/11/97/566591197.db2.gz QJHUBUGUFAIQPM-IBGZPJMESA-N 0 1 395.341 3.288 10 0 GGAEMN O=C(CCc1nc[nH]n1)N[C@H]1CCCSc2ccc(Br)cc21 ZINC000628828925 566591263 /nfs/dbraw/zinc/59/12/63/566591263.db2.gz FZQWJCLXNLYZJM-LBPRGKRZSA-N 0 1 381.299 3.243 10 0 GGAEMN CC[C@H]1CN(C(=O)NCCc2cccc(Cl)c2Cl)CCN1CCOC ZINC000605050584 566593509 /nfs/dbraw/zinc/59/35/09/566593509.db2.gz XTFSIKWQUPJUHA-HNNXBMFYSA-N 0 1 388.339 3.288 10 0 GGAEMN Cc1ccc2nc(CNCc3n[nH]c(-c4ccc(Br)cc4)n3)cn2c1 ZINC000560076834 566594493 /nfs/dbraw/zinc/59/44/93/566594493.db2.gz IBROOBWGCIQECG-UHFFFAOYSA-N 0 1 397.280 3.480 10 0 GGAEMN Cc1ccc2nc(CNCc3nc(-c4ccc(Br)cc4)n[nH]3)cn2c1 ZINC000560076834 566594501 /nfs/dbraw/zinc/59/45/01/566594501.db2.gz IBROOBWGCIQECG-UHFFFAOYSA-N 0 1 397.280 3.480 10 0 GGAEMN Cc1cccc(CC(=O)N2CCC(C)(N3CCOCC3)CC2)c1Br ZINC000628904555 566595748 /nfs/dbraw/zinc/59/57/48/566595748.db2.gz NKYQXHKQMSEGCZ-UHFFFAOYSA-N 0 1 395.341 3.013 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1 ZINC000628904497 566595807 /nfs/dbraw/zinc/59/58/07/566595807.db2.gz KDJDALRQGLCMSE-UHFFFAOYSA-N 0 1 399.304 3.224 10 0 GGAEMN FC(F)Oc1cc(CNCc2cnc3ccc(Br)cn23)ccn1 ZINC000560093705 566597294 /nfs/dbraw/zinc/59/72/94/566597294.db2.gz BNLWDZGNLGGNCD-UHFFFAOYSA-N 0 1 383.196 3.383 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3ccc(Br)cc3C2)n[nH]1 ZINC000560110096 566598578 /nfs/dbraw/zinc/59/85/78/566598578.db2.gz CJKKQXAEJDSSON-NSHDSACASA-N 0 1 377.286 3.180 10 0 GGAEMN C[C@H](C(=O)Nc1nc2c(s1)CN(C(C)(C)C)CC2)N(C)CC(F)(F)F ZINC000425035297 566600001 /nfs/dbraw/zinc/60/00/01/566600001.db2.gz HNFJGOKMQCPUIH-SNVBAGLBSA-N 0 1 378.464 3.121 10 0 GGAEMN CCOCCO[C@H](C)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968617 566600227 /nfs/dbraw/zinc/60/02/27/566600227.db2.gz KYWVNFAJOYOPCV-WBMJQRKESA-N 0 1 377.312 3.154 10 0 GGAEMN CON1CCC(CC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000628969334 566600534 /nfs/dbraw/zinc/60/05/34/566600534.db2.gz RNLXDNXZSLYIKL-QGZVFWFLSA-N 0 1 388.339 3.376 10 0 GGAEMN CC(C)CCC(=O)NCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968769 566600634 /nfs/dbraw/zinc/60/06/34/566600634.db2.gz OXMBJJDOGRHYOI-INIZCTEOSA-N 0 1 388.339 3.265 10 0 GGAEMN CC(C)NC(=O)CCCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968887 566600686 /nfs/dbraw/zinc/60/06/86/566600686.db2.gz VIWTZIDISFJHDH-INIZCTEOSA-N 0 1 388.339 3.407 10 0 GGAEMN C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968880 566600759 /nfs/dbraw/zinc/60/07/59/566600759.db2.gz UXDDTUGOKUNDJF-RVSPLBMKSA-N 0 1 389.323 3.296 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CCOC[C@@H]1CCCO1)c1ccc(Cl)c(Cl)c1 ZINC000628968370 566600908 /nfs/dbraw/zinc/60/09/08/566600908.db2.gz HEGMZWONYWEQHC-WMLDXEAASA-N 0 1 389.323 3.298 10 0 GGAEMN COc1cccnc1CC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628969381 566601064 /nfs/dbraw/zinc/60/10/64/566601064.db2.gz SYAOZOBTIGQJIC-MRXNPFEDSA-N 0 1 382.291 3.359 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CCOC1CCOCC1)c1ccc(Cl)c(Cl)c1 ZINC000628969531 566601137 /nfs/dbraw/zinc/60/11/37/566601137.db2.gz UISMQQWMVNBCJJ-QGZVFWFLSA-N 0 1 389.323 3.298 10 0 GGAEMN C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968157 566601161 /nfs/dbraw/zinc/60/11/61/566601161.db2.gz FATGPTMNNWACKJ-XHDPSFHLSA-N 0 1 388.339 3.263 10 0 GGAEMN Cc1c(CCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)cnn1C ZINC000628969845 566602101 /nfs/dbraw/zinc/60/21/01/566602101.db2.gz ZNLKDBFVWWRVND-KRWDZBQOSA-N 0 1 383.323 3.387 10 0 GGAEMN CN(CC(=O)Nc1nc(-c2ccccc2Cl)n[nH]1)c1ccc(Cl)cn1 ZINC000605375703 566605372 /nfs/dbraw/zinc/60/53/72/566605372.db2.gz YFWUSGDJMNBCAP-UHFFFAOYSA-N 0 1 377.235 3.248 10 0 GGAEMN COc1ccc(Cl)cc1CS(=O)(=O)NCc1nc2ccc(C)cc2[nH]1 ZINC000466913639 566607706 /nfs/dbraw/zinc/60/77/06/566607706.db2.gz KSTYBDSBDOXCBR-UHFFFAOYSA-N 0 1 379.869 3.153 10 0 GGAEMN O=C(N[C@H]1CSc2ccc(Br)cc21)N[C@H]1CCc2nc[nH]c2C1 ZINC000579419093 566608086 /nfs/dbraw/zinc/60/80/86/566608086.db2.gz CBFHUPUICSIOMK-HZMBPMFUSA-N 0 1 393.310 3.176 10 0 GGAEMN O=C([O-])C[N@@H+](Cc1ccccc1)C[C@H](O)COc1c(Cl)cccc1Cl ZINC000652456041 566612376 /nfs/dbraw/zinc/61/23/76/566612376.db2.gz YAJBYBKNSZHFDC-AWEZNQCLSA-N 0 1 384.259 3.320 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1C[C@@H]2CCC[C@]2(CO)C1 ZINC000629085023 566612901 /nfs/dbraw/zinc/61/29/01/566612901.db2.gz HKHIQCJMLBHRJA-SCLBCKFNSA-N 0 1 390.281 3.074 10 0 GGAEMN Brc1ccccc1-n1cc(CN[C@H]2CCN(c3ccccc3)C2)nn1 ZINC000674878778 566613831 /nfs/dbraw/zinc/61/38/31/566613831.db2.gz QDTBYXHVDJOVNL-HNNXBMFYSA-N 0 1 398.308 3.398 10 0 GGAEMN CCOc1cc(CN2CCSC[C@@H]2CCO)ccc1OCC(F)(F)F ZINC000539912330 566613815 /nfs/dbraw/zinc/61/38/15/566613815.db2.gz UETREQMEYGABMF-AWEZNQCLSA-N 0 1 379.444 3.326 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCc1ccc(Br)c(F)c1F ZINC000629099297 566614277 /nfs/dbraw/zinc/61/42/77/566614277.db2.gz FJCRRTASNYOFAO-UHFFFAOYSA-N 0 1 394.241 3.353 10 0 GGAEMN Brc1ccccc1-n1cc(CN[C@@H]2CCN(c3ccccc3)C2)nn1 ZINC000674878780 566614908 /nfs/dbraw/zinc/61/49/08/566614908.db2.gz QDTBYXHVDJOVNL-OAHLLOKOSA-N 0 1 398.308 3.398 10 0 GGAEMN O=C([O-])C[N@H+](C[C@H](O)COc1c(Cl)cccc1Cl)C1CCCCC1 ZINC000652482799 566614899 /nfs/dbraw/zinc/61/48/99/566614899.db2.gz VRAHHKFGBSFOCD-ZDUSSCGKSA-N 0 1 376.280 3.452 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)NC1(c2ccccc2Br)CCC1 ZINC000652516730 566616479 /nfs/dbraw/zinc/61/64/79/566616479.db2.gz FYNCTCPGKFKCDM-UHFFFAOYSA-N 0 1 377.286 3.476 10 0 GGAEMN Cc1nc(CN2CCN(C(=O)c3c(Cl)cc(Cl)cc3Cl)CC2)n[nH]1 ZINC000449927297 566616805 /nfs/dbraw/zinc/61/68/05/566616805.db2.gz OBMFMUKKVZVRFS-UHFFFAOYSA-N 0 1 388.686 3.031 10 0 GGAEMN Cc1nc([C@@H](NS(=O)(=O)c2nc(C)c(C)s2)c2ccc(Cl)cc2)no1 ZINC000539948619 566617034 /nfs/dbraw/zinc/61/70/34/566617034.db2.gz DTIFKQFCZJNEGB-ZDUSSCGKSA-N 0 1 398.897 3.173 10 0 GGAEMN Cc1nc([C@H](NS(=O)(=O)c2nc(C)c(C)s2)c2ccc(Cl)cc2)no1 ZINC000539948618 566617368 /nfs/dbraw/zinc/61/73/68/566617368.db2.gz DTIFKQFCZJNEGB-CYBMUJFWSA-N 0 1 398.897 3.173 10 0 GGAEMN O=C(N1CCC[C@@H](c2nn[nH]n2)C1)C1(c2c(Cl)cccc2Cl)CCC1 ZINC000579551672 566618736 /nfs/dbraw/zinc/61/87/36/566618736.db2.gz DNLLWKLLPLDHFG-LLVKDONJSA-N 0 1 380.279 3.334 10 0 GGAEMN O=C(N1CCC[C@H](c2nn[nH]n2)C1)C1(c2c(Cl)cccc2Cl)CCC1 ZINC000579551673 566619035 /nfs/dbraw/zinc/61/90/35/566619035.db2.gz DNLLWKLLPLDHFG-NSHDSACASA-N 0 1 380.279 3.334 10 0 GGAEMN Cc1c(Br)c2ccccc2n1CC(=O)N1CCN(C(C)C)CC1 ZINC000513728294 566619579 /nfs/dbraw/zinc/61/95/79/566619579.db2.gz GTNXGJBJRZNNHG-UHFFFAOYSA-N 0 1 378.314 3.265 10 0 GGAEMN C[C@@H]1CO[C@@H](C)CN1CCCOc1cccc(I)c1 ZINC000513716721 566619951 /nfs/dbraw/zinc/61/99/51/566619951.db2.gz HEHWCOAKLZPJLE-OLZOCXBDSA-N 0 1 375.250 3.169 10 0 GGAEMN COc1cc2nccc(NCC[C@H](O)C(F)(F)F)c2cc1Br ZINC000425231833 566620612 /nfs/dbraw/zinc/62/06/12/566620612.db2.gz TUALVDGLLFHZIZ-ZDUSSCGKSA-N 0 1 379.176 3.153 10 0 GGAEMN COc1cc2nccc(N3CCO[C@@]4(CCOC4)C3)c2cc1Br ZINC000425240569 566621549 /nfs/dbraw/zinc/62/15/49/566621549.db2.gz LZFMCCVWTKITRK-KRWDZBQOSA-N 0 1 379.254 3.002 10 0 GGAEMN CS(=O)(=O)NCC[C@@H]1CCCCN1CCc1cc(Cl)ccc1Cl ZINC000486805876 566623451 /nfs/dbraw/zinc/62/34/51/566623451.db2.gz ZSQWQTMPOXKNIU-HNNXBMFYSA-N 0 1 379.353 3.330 10 0 GGAEMN CS(=O)(=O)NCC[C@H]1CCCCN1CCc1cc(Cl)ccc1Cl ZINC000486805877 566623942 /nfs/dbraw/zinc/62/39/42/566623942.db2.gz ZSQWQTMPOXKNIU-OAHLLOKOSA-N 0 1 379.353 3.330 10 0 GGAEMN Cc1nc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)s1 ZINC000579603391 566624244 /nfs/dbraw/zinc/62/42/44/566624244.db2.gz TWVHDHLJLADBNI-TZMCWYRMSA-N 0 1 380.311 3.389 10 0 GGAEMN CCN(CC(=O)N1CCC[C@H]1c1ccccc1I)C1CC1 ZINC000486803733 566624232 /nfs/dbraw/zinc/62/42/32/566624232.db2.gz JZWIFQPAQGESOY-INIZCTEOSA-N 0 1 398.288 3.439 10 0 GGAEMN C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2cc(Br)c(F)cc2[O-])C1 ZINC000450015660 566624642 /nfs/dbraw/zinc/62/46/42/566624642.db2.gz HVFYLLQWSGPOEY-GFCCVEGCSA-N 0 1 385.277 3.098 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCC(C2(O)CC2)CC1 ZINC000652669514 566624793 /nfs/dbraw/zinc/62/47/93/566624793.db2.gz KQKXRSYHAIYAOO-UHFFFAOYSA-N 0 1 390.281 3.216 10 0 GGAEMN COCc1cnc(CN[C@H]2CCN(c3ccccc3Br)C2)s1 ZINC000540067970 566626144 /nfs/dbraw/zinc/62/61/44/566626144.db2.gz ICTBQKWDRDOQKU-LBPRGKRZSA-N 0 1 382.327 3.421 10 0 GGAEMN Cc1cc(-c2noc(Cc3cc[nH]c(=O)c3Br)n2)cc2nc[nH]c21 ZINC000579643908 566626309 /nfs/dbraw/zinc/62/63/09/566626309.db2.gz DOAKWAXQLDEMOH-UHFFFAOYSA-N 0 1 386.209 3.375 10 0 GGAEMN COC(=O)c1cnc([C@H](C)N=c2[nH]n3cc(C4CCCC4)nc3s2)s1 ZINC000425272457 566626458 /nfs/dbraw/zinc/62/64/58/566626458.db2.gz KTHQVZUQPHIOOO-VIFPVBQESA-N 0 1 377.495 3.287 10 0 GGAEMN Cc1nnc(SCC(=O)N2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)[nH]1 ZINC000629247255 566626639 /nfs/dbraw/zinc/62/66/39/566626639.db2.gz OYHGJPWCPAQFQL-GWCFXTLKSA-N 0 1 395.326 3.372 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)n1 ZINC000629247255 566626640 /nfs/dbraw/zinc/62/66/40/566626640.db2.gz OYHGJPWCPAQFQL-GWCFXTLKSA-N 0 1 395.326 3.372 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC3(CC2)C(F)(F)C3(F)F)c1Br ZINC000652751898 566627196 /nfs/dbraw/zinc/62/71/96/566627196.db2.gz WGLCWGHLLBRXQQ-UHFFFAOYSA-N 0 1 384.171 3.241 10 0 GGAEMN CN(CCOc1ccc(Br)cc1)C(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000467113279 566627682 /nfs/dbraw/zinc/62/76/82/566627682.db2.gz SFQHHNJRINSFMD-CQSZACIVSA-N 0 1 378.270 3.130 10 0 GGAEMN O=C(CCc1cccc(F)c1Br)N1CCC[C@@H](c2n[nH]c(=O)o2)C1 ZINC000425296072 566627929 /nfs/dbraw/zinc/62/79/29/566627929.db2.gz GJEKNNNBAWMJCP-LLVKDONJSA-N 0 1 398.232 3.016 10 0 GGAEMN CN(Cc1cc(Br)cn1C)C(=O)Nc1cnn(-c2ccncc2)c1 ZINC000675165188 566628230 /nfs/dbraw/zinc/62/82/30/566628230.db2.gz YPRXODQDPRYSAX-UHFFFAOYSA-N 0 1 389.257 3.032 10 0 GGAEMN O=C(NCCc1nc[nH]n1)C1(c2ccc(Br)cc2)CCCCC1 ZINC000675225470 566628876 /nfs/dbraw/zinc/62/88/76/566628876.db2.gz XFJUAXOIFPFMRL-UHFFFAOYSA-N 0 1 377.286 3.128 10 0 GGAEMN CO[C@@H](C)CN(CC(=O)Nc1c(F)cc(F)cc1Br)C(C)C ZINC000467154764 566630311 /nfs/dbraw/zinc/63/03/11/566630311.db2.gz HISLMFTZYPUQAC-JTQLQIEISA-N 0 1 379.245 3.411 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCc2c(F)cc(Br)cc2C1 ZINC000675237216 566630969 /nfs/dbraw/zinc/63/09/69/566630969.db2.gz CZIMYWSFNNCJDN-ZDUSSCGKSA-N 0 1 378.245 3.316 10 0 GGAEMN CS(=O)(=O)N1CC[C@H](CN2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000513883005 566631804 /nfs/dbraw/zinc/63/18/04/566631804.db2.gz UPKHKPDTHGAUMQ-WBMJQRKESA-N 0 1 377.337 3.412 10 0 GGAEMN Cc1ncc([C@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C)n1 ZINC000540148502 566631977 /nfs/dbraw/zinc/63/19/77/566631977.db2.gz QVAPYINPECODRM-JTQLQIEISA-N 0 1 387.285 3.492 10 0 GGAEMN Cc1ncc([C@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)n1 ZINC000540148502 566631982 /nfs/dbraw/zinc/63/19/82/566631982.db2.gz QVAPYINPECODRM-JTQLQIEISA-N 0 1 387.285 3.492 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCCN[C@H](C)c2ccc(Cl)c(F)c2)s1 ZINC000540148751 566632539 /nfs/dbraw/zinc/63/25/39/566632539.db2.gz CKNAMTCICDPJNW-LLVKDONJSA-N 0 1 376.906 3.478 10 0 GGAEMN Cc1nc2ccc(Cn3nnc(Cc4cccc(Br)c4)n3)cc2[nH]1 ZINC000467204597 566633386 /nfs/dbraw/zinc/63/33/86/566633386.db2.gz CKUGMBYSTWIHEY-UHFFFAOYSA-N 0 1 383.253 3.259 10 0 GGAEMN C[C@@H](CNC(=O)[C@@H]1CCCc2[nH]ncc21)Oc1cccc(Br)c1 ZINC000467205093 566633824 /nfs/dbraw/zinc/63/38/24/566633824.db2.gz FCEBFYUMAWWMIW-SMDDNHRTSA-N 0 1 378.270 3.176 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1ccc(F)cc1OCC(F)(F)F)C1CC1 ZINC000629290289 566637342 /nfs/dbraw/zinc/63/73/42/566637342.db2.gz RFVYVKXOTHGKHH-AWEZNQCLSA-N 0 1 385.379 3.324 10 0 GGAEMN CN(C)S(=O)(=O)c1ccc(CN2CCC[C@@H]2Cc2ccc(F)cc2)s1 ZINC000425399681 566638372 /nfs/dbraw/zinc/63/83/72/566638372.db2.gz BMFCKSUAKYAGHV-MRXNPFEDSA-N 0 1 382.526 3.345 10 0 GGAEMN CC(=O)Nc1ccc(Br)cc1NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000467264234 566638709 /nfs/dbraw/zinc/63/87/09/566638709.db2.gz KIZILJBNRFKPPY-NSHDSACASA-N 0 1 377.242 3.189 10 0 GGAEMN CN(C)S(=O)(=O)c1ccc(CN(CCc2cccc(F)c2)C2CC2)s1 ZINC000425411810 566639854 /nfs/dbraw/zinc/63/98/54/566639854.db2.gz YUIOGUVMUPUGJD-UHFFFAOYSA-N 0 1 382.526 3.345 10 0 GGAEMN Cn1ncc(Br)c1CNCCc1cc(Br)ccc1F ZINC000486982352 566640180 /nfs/dbraw/zinc/64/01/80/566640180.db2.gz UKGBVEAHQFMVFI-UHFFFAOYSA-N 0 1 391.082 3.417 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1ccccc1Sc1ncccn1)C1CC1 ZINC000629303985 566640741 /nfs/dbraw/zinc/64/07/41/566640741.db2.gz PRIPXMMJLWSLPR-HNNXBMFYSA-N 0 1 379.507 3.185 10 0 GGAEMN COc1ccc(Br)c(CN2CCCC[C@H]2CN2CCOCC2)c1 ZINC000514084509 566640952 /nfs/dbraw/zinc/64/09/52/566640952.db2.gz QHYLWLZPKPVGIB-INIZCTEOSA-N 0 1 383.330 3.144 10 0 GGAEMN O=C(NCCc1nc2ccccc2o1)c1n[nH]c2ccc(Br)cc21 ZINC000560592036 566641277 /nfs/dbraw/zinc/64/12/77/566641277.db2.gz KEFDPDUWFLZPDE-UHFFFAOYSA-N 0 1 385.221 3.439 10 0 GGAEMN COc1ccccc1C[C@H](C)N(C)Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000425424576 566641443 /nfs/dbraw/zinc/64/14/43/566641443.db2.gz XDRHOOWEILINAT-AWEZNQCLSA-N 0 1 382.551 3.070 10 0 GGAEMN O=C(NCc1ccccc1-n1ccnc1)c1n[nH]c2ccc(Br)cc21 ZINC000540271490 566642621 /nfs/dbraw/zinc/64/26/21/566642621.db2.gz JUDPOAYAVUNQKH-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CC[C@H](C2CCOCC2)C1 ZINC000514101492 566643115 /nfs/dbraw/zinc/64/31/15/566643115.db2.gz FFQQDWIBWLSROM-AWEZNQCLSA-N 0 1 382.298 3.484 10 0 GGAEMN CC(=O)N[C@H](Cc1nc([C@@H](N)CC(C)C)no1)c1ccc(Br)cc1 ZINC000579831824 566643581 /nfs/dbraw/zinc/64/35/81/566643581.db2.gz PCXXAKOGCXEMFN-LSDHHAIUSA-N 0 1 395.301 3.298 10 0 GGAEMN C[C@@H](NCc1ccc(S(=O)(=O)N(C)C)s1)c1ccc2ncsc2c1 ZINC000425436714 566643756 /nfs/dbraw/zinc/64/37/56/566643756.db2.gz XDAKQTDPQNOURD-LLVKDONJSA-N 0 1 381.548 3.459 10 0 GGAEMN O=C(c1cnc(C2CC2)[nH]1)N1CCN(Cc2ccc(Br)cc2)CC1 ZINC000487046293 566644388 /nfs/dbraw/zinc/64/43/88/566644388.db2.gz WKRFYEKGWXMYAL-UHFFFAOYSA-N 0 1 389.297 3.008 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3cc(Br)cc(C)c3C2)n[nH]1 ZINC000540326161 566645649 /nfs/dbraw/zinc/64/56/49/566645649.db2.gz YHDJTCXSRBBOPN-LBPRGKRZSA-N 0 1 391.313 3.488 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000653018318 566646094 /nfs/dbraw/zinc/64/60/94/566646094.db2.gz YKRFGIJBQZLSIB-CQSZACIVSA-N 0 1 378.270 3.096 10 0 GGAEMN CSc1cc(NS(=O)(=O)c2cc3c(cc2Cl)N(C(C)=O)CC3)ccn1 ZINC000629349664 566647152 /nfs/dbraw/zinc/64/71/52/566647152.db2.gz POJPDHUEAKHOQL-UHFFFAOYSA-N 0 1 397.909 3.167 10 0 GGAEMN COC(=O)c1cnc([C@@H](C)NCCCc2nc(-c3cccs3)no2)s1 ZINC000425483302 566648405 /nfs/dbraw/zinc/64/84/05/566648405.db2.gz HWPJHBXGXUZCKM-SNVBAGLBSA-N 0 1 378.479 3.325 10 0 GGAEMN C[C@@H](c1ccc(CN2CCCC[C@@H]2CNS(C)(=O)=O)cc1)C(F)(F)F ZINC000450253760 566649108 /nfs/dbraw/zinc/64/91/08/566649108.db2.gz PVLWROSVLDTTKG-XJKSGUPXSA-N 0 1 378.460 3.256 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC(c2nc3ccccc3[nH]2)C1 ZINC000675526747 566652030 /nfs/dbraw/zinc/65/20/30/566652030.db2.gz NUIJGRAHWLWLQW-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)[C@@H]2CCC[C@@H]21 ZINC000629371513 566652563 /nfs/dbraw/zinc/65/25/63/566652563.db2.gz ABNBDBWPUOUOAQ-VPWBDBDCSA-N 0 1 388.291 3.308 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCO3)[C@H]2CCC[C@@H]21 ZINC000629373085 566652577 /nfs/dbraw/zinc/65/25/77/566652577.db2.gz JXJFQNFRJXKPMX-BZPMIXESSA-N 0 1 382.254 3.253 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@H]2CCC[C@H]21 ZINC000629377214 566652670 /nfs/dbraw/zinc/65/26/70/566652670.db2.gz MBDIDLXGSPRCOE-ZOWXZIJZSA-N 0 1 378.270 3.401 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@H]2CCC[C@H]21 ZINC000629377214 566652677 /nfs/dbraw/zinc/65/26/77/566652677.db2.gz MBDIDLXGSPRCOE-ZOWXZIJZSA-N 0 1 378.270 3.401 10 0 GGAEMN CCc1ccc([C@H]2CNCCN2C(=O)c2nscc2Br)cc1 ZINC000653137299 566652869 /nfs/dbraw/zinc/65/28/69/566652869.db2.gz SZECQOHDADNMOV-CQSZACIVSA-N 0 1 380.311 3.255 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2cc(F)cc(Cl)c2)[C@@H]1O ZINC000579933753 566652861 /nfs/dbraw/zinc/65/28/61/566652861.db2.gz DLEAZJVQAYURDO-OCCSQVGLSA-N 0 1 391.873 3.092 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(c(Br)c2)OCO3)[C@H]2CCC[C@H]21 ZINC000629372006 566652950 /nfs/dbraw/zinc/65/29/50/566652950.db2.gz AQSBGOSIEFTBSE-SCRDCRAPSA-N 0 1 382.254 3.253 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCCO3)[C@H]2CCC[C@H]21 ZINC000629372784 566653032 /nfs/dbraw/zinc/65/30/32/566653032.db2.gz HMBNWIMKHMABSM-GUTXKFCHSA-N 0 1 396.281 3.296 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCCO3)[C@H]2CCC[C@@H]21 ZINC000629372786 566653158 /nfs/dbraw/zinc/65/31/58/566653158.db2.gz HMBNWIMKHMABSM-NFAWXSAZSA-N 0 1 396.281 3.296 10 0 GGAEMN CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000675551283 566653413 /nfs/dbraw/zinc/65/34/13/566653413.db2.gz RCZCHFPEIVQPQQ-HNNXBMFYSA-N 0 1 382.888 3.374 10 0 GGAEMN O=C(NCc1cnc(-c2ccc(Cl)cc2)s1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000514590818 566654908 /nfs/dbraw/zinc/65/49/08/566654908.db2.gz JRNKHPKMKZPMSD-GASCZTMLSA-N 0 1 376.913 3.499 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cccc(Br)c2)CC1 ZINC000629419810 566655080 /nfs/dbraw/zinc/65/50/80/566655080.db2.gz GHVVXMLSUJAXCC-UHFFFAOYSA-N 0 1 381.314 3.166 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(F)c(Br)c2)CC1 ZINC000629417307 566655099 /nfs/dbraw/zinc/65/50/99/566655099.db2.gz GQCOHNHCOLVMRS-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(F)cc(Br)c2)CC1 ZINC000629416528 566655297 /nfs/dbraw/zinc/65/52/97/566655297.db2.gz BYYULWULAOOHIA-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN O=C([O-])[C@@H]1Cc2c(Br)cccc2C[N@@H+]1C[C@@H](O)C1CCCCC1 ZINC000579968201 566655254 /nfs/dbraw/zinc/65/52/54/566655254.db2.gz LWSHUUSJQPGDAJ-DLBZAZTESA-N 0 1 382.298 3.202 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc(Br)c3cc(C)oc32)CC1 ZINC000467621423 566656973 /nfs/dbraw/zinc/65/69/73/566656973.db2.gz JJTUIMILVKXWFQ-UHFFFAOYSA-N 0 1 395.297 3.298 10 0 GGAEMN COCc1cc(Cl)cc(S(=O)(=O)Nc2ccccc2N(C)C(C)=O)c1 ZINC000580021163 566658699 /nfs/dbraw/zinc/65/86/99/566658699.db2.gz RFDPSQGABXNPSD-UHFFFAOYSA-N 0 1 382.869 3.270 10 0 GGAEMN Cn1ncc(Br)c1CN[C@@H]1CCCN(Cc2c(F)cccc2F)C1 ZINC000487279384 566660591 /nfs/dbraw/zinc/66/05/91/566660591.db2.gz VSPKIUAJNWMIKO-GFCCVEGCSA-N 0 1 399.283 3.215 10 0 GGAEMN Cc1cc(F)ccc1N1CCC[C@@H](NCc2c(Br)cnn2C)C1 ZINC000487299548 566662239 /nfs/dbraw/zinc/66/22/39/566662239.db2.gz MKFNNQGPXNRFPN-CQSZACIVSA-N 0 1 381.293 3.389 10 0 GGAEMN CCOc1c(Cl)cc(NC(=O)N2CCN([C@H](CC)CO)CC2)cc1Cl ZINC000467766099 566663665 /nfs/dbraw/zinc/66/36/65/566663665.db2.gz BQVGIFONVNIONI-CYBMUJFWSA-N 0 1 390.311 3.313 10 0 GGAEMN CC(C)c1n[n-]c(=NC2CC[NH+](Cc3ccc(Br)cc3)CC2)o1 ZINC000450387869 566665694 /nfs/dbraw/zinc/66/56/94/566665694.db2.gz KCUIADVXVXVQPI-UHFFFAOYSA-N 0 1 379.302 3.454 10 0 GGAEMN O=C(Nc1cnc2c(Br)cccn12)N[C@H]1CCCc2cn[nH]c21 ZINC000425671164 566665843 /nfs/dbraw/zinc/66/58/43/566665843.db2.gz HDIPATRPMHNSPL-NSHDSACASA-N 0 1 375.230 3.019 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@H](O)COc1cc(Cl)ccc1Cl ZINC000629587859 566669097 /nfs/dbraw/zinc/66/90/97/566669097.db2.gz WJXFMEXKWDANTQ-JTQLQIEISA-N 0 1 398.212 3.275 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000629587860 566669470 /nfs/dbraw/zinc/66/94/70/566669470.db2.gz WJXFMEXKWDANTQ-SNVBAGLBSA-N 0 1 398.212 3.275 10 0 GGAEMN C[C@@H]1C[C@@H](C)CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000607416137 566670775 /nfs/dbraw/zinc/67/07/75/566670775.db2.gz WUNHFWFGSNJINY-VXGBXAGGSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@@H]1C[C@@H](C)CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000607416137 566670785 /nfs/dbraw/zinc/67/07/85/566670785.db2.gz WUNHFWFGSNJINY-VXGBXAGGSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@@H]1C[C@H](C)CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000607416136 566671070 /nfs/dbraw/zinc/67/10/70/566671070.db2.gz WUNHFWFGSNJINY-TXEJJXNPSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@@H]1C[C@H](C)CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000607416136 566671074 /nfs/dbraw/zinc/67/10/74/566671074.db2.gz WUNHFWFGSNJINY-TXEJJXNPSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@@H](O)CN(Cc1ccccc1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000607388054 566671200 /nfs/dbraw/zinc/67/12/00/566671200.db2.gz HCOGNRYGVXFXNT-GFCCVEGCSA-N 0 1 388.265 3.349 10 0 GGAEMN O=C([O-])C[C@@H]([NH2+]Cc1cc2n(n1)CCCC2)c1cccc(Br)c1 ZINC000653502655 566674051 /nfs/dbraw/zinc/67/40/51/566674051.db2.gz KXPBEPHNFVWVQY-MRXNPFEDSA-N 0 1 378.270 3.288 10 0 GGAEMN Cc1ccc2nc(CNC(=O)N(C)Cc3cc(Br)cn3C)[nH]c2c1 ZINC000467978710 566677889 /nfs/dbraw/zinc/67/78/89/566677889.db2.gz SPNGNLBFQQXQMK-UHFFFAOYSA-N 0 1 390.285 3.314 10 0 GGAEMN Cn1ncc(Br)c1CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 ZINC000487564922 566680826 /nfs/dbraw/zinc/68/08/26/566680826.db2.gz VBHWHDSEPWNUMH-JTQLQIEISA-N 0 1 387.684 3.344 10 0 GGAEMN Cc1ccc(OC[C@@H](O)CN[C@@H](CCO)c2ccccc2Br)cc1 ZINC000514963273 566681727 /nfs/dbraw/zinc/68/17/27/566681727.db2.gz NKNGRDHFKJEMRE-KXBFYZLASA-N 0 1 394.309 3.211 10 0 GGAEMN OC[C@@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1cccnc1 ZINC000514943904 566681880 /nfs/dbraw/zinc/68/18/80/566681880.db2.gz CQDWHTGHECUNGL-OAHLLOKOSA-N 0 1 387.281 3.100 10 0 GGAEMN Cc1ccc(OC[C@H](O)CN[C@@H](CCO)c2ccccc2Br)cc1 ZINC000514963270 566681916 /nfs/dbraw/zinc/68/19/16/566681916.db2.gz NKNGRDHFKJEMRE-BEFAXECRSA-N 0 1 394.309 3.211 10 0 GGAEMN CN1CCN(C(=O)c2cc(=O)c3ccccc3[nH]2)c2ccc(Br)cc21 ZINC000561205826 566685121 /nfs/dbraw/zinc/68/51/21/566685121.db2.gz RYANLZDSUAJEED-UHFFFAOYSA-N 0 1 398.260 3.387 10 0 GGAEMN O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCN(C[C@H]2CCOC2)CC1 ZINC000426057955 566688784 /nfs/dbraw/zinc/68/87/84/566688784.db2.gz KODCVHOAJMPMNN-UKRRQHHQSA-N 0 1 383.945 3.143 10 0 GGAEMN CC[N@H+]1CCCC[C@@H]1C(=O)NCc1cc2cccnc2cc1Br ZINC000676396717 566689588 /nfs/dbraw/zinc/68/95/88/566689588.db2.gz NUYWLXRZAAYZKL-QGZVFWFLSA-N 0 1 376.298 3.488 10 0 GGAEMN CCN1CCCC[C@@H]1C(=O)NCc1cc2cccnc2cc1Br ZINC000676396717 566689592 /nfs/dbraw/zinc/68/95/92/566689592.db2.gz NUYWLXRZAAYZKL-QGZVFWFLSA-N 0 1 376.298 3.488 10 0 GGAEMN O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000426057953 566689657 /nfs/dbraw/zinc/68/96/57/566689657.db2.gz KODCVHOAJMPMNN-DZGCQCFKSA-N 0 1 383.945 3.143 10 0 GGAEMN O=C(Nc1cccc(N2CCC[NH+]=C2[O-])c1)c1ncsc1Br ZINC000561266514 566691161 /nfs/dbraw/zinc/69/11/61/566691161.db2.gz RDQWTOWGPQLCDE-UHFFFAOYSA-N 0 1 381.255 3.078 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)C1 ZINC000676420644 566692208 /nfs/dbraw/zinc/69/22/08/566692208.db2.gz MXSGMIPLCOANLN-VXGBXAGGSA-N 0 1 376.448 3.145 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3sc(Br)cc3C2)n[nH]1 ZINC000676423006 566693624 /nfs/dbraw/zinc/69/36/24/566693624.db2.gz YJSPRAPKDBGKTK-VIFPVBQESA-N 0 1 383.315 3.241 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SCc2cn(CC3CC3)nn2)n1 ZINC000450668099 566695738 /nfs/dbraw/zinc/69/57/38/566695738.db2.gz NIWAJXIQJFVOTO-UHFFFAOYSA-N 0 1 376.873 3.428 10 0 GGAEMN Cn1ncc(Br)c1CN1CCC2(CC1)OCCc1ccsc12 ZINC000426149594 566695886 /nfs/dbraw/zinc/69/58/86/566695886.db2.gz OGTAPTCDWFLQJR-UHFFFAOYSA-N 0 1 382.327 3.308 10 0 GGAEMN FC(F)(F)[C@@H](CN[C@@H]1CCCOc2cc(Cl)ccc21)N1CCOCC1 ZINC000515189551 566697569 /nfs/dbraw/zinc/69/75/69/566697569.db2.gz STBOPCXNIWINLN-GDBMZVCRSA-N 0 1 378.822 3.406 10 0 GGAEMN FC(F)(F)[C@H](CN[C@H]1CCCOc2cc(Cl)ccc21)N1CCOCC1 ZINC000515189553 566697841 /nfs/dbraw/zinc/69/78/41/566697841.db2.gz STBOPCXNIWINLN-HOCLYGCPSA-N 0 1 378.822 3.406 10 0 GGAEMN COCCN(C(C)=O)c1nc(CN[C@H](C)C2CCC(F)(F)CC2)cs1 ZINC000653870440 566699865 /nfs/dbraw/zinc/69/98/65/566699865.db2.gz SRPJDNKUKSOOQX-GFCCVEGCSA-N 0 1 375.485 3.446 10 0 GGAEMN C[C@@H]1C[C@H]1N1C[C@H](NCc2cc(Br)ccc2OC(F)F)CC1=O ZINC000608072789 566699982 /nfs/dbraw/zinc/69/99/82/566699982.db2.gz SMNOWZKIJUVWAD-OASPWFOLSA-N 0 1 389.240 3.149 10 0 GGAEMN C[C@@H](NCC(=O)Nc1cc(S(C)(=O)=O)ccc1F)c1cccc(Cl)c1 ZINC000488021100 566704261 /nfs/dbraw/zinc/70/42/61/566704261.db2.gz DEMHSIGBKDMJOP-LLVKDONJSA-N 0 1 384.860 3.172 10 0 GGAEMN Cc1nc2ccc(CN(C)[C@H](C)c3cccc(S(N)(=O)=O)c3)cc2s1 ZINC000426412595 566710405 /nfs/dbraw/zinc/71/04/05/566710405.db2.gz UNBOGYWOEQTFJP-GFCCVEGCSA-N 0 1 375.519 3.445 10 0 GGAEMN Cc1onc(-c2cccc(Br)c2)c1C(=O)N[C@@H]1CCCN(C)C1 ZINC000676877409 566714816 /nfs/dbraw/zinc/71/48/16/566714816.db2.gz ILMAWVQGEWKRFT-CQSZACIVSA-N 0 1 378.270 3.237 10 0 GGAEMN COCCN(Cc1ccc(Br)c(Br)c1)[C@H]1CCOC1 ZINC000426505906 566715172 /nfs/dbraw/zinc/71/51/72/566715172.db2.gz ZXPQXCLMXGIYPS-LBPRGKRZSA-N 0 1 393.119 3.449 10 0 GGAEMN Cn1[nH]c([C@H]2CCCN2CC/C=C\c2ccc(Br)cc2)nc1=N ZINC000450906677 566719235 /nfs/dbraw/zinc/71/92/35/566719235.db2.gz DRPWOWGGXDGPEQ-ZSQCLPQSSA-N 0 1 376.302 3.231 10 0 GGAEMN O=C1N=NC(C2CCN(CC[S@@](=O)c3cc(Cl)ccc3Cl)CC2)O1 ZINC000450915015 566720585 /nfs/dbraw/zinc/72/05/85/566720585.db2.gz OREDFMCAEUCERG-XMMPIXPASA-N 0 1 390.292 3.069 10 0 GGAEMN CCc1nc(C[NH2+]Cc2ccc(Br)cc2OC)ccc1C(=O)[O-] ZINC000426652535 566722593 /nfs/dbraw/zinc/72/25/93/566722593.db2.gz VASFYCSDNWKMQX-UHFFFAOYSA-N 0 1 379.254 3.403 10 0 GGAEMN O=C([O-])c1csc(C[NH2+]Cc2ccc(Br)c3cccnc23)n1 ZINC000426675099 566723739 /nfs/dbraw/zinc/72/37/39/566723739.db2.gz PEXGEMLNZIMSEW-UHFFFAOYSA-N 0 1 378.251 3.442 10 0 GGAEMN Cc1cccc(CN=c2ccc(C(=O)NC3CCCC3)n[nH]2)c1Br ZINC000468734995 566724492 /nfs/dbraw/zinc/72/44/92/566724492.db2.gz MTTJOHSOHNVIAN-UHFFFAOYSA-N 0 1 389.297 3.254 10 0 GGAEMN Clc1cc2nc(-c3cn(C[C@H]4CCOC4)nn3)[nH]c2c(Br)c1 ZINC000630382047 566724622 /nfs/dbraw/zinc/72/46/22/566724622.db2.gz QFIXJDUMTYSGDO-MRVPVSSYSA-N 0 1 382.649 3.274 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccsc1 ZINC000654288925 566726134 /nfs/dbraw/zinc/72/61/34/566726134.db2.gz VTFITEPHIPUSEN-MJBXVCDLSA-N 0 1 379.448 3.150 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CC(Cc2ccccc2Br)C1 ZINC000630397949 566726284 /nfs/dbraw/zinc/72/62/84/566726284.db2.gz AWLUGJKNGFFGAB-UHFFFAOYSA-N 0 1 391.313 3.297 10 0 GGAEMN C[C@@H](c1ccc(CN2CCC[C@H](S(=O)(=O)N(C)C)C2)cc1)C(F)(F)F ZINC000450970682 566726982 /nfs/dbraw/zinc/72/69/82/566726982.db2.gz FERFEDSENBUWGT-BBRMVZONSA-N 0 1 378.460 3.208 10 0 GGAEMN COC(=O)C[C@](C)(NCc1cn(C)nc1C)c1ccc(Br)cc1 ZINC000450987705 566730145 /nfs/dbraw/zinc/73/01/45/566730145.db2.gz MGTLMVSOWIFMCI-KRWDZBQOSA-N 0 1 380.286 3.059 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)NCc2ccc(Br)cc2OC)C[C@H]1C ZINC000488495748 566730351 /nfs/dbraw/zinc/73/03/51/566730351.db2.gz JCUIOIOZWKKPCN-OLZOCXBDSA-N 0 1 384.318 3.082 10 0 GGAEMN O=C(NCCCCN1CCOCC1)NCCCc1c(Cl)cccc1Cl ZINC000654377827 566731663 /nfs/dbraw/zinc/73/16/63/566731663.db2.gz YPYZZOAMVPFUBR-UHFFFAOYSA-N 0 1 388.339 3.338 10 0 GGAEMN CCN1CCN(CC(C)(C)NC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000654412777 566733386 /nfs/dbraw/zinc/73/33/86/566733386.db2.gz MUQPWKIPEYQSLH-UHFFFAOYSA-N 0 1 396.373 3.212 10 0 GGAEMN CCOCc1cccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2Cl)c1 ZINC000608810570 566736075 /nfs/dbraw/zinc/73/60/75/566736075.db2.gz ZHYAIASUGBQMIV-UHFFFAOYSA-N 0 1 383.853 3.464 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(C[C@@H](O)COc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000677269335 566736419 /nfs/dbraw/zinc/73/64/19/566736419.db2.gz MSQKTLRQQURDCN-OSLDLMBLSA-N 0 1 390.307 3.001 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)N1CCOc2cccc(Br)c2C1 ZINC000654495142 566736564 /nfs/dbraw/zinc/73/65/64/566736564.db2.gz IQCLDHDAOXVMEX-CQSZACIVSA-N 0 1 391.269 3.154 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(C[C@@H](O)COc3ccc(Cl)c(Cl)c3)[C@@H]2C1 ZINC000677269333 566736718 /nfs/dbraw/zinc/73/67/18/566736718.db2.gz MSQKTLRQQURDCN-HLNSBACISA-N 0 1 390.307 3.001 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@@H]2CCCCN2S(=O)(=O)c2cccs2)n1 ZINC000580951960 566737299 /nfs/dbraw/zinc/73/72/99/566737299.db2.gz YHJCTNMCZOYAME-STQMWFEESA-N 0 1 384.527 3.093 10 0 GGAEMN CCOC(=O)CC1(NC(=O)c2n[nH]c3ccc(Br)cc32)CCCC1 ZINC000468854332 566737356 /nfs/dbraw/zinc/73/73/56/566737356.db2.gz GTEMPVMBFLNFHT-UHFFFAOYSA-N 0 1 394.269 3.321 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@H]2CCCCN2S(=O)(=O)c2cccs2)n1 ZINC000580951957 566737768 /nfs/dbraw/zinc/73/77/68/566737768.db2.gz YHJCTNMCZOYAME-CHWSQXEVSA-N 0 1 384.527 3.093 10 0 GGAEMN CC(C)Oc1ccc(Br)cc1NS(=O)(=O)c1c[nH]c(=O)s1 ZINC000451027477 566737921 /nfs/dbraw/zinc/73/79/21/566737921.db2.gz WWWNLOJJYAWHSM-UHFFFAOYSA-N 0 1 393.284 3.199 10 0 GGAEMN CCc1[nH]nc(C(=O)Nc2cccc3c2OCC[C@@H]3N(C)C)c1Br ZINC000468868169 566738960 /nfs/dbraw/zinc/73/89/60/566738960.db2.gz GNWYKPYUFMSMHA-ZDUSSCGKSA-N 0 1 393.285 3.372 10 0 GGAEMN COC[C@H](C)Oc1ccc(Cl)cc1S(=O)(=O)NC(C)(C)C(F)(F)F ZINC000451030202 566739093 /nfs/dbraw/zinc/73/90/93/566739093.db2.gz IGVUSNAYSQACDP-VIFPVBQESA-N 0 1 389.823 3.373 10 0 GGAEMN Cc1c(Br)cc(-c2nc(=O)c3ccc(Cl)cc3[nH]2)c(=O)n1C ZINC000516030794 566742304 /nfs/dbraw/zinc/74/23/04/566742304.db2.gz YHXWMBLLYAYZDS-UHFFFAOYSA-N 0 1 380.629 3.425 10 0 GGAEMN O=C(NCc1n[nH]c([C@H]2CCCO2)n1)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000654571386 566743021 /nfs/dbraw/zinc/74/30/21/566743021.db2.gz YHJBBGXLGRVADP-GHMZBOCLSA-N 0 1 381.889 3.248 10 0 GGAEMN O=C(NCc1n[nH]c([C@@H]2CCCO2)n1)N[C@H]1CCCc2sc(Cl)cc21 ZINC000654571388 566743071 /nfs/dbraw/zinc/74/30/71/566743071.db2.gz YHJBBGXLGRVADP-QWRGUYRKSA-N 0 1 381.889 3.248 10 0 GGAEMN CN(C)[C@H](CNC(=O)c1c(F)cncc1Br)c1cccc(F)c1 ZINC000630577424 566743094 /nfs/dbraw/zinc/74/30/94/566743094.db2.gz ZYCRXQROHPHIKR-CQSZACIVSA-N 0 1 384.224 3.155 10 0 GGAEMN CC[C@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccn(C)n1 ZINC000541743994 566744153 /nfs/dbraw/zinc/74/41/53/566744153.db2.gz CYMRQLJWASTSNR-ZDUSSCGKSA-N 0 1 375.274 3.209 10 0 GGAEMN CC[C@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccn(C)n1 ZINC000541743994 566744161 /nfs/dbraw/zinc/74/41/61/566744161.db2.gz CYMRQLJWASTSNR-ZDUSSCGKSA-N 0 1 375.274 3.209 10 0 GGAEMN Fc1cc(Br)cc(OCCN2CCC(Oc3cnccn3)CC2)c1 ZINC000488732450 566744230 /nfs/dbraw/zinc/74/42/30/566744230.db2.gz HSAUMQDAVVGHLS-UHFFFAOYSA-N 0 1 396.260 3.300 10 0 GGAEMN O=S(=O)(NCc1ccc(Cl)o1)c1cc(F)c(Br)cc1F ZINC000677420012 566745375 /nfs/dbraw/zinc/74/53/75/566745375.db2.gz OFMXYELMCSNFQR-UHFFFAOYSA-N 0 1 386.601 3.452 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccccc2OCc2cscn2)[nH]1 ZINC000468929981 566745394 /nfs/dbraw/zinc/74/53/94/566745394.db2.gz IUWPKBJMYXTSDU-UHFFFAOYSA-N 0 1 375.479 3.270 10 0 GGAEMN Brc1cccc(-c2ccc(CN3CCN4CCOC[C@H]4C3)o2)c1 ZINC000541760416 566746220 /nfs/dbraw/zinc/74/62/20/566746220.db2.gz LTHGKIDEXBIQAU-MRXNPFEDSA-N 0 1 377.282 3.226 10 0 GGAEMN CNC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(C)sc3c2)cc1Cl ZINC000427097420 566746706 /nfs/dbraw/zinc/74/67/06/566746706.db2.gz SDLMITALJKJPHI-UHFFFAOYSA-N 0 1 395.893 3.419 10 0 GGAEMN Cc1nc2c(Cl)cccc2c(N2CCC(N(C)S(C)(=O)=O)CC2)c1C ZINC000516123514 566747275 /nfs/dbraw/zinc/74/72/75/566747275.db2.gz AZQUCYPPEFFPKI-UHFFFAOYSA-N 0 1 381.929 3.365 10 0 GGAEMN C[C@H](CNC(=O)c1c(F)cncc1Br)N1CCc2ccccc2C1 ZINC000630707070 566748364 /nfs/dbraw/zinc/74/83/64/566748364.db2.gz RKDLGIVLOOOCHD-GFCCVEGCSA-N 0 1 392.272 3.160 10 0 GGAEMN O=C(N[C@H]1CCCN(Cc2ccccc2)C1)c1c(F)cncc1Br ZINC000630724831 566748561 /nfs/dbraw/zinc/74/85/61/566748561.db2.gz GPRQQMWZIRHRRX-AWEZNQCLSA-N 0 1 392.272 3.378 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)Nc3ccc(C(N)=O)c(Cl)c3)cc2s1 ZINC000427111226 566748785 /nfs/dbraw/zinc/74/87/85/566748785.db2.gz YTRJTZZGAZRSBT-UHFFFAOYSA-N 0 1 381.866 3.158 10 0 GGAEMN CC[C@H](NS(=O)(=O)c1cc(Cl)ccc1OCCCOC)C(F)(F)F ZINC000469010799 566753001 /nfs/dbraw/zinc/75/30/01/566753001.db2.gz RCDDZEIBZNFEOP-ZDUSSCGKSA-N 0 1 389.823 3.375 10 0 GGAEMN COC(=O)c1c(C)c(NS(=O)(=O)c2cc(Cl)ccc2OC)ccc1F ZINC000516221761 566753441 /nfs/dbraw/zinc/75/34/41/566753441.db2.gz WBJJRVYZAOTVAL-UHFFFAOYSA-N 0 1 387.816 3.384 10 0 GGAEMN CN(C)c1ccncc1C(=O)NCCCc1ccc(Br)cc1F ZINC000541840578 566753660 /nfs/dbraw/zinc/75/36/60/566753660.db2.gz MZLZBMWTZPHSMO-UHFFFAOYSA-N 0 1 380.261 3.412 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1C[C@@H]2CCCC[C@H]2C1 ZINC000427181985 566754198 /nfs/dbraw/zinc/75/41/98/566754198.db2.gz KYHKVANAFABIBE-QWRGUYRKSA-N 0 1 395.244 3.430 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1C[C@@H]2CCCC[C@@H]2C1 ZINC000427181984 566754608 /nfs/dbraw/zinc/75/46/08/566754608.db2.gz KYHKVANAFABIBE-PHIMTYICSA-N 0 1 395.244 3.430 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccc2c(c1)C[C@H](C)O2 ZINC000609264194 566755593 /nfs/dbraw/zinc/75/55/93/566755593.db2.gz NYYYYTPIQMKIEW-JTQLQIEISA-N 0 1 381.837 3.251 10 0 GGAEMN COc1nc(C)c(Br)cc1C(=O)Nc1nc2ccc(F)cc2[nH]1 ZINC000488888632 566755932 /nfs/dbraw/zinc/75/59/32/566755932.db2.gz ABRITNRDENNADN-UHFFFAOYSA-N 0 1 379.189 3.429 10 0 GGAEMN O=C(Nc1nc2ccc(F)cc2[nH]1)c1cc(Br)c2c(c1)OCCO2 ZINC000488907488 566756842 /nfs/dbraw/zinc/75/68/42/566756842.db2.gz JMYGSEGBIWPECK-UHFFFAOYSA-N 0 1 392.184 3.488 10 0 GGAEMN Cc1c(Br)csc1C(=O)N1CCCN(C[C@@H]2CCCO2)CC1 ZINC000630846231 566756824 /nfs/dbraw/zinc/75/68/24/566756824.db2.gz ICUMNBKWVMUDCK-ZDUSSCGKSA-N 0 1 387.343 3.146 10 0 GGAEMN COC(=O)CCN(Cc1ccc(Br)cc1OC)C[C@H]1CCCO1 ZINC000541925517 566758997 /nfs/dbraw/zinc/75/89/97/566758997.db2.gz MXVQYVBIGNVTIV-OAHLLOKOSA-N 0 1 386.286 3.002 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3c[nH]c4ccc(Br)cc34)cc21 ZINC000677714293 566759555 /nfs/dbraw/zinc/75/95/55/566759555.db2.gz VYBPGOFULXZCFX-UHFFFAOYSA-N 0 1 398.220 3.158 10 0 GGAEMN COC(=O)CCN(Cc1ccc(Br)cc1OC)C[C@@H]1CCCO1 ZINC000541925516 566760008 /nfs/dbraw/zinc/76/00/08/566760008.db2.gz MXVQYVBIGNVTIV-HNNXBMFYSA-N 0 1 386.286 3.002 10 0 GGAEMN C[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1cc(F)c(Cl)cc1Cl ZINC000562056003 566761027 /nfs/dbraw/zinc/76/10/27/566761027.db2.gz OEJPUORQZLTNHD-GHMZBOCLSA-N 0 1 398.331 3.054 10 0 GGAEMN O=S(=O)(C[C@@H]1CCCC1(F)F)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000451136532 566763724 /nfs/dbraw/zinc/76/37/24/566763724.db2.gz QOTQSIUXFSBYTL-GJZGRUSLSA-N 0 1 392.537 3.315 10 0 GGAEMN COC(=O)[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1cccs1 ZINC000609520702 566768312 /nfs/dbraw/zinc/76/83/12/566768312.db2.gz XGYNZOKFIBDYAU-ZDUSSCGKSA-N 0 1 394.250 3.031 10 0 GGAEMN Brc1ccccc1-c1n[nH]c(SC[C@@H]2CCc3ncnn32)n1 ZINC000631004077 566770107 /nfs/dbraw/zinc/77/01/07/566770107.db2.gz SGLLBOJXYFDNQH-VIFPVBQESA-N 0 1 377.271 3.105 10 0 GGAEMN Cc1c(-c2nc([C@H](N)CC(C)C)no2)nnn1-c1cccc(Br)c1 ZINC000581369329 566771754 /nfs/dbraw/zinc/77/17/54/566771754.db2.gz TYKVAUYCICZLIP-CYBMUJFWSA-N 0 1 391.273 3.434 10 0 GGAEMN O=C(c1ccco1)N1CCC(NCc2ncc(Br)cc2Cl)CC1 ZINC000631040379 566772191 /nfs/dbraw/zinc/77/21/91/566772191.db2.gz PCHZVIDQVOPCOC-UHFFFAOYSA-N 0 1 398.688 3.485 10 0 GGAEMN Clc1cc(Br)cnc1CNCCc1nnc2n1CCCCC2 ZINC000631038496 566772229 /nfs/dbraw/zinc/77/22/29/566772229.db2.gz ZAKHNCAJYPZDMK-UHFFFAOYSA-N 0 1 384.709 3.148 10 0 GGAEMN CC(C)C[C@H](N)c1noc(COc2ccc(I)cc2)n1 ZINC000581369123 566772374 /nfs/dbraw/zinc/77/23/74/566772374.db2.gz GAUNGKKMSQQCGW-LBPRGKRZSA-N 0 1 387.221 3.299 10 0 GGAEMN Cc1c(-c2nc([C@@H](N)CC(C)C)no2)nnn1-c1cccc(Br)c1 ZINC000581369330 566772524 /nfs/dbraw/zinc/77/25/24/566772524.db2.gz TYKVAUYCICZLIP-ZDUSSCGKSA-N 0 1 391.273 3.434 10 0 GGAEMN C[C@@H](c1nncn1C)N1CC[C@H](Cc2cccc(I)c2)C1 ZINC000451186146 566773008 /nfs/dbraw/zinc/77/30/08/566773008.db2.gz DMHXUTCBTOCTKG-GXTWGEPZSA-N 0 1 396.276 3.045 10 0 GGAEMN COc1ccc(CN2CCC[C@H](c3ccnc(N)n3)C2)c(Br)c1 ZINC000581396730 566773015 /nfs/dbraw/zinc/77/30/15/566773015.db2.gz QZTWWRXEMJAXNU-ZDUSSCGKSA-N 0 1 377.286 3.040 10 0 GGAEMN COc1cc(Cl)c(Br)cc1C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000562251814 566774801 /nfs/dbraw/zinc/77/48/01/566774801.db2.gz VHMPEWRABMRDPB-MRVPVSSYSA-N 0 1 384.661 3.122 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H](C(=O)OC)c1ccccc1C(F)(F)F ZINC000542104718 566775308 /nfs/dbraw/zinc/77/53/08/566775308.db2.gz QAHQPBYHUCSUCT-NSHDSACASA-N 0 1 375.372 3.419 10 0 GGAEMN COc1cc(Cl)c(Br)cc1C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000562251815 566775476 /nfs/dbraw/zinc/77/54/76/566775476.db2.gz VHMPEWRABMRDPB-QMMMGPOBSA-N 0 1 384.661 3.122 10 0 GGAEMN CCc1nnc(CN2CC[C@@H](Cc3cccc(I)c3)C2)o1 ZINC000451194800 566775545 /nfs/dbraw/zinc/77/55/45/566775545.db2.gz SGGZPYLJFSLLED-ZDUSSCGKSA-N 0 1 397.260 3.301 10 0 GGAEMN Ic1cccc(C[C@@H]2CCN(Cc3cnns3)C2)c1 ZINC000451195677 566775574 /nfs/dbraw/zinc/77/55/74/566775574.db2.gz UQCLBOPNUUMRQH-LBPRGKRZSA-N 0 1 385.274 3.207 10 0 GGAEMN O=C(NCCCNCc1ncc(Br)cc1Cl)c1cccs1 ZINC000631071501 566775990 /nfs/dbraw/zinc/77/59/90/566775990.db2.gz NWLSKFJGIBBKCZ-UHFFFAOYSA-N 0 1 388.718 3.469 10 0 GGAEMN Cn1ccc(CN2CCC[C@@H]2c2ccccc2I)cc1=O ZINC000609614086 566776093 /nfs/dbraw/zinc/77/60/93/566776093.db2.gz XQOXBAJBSMSPKW-MRXNPFEDSA-N 0 1 394.256 3.327 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCc3cc(OC)c(F)cc3C2)c1Br ZINC000469264440 566776835 /nfs/dbraw/zinc/77/68/35/566776835.db2.gz MDRNUQAJUGPPHO-UHFFFAOYSA-N 0 1 382.233 3.081 10 0 GGAEMN CCN(CC)C(=O)c1ccc(S(=O)(=O)Nc2ccnc(SC)c2)cc1 ZINC000678029745 566777158 /nfs/dbraw/zinc/77/71/58/566777158.db2.gz FAECUJNZAGOOEW-UHFFFAOYSA-N 0 1 379.507 3.086 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@H](Cc1ccccc1)C(N)=O ZINC000469284160 566777673 /nfs/dbraw/zinc/77/76/73/566777673.db2.gz UCUQXVBRWRENDM-MLGOLLRUSA-N 0 1 377.282 3.205 10 0 GGAEMN O=c1cccc2n1C[C@H]1C[C@@H]2CN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000451222306 566778071 /nfs/dbraw/zinc/77/80/71/566778071.db2.gz LUZJLAMUWKOOQT-QWHCGFSZSA-N 0 1 399.292 3.106 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCCc3cc(Br)ccc32)[nH]1 ZINC000562296825 566778157 /nfs/dbraw/zinc/77/81/57/566778157.db2.gz CCQNSFCHIUXMGW-UHFFFAOYSA-N 0 1 381.299 3.337 10 0 GGAEMN C[C@H]1C[C@@H](N[C@H]2CCCN(Cc3nccn3C)C2=O)c2ccsc2S1 ZINC000542156983 566778398 /nfs/dbraw/zinc/77/83/98/566778398.db2.gz IZPADBVYRHOWPW-AEGPPILISA-N 0 1 376.551 3.188 10 0 GGAEMN CC(C)(C[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(N)=O ZINC000451216089 566778657 /nfs/dbraw/zinc/77/86/57/566778657.db2.gz LUNLGUNVCYSYRR-LBPRGKRZSA-N 0 1 393.329 3.439 10 0 GGAEMN COCCc1ncc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000631103537 566780561 /nfs/dbraw/zinc/78/05/61/566780561.db2.gz IVFNNPVDDOOBAE-MAUKXSAKSA-N 0 1 379.913 3.047 10 0 GGAEMN Clc1ccc(Br)c(CCNCc2cn(C[C@@H]3CCOC3)nn2)c1 ZINC000631097618 566780591 /nfs/dbraw/zinc/78/05/91/566780591.db2.gz DLGUADDWHJBDSD-LBPRGKRZSA-N 0 1 399.720 3.063 10 0 GGAEMN C[C@@H]1CCC[C@@H]1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000542187091 566781138 /nfs/dbraw/zinc/78/11/38/566781138.db2.gz YTOQYPJCAAUOCT-DGCLKSJQSA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@@H]1CCC[C@@H]1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000542187091 566781148 /nfs/dbraw/zinc/78/11/48/566781148.db2.gz YTOQYPJCAAUOCT-DGCLKSJQSA-N 0 1 392.301 3.470 10 0 GGAEMN O=C(c1cccc2[nH]cnc21)N(CCO)Cc1cc(Br)cs1 ZINC000427585508 566781187 /nfs/dbraw/zinc/78/11/87/566781187.db2.gz GPJNTYCFELYVQI-UHFFFAOYSA-N 0 1 380.267 3.022 10 0 GGAEMN Cc1ccccc1[C@H](N)C(=O)Nc1ccc(CN(C)C)c(Br)c1 ZINC000581487655 566782139 /nfs/dbraw/zinc/78/21/39/566782139.db2.gz ZKVHMEPQGLPMHF-KRWDZBQOSA-N 0 1 376.298 3.458 10 0 GGAEMN CC[C@H]1CN(C)CCN1C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000655143141 566782718 /nfs/dbraw/zinc/78/27/18/566782718.db2.gz NCDAWLHFWPIXNI-DZGCQCFKSA-N 0 1 382.302 3.008 10 0 GGAEMN C[C@H](Cc1ccccc1Br)NC(=O)c1ccc(CN(C)C)nc1 ZINC000516789941 566783038 /nfs/dbraw/zinc/78/30/38/566783038.db2.gz JTJMFKLAGAJCIR-CYBMUJFWSA-N 0 1 376.298 3.267 10 0 GGAEMN Brc1ccc([C@H]2C[C@H](NCc3cn(C[C@H]4CCOC4)nn3)C2)cc1 ZINC000631139568 566783576 /nfs/dbraw/zinc/78/35/76/566783576.db2.gz ODHHGIKSDURGMM-FRFSOERESA-N 0 1 391.313 3.113 10 0 GGAEMN Cn1nc2c(c1CN[C@](C)(CO)c1ccc(Br)cc1)CCCC2 ZINC000631134849 566784253 /nfs/dbraw/zinc/78/42/53/566784253.db2.gz YWKPAVISSQLJLE-GOSISDBHSA-N 0 1 378.314 3.059 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2ccc(C(F)(F)F)s2)Oc2ccccc21 ZINC000581548186 566786249 /nfs/dbraw/zinc/78/62/49/566786249.db2.gz WMGKUNJQWBLYHH-SNVBAGLBSA-N 0 1 377.409 3.091 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)C3CCC(C(F)(F)F)CC3)[nH]c2c1 ZINC000451276717 566786849 /nfs/dbraw/zinc/78/68/49/566786849.db2.gz UJUGWKFIVVCISU-UHFFFAOYSA-N 0 1 375.416 3.412 10 0 GGAEMN O=C(N[C@@H](C1CC1)[C@@H]1CCCCO1)c1n[nH]c2ccc(Br)cc21 ZINC000655222836 566787294 /nfs/dbraw/zinc/78/72/94/566787294.db2.gz MNQSOFJIVPPXIB-GJZGRUSLSA-N 0 1 378.270 3.403 10 0 GGAEMN COc1cc(CN[C@H]2CCCc3c2ccc(=O)n3C)c(F)cc1Br ZINC000631169580 566787846 /nfs/dbraw/zinc/78/78/46/566787846.db2.gz ZAJNOPYZJJVKAC-HNNXBMFYSA-N 0 1 395.272 3.463 10 0 GGAEMN COCCN(CCC(=O)NCc1ccccc1Cl)Cc1scnc1C ZINC000489444674 566788223 /nfs/dbraw/zinc/78/82/23/566788223.db2.gz FEBJGOPIGDSGHK-UHFFFAOYSA-N 0 1 381.929 3.260 10 0 GGAEMN Brc1ccc(/C=C\CCNCc2cn(C[C@H]3CCOC3)nn2)cc1 ZINC000631180806 566789332 /nfs/dbraw/zinc/78/93/32/566789332.db2.gz HYXBYRJKSUHVDU-SSCKWRJFSA-N 0 1 391.313 3.270 10 0 GGAEMN C[C@H](NC(=O)N(C)Cc1cc(C(C)(C)C)[nH]n1)c1ncc(Br)cn1 ZINC000562408269 566789476 /nfs/dbraw/zinc/78/94/76/566789476.db2.gz BORXSPNXHYMTAO-JTQLQIEISA-N 0 1 395.305 3.162 10 0 GGAEMN Brc1c2ccccc2oc1CNCc1n[nH]c(C2CCOCC2)n1 ZINC000631212280 566790731 /nfs/dbraw/zinc/79/07/31/566790731.db2.gz DLPXSBKSOPTGNQ-UHFFFAOYSA-N 0 1 391.269 3.497 10 0 GGAEMN Clc1c(Br)cccc1CNCc1n[nH]c(C2CCOCC2)n1 ZINC000631214257 566791066 /nfs/dbraw/zinc/79/10/66/566791066.db2.gz UIWPUHDJFZGYCN-UHFFFAOYSA-N 0 1 385.693 3.404 10 0 GGAEMN Fc1c(Br)ccc(CNCc2n[nH]c(C3CCOCC3)n2)c1F ZINC000631212342 566791710 /nfs/dbraw/zinc/79/17/10/566791710.db2.gz FFJCSZUHNYETEK-UHFFFAOYSA-N 0 1 387.228 3.029 10 0 GGAEMN O=C(c1cc(C(F)(F)F)[nH]n1)N1CCOc2cccc(Br)c2C1 ZINC000655318337 566792055 /nfs/dbraw/zinc/79/20/55/566792055.db2.gz AVBFRVHKBFMCIJ-UHFFFAOYSA-N 0 1 390.159 3.226 10 0 GGAEMN Cc1cc(C(=O)N2CCN3C[C@H](O)C[C@H]3C2)sc1-c1cccc(Cl)c1 ZINC000655299273 566792216 /nfs/dbraw/zinc/79/22/16/566792216.db2.gz YAKPSXCNMZQQQO-JKSUJKDBSA-N 0 1 376.909 3.268 10 0 GGAEMN Brc1ccc2oc(CNCc3n[nH]c(C4CCOCC4)n3)cc2c1 ZINC000631214791 566793373 /nfs/dbraw/zinc/79/33/73/566793373.db2.gz ZBHVIGKNNXHSHL-UHFFFAOYSA-N 0 1 391.269 3.497 10 0 GGAEMN C[C@@H](CNCc1ncc(Br)s1)c1ccc(S(C)(=O)=O)cc1 ZINC000631268108 566794790 /nfs/dbraw/zinc/79/47/90/566794790.db2.gz AIMFGXQCKHCXSG-JTQLQIEISA-N 0 1 389.340 3.202 10 0 GGAEMN O=C(CCc1nc[nH]n1)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000655346277 566795408 /nfs/dbraw/zinc/79/54/08/566795408.db2.gz FXSYZLOMGQVIBR-UHFFFAOYSA-N 0 1 388.686 3.046 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)c1cc(C2CC2)[nH]n1 ZINC000427784515 566797287 /nfs/dbraw/zinc/79/72/87/566797287.db2.gz OHPKZZPRQDFGGR-UHFFFAOYSA-N 0 1 384.299 3.400 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@H]2Cc3ccccc3CN2)cc1Br ZINC000581668037 566797868 /nfs/dbraw/zinc/79/78/68/566797868.db2.gz YUIBNFQCLTVZCM-GOSISDBHSA-N 0 1 388.309 3.164 10 0 GGAEMN CCn1nccc1CCN1CCN(Cc2ccc(Br)c(F)c2)CC1 ZINC000562509721 566798364 /nfs/dbraw/zinc/79/83/64/566798364.db2.gz LYRXQMYHNKWJHH-UHFFFAOYSA-N 0 1 395.320 3.165 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)C3CCC(C(F)(F)F)CC3)[nH]c21 ZINC000451365301 566803608 /nfs/dbraw/zinc/80/36/08/566803608.db2.gz WQGRSEPGQGXKJU-UHFFFAOYSA-N 0 1 375.416 3.412 10 0 GGAEMN Brc1ccc2nccc(NCc3n[nH]c(C4CCOCC4)n3)c2c1 ZINC000631460371 566805337 /nfs/dbraw/zinc/80/53/37/566805337.db2.gz QXUXIAUPIJRKMA-UHFFFAOYSA-N 0 1 388.269 3.043 10 0 GGAEMN C[C@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)c(F)c1 ZINC000678595585 566806047 /nfs/dbraw/zinc/80/60/47/566806047.db2.gz UQRLIVLAFODZCD-ZBEGNZNMSA-N 0 1 385.277 3.019 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)[C@@H](C)Oc1ccc(Br)cc1 ZINC000610108980 566806137 /nfs/dbraw/zinc/80/61/37/566806137.db2.gz VCGDZRGKMWNKHT-SECBINFHSA-N 0 1 396.241 3.063 10 0 GGAEMN Cc1cnc(N)c(S(=O)(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)c1 ZINC000678612572 566807691 /nfs/dbraw/zinc/80/76/91/566807691.db2.gz AZNGPCWOOSAVPD-UHFFFAOYSA-N 0 1 381.326 3.427 10 0 GGAEMN O=C(c1ccc2scc(Br)c2c1)N1CCC[C@@H](c2nn[nH]n2)C1 ZINC000562690977 566813034 /nfs/dbraw/zinc/81/30/34/566813034.db2.gz IQMOHEIZPWAPDH-SNVBAGLBSA-N 0 1 392.282 3.197 10 0 GGAEMN O=C([O-])CCCCC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000655554751 566813108 /nfs/dbraw/zinc/81/31/08/566813108.db2.gz KCYRDHPUUZFHFO-UHFFFAOYSA-N 0 1 397.313 3.175 10 0 GGAEMN O=C([C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21)N1CCC(c2cnc[nH]2)CC1 ZINC000631673171 566815058 /nfs/dbraw/zinc/81/50/58/566815058.db2.gz GJAKXZXBRVVGBN-BPQIPLTHSA-N 0 1 386.293 3.464 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451415700 566815774 /nfs/dbraw/zinc/81/57/74/566815774.db2.gz FTGRPVHAUBZMDI-BRWVUGGUSA-N 0 1 382.298 3.361 10 0 GGAEMN COc1ccc([C@@H](C)NCc2n[nH]c(C3CCOCC3)n2)c(Br)c1 ZINC000631691728 566816069 /nfs/dbraw/zinc/81/60/69/566816069.db2.gz AYOUEZOULNJNDE-LLVKDONJSA-N 0 1 395.301 3.321 10 0 GGAEMN CC[C@H]1CN(C)CCCN1S(=O)(=O)Cc1cccc(Br)c1C ZINC000655580780 566816483 /nfs/dbraw/zinc/81/64/83/566816483.db2.gz FXLZFVYULQLNMD-HNNXBMFYSA-N 0 1 389.359 3.003 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccc(F)c(Br)c1 ZINC000678771719 566816917 /nfs/dbraw/zinc/81/69/17/566816917.db2.gz YFQIBRDUMLYPBM-OAUYIBNBSA-N 0 1 399.304 3.409 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)n[nH]1 ZINC000517273558 566817869 /nfs/dbraw/zinc/81/78/69/566817869.db2.gz MHYFZXLCAKSMML-HPEXNQPKSA-N 0 1 377.286 3.267 10 0 GGAEMN CS(=O)(=O)c1cccc([C@H](N[C@@H]2CCC[C@H]2O)c2ccc(Cl)cc2)c1 ZINC000562738186 566818329 /nfs/dbraw/zinc/81/83/29/566818329.db2.gz GOHJYDHMVGNEJQ-GUDVDZBRSA-N 0 1 379.909 3.336 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000678792378 566818930 /nfs/dbraw/zinc/81/89/30/566818930.db2.gz WVQKQLOBWMAIHB-UHFFFAOYSA-N 0 1 376.203 3.151 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)n[nH]1 ZINC000655617513 566822742 /nfs/dbraw/zinc/82/27/42/566822742.db2.gz PJBIOVWWWISVQI-SNVBAGLBSA-N 0 1 384.267 3.342 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1S(=O)(=O)N[C@@H](c1ccccc1)C(F)(F)F ZINC000631762341 566823441 /nfs/dbraw/zinc/82/34/41/566823441.db2.gz BNHXUZQCLFJDCX-JTQLQIEISA-N 0 1 387.305 3.021 10 0 GGAEMN Nc1c(Cl)ccc(C(=O)NCCc2nnc(-c3ccccc3)[nH]2)c1Cl ZINC000469883162 566824970 /nfs/dbraw/zinc/82/49/70/566824970.db2.gz HKHWYSKMYSOYKJ-UHFFFAOYSA-N 0 1 376.247 3.333 10 0 GGAEMN COC(=O)c1sc2ccccc2c1S(=O)(=O)Nc1c(O)cccc1F ZINC000610335973 566825217 /nfs/dbraw/zinc/82/52/17/566825217.db2.gz XKWJLBNYVAJUNQ-UHFFFAOYSA-N 0 1 381.406 3.333 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2ccc(F)cc2Br)[nH]n1 ZINC000490035050 566826070 /nfs/dbraw/zinc/82/60/70/566826070.db2.gz FVBIPLPHSPVQMD-UHFFFAOYSA-N 0 1 393.260 3.085 10 0 GGAEMN CCOC(=O)[C@H](CNC(=O)c1cccc(Br)c1O)c1ccccc1 ZINC000610354682 566826964 /nfs/dbraw/zinc/82/69/64/566826964.db2.gz LGVQJHTUIMRXBJ-CQSZACIVSA-N 0 1 392.249 3.231 10 0 GGAEMN COCCN(Cc1ccnc(-c2ccc(Br)cc2)n1)[C@H]1CCOC1 ZINC000490047092 566827309 /nfs/dbraw/zinc/82/73/09/566827309.db2.gz JFZOQORDDSXGIS-KRWDZBQOSA-N 0 1 392.297 3.143 10 0 GGAEMN CC(C)(CNC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1 ZINC000517449608 566827880 /nfs/dbraw/zinc/82/78/80/566827880.db2.gz VDAXALZTOXULQE-AWEZNQCLSA-N 0 1 391.313 3.307 10 0 GGAEMN C[C@H]1[C@H](C(F)(F)F)CCN1S(=O)(=O)c1cc(C(F)(F)F)ccc1O ZINC000451512729 566830457 /nfs/dbraw/zinc/83/04/57/566830457.db2.gz XXTFOJBUSGKQET-IONNQARKSA-N 0 1 377.306 3.372 10 0 GGAEMN COc1ccc(Cl)c(S(=O)(=O)N[C@@H](C[C@@H]2CCCO2)C(F)(F)F)c1 ZINC000655661771 566830370 /nfs/dbraw/zinc/83/03/70/566830370.db2.gz IBLCDBQMJVVOQV-GWCFXTLKSA-N 0 1 387.807 3.127 10 0 GGAEMN C[C@@H]1[C@@H](C(F)(F)F)CCN1S(=O)(=O)c1cc(C(F)(F)F)ccc1O ZINC000451512727 566830659 /nfs/dbraw/zinc/83/06/59/566830659.db2.gz XXTFOJBUSGKQET-APPZFPTMSA-N 0 1 377.306 3.372 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccc(Cl)c(F)c1 ZINC000655662581 566830681 /nfs/dbraw/zinc/83/06/81/566830681.db2.gz SWBFECVKSMUDCB-UFBFGSQYSA-N 0 1 375.771 3.257 10 0 GGAEMN O=S(=O)(N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1C(F)(F)F ZINC000655663903 566831475 /nfs/dbraw/zinc/83/14/75/566831475.db2.gz OPHFWXKCFJWQTK-JOYOIKCWSA-N 0 1 391.333 3.484 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)Nc1cccc(N(C)C)n1 ZINC000542863747 566832827 /nfs/dbraw/zinc/83/28/27/566832827.db2.gz FFYGBEKUYRSOLY-UHFFFAOYSA-N 0 1 384.299 3.328 10 0 GGAEMN CN(CC(=O)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1)[C@@H]1CCSC1 ZINC000490182808 566835106 /nfs/dbraw/zinc/83/51/06/566835106.db2.gz RKKSQORXZSHEKP-CJNGLKHVSA-N 0 1 378.929 3.317 10 0 GGAEMN O=S(=O)(NC[C@H]1CC12CCSCC2)c1cc(C(F)(F)F)ccc1O ZINC000562929570 566835693 /nfs/dbraw/zinc/83/56/93/566835693.db2.gz GIRHFYZEIMGNME-LLVKDONJSA-N 0 1 381.441 3.223 10 0 GGAEMN Brc1ccc(N2CCN(CCN3CCc4ccccc43)CC2)nc1 ZINC000428380353 566835809 /nfs/dbraw/zinc/83/58/09/566835809.db2.gz LDJIKAMTNFIXRJ-UHFFFAOYSA-N 0 1 387.325 3.029 10 0 GGAEMN CCCN(C)[C@H](CNS(=O)(=O)[C@@H]1CCO[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000451540686 566836297 /nfs/dbraw/zinc/83/62/97/566836297.db2.gz ZMTWKFTXJKZJTK-BMGDILEWSA-N 0 1 388.961 3.210 10 0 GGAEMN COC[C@@](C)(CO)NCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000679118246 566836708 /nfs/dbraw/zinc/83/67/08/566836708.db2.gz VGPBLPJNFMAMFJ-GOSISDBHSA-N 0 1 396.329 3.245 10 0 GGAEMN COC[C@](C)(CO)NCc1cn(-c2ccc(Br)cc2)nc1C(C)C ZINC000679118247 566837053 /nfs/dbraw/zinc/83/70/53/566837053.db2.gz VGPBLPJNFMAMFJ-SFHVURJKSA-N 0 1 396.329 3.245 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000490223497 566837564 /nfs/dbraw/zinc/83/75/64/566837564.db2.gz OJNQNQBSAJNUQY-UGSOOPFHSA-N 0 1 396.329 3.256 10 0 GGAEMN Cc1nc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@@H](C)C2)c(-c2ccccc2)s1 ZINC000632026754 566841775 /nfs/dbraw/zinc/84/17/75/566841775.db2.gz LLOLEPYZASFFNU-XJKSGUPXSA-N 0 1 379.551 3.222 10 0 GGAEMN C[C@@H]1C[C@H](NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)CCN1C ZINC000632030408 566843244 /nfs/dbraw/zinc/84/32/44/566843244.db2.gz RLUSNHAEPVNNTJ-ZYHUDNBSSA-N 0 1 386.386 3.102 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000679302712 566846863 /nfs/dbraw/zinc/84/68/63/566846863.db2.gz FVSBXSWXMKLYQI-LLVKDONJSA-N 0 1 382.233 3.067 10 0 GGAEMN CC(F)(F)CCCNS(=O)(=O)c1cc(F)c(Br)cc1F ZINC000451607347 566848802 /nfs/dbraw/zinc/84/88/02/566848802.db2.gz KNSNLJCDKUUPOH-UHFFFAOYSA-N 0 1 378.185 3.441 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(-c2sccc2S(=O)(=O)N2CCCCC2)n1 ZINC000582301219 566849679 /nfs/dbraw/zinc/84/96/79/566849679.db2.gz XQTWTMZKUJQZJN-GFCCVEGCSA-N 0 1 384.527 3.019 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NCCCC(C)(F)F ZINC000451611930 566850281 /nfs/dbraw/zinc/85/02/81/566850281.db2.gz ZCKDKGWJKMJNDN-UHFFFAOYSA-N 0 1 390.235 3.494 10 0 GGAEMN O=S(=O)(NCCCC1CCOCC1)c1cc(F)c(Br)cc1F ZINC000451609706 566850473 /nfs/dbraw/zinc/85/04/73/566850473.db2.gz QMSIHCZCVDFJDL-UHFFFAOYSA-N 0 1 398.269 3.212 10 0 GGAEMN C[C@H](N[C@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)s1 ZINC000543085529 566850635 /nfs/dbraw/zinc/85/06/35/566850635.db2.gz QUNYBWMZNDRZQV-RYUDHWBXSA-N 0 1 397.342 3.086 10 0 GGAEMN O[C@@H](CCNCc1nc(-c2ccc(Br)cc2)c[nH]1)C(F)(F)F ZINC000582327885 566851217 /nfs/dbraw/zinc/85/12/17/566851217.db2.gz BUUPSSBTVIMOSK-LBPRGKRZSA-N 0 1 378.192 3.242 10 0 GGAEMN COCC1(CN[C@@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000655818087 566851258 /nfs/dbraw/zinc/85/12/58/566851258.db2.gz QJYJCHNGTMXKIT-LBPRGKRZSA-N 0 1 379.302 3.415 10 0 GGAEMN CC[C@@H]1CN(C)CCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000563064772 566851271 /nfs/dbraw/zinc/85/12/71/566851271.db2.gz WFXQVCGPIKVQDH-DOMZBBRYSA-N 0 1 382.302 3.008 10 0 GGAEMN Cn1nnnc1CCN[C@@H](c1ccccc1)c1cc(Br)ccc1F ZINC000679351097 566851404 /nfs/dbraw/zinc/85/14/04/566851404.db2.gz JARIMUACKAIJRJ-KRWDZBQOSA-N 0 1 390.260 3.033 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@@H](c2ccc(Br)cc2)[C@H]2CCCO2)CC1=O ZINC000679354705 566851810 /nfs/dbraw/zinc/85/18/10/566851810.db2.gz YMIUROXHQZHZLZ-ZIIYPAMZSA-N 0 1 393.325 3.268 10 0 GGAEMN COc1cc(CN[C@@H]2CCc3ccccc3NC2=O)cc(Br)c1O ZINC000655813283 566852045 /nfs/dbraw/zinc/85/20/45/566852045.db2.gz BLUBXLZMIYGGOJ-OAHLLOKOSA-N 0 1 391.265 3.206 10 0 GGAEMN CSCCCN(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000543113055 566852138 /nfs/dbraw/zinc/85/21/38/566852138.db2.gz CAGGAOVTOYWCBO-UHFFFAOYSA-N 0 1 398.330 3.129 10 0 GGAEMN CSCCCN(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000543113055 566852141 /nfs/dbraw/zinc/85/21/41/566852141.db2.gz CAGGAOVTOYWCBO-UHFFFAOYSA-N 0 1 398.330 3.129 10 0 GGAEMN COCCS(=O)(=O)c1ccc(CNCc2cnc(CC(C)C)s2)cc1 ZINC000428533348 566852462 /nfs/dbraw/zinc/85/24/62/566852462.db2.gz DGUUWVYVMIKXDQ-UHFFFAOYSA-N 0 1 382.551 3.052 10 0 GGAEMN COCC1(CN[C@H](C)c2nnn(-c3cccc(Br)c3)c2C)CC1 ZINC000655818085 566852441 /nfs/dbraw/zinc/85/24/41/566852441.db2.gz QJYJCHNGTMXKIT-GFCCVEGCSA-N 0 1 379.302 3.415 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@@H]1F ZINC000679380316 566853698 /nfs/dbraw/zinc/85/36/98/566853698.db2.gz GMLFGBLGMCPYSS-MFKMUULPSA-N 0 1 396.264 3.124 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@@H]1F ZINC000679380316 566853704 /nfs/dbraw/zinc/85/37/04/566853704.db2.gz GMLFGBLGMCPYSS-MFKMUULPSA-N 0 1 396.264 3.124 10 0 GGAEMN CC[C@H](NCc1cn(-c2ccccc2Br)nn1)[C@H]1CCCCO1 ZINC000655856316 566854034 /nfs/dbraw/zinc/85/40/34/566854034.db2.gz MQUGHLFWSYSARU-DOTOQJQBSA-N 0 1 379.302 3.467 10 0 GGAEMN NC(=O)N[C@@H]1CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000470174899 566854289 /nfs/dbraw/zinc/85/42/89/566854289.db2.gz NQLDTHZNFNVASR-OAHLLOKOSA-N 0 1 390.281 3.484 10 0 GGAEMN COc1ccc(F)cc1CNC[C@@H](O)COc1cccc(Br)c1 ZINC000582356319 566855331 /nfs/dbraw/zinc/85/53/31/566855331.db2.gz NLJWYOAVJIHRFY-OAHLLOKOSA-N 0 1 384.245 3.126 10 0 GGAEMN O=S1(=O)C[C@H](CN[C@H]2CCSc3c(F)cccc32)Oc2ccccc21 ZINC000563126244 566855985 /nfs/dbraw/zinc/85/59/85/566855985.db2.gz RYIARLZEUICXAK-WFASDCNBSA-N 0 1 379.478 3.187 10 0 GGAEMN CN1CC[C@H](NC(=O)c2c(F)cncc2Br)[C@H]1c1ccccc1 ZINC000632159627 566856819 /nfs/dbraw/zinc/85/68/19/566856819.db2.gz JAVUZJJZALQDIC-GOEBONIOSA-N 0 1 378.245 3.158 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2cscc2C(F)(F)F)Oc2ccccc21 ZINC000563121793 566856896 /nfs/dbraw/zinc/85/68/96/566856896.db2.gz FXDQDKCONBLDNP-NSHDSACASA-N 0 1 377.409 3.091 10 0 GGAEMN CN1CC[C@@H](NC(=O)c2c(F)cncc2Br)[C@@H]1c1ccccc1 ZINC000632159629 566856872 /nfs/dbraw/zinc/85/68/72/566856872.db2.gz JAVUZJJZALQDIC-ZBFHGGJFSA-N 0 1 378.245 3.158 10 0 GGAEMN CN1CC[C@H](NC(=O)c2c(F)cncc2Br)[C@@H]1c1ccccc1 ZINC000632159628 566856991 /nfs/dbraw/zinc/85/69/91/566856991.db2.gz JAVUZJJZALQDIC-HOCLYGCPSA-N 0 1 378.245 3.158 10 0 GGAEMN CCOc1cc(C[N@H+]2CC[C@@H](C)[C@@H](C(=O)[O-])C2)cc(Br)c1OC ZINC000563131496 566858490 /nfs/dbraw/zinc/85/84/90/566858490.db2.gz LAKQKRHNHLXWCH-YPMHNXCESA-N 0 1 386.286 3.399 10 0 GGAEMN C[C@@H]([N-]S(=O)(=O)c1onc(C2CC2)c1Cl)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000632197027 566860207 /nfs/dbraw/zinc/86/02/07/566860207.db2.gz KJBKQMXINYFZPE-DGCLKSJQSA-N 0 1 387.933 3.137 10 0 GGAEMN CCc1cnc(CCNCc2cn(-c3ccccc3Br)nn2)s1 ZINC000582455769 566863454 /nfs/dbraw/zinc/86/34/54/566863454.db2.gz KZPGPDNATIQLEL-UHFFFAOYSA-N 0 1 392.326 3.381 10 0 GGAEMN CCC[C@H](C)[C@H](CO)NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000563219730 566865225 /nfs/dbraw/zinc/86/52/25/566865225.db2.gz WKIORTQYVZCILN-GUYCJALGSA-N 0 1 382.551 3.100 10 0 GGAEMN CCC[C@@H](C)[C@@H](CO)NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000563219728 566865602 /nfs/dbraw/zinc/86/56/02/566865602.db2.gz WKIORTQYVZCILN-CXAGYDPISA-N 0 1 382.551 3.100 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCC[C@@H](OC(F)F)C1)c1ccc(Cl)cc1 ZINC000679698075 566868054 /nfs/dbraw/zinc/86/80/54/566868054.db2.gz DSVQTGLBGQHCIR-CABCVRRESA-N 0 1 375.847 3.356 10 0 GGAEMN O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)c1csc(=NC2CC2)[nH]1 ZINC000543314204 566870416 /nfs/dbraw/zinc/87/04/16/566870416.db2.gz AMRLJMXKXZKAOW-GFCCVEGCSA-N 0 1 377.338 3.451 10 0 GGAEMN COc1c(O)cccc1CN[C@@H]1CCO[C@H]1c1cncc(Br)c1 ZINC000582532209 566872268 /nfs/dbraw/zinc/87/22/68/566872268.db2.gz HGSHPGZDUXEBRY-ZBFHGGJFSA-N 0 1 379.254 3.178 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)n1 ZINC000490767415 566878181 /nfs/dbraw/zinc/87/81/81/566878181.db2.gz IABYANMKZZKXBR-UHFFFAOYSA-N 0 1 377.754 3.072 10 0 GGAEMN Cc1ccc(CN(C)C(=O)c2c[nH]c3ccc(Br)cc3c2=O)o1 ZINC000543417150 566879988 /nfs/dbraw/zinc/87/99/88/566879988.db2.gz NTTSETXULOVFAM-UHFFFAOYSA-N 0 1 375.222 3.464 10 0 GGAEMN O=S1(=O)CCCC[C@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000543427588 566880421 /nfs/dbraw/zinc/88/04/21/566880421.db2.gz PKBOOEPQPHGAMD-DZGCQCFKSA-N 0 1 388.327 3.220 10 0 GGAEMN O=S1(=O)CCCC[C@@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000543427589 566880734 /nfs/dbraw/zinc/88/07/34/566880734.db2.gz PKBOOEPQPHGAMD-HIFRSBDPSA-N 0 1 388.327 3.220 10 0 GGAEMN CN(C(=O)CSCc1ccc(Br)cc1)[C@@H]1CN2CCC1CC2 ZINC000518432057 566882968 /nfs/dbraw/zinc/88/29/68/566882968.db2.gz JITRLWGDIINNDX-MRXNPFEDSA-N 0 1 383.355 3.235 10 0 GGAEMN C[C@@H](COc1ccc2cc(Br)ccc2c1)NCc1cn(C)nn1 ZINC000679993662 566885205 /nfs/dbraw/zinc/88/52/05/566885205.db2.gz NBMXJLXCOFSJNY-LBPRGKRZSA-N 0 1 375.270 3.288 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)N2CCc3cccc(Br)c3C2)n[nH]1 ZINC000518481570 566885733 /nfs/dbraw/zinc/88/57/33/566885733.db2.gz IELHIRYVOLZKOM-UHFFFAOYSA-N 0 1 392.301 3.133 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000543483128 566885857 /nfs/dbraw/zinc/88/58/57/566885857.db2.gz IGOADJNFPZBSDI-NVXWUHKLSA-N 0 1 397.357 3.136 10 0 GGAEMN CS(=O)(=O)CC[C@@H]1CCCCN1CCc1cccc(OC(F)(F)F)c1 ZINC000428859726 566886851 /nfs/dbraw/zinc/88/68/51/566886851.db2.gz DAPBASZEUXIZIL-HNNXBMFYSA-N 0 1 379.444 3.417 10 0 GGAEMN CC(C)c1nc(S(=O)(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)c[nH]1 ZINC000680095367 566891713 /nfs/dbraw/zinc/89/17/13/566891713.db2.gz QHPBTEPUVOAETL-GFCCVEGCSA-N 0 1 383.342 3.393 10 0 GGAEMN COC(=O)C[C@](C)(NCc1n[nH]c(C(C)C)n1)c1ccc(Br)cc1 ZINC000428941624 566891988 /nfs/dbraw/zinc/89/19/88/566891988.db2.gz JRXNWIXIDSAANQ-KRWDZBQOSA-N 0 1 395.301 3.259 10 0 GGAEMN C[C@H](Oc1cccc(CO)c1)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000491064964 566892224 /nfs/dbraw/zinc/89/22/24/566892224.db2.gz ZRKDYTSFULBUSV-JTQLQIEISA-N 0 1 390.237 3.224 10 0 GGAEMN COc1ccc([C@@H](NCc2ccc(S(=O)(=O)N(C)C)s2)C(C)C)cc1 ZINC000582803293 566894871 /nfs/dbraw/zinc/89/48/71/566894871.db2.gz WDFIEMYYBIJUCT-SFHVURJKSA-N 0 1 382.551 3.494 10 0 GGAEMN O=C(Cc1n[nH]c2ccccc21)Nc1cc(I)ccc1O ZINC000611156714 566894778 /nfs/dbraw/zinc/89/47/78/566894778.db2.gz PTKYOPOEXBZQIK-UHFFFAOYSA-N 0 1 393.184 3.054 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCCN2[C@@H](C)CCC[C@@H]2C)c(Br)c1 ZINC000518622350 566897540 /nfs/dbraw/zinc/89/75/40/566897540.db2.gz OFUNCEDHUKZWMS-KBPBESRZSA-N 0 1 389.359 3.299 10 0 GGAEMN CN(C)[C@@H](CN1C(=O)N[C@H](Cc2cccc(Cl)c2)C1=O)c1cccs1 ZINC000518742395 566901169 /nfs/dbraw/zinc/90/11/69/566901169.db2.gz UMEZNCYGSKLPSS-CABCVRRESA-N 0 1 377.897 3.167 10 0 GGAEMN COc1cc(NC(=O)NC[C@H](c2cccs2)N(C)C)ncc1Br ZINC000680367940 566903784 /nfs/dbraw/zinc/90/37/84/566903784.db2.gz CSURBARNFXVRBR-LLVKDONJSA-N 0 1 399.314 3.339 10 0 GGAEMN C[C@H](NC(=O)CN1CCC[C@@]2(CCOC2)C1)c1ccc(Br)cc1 ZINC000451907579 566904078 /nfs/dbraw/zinc/90/40/78/566904078.db2.gz XIDZPEXOSMVDJI-KBXCAEBGSA-N 0 1 381.314 3.129 10 0 GGAEMN CN(Cc1cccc2c(Br)cccc12)C[C@H]1CCS(=O)(=O)C1 ZINC000429045521 566904162 /nfs/dbraw/zinc/90/41/62/566904162.db2.gz JTVKNRWEGXPIFG-CYBMUJFWSA-N 0 1 382.323 3.469 10 0 GGAEMN CC1(C)C[C@H]1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000491344316 566904791 /nfs/dbraw/zinc/90/47/91/566904791.db2.gz YYRIYUBWUURRDO-NSHDSACASA-N 0 1 378.274 3.080 10 0 GGAEMN CC1(C)C[C@H]1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000491344316 566904795 /nfs/dbraw/zinc/90/47/95/566904795.db2.gz YYRIYUBWUURRDO-NSHDSACASA-N 0 1 378.274 3.080 10 0 GGAEMN CC1(C)C[C@@H]1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000491344315 566905016 /nfs/dbraw/zinc/90/50/16/566905016.db2.gz YYRIYUBWUURRDO-LLVKDONJSA-N 0 1 378.274 3.080 10 0 GGAEMN CC1(C)C[C@@H]1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000491344315 566905021 /nfs/dbraw/zinc/90/50/21/566905021.db2.gz YYRIYUBWUURRDO-LLVKDONJSA-N 0 1 378.274 3.080 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)CN(C)[C@@H]1CCSC1 ZINC000470827232 566908113 /nfs/dbraw/zinc/90/81/13/566908113.db2.gz MLYLCIQOUOCQLM-DGCLKSJQSA-N 0 1 387.343 3.072 10 0 GGAEMN C[C@H](NCC(=O)N1CCC[C@@H](C(F)(F)F)C1)[C@@H]1OCCc2sccc21 ZINC000429120732 566910039 /nfs/dbraw/zinc/91/00/39/566910039.db2.gz IHSMDALHSSHIRX-OZVIIMIRSA-N 0 1 376.444 3.141 10 0 GGAEMN O=C(COc1ccc2cc(Br)ccc2c1)N1CCN2CCC1CC2 ZINC000470853294 566910473 /nfs/dbraw/zinc/91/04/73/566910473.db2.gz ARXJPZYMZVISOP-UHFFFAOYSA-N 0 1 389.293 3.288 10 0 GGAEMN CCc1nc([C@H](C)S(=O)(=O)c2nccn2-c2cccc(Cl)c2C)n[nH]1 ZINC000656555554 566915743 /nfs/dbraw/zinc/91/57/43/566915743.db2.gz GUZMPDQVIKFTAI-NSHDSACASA-N 0 1 379.873 3.050 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)[C@H]1Cc2cc(Br)ccc2O1 ZINC000470958312 566919111 /nfs/dbraw/zinc/91/91/11/566919111.db2.gz BSMXHTGPINGWSX-OAHLLOKOSA-N 0 1 385.221 3.176 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000543908150 566921212 /nfs/dbraw/zinc/92/12/12/566921212.db2.gz DYTHMISOWNWDIE-ZJWNCGCPSA-N 0 1 378.460 3.122 10 0 GGAEMN C[C@H]1COCC[C@H]1c1nc(-c2nc(-c3cccc(Br)c3)n[nH]2)no1 ZINC000519129802 566921490 /nfs/dbraw/zinc/92/14/90/566921490.db2.gz NYMHBOYUTMTODV-JOYOIKCWSA-N 0 1 390.241 3.424 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCOCC2(CC2)C1 ZINC000543950616 566924586 /nfs/dbraw/zinc/92/45/86/566924586.db2.gz WCHJHWGHUIWXIR-UHFFFAOYSA-N 0 1 376.254 3.092 10 0 GGAEMN CN(CC(=O)Nc1ccc(F)c(Cl)c1)C1CCN(CC(F)(F)F)CC1 ZINC000452027557 566925065 /nfs/dbraw/zinc/92/50/65/566925065.db2.gz AHXWNTICTAWPMH-UHFFFAOYSA-N 0 1 381.801 3.376 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)Nc2ccc3c(c2)CCOC3)cc1OC ZINC000656643311 566929490 /nfs/dbraw/zinc/92/94/90/566929490.db2.gz BOOKGJCKICRGAF-UHFFFAOYSA-N 0 1 383.853 3.231 10 0 GGAEMN COc1ccc(Br)c(S(=O)(=O)Nc2ccc3c(c2)CCOC3)c1 ZINC000656647706 566930561 /nfs/dbraw/zinc/93/05/61/566930561.db2.gz YRQLLCNCXBEENN-UHFFFAOYSA-N 0 1 398.278 3.331 10 0 GGAEMN CN(CCCN(C)C(=O)c1c(F)cncc1Br)Cc1ccco1 ZINC000633057161 566932618 /nfs/dbraw/zinc/93/26/18/566932618.db2.gz AUXYHYOBSZWCJF-UHFFFAOYSA-N 0 1 384.249 3.170 10 0 GGAEMN O=C(Nc1ccc(Br)c(C2CC2)n1)N[C@H]1CCc2nc[nH]c2C1 ZINC000519325311 566932884 /nfs/dbraw/zinc/93/28/84/566932884.db2.gz AKYLBSGCPLGATP-JTQLQIEISA-N 0 1 376.258 3.124 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)sc1Br ZINC000583254304 566933611 /nfs/dbraw/zinc/93/36/11/566933611.db2.gz DPURVDQPBDIEMU-GHMZBOCLSA-N 0 1 391.287 3.188 10 0 GGAEMN NC(=O)[C@@H](NC[C@@H]1C[C@H](c2ccccc2)CO1)c1ccc(Br)cc1 ZINC000656685611 566933778 /nfs/dbraw/zinc/93/37/78/566933778.db2.gz VTWPYLLUKMEGTN-SZMVWBNQSA-N 0 1 389.293 3.138 10 0 GGAEMN C[C@H]1[C@H](NC(=O)c2c(F)cncc2Br)CCN1Cc1ccccc1 ZINC000633096831 566934070 /nfs/dbraw/zinc/93/40/70/566934070.db2.gz MDNIENXSFOXQAP-BLLLJJGKSA-N 0 1 392.272 3.376 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)n[nH]1 ZINC000633130308 566935524 /nfs/dbraw/zinc/93/55/24/566935524.db2.gz HYINXIQLWNJZBR-ZNXFUKJZSA-N 0 1 389.297 3.049 10 0 GGAEMN O[C@H](CNCc1cnc(C(F)(F)F)nc1)COc1ccc(Cl)cc1Cl ZINC000656705298 566935727 /nfs/dbraw/zinc/93/57/27/566935727.db2.gz ODFPMOXKBPOCRT-LLVKDONJSA-N 0 1 396.196 3.332 10 0 GGAEMN CC(C)N1CC[C@H](N(C)S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000452102904 566936713 /nfs/dbraw/zinc/93/67/13/566936713.db2.gz JMEBCAHVJRQFLT-NSHDSACASA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1CN(CCO)CCN1Cc1csc(-c2ccc(Br)cc2)n1 ZINC000452110666 566936751 /nfs/dbraw/zinc/93/67/51/566936751.db2.gz AGPMHJMUKHVLMD-ZDUSSCGKSA-N 0 1 396.354 3.071 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H]1[C@@H]1CCCOC1 ZINC000519406358 566936924 /nfs/dbraw/zinc/93/69/24/566936924.db2.gz UAMDUVYHROYOFC-ABAIWWIYSA-N 0 1 378.270 3.357 10 0 GGAEMN CC(C)N1CC[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000452102903 566937404 /nfs/dbraw/zinc/93/74/04/566937404.db2.gz JMEBCAHVJRQFLT-LLVKDONJSA-N 0 1 395.750 3.206 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H]1[C@H]1CCCOC1 ZINC000519406360 566937613 /nfs/dbraw/zinc/93/76/13/566937613.db2.gz UAMDUVYHROYOFC-NHYWBVRUSA-N 0 1 378.270 3.357 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccccc2-c2nnnn2C(C)C)c(C)s1 ZINC000544096687 566937820 /nfs/dbraw/zinc/93/78/20/566937820.db2.gz PCXKFYAHNVZMCM-UHFFFAOYSA-N 0 1 377.495 3.400 10 0 GGAEMN CN(CCCNC(=O)C1CCC1)Cc1nc2ccc(Br)cc2[nH]1 ZINC000429548797 566937806 /nfs/dbraw/zinc/93/78/06/566937806.db2.gz QWLJHHAAGMRAII-UHFFFAOYSA-N 0 1 379.302 3.064 10 0 GGAEMN CC(C)[C@H](NCC(F)(F)F)C(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C ZINC000611799125 566939782 /nfs/dbraw/zinc/93/97/82/566939782.db2.gz KPCLSNNCLSHFRS-CABCVRRESA-N 0 1 379.854 3.235 10 0 GGAEMN CC[C@@H](C)N1CCN(C(=O)Nc2cnc3c(Br)cccn23)CC1 ZINC000564077318 566941814 /nfs/dbraw/zinc/94/18/14/566941814.db2.gz IPGSPNYZBBWVFT-GFCCVEGCSA-N 0 1 380.290 3.045 10 0 GGAEMN Nc1nc(-n2cccn2)cc(N2CCC[C@H]2c2ccc(Br)s2)n1 ZINC000544141916 566943992 /nfs/dbraw/zinc/94/39/92/566943992.db2.gz LGIZMRIICGOLHD-JTQLQIEISA-N 0 1 391.298 3.240 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1 ZINC000564093289 566945768 /nfs/dbraw/zinc/94/57/68/566945768.db2.gz JGXGLNNKEJUBRO-UHFFFAOYSA-N 0 1 383.901 3.089 10 0 GGAEMN C[C@@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NCc1n[nH]c(C2CC2)n1 ZINC000633258657 566946321 /nfs/dbraw/zinc/94/63/21/566946321.db2.gz GPJLPASCQXNDSZ-DYVFJYSZSA-N 0 1 375.270 3.039 10 0 GGAEMN C[C@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NCc1n[nH]c(C2CC2)n1 ZINC000633258656 566946716 /nfs/dbraw/zinc/94/67/16/566946716.db2.gz GPJLPASCQXNDSZ-CXAGYDPISA-N 0 1 375.270 3.039 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H](C(F)(F)F)C[N@H+](CCOc2ccccc2Br)C1 ZINC000656756435 566946626 /nfs/dbraw/zinc/94/66/26/566946626.db2.gz CPCBOVQFIBUXTD-MNOVXSKESA-N 0 1 396.203 3.413 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](CCOc2ccccc2Br)C1 ZINC000656756435 566946632 /nfs/dbraw/zinc/94/66/32/566946632.db2.gz CPCBOVQFIBUXTD-MNOVXSKESA-N 0 1 396.203 3.413 10 0 GGAEMN Brc1ccc2c(c1)C=C(CN1CC[C@@H](Nc3ncccn3)C1)CO2 ZINC000583382303 566946668 /nfs/dbraw/zinc/94/66/68/566946668.db2.gz ULXMHCQWESNBCI-MRXNPFEDSA-N 0 1 387.281 3.201 10 0 GGAEMN C[C@@]1(c2cccc(Br)c2)C[C@H]1C(=O)NCc1n[nH]c(C2CC2)n1 ZINC000633258658 566947099 /nfs/dbraw/zinc/94/70/99/566947099.db2.gz GPJLPASCQXNDSZ-GUYCJALGSA-N 0 1 375.270 3.039 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H](C(F)(F)F)C[N@H+](Cc2cc3c(cc2Cl)OCCO3)C1 ZINC000656758408 566947824 /nfs/dbraw/zinc/94/78/24/566947824.db2.gz XSFBPDJTDDEUEZ-MNOVXSKESA-N 0 1 379.762 3.196 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H](C(F)(F)F)C[N@@H+](Cc2cc3c(cc2Cl)OCCO3)C1 ZINC000656758408 566947827 /nfs/dbraw/zinc/94/78/27/566947827.db2.gz XSFBPDJTDDEUEZ-MNOVXSKESA-N 0 1 379.762 3.196 10 0 GGAEMN CO[C@@H](C[N@H+]1Cc2cccc(Br)c2C[C@@H]1C(=O)[O-])C1CCCC1 ZINC000656757008 566947864 /nfs/dbraw/zinc/94/78/64/566947864.db2.gz QKCISZICUYMPAD-SJORKVTESA-N 0 1 382.298 3.466 10 0 GGAEMN CO[C@H](C[N@H+]1Cc2cccc(Br)c2C[C@@H]1C(=O)[O-])C1CCCC1 ZINC000656757005 566948661 /nfs/dbraw/zinc/94/86/61/566948661.db2.gz QKCISZICUYMPAD-IAGOWNOFSA-N 0 1 382.298 3.466 10 0 GGAEMN CS(=O)(=O)N1CC[C@H](CN2CCC(c3c(Cl)cccc3Cl)CC2)C1 ZINC000564151473 566950189 /nfs/dbraw/zinc/95/01/89/566950189.db2.gz GWLKHYKJLOIJMF-CYBMUJFWSA-N 0 1 391.364 3.454 10 0 GGAEMN C[C@@H]1C[C@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CN1C1CC1 ZINC000612103528 566952718 /nfs/dbraw/zinc/95/27/18/566952718.db2.gz IUBIEMNGUQWVLZ-RQJHMYQMSA-N 0 1 395.194 3.361 10 0 GGAEMN Cn1c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(=O)[O-])nc2ccc(Br)cc21 ZINC000519648467 566955102 /nfs/dbraw/zinc/95/51/02/566955102.db2.gz WGLRUAYGPPOEDG-KANYHAFZSA-N 0 1 378.270 3.021 10 0 GGAEMN COc1cc(Br)c(CNCCc2cnc(C3CC3)nc2)cc1O ZINC000493704687 566955276 /nfs/dbraw/zinc/95/52/76/566955276.db2.gz FSKSLZLUMAAPCL-UHFFFAOYSA-N 0 1 378.270 3.163 10 0 GGAEMN COCCN1CCC[C@@H](NC(=O)c2coc3c2cc(Br)cc3C)C1 ZINC000681179887 566957085 /nfs/dbraw/zinc/95/70/85/566957085.db2.gz UGKOSIADHZIARE-CQSZACIVSA-N 0 1 395.297 3.344 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000656861802 566957253 /nfs/dbraw/zinc/95/72/53/566957253.db2.gz AZFDUNCPWNEUEV-STQMWFEESA-N 0 1 384.489 3.393 10 0 GGAEMN O=C(N[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N[C@@H]1CCCc2cn[nH]c21 ZINC000633408349 566957333 /nfs/dbraw/zinc/95/73/33/566957333.db2.gz MUWLZTWHJOOVCT-JJAZEVLHSA-N 0 1 387.281 3.187 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000656863377 566959128 /nfs/dbraw/zinc/95/91/28/566959128.db2.gz QQMQKJOOHIEWCK-HOCLYGCPSA-N 0 1 378.460 3.331 10 0 GGAEMN C[C@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C[C@H](C)S1 ZINC000544391299 566959658 /nfs/dbraw/zinc/95/96/58/566959658.db2.gz STSZRALYDBSPJX-UWVGGRQHSA-N 0 1 381.295 3.257 10 0 GGAEMN C[C@@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C[C@H](C)S1 ZINC000544391296 566959696 /nfs/dbraw/zinc/95/96/96/566959696.db2.gz STSZRALYDBSPJX-AOOOYVTPSA-N 0 1 381.295 3.257 10 0 GGAEMN COc1ccc(CN2CCC[C@@H](C(=O)N3CCCC3)C2)c(Br)c1 ZINC000583526297 566960209 /nfs/dbraw/zinc/96/02/09/566960209.db2.gz FPPAXDGXQZIMSK-OAHLLOKOSA-N 0 1 381.314 3.292 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N(CCN(C)C)Cc1ccccc1F ZINC000656880580 566964065 /nfs/dbraw/zinc/96/40/65/566964065.db2.gz LFQUYHYZZNPUTR-CYBMUJFWSA-N 0 1 384.439 3.108 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000656883841 566964729 /nfs/dbraw/zinc/96/47/29/566964729.db2.gz SIYRVVYVWWEJTK-IJEWVQPXSA-N 0 1 378.460 3.330 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 ZINC000656883839 566964906 /nfs/dbraw/zinc/96/49/06/566964906.db2.gz SIYRVVYVWWEJTK-FMKPAKJESA-N 0 1 378.460 3.330 10 0 GGAEMN N=c1[nH]oc2cc(CNC(=O)[C@@H]3[C@@H]4Cc5cc(Br)ccc5[C@@H]43)ccc12 ZINC000633466382 566965283 /nfs/dbraw/zinc/96/52/83/566965283.db2.gz UDBFMKSMWOSIJK-HYVNUMGLSA-N 0 1 398.260 3.205 10 0 GGAEMN O=C(c1ccc(Br)cc1F)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633523913 566966241 /nfs/dbraw/zinc/96/62/41/566966241.db2.gz AMKKZVHMELGWNJ-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN O=C(CSc1ccccc1Cl)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633524277 566966862 /nfs/dbraw/zinc/96/68/62/566966862.db2.gz HGZOWMYSXOIJAY-UHFFFAOYSA-N 0 1 377.897 3.246 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000656889897 566967519 /nfs/dbraw/zinc/96/75/19/566967519.db2.gz PGPWQNGRXKTCDE-KGLIPLIRSA-N 0 1 398.516 3.468 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000656889899 566968027 /nfs/dbraw/zinc/96/80/27/566968027.db2.gz PGPWQNGRXKTCDE-ZIAGYGMSSA-N 0 1 398.516 3.468 10 0 GGAEMN Cc1c(Br)scc1C(=O)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633527579 566969336 /nfs/dbraw/zinc/96/93/36/566969336.db2.gz YOTORABRDQVBRF-UHFFFAOYSA-N 0 1 396.310 3.246 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(F)c(F)cc1Br ZINC000544580641 566969947 /nfs/dbraw/zinc/96/99/47/566969947.db2.gz CENQNZXSVYQDIR-AWEZNQCLSA-N 0 1 393.191 3.365 10 0 GGAEMN CCC[C@H](C)[C@@H](CO)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000519829695 566972708 /nfs/dbraw/zinc/97/27/08/566972708.db2.gz QFXSGAXFXVMXRR-IMSIIYSGSA-N 0 1 383.341 3.089 10 0 GGAEMN CSc1cc(C(=O)NC[C@@H]2CCCCN2CCO)c(Cl)cc1Cl ZINC000452387968 566972726 /nfs/dbraw/zinc/97/27/26/566972726.db2.gz IOMGUPWOCPKMLO-NSHDSACASA-N 0 1 377.337 3.292 10 0 GGAEMN COC[C@H](Cc1ccccc1)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000471720317 566974066 /nfs/dbraw/zinc/97/40/66/566974066.db2.gz IINJRLODYVPDJD-AWEZNQCLSA-N 0 1 388.265 3.313 10 0 GGAEMN O=C(NCCN1CC=CCC1)Nc1nc2c(cccc2Br)s1 ZINC000494170481 566974373 /nfs/dbraw/zinc/97/43/73/566974373.db2.gz KIKWOXDGVTVJDP-UHFFFAOYSA-N 0 1 381.299 3.442 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)c[nH]2)C[C@H]1C(=O)[O-] ZINC000564453056 566975761 /nfs/dbraw/zinc/97/57/61/566975761.db2.gz LWXFJBMHVGQUAH-SMDDNHRTSA-N 0 1 378.270 3.382 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)c[nH]2)C[C@@H]1C(=O)[O-] ZINC000564453046 566976764 /nfs/dbraw/zinc/97/67/64/566976764.db2.gz LWXFJBMHVGQUAH-RISCZKNCSA-N 0 1 378.270 3.382 10 0 GGAEMN CC(C)N1C(=O)C[C@H](NC[C@H](O)C(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000494237384 566976999 /nfs/dbraw/zinc/97/69/99/566976999.db2.gz KMPNIPAXWHFKNR-KCQAQPDRSA-N 0 1 382.785 3.042 10 0 GGAEMN COC(=O)c1cnccc1NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000430046030 566978365 /nfs/dbraw/zinc/97/83/65/566978365.db2.gz MVBQMVFGHUDNBM-UHFFFAOYSA-N 0 1 395.651 3.051 10 0 GGAEMN C[C@@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000633682987 566978882 /nfs/dbraw/zinc/97/88/82/566978882.db2.gz WPVFVRGKXONBGZ-MWLCHTKSSA-N 0 1 381.249 3.229 10 0 GGAEMN CN1CCC[C@@H](NC(=O)Nc2nnc(-c3cccc(Br)c3)s2)C1 ZINC000681471873 566979563 /nfs/dbraw/zinc/97/95/63/566979563.db2.gz MAJNQJRROSGEGG-GFCCVEGCSA-N 0 1 396.314 3.183 10 0 GGAEMN C/C(=C/c1cccc(C(F)(F)F)c1)CN(C)[C@H]1CCN(S(C)(=O)=O)C1 ZINC000430100310 566981385 /nfs/dbraw/zinc/98/13/85/566981385.db2.gz ASLQCIZPZSNBIW-OVHOFWQVSA-N 0 1 376.444 3.074 10 0 GGAEMN CCOc1ccc(S(=O)(=O)Nc2ccc(OC)nc2C(F)(F)F)cc1 ZINC000681548520 566984197 /nfs/dbraw/zinc/98/41/97/566984197.db2.gz LCMCNTNEXCGYIU-UHFFFAOYSA-N 0 1 376.356 3.309 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000656960923 566984997 /nfs/dbraw/zinc/98/49/97/566984997.db2.gz QJZNKSHKXZRLOF-IJEWVQPXSA-N 0 1 378.460 3.015 10 0 GGAEMN COC(=O)c1cc(F)c(C)c(S(=O)(=O)Nc2ccc3scnc3c2)c1 ZINC000471920853 566986773 /nfs/dbraw/zinc/98/67/73/566986773.db2.gz BYKVNXJIBSAWNE-UHFFFAOYSA-N 0 1 380.422 3.331 10 0 GGAEMN CCCSc1nc(=NC(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)s[n-]1 ZINC000471944070 566988440 /nfs/dbraw/zinc/98/84/40/566988440.db2.gz PYBREBMLNAYZBP-KBPBESRZSA-N 0 1 377.539 3.029 10 0 GGAEMN C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C[C@H]1C(=O)[O-] ZINC000520229628 566989438 /nfs/dbraw/zinc/98/94/38/566989438.db2.gz ZNKFKUQQEMJORD-GXSJLCMTSA-N 0 1 378.778 3.340 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@H](CO)Cc1ccc(Br)cc1 ZINC000430140439 566989931 /nfs/dbraw/zinc/98/99/31/566989931.db2.gz UDGAFSVJHOIKPT-CQSZACIVSA-N 0 1 394.313 3.185 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2ccc(OC)cc2Br)[C@H]1n1cccn1 ZINC000564588297 566991294 /nfs/dbraw/zinc/99/12/94/566991294.db2.gz BLNMJEIYIGXPIN-GVDBMIGSSA-N 0 1 380.286 3.163 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(OC)cc2Br)[C@H]1n1cccn1 ZINC000564588295 566991383 /nfs/dbraw/zinc/99/13/83/566991383.db2.gz BLNMJEIYIGXPIN-BRWVUGGUSA-N 0 1 380.286 3.163 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@@H](CO)Cc1cccc(Br)c1 ZINC000430148471 566992218 /nfs/dbraw/zinc/99/22/18/566992218.db2.gz SFWPWAKARAGLKN-AWEZNQCLSA-N 0 1 394.313 3.185 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2ccc(Cl)cc2F)c(Cl)c1 ZINC000564622539 566992274 /nfs/dbraw/zinc/99/22/74/566992274.db2.gz GROYCQRXGZRJTC-UHFFFAOYSA-N 0 1 379.196 3.115 10 0 GGAEMN NC(=O)[C@H](NC[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(Br)cc1 ZINC000564608463 566992612 /nfs/dbraw/zinc/99/26/12/566992612.db2.gz MJUFZZRLSAROTC-KZNAEPCWSA-N 0 1 389.293 3.485 10 0 GGAEMN Cc1ccc(CCC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)o1 ZINC000472000244 566993231 /nfs/dbraw/zinc/99/32/31/566993231.db2.gz CUQODTOLKYLJMX-UHFFFAOYSA-N 0 1 389.253 3.385 10 0 GGAEMN Cc1ccc(CCC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)o1 ZINC000472000244 566993238 /nfs/dbraw/zinc/99/32/38/566993238.db2.gz CUQODTOLKYLJMX-UHFFFAOYSA-N 0 1 389.253 3.385 10 0 GGAEMN COc1ccccc1OCCNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000520333871 566997923 /nfs/dbraw/zinc/99/79/23/566997923.db2.gz HTXCUJRIPUKFNW-UHFFFAOYSA-N 0 1 390.237 3.143 10 0 GGAEMN C[C@H](Sc1ccc(Br)cc1)C(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000520372173 567000626 /nfs/dbraw/zinc/00/06/26/567000626.db2.gz DSJICVLFMWKDTM-BLLLJJGKSA-N 0 1 383.355 3.482 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1c(C)n[nH]c1C(F)(F)F ZINC000681747059 567003143 /nfs/dbraw/zinc/00/31/43/567003143.db2.gz CPGMSNNLPVYZKL-UHFFFAOYSA-N 0 1 392.175 3.438 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)N[C@H](C)c1n[nH]c(C(C)C)n1 ZINC000430276847 567004175 /nfs/dbraw/zinc/00/41/75/567004175.db2.gz MRVSQPXFAZZHHY-SNVBAGLBSA-N 0 1 396.289 3.260 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2cccc(C[S@@](C)=O)c2)c2ccccc2n1C ZINC000564742516 567004251 /nfs/dbraw/zinc/00/42/51/567004251.db2.gz AZGVHCXOCYULEB-XMMPIXPASA-N 0 1 376.503 3.166 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC(Cc3nccs3)CC2)c1Br ZINC000633950438 567004439 /nfs/dbraw/zinc/00/44/39/567004439.db2.gz SGJDEZNXSMHNCB-UHFFFAOYSA-N 0 1 383.315 3.286 10 0 GGAEMN CC(C)(C)N1CC[C@H](NS(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000657062724 567009115 /nfs/dbraw/zinc/00/91/15/567009115.db2.gz SEUXJFCNEJZDJZ-JTQLQIEISA-N 0 1 395.750 3.254 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1cc(Cl)ccc1Br ZINC000633991433 567009156 /nfs/dbraw/zinc/00/91/56/567009156.db2.gz LLCULYDADVLRFK-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000612987735 567009655 /nfs/dbraw/zinc/00/96/55/567009655.db2.gz NMBKZMAAFIIELW-QWRGUYRKSA-N 0 1 380.261 3.164 10 0 GGAEMN Cc1sc(Br)c(C(=O)NCc2n[nH]c(C3CCOCC3)n2)c1C ZINC000634008573 567009875 /nfs/dbraw/zinc/00/98/75/567009875.db2.gz VOZZXSXVRINEQO-UHFFFAOYSA-N 0 1 399.314 3.070 10 0 GGAEMN Cc1cc(Br)cc(C(=O)NCc2n[nH]c(C3CCOCC3)n2)c1C ZINC000634003493 567010413 /nfs/dbraw/zinc/01/04/13/567010413.db2.gz CWAPULQYMJVCHF-UHFFFAOYSA-N 0 1 393.285 3.008 10 0 GGAEMN C[C@@H]1CN(C)C[C@@H](C)N1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000613008561 567010660 /nfs/dbraw/zinc/01/06/60/567010660.db2.gz MHFLOOKOLMPAGW-ZIAGYGMSSA-N 0 1 380.330 3.214 10 0 GGAEMN C[C@H]1CN(C)C[C@H](C)N1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000613008558 567010929 /nfs/dbraw/zinc/01/09/29/567010929.db2.gz MHFLOOKOLMPAGW-KBPBESRZSA-N 0 1 380.330 3.214 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCc2ccccc2C1 ZINC000520566763 567012026 /nfs/dbraw/zinc/01/20/26/567012026.db2.gz KAMVYBDOPIRJQK-UHFFFAOYSA-N 0 1 383.245 3.489 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)NCCc1cccc(Cl)c1Cl ZINC000494644247 567013170 /nfs/dbraw/zinc/01/31/70/567013170.db2.gz ZWAWWGLBVLRLSV-CQSZACIVSA-N 0 1 387.332 3.345 10 0 GGAEMN CC(C)Oc1cc(NC(=O)[C@@H]2CCCc3n[nH]nc32)ccc1Br ZINC000634057394 567013373 /nfs/dbraw/zinc/01/33/73/567013373.db2.gz KSTOFEXQFAMLKI-LLVKDONJSA-N 0 1 379.258 3.413 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@H](C)C(=O)Nc1ccccc1Br ZINC000494652861 567015266 /nfs/dbraw/zinc/01/52/66/567015266.db2.gz XTIVOCKFTYJUOQ-BXUZGUMPSA-N 0 1 383.311 3.469 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)c2cc(Br)cc(N3CCCC3)c2)n[nH]1 ZINC000613124770 567016493 /nfs/dbraw/zinc/01/64/93/567016493.db2.gz SWDCKGSXAYIQGV-NSHDSACASA-N 0 1 392.301 3.221 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1 ZINC000494684727 567016549 /nfs/dbraw/zinc/01/65/49/567016549.db2.gz GAEGLZOXBJFZNU-KRWDZBQOSA-N 0 1 381.563 3.451 10 0 GGAEMN Cc1c(Br)cncc1C(=O)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000613152888 567017512 /nfs/dbraw/zinc/01/75/12/567017512.db2.gz WWKKSZYPECZRBA-LBPRGKRZSA-N 0 1 390.285 3.168 10 0 GGAEMN O=S(=O)(c1cscn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 ZINC000584170400 567018681 /nfs/dbraw/zinc/01/86/81/567018681.db2.gz NVEQPDIQKQXCOM-UHFFFAOYSA-N 0 1 385.942 3.083 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCC(F)(Cc3ccc(Cl)cc3)CC2)[nH]1 ZINC000452817667 567019091 /nfs/dbraw/zinc/01/90/91/567019091.db2.gz MPWTXUQNCPVDFV-UHFFFAOYSA-N 0 1 382.892 3.432 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CCC(F)(Cc3ccc(Cl)cc3)CC2)n1 ZINC000452817667 567019102 /nfs/dbraw/zinc/01/91/02/567019102.db2.gz MPWTXUQNCPVDFV-UHFFFAOYSA-N 0 1 382.892 3.432 10 0 GGAEMN COC1CCC(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000681982077 567019352 /nfs/dbraw/zinc/01/93/52/567019352.db2.gz COBQRRUWNWUXEI-UHFFFAOYSA-N 0 1 393.285 3.056 10 0 GGAEMN COC1CCC(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000681982077 567019357 /nfs/dbraw/zinc/01/93/57/567019357.db2.gz COBQRRUWNWUXEI-UHFFFAOYSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@@H]1[C@@H](C)N(C(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1C ZINC000613226388 567022903 /nfs/dbraw/zinc/02/29/03/567022903.db2.gz MDEOVGHKIKRJEU-ZIAGYGMSSA-N 0 1 380.330 3.214 10 0 GGAEMN C[C@H]1[C@H](C)N(C(=O)c2cc(Br)cc(N3CCCC3)c2)CCN1C ZINC000613226385 567023328 /nfs/dbraw/zinc/02/33/28/567023328.db2.gz MDEOVGHKIKRJEU-KBPBESRZSA-N 0 1 380.330 3.214 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN[C@@H](C)c1nncn1C ZINC000494787050 567024053 /nfs/dbraw/zinc/02/40/53/567024053.db2.gz HWCKALUVBZIBEX-ZDUSSCGKSA-N 0 1 394.317 3.264 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613245296 567024316 /nfs/dbraw/zinc/02/43/16/567024316.db2.gz FUOYYGSHDPLFGO-ZUCKAHLUSA-N 0 1 392.297 3.170 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613245294 567024649 /nfs/dbraw/zinc/02/46/49/567024649.db2.gz FUOYYGSHDPLFGO-PPHDSNJXSA-N 0 1 392.297 3.170 10 0 GGAEMN C[C@H](O)[C@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccccc1F ZINC000564980099 567025693 /nfs/dbraw/zinc/02/56/93/567025693.db2.gz YQJBFHNVENMLJG-WRSAYESZSA-N 0 1 398.272 3.040 10 0 GGAEMN C[C@H](O)[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccccc1F ZINC000564980098 567025853 /nfs/dbraw/zinc/02/58/53/567025853.db2.gz YQJBFHNVENMLJG-WPKBUWHJSA-N 0 1 398.272 3.040 10 0 GGAEMN Cc1cc(C(=O)N(C)[C@@H]2CCCN(C)C2)nn1-c1ccc(Br)cc1 ZINC000430646234 567027834 /nfs/dbraw/zinc/02/78/34/567027834.db2.gz WEDLGXDHCSKFOR-MRXNPFEDSA-N 0 1 391.313 3.109 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)c1cccc2nn[nH]c21 ZINC000584268307 567027932 /nfs/dbraw/zinc/02/79/32/567027932.db2.gz YNDOLCGNOBDQOR-UHFFFAOYSA-N 0 1 395.282 3.071 10 0 GGAEMN Cc1cc(Cc2nnc(N3Cc4ccc(C)c(Br)c4C3)n2C)[nH]n1 ZINC000634316270 567029283 /nfs/dbraw/zinc/02/92/83/567029283.db2.gz MLMNWSQTHFBQOS-UHFFFAOYSA-N 0 1 387.285 3.029 10 0 GGAEMN C[C@@]1(CCNS(=O)(=O)c2cc(F)c(Br)cc2F)CC1(F)F ZINC000657160811 567029326 /nfs/dbraw/zinc/02/93/26/567029326.db2.gz WDYBOUPYLPOLGI-LLVKDONJSA-N 0 1 390.196 3.441 10 0 GGAEMN Cn1cc(C[C@H]2CCC[C@H]2NS(=O)(=O)c2c(Cl)ccc(F)c2F)cn1 ZINC000657180130 567033857 /nfs/dbraw/zinc/03/38/57/567033857.db2.gz ZTWYMTTTYCXCNA-BXUZGUMPSA-N 0 1 389.855 3.041 10 0 GGAEMN Cc1ccc(CN2CC[C@@H](NC(=O)c3c(F)cncc3Br)C2)cc1 ZINC000634459298 567034786 /nfs/dbraw/zinc/03/47/86/567034786.db2.gz RLBHAYKXJDDBLK-CQSZACIVSA-N 0 1 392.272 3.296 10 0 GGAEMN C[C@H](NCC(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(Cl)cc1 ZINC000613396372 567034637 /nfs/dbraw/zinc/03/46/37/567034637.db2.gz DPGCSKJAPOXQJN-HNNXBMFYSA-N 0 1 377.941 3.397 10 0 GGAEMN COC(=O)CC1(NCc2ccnc(-c3ccc(Br)cc3)n2)CC1 ZINC000565050841 567035215 /nfs/dbraw/zinc/03/52/15/567035215.db2.gz HZNTYJKMEFWYGU-UHFFFAOYSA-N 0 1 376.254 3.091 10 0 GGAEMN Cc1ccc(CN2CC[C@@H](NC(=O)c3nscc3Br)C2)cc1 ZINC000634459417 567035325 /nfs/dbraw/zinc/03/53/25/567035325.db2.gz UOORNIVMUZNOFT-CYBMUJFWSA-N 0 1 380.311 3.218 10 0 GGAEMN O[C@@H](COc1c(Cl)cccc1Cl)CN1CCC[C@H](c2ccncn2)C1 ZINC000613380584 567035266 /nfs/dbraw/zinc/03/52/66/567035266.db2.gz IORDOYXLTDVDLW-UONOGXRCSA-N 0 1 382.291 3.403 10 0 GGAEMN C[C@@H](NCC(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(Cl)cc1 ZINC000613396373 567035361 /nfs/dbraw/zinc/03/53/61/567035361.db2.gz DPGCSKJAPOXQJN-OAHLLOKOSA-N 0 1 377.941 3.397 10 0 GGAEMN CO[C@@H](CSc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCOC1 ZINC000657233016 567039531 /nfs/dbraw/zinc/03/95/31/567039531.db2.gz PRLAXTXKGGODQQ-AAEUAGOBSA-N 0 1 384.299 3.378 10 0 GGAEMN CO[C@@H](CSc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCOC1 ZINC000657233021 567039552 /nfs/dbraw/zinc/03/95/52/567039552.db2.gz PRLAXTXKGGODQQ-YPMHNXCESA-N 0 1 384.299 3.378 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(Br)cc3C)[nH]c2c1 ZINC000472592421 567040374 /nfs/dbraw/zinc/04/03/74/567040374.db2.gz UWNPEDBMNUKZNE-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN COC(=O)C1(NC(=O)c2n[nH]c3ccc(Br)cc32)CCCCCC1 ZINC000521108290 567042396 /nfs/dbraw/zinc/04/23/96/567042396.db2.gz XUJLKDPMTFQQJZ-UHFFFAOYSA-N 0 1 394.269 3.321 10 0 GGAEMN CCCN1C(=O)N=NC1SCc1c(Br)cccc1C(=O)OC ZINC000430986968 567043900 /nfs/dbraw/zinc/04/39/00/567043900.db2.gz FWSPXKFDSKGLEM-UHFFFAOYSA-N 0 1 386.271 3.235 10 0 GGAEMN C[C@H](C1CC1)n1nccc1NS(=O)(=O)c1cscc1Br ZINC000634656745 567044226 /nfs/dbraw/zinc/04/42/26/567044226.db2.gz DSWZYZMOMVJCSC-MRVPVSSYSA-N 0 1 376.301 3.479 10 0 GGAEMN Cc1nc(NS(=O)(=O)c2c(C(F)(F)F)cnn2C)c(Cl)cc1Cl ZINC000634657021 567044609 /nfs/dbraw/zinc/04/46/09/567044609.db2.gz RAOVNUYGVIGXCX-UHFFFAOYSA-N 0 1 389.186 3.250 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000613571375 567046048 /nfs/dbraw/zinc/04/60/48/567046048.db2.gz RVNKZZOSYLNCHM-GFCCVEGCSA-N 0 1 379.291 3.170 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000613571377 567046175 /nfs/dbraw/zinc/04/61/75/567046175.db2.gz RVNKZZOSYLNCHM-LBPRGKRZSA-N 0 1 379.291 3.170 10 0 GGAEMN CCCCn1cc(S(=O)(=O)Nc2nc(C)ccc2Br)c(C)n1 ZINC000634658941 567046995 /nfs/dbraw/zinc/04/69/95/567046995.db2.gz JEAHVXLDLNOHHW-UHFFFAOYSA-N 0 1 387.303 3.258 10 0 GGAEMN Cc1cnn(C)c1NS(=O)(=O)c1cc(Br)c(Cl)cc1C ZINC000634659071 567047123 /nfs/dbraw/zinc/04/71/23/567047123.db2.gz SZELGKBVFDEGFQ-UHFFFAOYSA-N 0 1 378.679 3.254 10 0 GGAEMN CCN1CCCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)CC1 ZINC000431025443 567047360 /nfs/dbraw/zinc/04/73/60/567047360.db2.gz SVCIDZWMDDKRKU-UHFFFAOYSA-N 0 1 391.313 3.111 10 0 GGAEMN COc1cc(OC)c(CCNCc2c(F)cncc2Br)c(OC)c1 ZINC000657355319 567050122 /nfs/dbraw/zinc/05/01/22/567050122.db2.gz IVFLUVLZAYAPOV-UHFFFAOYSA-N 0 1 399.260 3.341 10 0 GGAEMN O=C(CCCNCc1c(F)cncc1Br)N1CCc2ccccc21 ZINC000657357262 567050880 /nfs/dbraw/zinc/05/08/80/567050880.db2.gz UTWQSKCMQKRCCF-UHFFFAOYSA-N 0 1 392.272 3.442 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@H]1Cc2ccccc2CN1 ZINC000584531151 567050974 /nfs/dbraw/zinc/05/09/74/567050974.db2.gz VZORQWUMVODYBM-SJKOYZFVSA-N 0 1 389.293 3.349 10 0 GGAEMN O=C(C1CCC1)N(CCCNCc1c(F)cncc1Br)C1CC1 ZINC000657359455 567051308 /nfs/dbraw/zinc/05/13/08/567051308.db2.gz UUNOCIQXSPYPOB-UHFFFAOYSA-N 0 1 384.293 3.254 10 0 GGAEMN CCc1cc(N2CCC(NCc3c(F)cncc3Br)CC2)ncn1 ZINC000657386458 567052655 /nfs/dbraw/zinc/05/26/55/567052655.db2.gz BVARRLWLEUOXHS-UHFFFAOYSA-N 0 1 394.292 3.094 10 0 GGAEMN O[C@H](CN[C@H](c1ccsc1)c1ccc(Cl)cc1)CC1(O)CCOCC1 ZINC000634700929 567054233 /nfs/dbraw/zinc/05/42/33/567054233.db2.gz HRIPCVKTDNKCLQ-ROUUACIJSA-N 0 1 381.925 3.373 10 0 GGAEMN Cc1c(NCc2c(F)cncc2Br)cccc1N1CC[NH+]=C1[O-] ZINC000657452831 567057935 /nfs/dbraw/zinc/05/79/35/567057935.db2.gz ZYNLLBSIQWVORT-UHFFFAOYSA-N 0 1 379.233 3.433 10 0 GGAEMN Fc1cncc(Br)c1CNCCCn1cc(Br)cn1 ZINC000657466604 567058310 /nfs/dbraw/zinc/05/83/10/567058310.db2.gz KAXBXHLGCWWKKR-UHFFFAOYSA-N 0 1 392.070 3.122 10 0 GGAEMN CN(C)CCN(Cc1ccsc1)S(=O)(=O)c1ccc2ncsc2c1 ZINC000565350920 567060716 /nfs/dbraw/zinc/06/07/16/567060716.db2.gz JKROBIOJSDSDNL-UHFFFAOYSA-N 0 1 381.548 3.110 10 0 GGAEMN Cc1ccc(C[C@H](CO)CNCc2cn(C3CCC3)nn2)cc1Br ZINC000657483563 567060889 /nfs/dbraw/zinc/06/08/89/567060889.db2.gz LTALVBGOVJDISV-HNNXBMFYSA-N 0 1 393.329 3.015 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCC12CCOCC2 ZINC000682590996 567062521 /nfs/dbraw/zinc/06/25/21/567062521.db2.gz LCZUYAALCGWPCB-UHFFFAOYSA-N 0 1 376.254 3.234 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)no1)N1CCN2CCC1CC2 ZINC000613860628 567065763 /nfs/dbraw/zinc/06/57/63/567065763.db2.gz FXMYPACTASMRAH-UHFFFAOYSA-N 0 1 376.254 3.024 10 0 GGAEMN CC(=O)NCc1ccc(CNCc2cc(Br)cc3c2OCC3)cc1 ZINC000657543861 567066651 /nfs/dbraw/zinc/06/66/51/567066651.db2.gz JPQQFROLPVBYPP-UHFFFAOYSA-N 0 1 389.293 3.310 10 0 GGAEMN COc1cc(Br)ccc1CNCc1ccc(CNC(C)=O)cc1 ZINC000657543905 567067268 /nfs/dbraw/zinc/06/72/68/567067268.db2.gz KDMXHQNNCHUGKC-UHFFFAOYSA-N 0 1 377.282 3.384 10 0 GGAEMN Cc1n[nH]c(C(=O)N[C@@H](C)c2nc(-c3ccc(Br)cc3)no2)c1C ZINC000473170976 567067539 /nfs/dbraw/zinc/06/75/39/567067539.db2.gz PKFSVWULSVCCFM-JTQLQIEISA-N 0 1 390.241 3.330 10 0 GGAEMN COc1ccc(Br)c(CNCc2ccc(CNC(C)=O)cc2)c1 ZINC000657543703 567067958 /nfs/dbraw/zinc/06/79/58/567067958.db2.gz GYKNMGPAGZXKAM-UHFFFAOYSA-N 0 1 377.282 3.384 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613864981 567068078 /nfs/dbraw/zinc/06/80/78/567068078.db2.gz BQRNMMXUBJJNEU-WDEREUQCSA-N 0 1 378.270 3.163 10 0 GGAEMN O=S(=O)([N-]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Br)o1 ZINC000565449595 567068861 /nfs/dbraw/zinc/06/88/61/567068861.db2.gz GVWCYKWAQVAGCS-UHFFFAOYSA-N 0 1 399.310 3.116 10 0 GGAEMN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1)[C@@H]1CCc2[nH]cnc2C1 ZINC000613903255 567070545 /nfs/dbraw/zinc/07/05/45/567070545.db2.gz YUAFNURHMPFDKD-DGCLKSJQSA-N 0 1 379.291 3.217 10 0 GGAEMN COC[C@H](NCc1cn(-c2cccc(Cl)c2Cl)nn1)C1CCOCC1 ZINC000657565840 567070767 /nfs/dbraw/zinc/07/07/67/567070767.db2.gz VHBWPKZDVKALRW-HNNXBMFYSA-N 0 1 385.295 3.105 10 0 GGAEMN CC[C@H](COCC1CC1)NCc1cn(-c2ccccc2Br)nn1 ZINC000657563882 567070794 /nfs/dbraw/zinc/07/07/94/567070794.db2.gz XUWOPTJXBULTBY-CQSZACIVSA-N 0 1 379.302 3.325 10 0 GGAEMN CC[C@@H](COCC1CC1)NCc1cn(-c2ccccc2Br)nn1 ZINC000657563881 567071607 /nfs/dbraw/zinc/07/16/07/567071607.db2.gz XUWOPTJXBULTBY-AWEZNQCLSA-N 0 1 379.302 3.325 10 0 GGAEMN COC[C@@H](NCc1cn(-c2ccc(Cl)c(Cl)c2)nn1)C1CCOCC1 ZINC000657565719 567071616 /nfs/dbraw/zinc/07/16/16/567071616.db2.gz UFNSULHFPPNXCR-QGZVFWFLSA-N 0 1 385.295 3.105 10 0 GGAEMN OC[C@@H](CNCc1nc(-c2ccc(Br)cc2)c[nH]1)c1cccnc1 ZINC000584803078 567072020 /nfs/dbraw/zinc/07/20/20/567072020.db2.gz ZRDRDKMJLWSXMV-OAHLLOKOSA-N 0 1 387.281 3.100 10 0 GGAEMN COc1ccc(CNC(=O)CN(C)CCc2ccc(Br)cc2)cc1 ZINC000521658088 567072535 /nfs/dbraw/zinc/07/25/35/567072535.db2.gz SCTZWFMFPPSCHC-UHFFFAOYSA-N 0 1 391.309 3.248 10 0 GGAEMN CN(C)[C@@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccc(F)cc1 ZINC000431323433 567075173 /nfs/dbraw/zinc/07/51/73/567075173.db2.gz MQRLKSUNFJDRQY-INIZCTEOSA-N 0 1 395.272 3.255 10 0 GGAEMN COCCN(Cc1cc(Br)cs1)C(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613977736 567075359 /nfs/dbraw/zinc/07/53/59/567075359.db2.gz YKABVIYLAFEESE-NSHDSACASA-N 0 1 398.326 3.014 10 0 GGAEMN COCCN(Cc1cc(Br)cs1)C(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613977735 567075681 /nfs/dbraw/zinc/07/56/81/567075681.db2.gz YKABVIYLAFEESE-LLVKDONJSA-N 0 1 398.326 3.014 10 0 GGAEMN Cc1c([C@H](C)NC[C@@H]2CCC[C@H]2O)nnn1-c1cccc(Br)c1 ZINC000453366220 567079759 /nfs/dbraw/zinc/07/97/59/567079759.db2.gz CWZKVTKHYNLGLH-DETPVDSQSA-N 0 1 379.302 3.150 10 0 GGAEMN Cc1noc(C)c1CO[C@@H]1CCN(C(=O)c2cccc(Br)c2O)C1 ZINC000545865971 567081579 /nfs/dbraw/zinc/08/15/79/567081579.db2.gz PRNHCVJJAPHZGB-GFCCVEGCSA-N 0 1 395.253 3.191 10 0 GGAEMN CC1=CC[N@@H+](CCNC(=O)N[C@@H]2CCc3c2cccc3Br)CC1 ZINC000545858677 567081742 /nfs/dbraw/zinc/08/17/42/567081742.db2.gz KMMMZYDJOICFEN-QGZVFWFLSA-N 0 1 378.314 3.388 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@@H]2CCc3c2cccc3Br)CC1 ZINC000545858677 567081749 /nfs/dbraw/zinc/08/17/49/567081749.db2.gz KMMMZYDJOICFEN-QGZVFWFLSA-N 0 1 378.314 3.388 10 0 GGAEMN Cc1ccc(C(=O)N2CCN(C3CCOCC3)CC2)c(C)c1Br ZINC000682913050 567083275 /nfs/dbraw/zinc/08/32/75/567083275.db2.gz ORYAMENALSELMV-UHFFFAOYSA-N 0 1 381.314 3.003 10 0 GGAEMN O=C(NCCc1cc(Cl)ccc1Br)N[C@H]1CCc2nc[nH]c2C1 ZINC000565632315 567084349 /nfs/dbraw/zinc/08/43/49/567084349.db2.gz WOARELVJKWHDMQ-LBPRGKRZSA-N 0 1 397.704 3.225 10 0 GGAEMN O=C(NCc1ccc(-n2cccn2)cc1)c1n[nH]c2ccc(Br)cc21 ZINC000521924681 567086814 /nfs/dbraw/zinc/08/68/14/567086814.db2.gz DDWDDKBJKUSABX-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN CC(C)(CNC(=O)N[C@H]1CCc2nc[nH]c2C1)c1cccc(Br)c1 ZINC000521948164 567088302 /nfs/dbraw/zinc/08/83/02/567088302.db2.gz YVJKYKHEWFQYKW-AWEZNQCLSA-N 0 1 391.313 3.307 10 0 GGAEMN C[C@@H](c1ccccc1Br)N(C)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000521947945 567088683 /nfs/dbraw/zinc/08/86/83/567088683.db2.gz OHFFWKUKOZFUAG-RYUDHWBXSA-N 0 1 377.286 3.432 10 0 GGAEMN C[C@@]1(CNC(=O)c2n[nH]c3ccc(Br)cc32)CCO[C@H]1C1CC1 ZINC000545953762 567091885 /nfs/dbraw/zinc/09/18/85/567091885.db2.gz SEDAZAKEGQNGHU-RDJZCZTQSA-N 0 1 378.270 3.260 10 0 GGAEMN CC(C)OC(=O)CC[C@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000473623013 567093410 /nfs/dbraw/zinc/09/34/10/567093410.db2.gz OAEMKFAYKGIPRP-JTQLQIEISA-N 0 1 382.258 3.176 10 0 GGAEMN CC(C)[C@]1(C(=O)[O-])CC[N@@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000565722107 567093492 /nfs/dbraw/zinc/09/34/92/567093492.db2.gz GVBXMUQSHQLGJF-PXAZEXFGSA-N 0 1 376.280 3.166 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2C[C@H]2c2ccccc2Br)n[nH]1 ZINC000565752578 567096645 /nfs/dbraw/zinc/09/66/45/567096645.db2.gz YENMLAGLRAFTCX-JMPLFQLZSA-N 0 1 377.286 3.267 10 0 GGAEMN Cc1cc(C(=O)N2CCN(Cc3sc(C)cc3Br)[C@H](C)C2)n[nH]1 ZINC000453606593 567097116 /nfs/dbraw/zinc/09/71/16/567097116.db2.gz FGLMKHVTVVXGPL-LLVKDONJSA-N 0 1 397.342 3.197 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1Cc2ccccc2C1 ZINC000431624653 567097344 /nfs/dbraw/zinc/09/73/44/567097344.db2.gz WUFCBDUBAZTROO-UHFFFAOYSA-N 0 1 397.276 3.265 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1Cc2ccccc2C1 ZINC000431624653 567097347 /nfs/dbraw/zinc/09/73/47/567097347.db2.gz WUFCBDUBAZTROO-UHFFFAOYSA-N 0 1 397.276 3.265 10 0 GGAEMN O=C(NCc1cc(Br)ccc1OC(F)F)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635465557 567100873 /nfs/dbraw/zinc/10/08/73/567100873.db2.gz LSAASWRUVPWXMK-GHMZBOCLSA-N 0 1 386.196 3.194 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)s[n-]1 ZINC000473819122 567105183 /nfs/dbraw/zinc/10/51/83/567105183.db2.gz MYANGDLUVZEPOV-BETUJISGSA-N 0 1 379.555 3.381 10 0 GGAEMN CCC[N@@H+](C)C[C@@H]1CCN(C(=O)N=c2nc(-c3sccc3C)[n-]s2)C1 ZINC000473833818 567106163 /nfs/dbraw/zinc/10/61/63/567106163.db2.gz DLRHGZRFOMBJQJ-ZDUSSCGKSA-N 0 1 379.555 3.193 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)C[C@H](C)c2ccc(Br)cc2)C1 ZINC000431785166 567106943 /nfs/dbraw/zinc/10/69/43/567106943.db2.gz MVNWLVMITZQIDD-YJBOKZPZSA-N 0 1 397.357 3.416 10 0 GGAEMN CCC[N@@H+](C)C[C@H]1CCN(C(=O)N=c2nc(-c3sccc3C)[n-]s2)C1 ZINC000473833817 567106907 /nfs/dbraw/zinc/10/69/07/567106907.db2.gz DLRHGZRFOMBJQJ-CYBMUJFWSA-N 0 1 379.555 3.193 10 0 GGAEMN Cc1nc([C@](C)(NC(=O)c2cc(Br)cc3nc[nH]c32)C2CC2)no1 ZINC000497577458 567110911 /nfs/dbraw/zinc/11/09/11/567110911.db2.gz DQBQKPGPOSXXRJ-MRXNPFEDSA-N 0 1 390.241 3.072 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1 ZINC000635814766 567112644 /nfs/dbraw/zinc/11/26/44/567112644.db2.gz SVVNSBPNGXECMG-XHBSWPGZSA-N 0 1 394.244 3.015 10 0 GGAEMN O=C(NCc1cc(Br)ccc1Br)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635816085 567112991 /nfs/dbraw/zinc/11/29/91/567112991.db2.gz JKJHKVVYQLLRKS-GHMZBOCLSA-N 0 1 399.086 3.355 10 0 GGAEMN CCN(CCC1CC1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000546206678 567114360 /nfs/dbraw/zinc/11/43/60/567114360.db2.gz BALJNHDYFUGYRF-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCC(Nc2cccc(Br)c2)CC1 ZINC000635870951 567116791 /nfs/dbraw/zinc/11/67/91/567116791.db2.gz QRGBUUNZOMPHIZ-HZPDHXFCSA-N 0 1 389.297 3.379 10 0 GGAEMN C[C@H](NC[C@@H]1CC[N@H+]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060181 567118942 /nfs/dbraw/zinc/11/89/42/567118942.db2.gz KGVZBSUNOKEYBM-QWRGUYRKSA-N 0 1 394.368 3.164 10 0 GGAEMN Cc1c([C@@H](C)N[C@@H](CO)C2CCC2)nnn1-c1cccc(Br)c1 ZINC000658086707 567120354 /nfs/dbraw/zinc/12/03/54/567120354.db2.gz FAPAUUYVCHGNNX-BZNIZROVSA-N 0 1 379.302 3.150 10 0 GGAEMN CCc1ccc(S(=O)(=O)Nc2ncc(OC)cc2Br)s1 ZINC000566032673 567121221 /nfs/dbraw/zinc/12/12/21/567121221.db2.gz PVIUXNOAPOVJJD-UHFFFAOYSA-N 0 1 377.285 3.277 10 0 GGAEMN C[C@H]1C[C@H](NC2CCN(Cc3ccccc3Br)CC2)c2ncnn21 ZINC000658100272 567122284 /nfs/dbraw/zinc/12/22/84/567122284.db2.gz GPXBQUVYWLNWRZ-GUYCJALGSA-N 0 1 390.329 3.301 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@@H](CO)N[C@@H](C)c2ncc(Br)cc2F)C1 ZINC000658117307 567123983 /nfs/dbraw/zinc/12/39/83/567123983.db2.gz ZXUOIOKCNHVSGQ-HTTKSJEASA-N 0 1 375.282 3.200 10 0 GGAEMN CN(C)C[C@@H](Cc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1Cl ZINC000614632826 567127663 /nfs/dbraw/zinc/12/76/63/567127663.db2.gz FOYRSVFPSPPRBI-CQSZACIVSA-N 0 1 387.332 3.445 10 0 GGAEMN CN(C)C[C@H](Cc1ccccc1)NS(=O)(=O)c1cccc(Cl)c1Cl ZINC000614633709 567127837 /nfs/dbraw/zinc/12/78/37/567127837.db2.gz QXUIZBKNAACVOV-AWEZNQCLSA-N 0 1 387.332 3.445 10 0 GGAEMN CN(C)C[C@@H](Cc1ccccc1)NS(=O)(=O)c1cccc(Cl)c1Cl ZINC000614633710 567128405 /nfs/dbraw/zinc/12/84/05/567128405.db2.gz QXUIZBKNAACVOV-CQSZACIVSA-N 0 1 387.332 3.445 10 0 GGAEMN C[C@H](NC[C@@H]1CCC[C@@H](C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658216153 567129694 /nfs/dbraw/zinc/12/96/94/567129694.db2.gz PRJMEEQAUZMCHE-VWYCJHECSA-N 0 1 381.325 3.249 10 0 GGAEMN O=C(N[C@@H]1CCc2cc(O)ccc2C1)c1n[nH]c2ccc(Br)cc21 ZINC000683507806 567130025 /nfs/dbraw/zinc/13/00/25/567130025.db2.gz SRVLWYYYFPRZDU-CYBMUJFWSA-N 0 1 386.249 3.318 10 0 GGAEMN CCc1noc(C)c1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000588657460 567131711 /nfs/dbraw/zinc/13/17/11/567131711.db2.gz ZQPIFZIFANSLNE-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN CCc1noc(C)c1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000588657460 567131716 /nfs/dbraw/zinc/13/17/16/567131716.db2.gz ZQPIFZIFANSLNE-UHFFFAOYSA-N 0 1 390.241 3.023 10 0 GGAEMN CC(C)c1n[nH]cc1C(=O)Nc1n[nH]c(-c2ccccc2Br)n1 ZINC000683534188 567132164 /nfs/dbraw/zinc/13/21/64/567132164.db2.gz RDABIBFRBOYFIJ-UHFFFAOYSA-N 0 1 375.230 3.333 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@H]2CCc3c2ccc(F)c3Br)CC1 ZINC000658301807 567133421 /nfs/dbraw/zinc/13/34/21/567133421.db2.gz MFUPMCOOCQAGPA-ZDUSSCGKSA-N 0 1 376.291 3.132 10 0 GGAEMN O=C1N(CCN[C@H]2CCc3c2c(Br)ccc3F)C[C@@H]2CCCCN12 ZINC000658303687 567134341 /nfs/dbraw/zinc/13/43/41/567134341.db2.gz CNOCYPLWNCVGAU-LRDDRELGSA-N 0 1 396.304 3.455 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@@H]2CCc3c2cc(Br)cc3F)CC1 ZINC000658298158 567134384 /nfs/dbraw/zinc/13/43/84/567134384.db2.gz DEFKULYATRGUPS-CQSZACIVSA-N 0 1 376.291 3.132 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NCC1CCCC1 ZINC000588687068 567134466 /nfs/dbraw/zinc/13/44/66/567134466.db2.gz DLUGIHASAPOSNW-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NCC1CCCC1 ZINC000588687068 567134469 /nfs/dbraw/zinc/13/44/69/567134469.db2.gz DLUGIHASAPOSNW-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN C[C@H](NC(=O)[C@](C)(N)c1ccc(Br)cc1)[C@@H]1COc2ccccc21 ZINC000566190890 567134954 /nfs/dbraw/zinc/13/49/54/567134954.db2.gz KYYHVHINBMCXMZ-XGINMYPSSA-N 0 1 389.293 3.304 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(Br)c(F)c3)[nH]c21 ZINC000497948667 567135020 /nfs/dbraw/zinc/13/50/20/567135020.db2.gz BNTKYHKCIHKESA-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)CC1 ZINC000546565761 567138052 /nfs/dbraw/zinc/13/80/52/567138052.db2.gz HZDBKRLWMSLMFL-IAGOWNOFSA-N 0 1 378.314 3.256 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cccc(Br)c3C)[nH]c2c1 ZINC000474128828 567138743 /nfs/dbraw/zinc/13/87/43/567138743.db2.gz KAFOEGYTXLDMIQ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN C[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@H]1C(=O)[O-] ZINC000566221319 567138935 /nfs/dbraw/zinc/13/89/35/567138935.db2.gz NOQLYWALGMBXDR-MWLCHTKSSA-N 0 1 389.677 3.084 10 0 GGAEMN C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Br)cc2Cl)C[C@H]1C(=O)[O-] ZINC000566221319 567138943 /nfs/dbraw/zinc/13/89/43/567138943.db2.gz NOQLYWALGMBXDR-MWLCHTKSSA-N 0 1 389.677 3.084 10 0 GGAEMN CC1=CC[N@@H+](CCNC(=O)N=c2nc(-c3cccc(Cl)c3)[n-]s2)CC1 ZINC000546584468 567139346 /nfs/dbraw/zinc/13/93/46/567139346.db2.gz XHCYRESUNQVKFQ-UHFFFAOYSA-N 0 1 377.901 3.054 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3cc(Br)ccc3C)[nH]c21 ZINC000497993344 567140784 /nfs/dbraw/zinc/14/07/84/567140784.db2.gz MHVPAIAPDGUORP-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)C(C)(C)c2cccc(Br)c2)C1 ZINC000523287746 567149457 /nfs/dbraw/zinc/14/94/57/567149457.db2.gz YPOGTBWZBZLTRP-KRWDZBQOSA-N 0 1 397.357 3.200 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(CC(C)(C)O)C[C@H]1C ZINC000474222392 567149420 /nfs/dbraw/zinc/14/94/20/567149420.db2.gz YWSCIGJXKNBEDV-OLZOCXBDSA-N 0 1 389.323 3.064 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(CC(C)(C)O)C[C@@H]1C ZINC000474222394 567149570 /nfs/dbraw/zinc/14/95/70/567149570.db2.gz YWSCIGJXKNBEDV-STQMWFEESA-N 0 1 389.323 3.064 10 0 GGAEMN COC(=O)c1cc(NC(=O)c2ncc(C)cc2O)cc(Br)c1F ZINC000432350948 567153330 /nfs/dbraw/zinc/15/33/30/567153330.db2.gz GXULMDXZGGQVRS-UHFFFAOYSA-N 0 1 383.173 3.036 10 0 GGAEMN Cc1cc(-c2nc(-c3nc(-c4cccc(Br)c4)n[nH]3)no2)nc(C)n1 ZINC000566381443 567153996 /nfs/dbraw/zinc/15/39/96/567153996.db2.gz KYYYPDAYFAXIOJ-UHFFFAOYSA-N 0 1 398.224 3.358 10 0 GGAEMN CC(C)SCCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000498151968 567154784 /nfs/dbraw/zinc/15/47/84/567154784.db2.gz TYJZRMTZFCAWBZ-UHFFFAOYSA-N 0 1 398.330 3.175 10 0 GGAEMN CC(C)SCCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000498151968 567154786 /nfs/dbraw/zinc/15/47/86/567154786.db2.gz TYJZRMTZFCAWBZ-UHFFFAOYSA-N 0 1 398.330 3.175 10 0 GGAEMN CC1(C)CC[C@@H]1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000498156093 567155226 /nfs/dbraw/zinc/15/52/26/567155226.db2.gz MFTNWGWDUCCHSD-LBPRGKRZSA-N 0 1 378.274 3.222 10 0 GGAEMN CC1(C)CC[C@@H]1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000498156093 567155232 /nfs/dbraw/zinc/15/52/32/567155232.db2.gz MFTNWGWDUCCHSD-LBPRGKRZSA-N 0 1 378.274 3.222 10 0 GGAEMN O=C(CCOc1ccccc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000589076354 567155252 /nfs/dbraw/zinc/15/52/52/567155252.db2.gz DDONRCYHPJVNFI-UHFFFAOYSA-N 0 1 387.237 3.437 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1cc2c(c(Br)c1)OCO2 ZINC000589079551 567156252 /nfs/dbraw/zinc/15/62/52/567156252.db2.gz SHEZIKKOHWNZJO-UHFFFAOYSA-N 0 1 387.193 3.011 10 0 GGAEMN C[C@@H]1COCCN1C1CCN(C(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000615087007 567156830 /nfs/dbraw/zinc/15/68/30/567156830.db2.gz QQODFNIOGFQMAF-LLVKDONJSA-N 0 1 375.271 3.458 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(N3CCOC[C@H]3C)CC2)c(C)c1Br ZINC000615086054 567156945 /nfs/dbraw/zinc/15/69/45/567156945.db2.gz JLYBKNNCIHYUAM-CQSZACIVSA-N 0 1 395.341 3.391 10 0 GGAEMN CSc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474301442 567157440 /nfs/dbraw/zinc/15/74/40/567157440.db2.gz CTTQTJHLPQBGSM-QGZVFWFLSA-N 0 1 376.547 3.304 10 0 GGAEMN CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccccc1Cl ZINC000474302787 567158217 /nfs/dbraw/zinc/15/82/17/567158217.db2.gz NIJKCMTUYLVEFQ-GOSISDBHSA-N 0 1 378.925 3.376 10 0 GGAEMN C[C@@H](CNC(=O)c1cnccc1N(C)C)Oc1cccc(Br)c1 ZINC000546791554 567159971 /nfs/dbraw/zinc/15/99/71/567159971.db2.gz VKOICMDALCFETK-LBPRGKRZSA-N 0 1 378.270 3.107 10 0 GGAEMN Cc1nc(C)c(CN2CCC[C@H](C(=O)Nc3ccc(Br)cn3)C2)o1 ZINC000683898293 567160203 /nfs/dbraw/zinc/16/02/03/567160203.db2.gz LVILUPZPHNVGJC-ZDUSSCGKSA-N 0 1 393.285 3.300 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC(Nc3cccc(Br)c3)CC2)C1 ZINC000683979205 567167796 /nfs/dbraw/zinc/16/77/96/567167796.db2.gz IKEJNZYFZKIGNC-KRWDZBQOSA-N 0 1 395.345 3.129 10 0 GGAEMN O=C(Cc1cccs1)N1CCC[C@H]1C(=O)Nc1cc(F)cc(Cl)c1O ZINC000474428754 567170333 /nfs/dbraw/zinc/17/03/33/567170333.db2.gz FFUPBXBEXXIRKW-AWEZNQCLSA-N 0 1 382.844 3.418 10 0 GGAEMN O=C(Nc1cc(F)cc(Cl)c1O)c1cnn2cc(Br)cnc12 ZINC000474441870 567171259 /nfs/dbraw/zinc/17/12/59/567171259.db2.gz RFPFJZVXBVFNDD-UHFFFAOYSA-N 0 1 385.580 3.242 10 0 GGAEMN Cc1n[nH]c(C(=O)NC2(c3cccc(Br)c3)CCOCC2)c1C ZINC000523743095 567171727 /nfs/dbraw/zinc/17/17/27/567171727.db2.gz DQZZHPMMKFRDTM-UHFFFAOYSA-N 0 1 378.270 3.225 10 0 GGAEMN O=C(Nc1cc(F)cc(Cl)c1O)[C@@H]1CSCN1C(=O)c1ccccc1 ZINC000474446137 567172907 /nfs/dbraw/zinc/17/29/07/567172907.db2.gz NTXUJDPKLACRHR-AWEZNQCLSA-N 0 1 380.828 3.339 10 0 GGAEMN CCOC1(C)CCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000566636734 567175322 /nfs/dbraw/zinc/17/53/22/567175322.db2.gz RMNUSTXWKGRMQC-UHFFFAOYSA-N 0 1 393.281 3.322 10 0 GGAEMN CCC[C@H](NC(=O)c1coc2c1cc(Br)cc2C)c1nn[nH]n1 ZINC000474497419 567176079 /nfs/dbraw/zinc/17/60/79/567176079.db2.gz UJLQHWCNUXBICB-LBPRGKRZSA-N 0 1 378.230 3.288 10 0 GGAEMN Cc1nc(CS(=O)(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)cs1 ZINC000684101324 567177820 /nfs/dbraw/zinc/17/78/20/567177820.db2.gz ZYOSIKWHIIIDOD-CZUORRHYSA-N 0 1 385.580 3.016 10 0 GGAEMN Cc1nc(CS(=O)(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)cs1 ZINC000684101320 567178829 /nfs/dbraw/zinc/17/88/29/567178829.db2.gz ZYOSIKWHIIIDOD-BBRMVZONSA-N 0 1 385.580 3.016 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)C[C@H]1C(=O)[O-] ZINC000566679508 567179823 /nfs/dbraw/zinc/17/98/23/567179823.db2.gz WHSLHPRGQHWTSM-WCQYABFASA-N 0 1 384.270 3.153 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC[C@H](C2CC2)C1 ZINC000589526507 567182024 /nfs/dbraw/zinc/18/20/24/567182024.db2.gz PPYKEJPBQNJZRE-NSHDSACASA-N 0 1 395.244 3.430 10 0 GGAEMN O=C(Nc1nc(CC(F)(F)F)cs1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000615410916 567182818 /nfs/dbraw/zinc/18/28/18/567182818.db2.gz QKIYUGYJGOWPTF-DTWKUNHWSA-N 0 1 392.321 3.170 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1c(F)cccc1F ZINC000524162030 567185027 /nfs/dbraw/zinc/18/50/27/567185027.db2.gz ATANJKNLUOLKJQ-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1c(F)cccc1F ZINC000524162030 567185039 /nfs/dbraw/zinc/18/50/39/567185039.db2.gz ATANJKNLUOLKJQ-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN COc1ccc(CN2CCCC[C@H]2CN2CCOCC2)c(Br)c1 ZINC000566764056 567187168 /nfs/dbraw/zinc/18/71/68/567187168.db2.gz BKAIIJSVAFNODR-INIZCTEOSA-N 0 1 383.330 3.144 10 0 GGAEMN CCn1cnc2c1ncnc2NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000524221987 567188833 /nfs/dbraw/zinc/18/88/33/567188833.db2.gz WTHLHQFCZAZDSN-UHFFFAOYSA-N 0 1 399.256 3.006 10 0 GGAEMN CCn1cnc2c1ncnc2NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000524221987 567188839 /nfs/dbraw/zinc/18/88/39/567188839.db2.gz WTHLHQFCZAZDSN-UHFFFAOYSA-N 0 1 399.256 3.006 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@@H]1C ZINC000498570882 567188959 /nfs/dbraw/zinc/18/89/59/567188959.db2.gz HVZZHORZYGJVHJ-QWHCGFSZSA-N 0 1 386.277 3.154 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3[nH]nc4ccc(Br)cc43)[nH]c21 ZINC000498599197 567191216 /nfs/dbraw/zinc/19/12/16/567191216.db2.gz HQICQSDBQLUUAD-UHFFFAOYSA-N 0 1 384.237 3.440 10 0 GGAEMN Fc1ccc(-c2n[nH]c(CNc3ncnc4ccc(Br)cc43)n2)cc1 ZINC000524303847 567192231 /nfs/dbraw/zinc/19/22/31/567192231.db2.gz UGGQKMZYSNTSBA-UHFFFAOYSA-N 0 1 399.227 3.351 10 0 GGAEMN Fc1ccc(-c2nc(CNc3ncnc4ccc(Br)cc43)n[nH]2)cc1 ZINC000524303847 567192237 /nfs/dbraw/zinc/19/22/37/567192237.db2.gz UGGQKMZYSNTSBA-UHFFFAOYSA-N 0 1 399.227 3.351 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3c(F)ccc(Br)c3C2)n[nH]1 ZINC000454673494 567193672 /nfs/dbraw/zinc/19/36/72/567193672.db2.gz AZHYTLCUOQVJOD-JTQLQIEISA-N 0 1 395.276 3.319 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N(Cc2cc(Br)ccc2F)C2CC2)C1 ZINC000589767878 567194218 /nfs/dbraw/zinc/19/42/18/567194218.db2.gz WTMVJCMWILXQDA-CQSZACIVSA-N 0 1 384.293 3.356 10 0 GGAEMN CC(C)c1nc(CNC(=O)c2c(F)c(F)c(Br)c(F)c2F)n[nH]1 ZINC000615670477 567198187 /nfs/dbraw/zinc/19/81/87/567198187.db2.gz UZOOTSQNYIKKMF-UHFFFAOYSA-N 0 1 395.154 3.177 10 0 GGAEMN O=C(CCN1CCN(c2ccccn2)CC1)Nc1cscc1Br ZINC000615731037 567201660 /nfs/dbraw/zinc/20/16/60/567201660.db2.gz GSEFZFIEKQMFTC-UHFFFAOYSA-N 0 1 395.326 3.056 10 0 GGAEMN Cc1c([C@H](C)NCC2=CCOCC2)nnn1-c1cccc(Br)c1 ZINC000566897285 567201977 /nfs/dbraw/zinc/20/19/77/567201977.db2.gz VMEOSLUADSKSOR-LBPRGKRZSA-N 0 1 377.286 3.336 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000566921112 567203097 /nfs/dbraw/zinc/20/30/97/567203097.db2.gz WQOFUMSECURKQI-YUDUHTQSSA-N 0 1 388.291 3.451 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000566921111 567203372 /nfs/dbraw/zinc/20/33/72/567203372.db2.gz WQOFUMSECURKQI-YOENINGUSA-N 0 1 388.291 3.451 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N1CCCC[C@@H]1Cc1cccc(Br)c1 ZINC000659323816 567205644 /nfs/dbraw/zinc/20/56/44/567205644.db2.gz CZMWXIBYCOUIBJ-SJORKVTESA-N 0 1 383.330 3.125 10 0 GGAEMN COCc1csc(NC(=O)N(C)C2CCN(CCC(F)(F)F)CC2)n1 ZINC000454882306 567208911 /nfs/dbraw/zinc/20/89/11/567208911.db2.gz KADADPYYQFUREJ-UHFFFAOYSA-N 0 1 380.436 3.170 10 0 GGAEMN CCOc1c(Br)cc(C(=O)N(C)[C@@H]2CN3CCC2CC3)cc1OC ZINC000524694925 567208955 /nfs/dbraw/zinc/20/89/55/567208955.db2.gz IHOXRTKVBHKIES-OAHLLOKOSA-N 0 1 397.313 3.023 10 0 GGAEMN C[C@@H](NCCOCC1CCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000684556606 567216003 /nfs/dbraw/zinc/21/60/03/567216003.db2.gz AEMOXLFQCWEYHI-SNVBAGLBSA-N 0 1 381.325 3.108 10 0 GGAEMN C[C@H](NCCOCC1CCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000684556604 567216235 /nfs/dbraw/zinc/21/62/35/567216235.db2.gz AEMOXLFQCWEYHI-JTQLQIEISA-N 0 1 381.325 3.108 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C[C@H]1C ZINC000498977169 567216309 /nfs/dbraw/zinc/21/63/09/567216309.db2.gz XYCDKCKEKXQBFH-DVOMOZLQSA-N 0 1 396.329 3.397 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@H]2CCOc3ccc(Br)cc32)C[C@H]1C ZINC000498977171 567217063 /nfs/dbraw/zinc/21/70/63/567217063.db2.gz XYCDKCKEKXQBFH-WWGRRREGSA-N 0 1 396.329 3.397 10 0 GGAEMN COCc1nc(C(=O)Nc2nnc(-c3cccc(Br)c3)s2)co1 ZINC000547533371 567217352 /nfs/dbraw/zinc/21/73/52/567217352.db2.gz FWMJGADTKWWJKZ-UHFFFAOYSA-N 0 1 395.238 3.354 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NS(=O)(=O)c2ccc3nc(C)sc3c2)n[nH]1 ZINC000567101071 567218788 /nfs/dbraw/zinc/21/87/88/567218788.db2.gz SSSYUSHTVYTVGR-UWVGGRQHSA-N 0 1 379.511 3.276 10 0 GGAEMN CC(C)(C)c1[nH]ncc1C(=O)Nc1cc(I)ccc1O ZINC000590316445 567219430 /nfs/dbraw/zinc/21/94/30/567219430.db2.gz VQXLPXKWKJCIAD-UHFFFAOYSA-N 0 1 385.205 3.270 10 0 GGAEMN COC(=O)c1ccccc1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000590348468 567220613 /nfs/dbraw/zinc/22/06/13/567220613.db2.gz GUMUOYYYNOMIPG-UHFFFAOYSA-N 0 1 388.221 3.042 10 0 GGAEMN CCc1nc(CN2CCC[C@@H]2c2ccccc2I)n[nH]1 ZINC000475032335 567221260 /nfs/dbraw/zinc/22/12/60/567221260.db2.gz LEIUPYLXZAGLON-CYBMUJFWSA-N 0 1 382.249 3.309 10 0 GGAEMN CCOC(=O)CC1(NCc2ncc(I)s2)CCCC1 ZINC000567147753 567222259 /nfs/dbraw/zinc/22/22/59/567222259.db2.gz ZQXWTKIQKDWSQN-UHFFFAOYSA-N 0 1 394.278 3.103 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(C(=O)c3cc(Cl)cc(Cl)c3)CC2)n[nH]1 ZINC000659821776 567228755 /nfs/dbraw/zinc/22/87/55/567228755.db2.gz OMVJUCGNXBLEOA-LLVKDONJSA-N 0 1 382.295 3.193 10 0 GGAEMN Brc1cccc(-c2n[nH]c(-c3noc(C=Cc4cnccn4)n3)n2)c1 ZINC000567242450 567229619 /nfs/dbraw/zinc/22/96/19/567229619.db2.gz CBAYOYUUJDXFPA-SNAWJCMRSA-N 0 1 396.208 3.245 10 0 GGAEMN Brc1cccc(-c2n[nH]c(-c3noc(C=Cc4cnccn4)n3)n2)c1 ZINC000567242449 567229832 /nfs/dbraw/zinc/22/98/32/567229832.db2.gz CBAYOYUUJDXFPA-PLNGDYQASA-N 0 1 396.208 3.245 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(C(=O)c3cccc(Cl)c3Cl)CC2)n[nH]1 ZINC000659843621 567230854 /nfs/dbraw/zinc/23/08/54/567230854.db2.gz XBDWVPLRCJUCRO-LLVKDONJSA-N 0 1 382.295 3.193 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2ccccc2C(F)(F)F)c(Cl)c1 ZINC000590592330 567234075 /nfs/dbraw/zinc/23/40/75/567234075.db2.gz JMGGCPZYCYTZME-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN CCOC(=O)c1csc(=NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)[n-]1 ZINC000590571960 567234163 /nfs/dbraw/zinc/23/41/63/567234163.db2.gz KOLFVTHHQZSZQB-UHFFFAOYSA-N 0 1 379.913 3.472 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000433245157 567235390 /nfs/dbraw/zinc/23/53/90/567235390.db2.gz IMSBEWJCPRQTJV-GJZGRUSLSA-N 0 1 395.322 3.248 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cccc(Br)c2OC)[C@H]1n1cccn1 ZINC000567372127 567239851 /nfs/dbraw/zinc/23/98/51/567239851.db2.gz XFCPTPYNAZOOCG-BZUAXINKSA-N 0 1 380.286 3.163 10 0 GGAEMN CCOc1c(Br)cc(C[N@H+]2CC[C@@H](C)[C@H](C(=O)[O-])C2)cc1OC ZINC000567385949 567241231 /nfs/dbraw/zinc/24/12/31/567241231.db2.gz YEPDAGFOZACJJX-DGCLKSJQSA-N 0 1 386.286 3.399 10 0 GGAEMN COC(=O)c1cc(NC(=O)c2cc(-c3ccoc3)n[nH]2)ccc1Br ZINC000547724910 567241797 /nfs/dbraw/zinc/24/17/97/567241797.db2.gz SQOZNFJBTQJVIU-UHFFFAOYSA-N 0 1 390.193 3.471 10 0 GGAEMN CC1(C)CCc2sc(NC(=O)C(C[C@H]3COCCO3)C(F)(F)F)nc21 ZINC000616372765 567241810 /nfs/dbraw/zinc/24/18/10/567241810.db2.gz WHAOCIJKLQBIKL-UWVGGRQHSA-N 0 1 378.416 3.289 10 0 GGAEMN CCOc1c(Br)cc(C[N@H+]2CC[C@H](C)[C@@H](C(=O)[O-])C2)cc1OC ZINC000567385948 567241865 /nfs/dbraw/zinc/24/18/65/567241865.db2.gz YEPDAGFOZACJJX-AAEUAGOBSA-N 0 1 386.286 3.399 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C3(c4cncc(Br)c4)CC3)[nH]c21 ZINC000684926088 567247292 /nfs/dbraw/zinc/24/72/92/567247292.db2.gz OSELCICLJWMHST-UHFFFAOYSA-N 0 1 385.265 3.377 10 0 GGAEMN CN(C)CCN(Cc1cccs1)S(=O)(=O)c1ccc2ncsc2c1 ZINC000547794866 567247438 /nfs/dbraw/zinc/24/74/38/567247438.db2.gz MIZVYZIKGCHCAL-UHFFFAOYSA-N 0 1 381.548 3.110 10 0 GGAEMN COc1ncc(CNC2(c3cccc(Br)c3)CCOCC2)c(C)n1 ZINC000525461522 567249442 /nfs/dbraw/zinc/24/94/42/567249442.db2.gz XETLYWYPJDBYIR-UHFFFAOYSA-N 0 1 392.297 3.352 10 0 GGAEMN CC[C@@H]1CCCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000525513894 567251455 /nfs/dbraw/zinc/25/14/55/567251455.db2.gz XZROEODZPUGUHZ-CYBMUJFWSA-N 0 1 378.274 3.318 10 0 GGAEMN CC[C@@H]1CCCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000525513894 567251462 /nfs/dbraw/zinc/25/14/62/567251462.db2.gz XZROEODZPUGUHZ-CYBMUJFWSA-N 0 1 378.274 3.318 10 0 GGAEMN COc1cnc(NS(=O)(=O)c2ccc3nc(C(C)(C)C)sc3c2)nc1 ZINC000685005245 567252837 /nfs/dbraw/zinc/25/28/37/567252837.db2.gz APDPLZPHSXTESE-UHFFFAOYSA-N 0 1 378.479 3.193 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)NC1(Cc2ccccc2Br)CC1 ZINC000567541406 567254592 /nfs/dbraw/zinc/25/45/92/567254592.db2.gz LVDMYVNPOGKUPV-ZDUSSCGKSA-N 0 1 389.297 3.104 10 0 GGAEMN COc1ncc(CNCCC(=O)Nc2cc(Br)ccc2C)s1 ZINC000638594970 567259598 /nfs/dbraw/zinc/25/95/98/567259598.db2.gz CNFUKNAASXWLBF-UHFFFAOYSA-N 0 1 384.299 3.341 10 0 GGAEMN C[C@@H](C(=O)Nc1cccc(Br)c1)N1CCC[C@@H](n2ccnc2)C1 ZINC000591081509 567262597 /nfs/dbraw/zinc/26/25/97/567262597.db2.gz DKGWYNGNAIVOMM-XJKSGUPXSA-N 0 1 377.286 3.310 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(Br)c1)N1CCC[C@H](n2ccnc2)C1 ZINC000591081507 567262995 /nfs/dbraw/zinc/26/29/95/567262995.db2.gz DKGWYNGNAIVOMM-CJNGLKHVSA-N 0 1 377.286 3.310 10 0 GGAEMN O=C(COCC1CCCC1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000455359815 567264171 /nfs/dbraw/zinc/26/41/71/567264171.db2.gz PAMFNLWGNHRQJA-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN O=C(COCC1CCCC1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000455359815 567264179 /nfs/dbraw/zinc/26/41/79/567264179.db2.gz PAMFNLWGNHRQJA-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN CC1(C)CN(CC2=Cc3cc(Br)ccc3OC2)C[C@]2(CCOC2)O1 ZINC000475630147 567264415 /nfs/dbraw/zinc/26/44/15/567264415.db2.gz ZTTAJIMWQVWSNQ-IBGZPJMESA-N 0 1 394.309 3.495 10 0 GGAEMN C[C@H]1C[C@H]1CNS(=O)(=O)c1scc(Br)c1Br ZINC000433639834 567265034 /nfs/dbraw/zinc/26/50/34/567265034.db2.gz OICYXYCRQTUFGR-WDSKDSINSA-N 0 1 389.134 3.207 10 0 GGAEMN Cc1ccc(NC(=O)N2CCN(CC3(O)CCSCC3)CC2)cc1Cl ZINC000660130889 567265191 /nfs/dbraw/zinc/26/51/91/567265191.db2.gz QNCOGOSRFVSVAB-UHFFFAOYSA-N 0 1 383.945 3.056 10 0 GGAEMN O=C(NCc1cc(Cl)cc(Br)c1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000567708053 567270916 /nfs/dbraw/zinc/27/09/16/567270916.db2.gz RCFWXYWMGNMNQZ-GFCCVEGCSA-N 0 1 383.677 3.182 10 0 GGAEMN C/C(=C\c1cccc(C(F)(F)F)c1)CN1CCC(NS(C)(=O)=O)CC1 ZINC000685409126 567271716 /nfs/dbraw/zinc/27/17/16/567271716.db2.gz LGMPTRWMFJBZGL-JLHYYAGUSA-N 0 1 376.444 3.122 10 0 GGAEMN CN(C(=O)c1cccc2nn[nH]c21)[C@@H]1CCOc2ccc(Br)cc21 ZINC000525873827 567272410 /nfs/dbraw/zinc/27/24/10/567272410.db2.gz NVUNOZZUCYKKCV-CQSZACIVSA-N 0 1 387.237 3.316 10 0 GGAEMN COc1c(Br)c(C)sc1C(=O)NC[C@@H]1CCN1C(C)(C)C ZINC000617013083 567275102 /nfs/dbraw/zinc/27/51/02/567275102.db2.gz MYBFEKXIQRFCFG-JTQLQIEISA-N 0 1 375.332 3.430 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617006883 567276559 /nfs/dbraw/zinc/27/65/59/567276559.db2.gz HQQUXBPMVWLMPV-CQSZACIVSA-N 0 1 397.313 3.020 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)Nc2ccc(Br)c(C(=O)OC)c2)C[C@H]1C ZINC000548081791 567277725 /nfs/dbraw/zinc/27/77/25/567277725.db2.gz LKUAASMFRJCTKA-NEPJUHHUSA-N 0 1 398.301 3.182 10 0 GGAEMN C[C@H](NCCO[C@H]1CC1(F)F)c1cc2c(cc1Br)OCCO2 ZINC000660188645 567278019 /nfs/dbraw/zinc/27/80/19/567278019.db2.gz UZHWAUCAFGWJNE-XPTSAGLGSA-N 0 1 378.213 3.295 10 0 GGAEMN CC(C)[C@H](NCc1coc(S(N)(=O)=O)c1)c1cccc(C(F)(F)F)c1 ZINC000660192482 567278351 /nfs/dbraw/zinc/27/83/51/567278351.db2.gz SSKNUYPUNFAJBI-HNNXBMFYSA-N 0 1 376.400 3.433 10 0 GGAEMN COc1cc(C)c(S(=O)(=O)NCc2nc3ccc(C)cc3[nH]2)cc1Cl ZINC000433864853 567278592 /nfs/dbraw/zinc/27/85/92/567278592.db2.gz ZWCATPIRAKYZRM-UHFFFAOYSA-N 0 1 379.869 3.320 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)NC3(c4nn[nH]n4)CCCC3)coc21 ZINC000548104150 567280289 /nfs/dbraw/zinc/28/02/89/567280289.db2.gz MBZWIUCJQHFTGV-UHFFFAOYSA-N 0 1 390.241 3.216 10 0 GGAEMN COc1cc(C)c(S(=O)(=O)NCc2nc3cccc(C)c3[nH]2)cc1Cl ZINC000433871547 567280481 /nfs/dbraw/zinc/28/04/81/567280481.db2.gz DFJJLQIZKQBFSN-UHFFFAOYSA-N 0 1 379.869 3.320 10 0 GGAEMN CC(C)CCc1nnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)s1 ZINC000617093068 567281140 /nfs/dbraw/zinc/28/11/40/567281140.db2.gz DZJCXTADQXXXAH-WDEREUQCSA-N 0 1 381.420 3.049 10 0 GGAEMN CC(C)CCc1nnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)s1 ZINC000617093067 567281408 /nfs/dbraw/zinc/28/14/08/567281408.db2.gz DZJCXTADQXXXAH-QWRGUYRKSA-N 0 1 381.420 3.049 10 0 GGAEMN CC(C)CCc1nnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)s1 ZINC000617093063 567281451 /nfs/dbraw/zinc/28/14/51/567281451.db2.gz DZJCXTADQXXXAH-GHMZBOCLSA-N 0 1 381.420 3.049 10 0 GGAEMN C[C@@H](NCc1nc2ccc(Br)cc2[nH]1)c1nnc2n1CCCCC2 ZINC000660262869 567283107 /nfs/dbraw/zinc/28/31/07/567283107.db2.gz UTHUMVFKLPKUKN-LLVKDONJSA-N 0 1 389.301 3.494 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000685589517 567283227 /nfs/dbraw/zinc/28/32/27/567283227.db2.gz ZXKQFUNWBZGRCR-GHMZBOCLSA-N 0 1 398.413 3.157 10 0 GGAEMN C[C@@H](NCCOc1cccc(Br)c1)c1nnc2n1CCCCC2 ZINC000660259697 567283284 /nfs/dbraw/zinc/28/32/84/567283284.db2.gz NCWGEKZUEHOHFZ-CYBMUJFWSA-N 0 1 379.302 3.497 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000685589516 567283659 /nfs/dbraw/zinc/28/36/59/567283659.db2.gz ZXKQFUNWBZGRCR-GDNZZTSVSA-N 0 1 398.413 3.157 10 0 GGAEMN C[C@H](NCC1(O)CCSCC1)c1nc(-c2ccc(Br)cc2)no1 ZINC000660271976 567284183 /nfs/dbraw/zinc/28/41/83/567284183.db2.gz MNWIHNJTFJMKHK-NSHDSACASA-N 0 1 398.326 3.408 10 0 GGAEMN CO[C@H](CCNC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C)C(F)(F)F ZINC000526046588 567286165 /nfs/dbraw/zinc/28/61/65/567286165.db2.gz MAKIKYQMRHHPBN-ZIAGYGMSSA-N 0 1 381.826 3.209 10 0 GGAEMN CCc1nc([C@@H](C)N2CCO[C@@H](c3ccc(F)c(Br)c3)C2)n[nH]1 ZINC000660312501 567286617 /nfs/dbraw/zinc/28/66/17/567286617.db2.gz HAUYKUGKEAYZBF-QMTHXVAHSA-N 0 1 383.265 3.403 10 0 GGAEMN CCN(CCNC(=O)N[C@H](c1nccs1)C(F)(F)F)CCC(F)(F)F ZINC000455632024 567287593 /nfs/dbraw/zinc/28/75/93/567287593.db2.gz FGBZLKQSVXUVEN-SECBINFHSA-N 0 1 392.369 3.320 10 0 GGAEMN CC(=O)N1CCc2cc(NC(=O)c3cc(Br)cc4nc[nH]c43)ccc21 ZINC000499982186 567289025 /nfs/dbraw/zinc/28/90/25/567289025.db2.gz UZHCKZXXCFWNSM-UHFFFAOYSA-N 0 1 399.248 3.487 10 0 GGAEMN O=C(NCCc1nc2ccccc2[nH]1)c1cc(Br)cc2nc[nH]c21 ZINC000500008909 567290383 /nfs/dbraw/zinc/29/03/83/567290383.db2.gz JIOLANYTLVCKCV-UHFFFAOYSA-N 0 1 384.237 3.174 10 0 GGAEMN O=C(Nc1nc2c(cccc2Br)s1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000685655302 567290855 /nfs/dbraw/zinc/29/08/55/567290855.db2.gz UDWLNKIMGUJJLY-MRVPVSSYSA-N 0 1 392.282 3.461 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)[C@@H]2CCc3cc(Br)ccc32)C[C@@H](C)O1 ZINC000567945147 567291919 /nfs/dbraw/zinc/29/19/19/567291919.db2.gz IMKIEIFWWNNHDA-HBUWYVDXSA-N 0 1 395.341 3.094 10 0 GGAEMN NC(=O)[C@@H](NCCc1ccc2ccccc2n1)c1ccc(Br)cc1 ZINC000591690871 567292249 /nfs/dbraw/zinc/29/22/49/567292249.db2.gz TYAQQMRYBYSHQX-SFHVURJKSA-N 0 1 384.277 3.356 10 0 GGAEMN Clc1cc(Br)cnc1CN[C@@H]1CCCC[C@H]1N1CCOCC1 ZINC000660387514 567292959 /nfs/dbraw/zinc/29/29/59/567292959.db2.gz KEUMBSWFCATIDH-GDBMZVCRSA-N 0 1 388.737 3.231 10 0 GGAEMN CC[C@@H]1[C@H](C)CCN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000476061579 567294350 /nfs/dbraw/zinc/29/43/50/567294350.db2.gz MKUCJWMDSRCHEF-NOZJJQNGSA-N 0 1 383.233 3.428 10 0 GGAEMN CSc1cc(Cl)ccc1NC(=O)c1cccc(N2CCN(C)CC2)n1 ZINC000617252352 567294887 /nfs/dbraw/zinc/29/48/87/567294887.db2.gz SAVRUJDQVMDPNA-UHFFFAOYSA-N 0 1 376.913 3.461 10 0 GGAEMN Cc1occc1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000591769666 567295142 /nfs/dbraw/zinc/29/51/42/567295142.db2.gz GCSYEXFCFLSIHP-UHFFFAOYSA-N 0 1 390.241 3.135 10 0 GGAEMN Cc1occc1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000591769666 567295143 /nfs/dbraw/zinc/29/51/43/567295143.db2.gz GCSYEXFCFLSIHP-UHFFFAOYSA-N 0 1 390.241 3.135 10 0 GGAEMN CCc1nc([C@H](C)N(CCNC(C)=O)Cc2ccc(Cl)cc2Cl)n[nH]1 ZINC000660487063 567300996 /nfs/dbraw/zinc/30/09/96/567300996.db2.gz UEHGPRYFCBVJEK-NSHDSACASA-N 0 1 384.311 3.373 10 0 GGAEMN CC(C)[C@H](N[C@@H](C)C(=O)Nc1ccccc1Br)[C@H](O)C(F)(F)F ZINC000660527231 567305508 /nfs/dbraw/zinc/30/55/08/567305508.db2.gz DBYGBCUYESMAGL-XDTLVQLUSA-N 0 1 397.235 3.314 10 0 GGAEMN Brc1cnc2c(CN3CCC(Cc4nccs4)CC3)cnn2c1 ZINC000639375413 567305950 /nfs/dbraw/zinc/30/59/50/567305950.db2.gz VHNUIAYRAMWESJ-UHFFFAOYSA-N 0 1 392.326 3.403 10 0 GGAEMN CCc1c(C(=O)N[C@@H]2CCCN(C)C2)cnn1-c1ccc(Br)cc1 ZINC000617415718 567306093 /nfs/dbraw/zinc/30/60/93/567306093.db2.gz MPWHZZWDSWWASH-CQSZACIVSA-N 0 1 391.313 3.021 10 0 GGAEMN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@@H]1CCCN(C)C1 ZINC000617414875 567307040 /nfs/dbraw/zinc/30/70/40/567307040.db2.gz SVMWFEWVPULFTR-ZYHUDNBSSA-N 0 1 375.694 3.080 10 0 GGAEMN CC(C)[C@H](NS(=O)(=O)c1cc2c(cc1Cl)CCC(=O)N2)C(F)(F)F ZINC000527043324 567308374 /nfs/dbraw/zinc/30/83/74/567308374.db2.gz BPOUTNUFTYOQNQ-ZDUSSCGKSA-N 0 1 384.807 3.090 10 0 GGAEMN C[C@@H](NC(=O)Nc1ccc(C(F)(F)F)c(Br)c1)c1nnc[nH]1 ZINC000527056808 567309171 /nfs/dbraw/zinc/30/91/71/567309171.db2.gz MGJDINHJYAQBBE-ZCFIWIBFSA-N 0 1 378.152 3.469 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)Nc2cc(Br)cnc2C)n[nH]1 ZINC000455827680 567310019 /nfs/dbraw/zinc/31/00/19/567310019.db2.gz RBUAPDTUSNOYLM-CYBMUJFWSA-N 0 1 379.262 3.338 10 0 GGAEMN Cc1ccc(Br)cc1CN[C@@H](c1cnn(C)c1)C1(CO)CCC1 ZINC000660599476 567311374 /nfs/dbraw/zinc/31/13/74/567311374.db2.gz JICOGESPMNSERS-KRWDZBQOSA-N 0 1 378.314 3.485 10 0 GGAEMN CCc1nc([C@H](C)N[C@H](C)c2ccc(Br)cc2OCCCO)n[nH]1 ZINC000660595011 567311525 /nfs/dbraw/zinc/31/15/25/567311525.db2.gz BKNRRFNSNRSUIX-NEPJUHHUSA-N 0 1 397.317 3.303 10 0 GGAEMN Cc1c(Br)cccc1CN[C@@H](c1cnn(C)c1)C1(CO)CCC1 ZINC000660602533 567311703 /nfs/dbraw/zinc/31/17/03/567311703.db2.gz SYEXNOFDWCCQDA-KRWDZBQOSA-N 0 1 378.314 3.485 10 0 GGAEMN Cc1ccc(Br)cc1CN[C@H](c1cnn(C)c1)C1(CO)CCC1 ZINC000660599477 567311827 /nfs/dbraw/zinc/31/18/27/567311827.db2.gz JICOGESPMNSERS-QGZVFWFLSA-N 0 1 378.314 3.485 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@H](c2ccsc2)N(C)C)c1Br ZINC000527089330 567312867 /nfs/dbraw/zinc/31/28/67/567312867.db2.gz IEOKAZHNPPXBLL-CYBMUJFWSA-N 0 1 383.315 3.060 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)C3(c4ccccc4Br)CC3)cc21 ZINC000476329697 567314981 /nfs/dbraw/zinc/31/49/81/567314981.db2.gz CRBMBCLKXXXTHU-UHFFFAOYSA-N 0 1 399.248 3.095 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)c1cc(Br)c(F)cc1F ZINC000617506574 567316937 /nfs/dbraw/zinc/31/69/37/567316937.db2.gz JQWMHWZGNMYESX-UHFFFAOYSA-N 0 1 388.168 3.188 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H]2C[C@H]2c2ccc(Br)c(F)c2)n[nH]1 ZINC000527159164 567316961 /nfs/dbraw/zinc/31/69/61/567316961.db2.gz ZQFRBQWHEMNYFV-UOWOHEGISA-N 0 1 395.276 3.406 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(C)cc2Br)[C@@H]1SC ZINC000592165885 567318854 /nfs/dbraw/zinc/31/88/54/567318854.db2.gz ACLUJFJZJMYPOW-FMKPAKJESA-N 0 1 387.343 3.195 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccccc2Br)[C@@H]1SC ZINC000592169725 567320505 /nfs/dbraw/zinc/32/05/05/567320505.db2.gz QKFZCRUDBWYMFD-QZKOUSHUSA-N 0 1 387.343 3.275 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCC(=O)N(CC)c2nc3ccccc3s2)[C@@H]1SC ZINC000592173928 567320641 /nfs/dbraw/zinc/32/06/41/567320641.db2.gz AHCINLVLCLFIMJ-CPUCHLNUSA-N 0 1 379.551 3.148 10 0 GGAEMN Cc1cc(CNC(=O)N[C@@H]2CSCc3ccc(Br)cc32)n[nH]1 ZINC000660711633 567320929 /nfs/dbraw/zinc/32/09/29/567320929.db2.gz AYYCORFZVRRFHH-CQSZACIVSA-N 0 1 381.299 3.268 10 0 GGAEMN CCN(C(=O)CCCC(=O)c1ccc(Br)cc1)[C@@H]1CCN(C)C1 ZINC000617551259 567320982 /nfs/dbraw/zinc/32/09/82/567320982.db2.gz OEFMBGNNDFIIFF-MRXNPFEDSA-N 0 1 381.314 3.355 10 0 GGAEMN CCN(C(=O)c1coc(-c2ccc(Br)cc2F)n1)[C@H]1CCN(C)C1 ZINC000617552229 567321039 /nfs/dbraw/zinc/32/10/39/567321039.db2.gz JYEOFEIMAAHQRF-LBPRGKRZSA-N 0 1 396.260 3.409 10 0 GGAEMN CCN(C(=O)c1cc(Br)sc1Br)[C@H]1CCN(C)C1 ZINC000617554906 567321163 /nfs/dbraw/zinc/32/11/63/567321163.db2.gz MDWRAAPOYIMHPI-QMMMGPOBSA-N 0 1 396.148 3.439 10 0 GGAEMN CCN(C(=O)c1ccc(Sc2ccccc2Cl)nn1)[C@H]1CCN(C)C1 ZINC000617554930 567321193 /nfs/dbraw/zinc/32/11/93/567321193.db2.gz MUJMBJJLSWKUHP-ZDUSSCGKSA-N 0 1 376.913 3.447 10 0 GGAEMN CCN(C(=O)c1cc(-c2cccc(Br)c2)no1)[C@H]1CCN(C)C1 ZINC000617562124 567324035 /nfs/dbraw/zinc/32/40/35/567324035.db2.gz BEHWOENUBCQQIB-AWEZNQCLSA-N 0 1 378.270 3.270 10 0 GGAEMN CC(C)c1nc([C@@H](C)NC(=O)Cc2noc3ccc(Br)cc23)n[nH]1 ZINC000568383435 567324277 /nfs/dbraw/zinc/32/42/77/567324277.db2.gz KCORHBSAMLQFDA-SECBINFHSA-N 0 1 392.257 3.252 10 0 GGAEMN Cn1ncc(Br)c1CN[C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000500471556 567324517 /nfs/dbraw/zinc/32/45/17/567324517.db2.gz QKMUUVPYQOZPRX-INIZCTEOSA-N 0 1 384.705 3.327 10 0 GGAEMN O=C(NC[C@@H](CO)CC1CCCC1)c1n[nH]c2ccc(Br)cc21 ZINC000500540027 567329442 /nfs/dbraw/zinc/32/94/42/567329442.db2.gz ZEXFXZNAWFOPAK-LBPRGKRZSA-N 0 1 380.286 3.244 10 0 GGAEMN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1C(=O)N[C@@H]1CCCN(C)C1 ZINC000660838841 567329729 /nfs/dbraw/zinc/32/97/29/567329729.db2.gz ZYRNFHBJRWQVON-XYPHTWIQSA-N 0 1 396.329 3.015 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(COc2cccc(I)c2)n1 ZINC000592353104 567331223 /nfs/dbraw/zinc/33/12/23/567331223.db2.gz SYCLJKHGBQBXET-GFCCVEGCSA-N 0 1 387.221 3.299 10 0 GGAEMN COCC(C)(C)N1CCN(Cc2ncc(Br)cc2Cl)CC1 ZINC000660881754 567332799 /nfs/dbraw/zinc/33/27/99/567332799.db2.gz JQMVDXHNWUMTMQ-UHFFFAOYSA-N 0 1 376.726 3.040 10 0 GGAEMN Ic1ccc2nc(-c3nc([C@H]4CCCN4)no3)ccc2c1 ZINC000592356178 567332812 /nfs/dbraw/zinc/33/28/12/567332812.db2.gz FSQIPSLDAYHRKG-GFCCVEGCSA-N 0 1 392.200 3.314 10 0 GGAEMN CC(C)C[C@H](N)c1noc(COc2cccc(I)c2)n1 ZINC000592353105 567332827 /nfs/dbraw/zinc/33/28/27/567332827.db2.gz SYCLJKHGBQBXET-LBPRGKRZSA-N 0 1 387.221 3.299 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2c(Br)cc(OC)cc2OC)[C@@H]1SC ZINC000592375344 567333551 /nfs/dbraw/zinc/33/35/51/567333551.db2.gz DYLQNCBCOHJXLC-BMFZPTHFSA-N 0 1 390.343 3.465 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCN(c2ccc(Cl)cc2Cl)CC1 ZINC000617790326 567336050 /nfs/dbraw/zinc/33/60/50/567336050.db2.gz KXAXRQMTYOIGTG-ZDUSSCGKSA-N 0 1 379.291 3.485 10 0 GGAEMN C[C@@H]1[C@@H](NC(=O)c2ncsc2Br)CCN1Cc1ccccc1 ZINC000568550893 567337318 /nfs/dbraw/zinc/33/73/18/567337318.db2.gz MVXVGQMAICUTCE-YPMHNXCESA-N 0 1 380.311 3.298 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000660976037 567338397 /nfs/dbraw/zinc/33/83/97/567338397.db2.gz PXWXJTSYVHRQPY-UHFFFAOYSA-N 0 1 394.235 3.171 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCN(c2ccc(F)cc2)CC1 ZINC000592448071 567339264 /nfs/dbraw/zinc/33/92/64/567339264.db2.gz HWYHZKDGGPRHNI-UHFFFAOYSA-N 0 1 379.229 3.256 10 0 GGAEMN O=C(NC1(C(=O)Nc2ccccc2)CC1)c1cccc(Br)c1O ZINC000548644404 567341194 /nfs/dbraw/zinc/34/11/94/567341194.db2.gz YVFIJALLHVGZCH-UHFFFAOYSA-N 0 1 375.222 3.056 10 0 GGAEMN O=C1C[C@@H](c2cccc(NS(=O)(=O)c3cc(Cl)ccc3Cl)c2)CN1 ZINC000435145992 567343682 /nfs/dbraw/zinc/34/36/82/567343682.db2.gz VQNXTUUOMCEXSS-LLVKDONJSA-N 0 1 385.272 3.398 10 0 GGAEMN CCOC(=O)c1sc([C@H](C)NC(=O)[C@H](N)c2cccc(Cl)c2)nc1C ZINC000592538547 567345788 /nfs/dbraw/zinc/34/57/88/567345788.db2.gz TZZBNJREZPTYIR-GXFFZTMASA-N 0 1 381.885 3.159 10 0 GGAEMN COCc1nc(CNC(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)n[nH]1 ZINC000617937945 567346154 /nfs/dbraw/zinc/34/61/54/567346154.db2.gz GXYCVMYRSURGQE-MRVPVSSYSA-N 0 1 375.281 3.055 10 0 GGAEMN COCc1nnc(CNC(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)[nH]1 ZINC000617937945 567346161 /nfs/dbraw/zinc/34/61/61/567346161.db2.gz GXYCVMYRSURGQE-MRVPVSSYSA-N 0 1 375.281 3.055 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1 ZINC000661112239 567349876 /nfs/dbraw/zinc/34/98/76/567349876.db2.gz KINUWMVURFPTLM-HDJSIYSDSA-N 0 1 384.293 3.037 10 0 GGAEMN CN(C)C[C@H]1CCCN1S(=O)(=O)c1ccc2nc(C(C)(C)C)sc2c1 ZINC000435229315 567351218 /nfs/dbraw/zinc/35/12/18/567351218.db2.gz GOAQSUKFWZXJSQ-CYBMUJFWSA-N 0 1 381.567 3.309 10 0 GGAEMN CCOC(=O)c1c[nH]c(NC(=O)[C@@H]2CCc3cc(Br)ccc32)n1 ZINC000592630164 567351644 /nfs/dbraw/zinc/35/16/44/567351644.db2.gz HILPKBHPTNJXLQ-GFCCVEGCSA-N 0 1 378.226 3.017 10 0 GGAEMN CC1=C[C@@H](C)CN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000435258331 567352052 /nfs/dbraw/zinc/35/20/52/567352052.db2.gz BHTMUQWVENMOLU-SECBINFHSA-N 0 1 381.217 3.206 10 0 GGAEMN CC(=O)c1[nH]c(CCN2CCc3ccc(F)c(Br)c3C2)nc1C ZINC000527627872 567352100 /nfs/dbraw/zinc/35/21/00/567352100.db2.gz VCLPRDZIBDPHCH-UHFFFAOYSA-N 0 1 380.261 3.423 10 0 GGAEMN COC[C@@H](NCc1nnc(-c2ccccc2Br)o1)C1CCOCC1 ZINC000661161421 567352294 /nfs/dbraw/zinc/35/22/94/567352294.db2.gz VMOVIEMSOUPYIK-OAHLLOKOSA-N 0 1 396.285 3.030 10 0 GGAEMN Brc1cccc(-c2cnc(CN3CC[C@@H](Cn4ccnn4)C3)o2)c1 ZINC000661145596 567352385 /nfs/dbraw/zinc/35/23/85/567352385.db2.gz UPFCFAXNAHZIBG-CYBMUJFWSA-N 0 1 388.269 3.218 10 0 GGAEMN COC[C@@H](NCc1nc(-c2cccc(Br)c2)no1)C1CCOCC1 ZINC000661161232 567352665 /nfs/dbraw/zinc/35/26/65/567352665.db2.gz SDGWRTNKXOAUSP-OAHLLOKOSA-N 0 1 396.285 3.030 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCOC[C@H]1CC(F)F)c1ccc(Cl)cc1 ZINC000548815019 567352756 /nfs/dbraw/zinc/35/27/56/567352756.db2.gz JKDPSWNYGWFUFR-CABCVRRESA-N 0 1 375.847 3.008 10 0 GGAEMN Brc1ccccc1-c1cnc(CN2CC[C@H](Cn3ccnn3)C2)o1 ZINC000661143015 567353394 /nfs/dbraw/zinc/35/33/94/567353394.db2.gz FBEAORFQYPVNKB-ZDUSSCGKSA-N 0 1 388.269 3.218 10 0 GGAEMN Cc1cc(Br)c(CNC[C@H]2COCCO2)cc1Br ZINC000527640504 567355319 /nfs/dbraw/zinc/35/53/19/567355319.db2.gz FNJLOIZDMYMIPI-NSHDSACASA-N 0 1 379.092 3.025 10 0 GGAEMN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2ncc(Br)cc2Cl)C1 ZINC000661217315 567357071 /nfs/dbraw/zinc/35/70/71/567357071.db2.gz MRHWPDHOINRLFA-IXPVHAAZSA-N 0 1 377.710 3.153 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@@H](CO)NCc2c(F)ccc(Br)c2F)C1 ZINC000661218534 567357414 /nfs/dbraw/zinc/35/74/14/567357414.db2.gz ZQWZCLUFNLDHOW-FIXISWKDSA-N 0 1 378.257 3.383 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@@H](CO)NCc2nc3ccc(Br)cc3o2)C1 ZINC000661215045 567357470 /nfs/dbraw/zinc/35/74/70/567357470.db2.gz DRDWUSNVRHVJFH-NJZAAPMLSA-N 0 1 383.286 3.246 10 0 GGAEMN Cc1ccc2c(c1Br)CN(C(=O)N[C@@H]1CCc3nc[nH]c3C1)C2 ZINC000661205607 567357485 /nfs/dbraw/zinc/35/74/85/567357485.db2.gz ZSDNORSJTKWWTD-GFCCVEGCSA-N 0 1 375.270 3.063 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@H](CO)NCc2ncc(Br)cc2Cl)C1 ZINC000661217319 567357710 /nfs/dbraw/zinc/35/77/10/567357710.db2.gz MRHWPDHOINRLFA-NVBFEUDRSA-N 0 1 377.710 3.153 10 0 GGAEMN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000661204073 567357762 /nfs/dbraw/zinc/35/77/62/567357762.db2.gz BUJKMVOSEMHJJZ-LSDHHAIUSA-N 0 1 391.313 3.350 10 0 GGAEMN CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2ccc(Br)c(F)c2F)C1 ZINC000527665917 567358645 /nfs/dbraw/zinc/35/86/45/567358645.db2.gz RWJOTMCAPYGSAT-GHMZBOCLSA-N 0 1 382.270 3.173 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccccn1)N1CCc2cccc(Br)c2C1 ZINC000568818578 567359344 /nfs/dbraw/zinc/35/93/44/567359344.db2.gz PIEJXTCNDJHUIY-UHFFFAOYSA-N 0 1 383.249 3.433 10 0 GGAEMN COCCN1CC[C@@H](NC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)C1 ZINC000435417718 567360748 /nfs/dbraw/zinc/36/07/48/567360748.db2.gz NBZPFGBPPOQRMW-SWLSCSKDSA-N 0 1 386.323 3.343 10 0 GGAEMN COc1cccc([C@H](CNC(=O)[C@@H]2C[C@]2(C)Br)N2CCCC2)c1 ZINC000527686958 567361787 /nfs/dbraw/zinc/36/17/87/567361787.db2.gz YEEYOWGEFKODNW-BQFCYCMXSA-N 0 1 381.314 3.122 10 0 GGAEMN COc1cccc([C@H](CNC(=O)[C@H]2C[C@@]2(C)Br)N2CCCC2)c1 ZINC000527686960 567362077 /nfs/dbraw/zinc/36/20/77/567362077.db2.gz YEEYOWGEFKODNW-SOLBZPMBSA-N 0 1 381.314 3.122 10 0 GGAEMN Cc1cc(Br)c(CN[C@H](C)C[S@](C)=O)cc1Br ZINC000527691732 567362881 /nfs/dbraw/zinc/36/28/81/567362881.db2.gz NNBJKQOWYISIQJ-XLFHBGCDSA-N 0 1 383.149 3.377 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1csc(-c2ccc(Br)s2)n1 ZINC000618193067 567362823 /nfs/dbraw/zinc/36/28/23/567362823.db2.gz HZPXIRJIBXHVSW-UHFFFAOYSA-N 0 1 386.340 3.268 10 0 GGAEMN C[C@H](NC(=O)c1cccc(Br)c1O)c1ccc(-n2cncn2)cc1 ZINC000592825236 567366905 /nfs/dbraw/zinc/36/69/05/567366905.db2.gz HBLGXNHAMIYOSH-NSHDSACASA-N 0 1 387.237 3.226 10 0 GGAEMN C[C@H](CNC(=O)c1n[nH]c2ccc(I)cc21)CC(F)F ZINC000592827181 567366926 /nfs/dbraw/zinc/36/69/26/567366926.db2.gz XHTHTJRCKBMPGV-ZETCQYMHSA-N 0 1 393.175 3.189 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CC1)c1ccc(-c2ccc(Br)cc2)s1 ZINC000477042262 567367115 /nfs/dbraw/zinc/36/71/15/567367115.db2.gz ILVKLEBGDWEBCV-UHFFFAOYSA-N 0 1 390.266 3.110 10 0 GGAEMN CCCN(C)CC(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000592862605 567370346 /nfs/dbraw/zinc/37/03/46/567370346.db2.gz PTULCXBULWLFEW-UHFFFAOYSA-N 0 1 382.291 3.484 10 0 GGAEMN Cn1nccc1CCN1CCC[C@H]1c1ccc(I)cc1 ZINC000549040626 567370754 /nfs/dbraw/zinc/37/07/54/567370754.db2.gz IUUAZTKPRGCVFT-INIZCTEOSA-N 0 1 381.261 3.404 10 0 GGAEMN CO[C@]1(CO)CCCN([C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000661396916 567371149 /nfs/dbraw/zinc/37/11/49/567371149.db2.gz UFLPFVXLGKRSKX-SNUQEOBHSA-N 0 1 389.323 3.032 10 0 GGAEMN COC(=O)CC1(NCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000568986370 567371133 /nfs/dbraw/zinc/37/11/33/567371133.db2.gz AVSCVSGMECDHOB-HNNXBMFYSA-N 0 1 385.291 3.342 10 0 GGAEMN COCc1n[n-]c(=NC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)s1 ZINC000477102796 567371713 /nfs/dbraw/zinc/37/17/13/567371713.db2.gz SWLLJRQEWPHJCN-UHFFFAOYSA-N 0 1 387.336 3.490 10 0 GGAEMN CC[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC(C)(C)C ZINC000592896349 567373043 /nfs/dbraw/zinc/37/30/43/567373043.db2.gz KUWGODDOMQFVHF-NSHDSACASA-N 0 1 382.258 3.176 10 0 GGAEMN CCn1c(-c2ccc(F)cc2Br)nnc1N1CCN(C2CC2)CC1 ZINC000549098268 567373578 /nfs/dbraw/zinc/37/35/78/567373578.db2.gz HLYLHOFTGWMOPH-UHFFFAOYSA-N 0 1 394.292 3.151 10 0 GGAEMN COc1ccc(Br)cc1CNC[C@@H]1c2ccccc2C(=O)N1C ZINC000527804935 567374626 /nfs/dbraw/zinc/37/46/26/567374626.db2.gz GWTKZZNBCDPPJA-MRXNPFEDSA-N 0 1 375.266 3.374 10 0 GGAEMN C[N@H+]1CCC[C@@H](CN=c2[n-]nc(C3CCOCC3)s2)[C@@H]1c1cccs1 ZINC000549142527 567375585 /nfs/dbraw/zinc/37/55/85/567375585.db2.gz MDDTXDKLBABKHJ-GOEBONIOSA-N 0 1 378.567 3.411 10 0 GGAEMN COc1ccc(CNC[C@@H]2c3ccccc3C(=O)N2C)c(Br)c1 ZINC000527807566 567375619 /nfs/dbraw/zinc/37/56/19/567375619.db2.gz LHAWOZHEGJERLB-QGZVFWFLSA-N 0 1 375.266 3.374 10 0 GGAEMN O=C(Cn1ncc2ccccc21)Nc1nc(-c2ccccc2Br)n[nH]1 ZINC000592995210 567375666 /nfs/dbraw/zinc/37/56/66/567375666.db2.gz OSNSJGHQSWNGSC-UHFFFAOYSA-N 0 1 397.236 3.223 10 0 GGAEMN C[N@H+]1CCC[C@H](CN=c2[n-]nc(C3CCOCC3)s2)[C@H]1c1cccs1 ZINC000549142530 567375919 /nfs/dbraw/zinc/37/59/19/567375919.db2.gz MDDTXDKLBABKHJ-ZBFHGGJFSA-N 0 1 378.567 3.411 10 0 GGAEMN O=C1c2ccccc2C(=O)N1CCNCc1cc(Cl)ccc1Br ZINC000569061083 567376280 /nfs/dbraw/zinc/37/62/80/567376280.db2.gz ZKOVRWSAKFXYPA-UHFFFAOYSA-N 0 1 393.668 3.488 10 0 GGAEMN CC(C)(CNCc1c(F)ccc(Br)c1F)C(=O)N1CCCC1 ZINC000527810337 567376193 /nfs/dbraw/zinc/37/61/93/567376193.db2.gz FKZUKHIHXZGYQH-UHFFFAOYSA-N 0 1 375.257 3.466 10 0 GGAEMN C[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000618360399 567377426 /nfs/dbraw/zinc/37/74/26/567377426.db2.gz QLHVYUIKRHBBAI-MEBBXXQBSA-N 0 1 380.311 3.455 10 0 GGAEMN C[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000618360400 567378222 /nfs/dbraw/zinc/37/82/22/567378222.db2.gz QLHVYUIKRHBBAI-ZUZCIYMTSA-N 0 1 380.311 3.455 10 0 GGAEMN C[C@@H]1CC[N@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@@H]1C(=O)[O-] ZINC000569101785 567379821 /nfs/dbraw/zinc/37/98/21/567379821.db2.gz DKAPPXGEERJGPU-BDAKNGLRSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@@H]1C(=O)[O-] ZINC000569101785 567379824 /nfs/dbraw/zinc/37/98/24/567379824.db2.gz DKAPPXGEERJGPU-BDAKNGLRSA-N 0 1 386.271 3.103 10 0 GGAEMN CCc1occc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000435611712 567379966 /nfs/dbraw/zinc/37/99/66/567379966.db2.gz CDLJNYXOMZKOSA-UHFFFAOYSA-N 0 1 375.226 3.320 10 0 GGAEMN CCc1occc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000435611712 567379970 /nfs/dbraw/zinc/37/99/70/567379970.db2.gz CDLJNYXOMZKOSA-UHFFFAOYSA-N 0 1 375.226 3.320 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)N[C@H]1CSCc2ccc(Br)cc21 ZINC000618361780 567380106 /nfs/dbraw/zinc/38/01/06/567380106.db2.gz SNYHFVUMZHXJLP-HNNXBMFYSA-N 0 1 395.326 3.384 10 0 GGAEMN CN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@H]1CN2CCC1CC2 ZINC000569155649 567382493 /nfs/dbraw/zinc/38/24/93/567382493.db2.gz KKSDZACSUPOFGV-AWEZNQCLSA-N 0 1 389.297 3.005 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOC[C@@H]1c1ccc(Br)cc1 ZINC000618364263 567382778 /nfs/dbraw/zinc/38/27/78/567382778.db2.gz FWNXKQXKCZQNGP-RHSMWYFYSA-N 0 1 390.281 3.192 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)Cn2c(C)c(Br)c3ccccc32)n[nH]1 ZINC000477246004 567383042 /nfs/dbraw/zinc/38/30/42/567383042.db2.gz YYWPNPMSSLVUDB-JTQLQIEISA-N 0 1 390.285 3.270 10 0 GGAEMN O=S1(=O)C[C@@H](CN[C@@H]2CCc3cc(F)c(Cl)cc32)Oc2ccccc21 ZINC000527907747 567383677 /nfs/dbraw/zinc/38/36/77/567383677.db2.gz BEGOXGWVBDPEBJ-MLGOLLRUSA-N 0 1 381.856 3.291 10 0 GGAEMN CCC[C@H]1CN(C(=O)Nc2ncc(C(F)(F)F)s2)CCN1CCOC ZINC000549287263 567384068 /nfs/dbraw/zinc/38/40/68/567384068.db2.gz HUQLEXYLDAIWEW-NSHDSACASA-N 0 1 380.436 3.127 10 0 GGAEMN COc1cc(C)c(NS(=O)(=O)c2cnc3c(Cl)c(C)nn3c2)cc1C ZINC000435717794 567384858 /nfs/dbraw/zinc/38/48/58/567384858.db2.gz RPEYRRSYPYOQCN-UHFFFAOYSA-N 0 1 380.857 3.117 10 0 GGAEMN COc1ccc(CNC[C@H]2CS(=O)(=O)c3ccccc32)c(Br)c1 ZINC000569188169 567384916 /nfs/dbraw/zinc/38/49/16/567384916.db2.gz XWJNRXHWWOAKPC-ZDUSSCGKSA-N 0 1 396.306 3.118 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)C2(c3c(Cl)cccc3Cl)CC2)[nH][nH]1 ZINC000435714395 567384872 /nfs/dbraw/zinc/38/48/72/567384872.db2.gz QQWJTWNVQYWZJS-UHFFFAOYSA-N 0 1 376.247 3.209 10 0 GGAEMN COc1cc(C)c(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)cc1C ZINC000435730908 567385418 /nfs/dbraw/zinc/38/54/18/567385418.db2.gz GWUPZLDZRRGBAW-UHFFFAOYSA-N 0 1 382.825 3.201 10 0 GGAEMN C[C@@H](NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1cc(F)c(Br)cc1F ZINC000527948257 567386136 /nfs/dbraw/zinc/38/61/36/567386136.db2.gz DICSBMHCYKZCIF-BDAKNGLRSA-N 0 1 399.239 3.368 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@H]2CSC2(C)C)cc1 ZINC000549335376 567386339 /nfs/dbraw/zinc/38/63/39/567386339.db2.gz PQJJQAXDXWHHGT-AWEZNQCLSA-N 0 1 396.559 3.481 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](N2CC[C@@]3(O)C[C@H]3C2)C1=O ZINC000661722671 567389527 /nfs/dbraw/zinc/38/95/27/567389527.db2.gz JRPZQQYRBXYINW-URLQWDBASA-N 0 1 393.325 3.018 10 0 GGAEMN C[C@H]1Cc2cn[nH]c2[C@H](C(=O)Nc2nnc(C(F)(F)C(F)(F)F)s2)C1 ZINC000640737874 567390030 /nfs/dbraw/zinc/39/00/30/567390030.db2.gz DGHMQRVVLXHAEO-CAHLUQPWSA-N 0 1 381.330 3.220 10 0 GGAEMN C[C@@H]1Cc2cn[nH]c2[C@H](C(=O)Nc2nnc(C(F)(F)C(F)(F)F)s2)C1 ZINC000640737876 567390054 /nfs/dbraw/zinc/39/00/54/567390054.db2.gz DGHMQRVVLXHAEO-IYSWYEEDSA-N 0 1 381.330 3.220 10 0 GGAEMN O=C([O-])[C@@H](c1cccc(Br)c1)[N@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000569238449 567390096 /nfs/dbraw/zinc/39/00/96/567390096.db2.gz QHDJNVZJNOQQST-CWRNSKLLSA-N 0 1 396.306 3.344 10 0 GGAEMN O=C([O-])[C@@H](c1cccc(Br)c1)[N@@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000569238449 567390103 /nfs/dbraw/zinc/39/01/03/567390103.db2.gz QHDJNVZJNOQQST-CWRNSKLLSA-N 0 1 396.306 3.344 10 0 GGAEMN Cn1cc(N2CCC[C@@H](NCc3c(F)ccc(Br)c3F)C2)cn1 ZINC000501466811 567391085 /nfs/dbraw/zinc/39/10/85/567391085.db2.gz LEXHNMFDKSIFCD-LLVKDONJSA-N 0 1 385.256 3.219 10 0 GGAEMN Cn1cc(N2CCC[C@H](NCc3c(F)ccc(Br)c3F)C2)cn1 ZINC000501466812 567391477 /nfs/dbraw/zinc/39/14/77/567391477.db2.gz LEXHNMFDKSIFCD-NSHDSACASA-N 0 1 385.256 3.219 10 0 GGAEMN O=C(Cc1cscc1Br)N[C@@H](Cc1nc[nH]n1)c1ccccc1 ZINC000501460236 567391919 /nfs/dbraw/zinc/39/19/19/567391919.db2.gz ANDJDAZLBAZJJM-AWEZNQCLSA-N 0 1 391.294 3.271 10 0 GGAEMN COCCN(Cc1ccc(I)c(Cl)c1)[C@@H]1CCOC1 ZINC000436116659 567406521 /nfs/dbraw/zinc/40/65/21/567406521.db2.gz WHLDXEGEVQUFKN-GFCCVEGCSA-N 0 1 395.668 3.182 10 0 GGAEMN C[C@@H]1C[C@H](C)CN(C(=O)CN[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000501548304 567396002 /nfs/dbraw/zinc/39/60/02/567396002.db2.gz YBZNVUTXGCUDHN-DVOMOZLQSA-N 0 1 381.314 3.367 10 0 GGAEMN CO[C@@H]1C[C@@H](N(C)C(=O)c2[nH]nc3ccc(Br)cc32)C12CCC2 ZINC000456638899 567397081 /nfs/dbraw/zinc/39/70/81/567397081.db2.gz NWGHEALWTNIMCW-ZIAGYGMSSA-N 0 1 378.270 3.355 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2ccc(Cl)cc2F)C1 ZINC000435967743 567397588 /nfs/dbraw/zinc/39/75/88/567397588.db2.gz ARQFVIQJAQGJBJ-INIZCTEOSA-N 0 1 388.936 3.185 10 0 GGAEMN O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1cc(Br)cc2nc[nH]c21 ZINC000501575641 567397742 /nfs/dbraw/zinc/39/77/42/567397742.db2.gz AOIYHLRUIIDUCJ-ZDUSSCGKSA-N 0 1 387.237 3.233 10 0 GGAEMN O=C(NCC1(Cc2ccc(Br)cc2)CC1)[C@H]1CCc2[nH]cnc2C1 ZINC000618538327 567398302 /nfs/dbraw/zinc/39/83/02/567398302.db2.gz KKGJNJZORACQIS-AWEZNQCLSA-N 0 1 388.309 3.416 10 0 GGAEMN Brc1ccc(-c2nc(Cn3cc(CNC4CC4)nn3)cs2)cc1 ZINC000640844754 567398768 /nfs/dbraw/zinc/39/87/68/567398768.db2.gz HYZQYUVQEPWOAK-UHFFFAOYSA-N 0 1 390.310 3.464 10 0 GGAEMN C[C@H](Cc1cnc[nH]1)C(=O)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000618545519 567399066 /nfs/dbraw/zinc/39/90/66/567399066.db2.gz PEAFCDIGSMUKKA-CYBMUJFWSA-N 0 1 376.298 3.490 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCc3[nH]c4ccc(Br)cc4c3C2)C1 ZINC000618560971 567400965 /nfs/dbraw/zinc/40/09/65/567400965.db2.gz AERCPMGRVAZGHQ-CYBMUJFWSA-N 0 1 391.313 3.092 10 0 GGAEMN CCOC(=O)COc1cccc(NS(=O)(=O)c2ccccc2SC)c1 ZINC000436013292 567401020 /nfs/dbraw/zinc/40/10/20/567401020.db2.gz BAWSYMRGHUVJCM-UHFFFAOYSA-N 0 1 381.475 3.151 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1CC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000456683267 567401402 /nfs/dbraw/zinc/40/14/02/567401402.db2.gz IEJPXFOHDMEHSB-JMCQJSRRSA-N 0 1 379.791 3.177 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC[C@@]2(CCOC2)C1 ZINC000456697898 567403006 /nfs/dbraw/zinc/40/30/06/567403006.db2.gz BYQFQUNDSUZVEP-GOSISDBHSA-N 0 1 390.281 3.482 10 0 GGAEMN O=C(NCc1cc(F)c(Br)cc1F)N[C@H]1CCCc2cn[nH]c21 ZINC000528254396 567404347 /nfs/dbraw/zinc/40/43/47/567404347.db2.gz QNKYOFWQRDEZAC-ZDUSSCGKSA-N 0 1 385.212 3.327 10 0 GGAEMN CCN(CC)[C@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccco1 ZINC000477616856 567405288 /nfs/dbraw/zinc/40/52/88/567405288.db2.gz KPCUSUBESDGVTM-OAHLLOKOSA-N 0 1 395.297 3.490 10 0 GGAEMN COCCN1CCCN(C(=O)c2c(C)cc(Br)cc2Cl)CC1 ZINC000477668513 567407755 /nfs/dbraw/zinc/40/77/55/567407755.db2.gz PLZNYVPRJTVRJZ-UHFFFAOYSA-N 0 1 389.721 3.205 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](N2CCC3(COC3)C2)C1=O ZINC000662073365 567408027 /nfs/dbraw/zinc/40/80/27/567408027.db2.gz MFBUMPLVZWOVTA-INIZCTEOSA-N 0 1 393.325 3.284 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)cc1Cl)N1CC[C@@H](N2CCCCC2)C1 ZINC000501886897 567410411 /nfs/dbraw/zinc/41/04/11/567410411.db2.gz IEHYZXFDSZUDBD-OAHLLOKOSA-N 0 1 377.337 3.383 10 0 GGAEMN COc1ccc(CN2CCC[C@H](C(=O)NC(C)C)C2)c(Br)c1OC ZINC000662116696 567412064 /nfs/dbraw/zinc/41/20/64/567412064.db2.gz HYFVMFMGGQWLGQ-AWEZNQCLSA-N 0 1 399.329 3.203 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2cc3[nH]ccc3cc2C)cc1 ZINC000436185314 567412005 /nfs/dbraw/zinc/41/20/05/567412005.db2.gz ZKIWRWMYYMHDLV-UHFFFAOYSA-N 0 1 378.475 3.071 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN(Cc2nc3ccc(Br)cc3o2)C1 ZINC000662118381 567412433 /nfs/dbraw/zinc/41/24/33/567412433.db2.gz BZBRJDUPOMDTJX-LBPRGKRZSA-N 0 1 380.286 3.327 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN([C@H](C)C(=O)Nc2cccc(Br)c2)C1 ZINC000662113528 567412589 /nfs/dbraw/zinc/41/25/89/567412589.db2.gz NXKAPNFBDAXUIX-ZIAGYGMSSA-N 0 1 396.329 3.013 10 0 GGAEMN COC(=O)c1cccc(F)c1NS(=O)(=O)c1sccc1Br ZINC000436189544 567412591 /nfs/dbraw/zinc/41/25/91/567412591.db2.gz UMUNVASZSXNCDV-UHFFFAOYSA-N 0 1 394.243 3.237 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN(Cc2nc3cc(Br)ccc3o2)C1 ZINC000662117086 567413148 /nfs/dbraw/zinc/41/31/48/567413148.db2.gz MOPPERPRVJONRJ-GFCCVEGCSA-N 0 1 380.286 3.327 10 0 GGAEMN CCCc1cc(C(=O)N2CCOC[C@H]2c2cccc(Br)c2)n[nH]1 ZINC000618776010 567414509 /nfs/dbraw/zinc/41/45/09/567414509.db2.gz MHOCDLXUCVUBKJ-INIZCTEOSA-N 0 1 378.270 3.338 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@H]1CCCC12CC2 ZINC000528361966 567415657 /nfs/dbraw/zinc/41/56/57/567415657.db2.gz DBPBXTXEIIHLIJ-CYBMUJFWSA-N 0 1 375.270 3.431 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCCC12CC2 ZINC000528361966 567415664 /nfs/dbraw/zinc/41/56/64/567415664.db2.gz DBPBXTXEIIHLIJ-CYBMUJFWSA-N 0 1 375.270 3.431 10 0 GGAEMN O=C1[C@@H](NCc2cc(Cl)cc(C(F)(F)F)c2)CCN1C1CCOCC1 ZINC000436295681 567417197 /nfs/dbraw/zinc/41/71/97/567417197.db2.gz QBFHGWFQIMYLHT-HNNXBMFYSA-N 0 1 376.806 3.228 10 0 GGAEMN FC(F)(F)C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCO1 ZINC000662229496 567419166 /nfs/dbraw/zinc/41/91/66/567419166.db2.gz UPNVSMWLEHHCHI-SNVBAGLBSA-N 0 1 378.192 3.479 10 0 GGAEMN CC(C)Nc1cc(Br)ccc1NC(=O)[C@H]1CCCc2n[nH]nc21 ZINC000618885493 567421842 /nfs/dbraw/zinc/42/18/42/567421842.db2.gz NMBAEMKYAYDZJI-NSHDSACASA-N 0 1 378.274 3.446 10 0 GGAEMN O=C(c1scc(Br)c1Br)N1CCN2CCC[C@@H]2C1 ZINC000528439025 567423343 /nfs/dbraw/zinc/42/33/43/567423343.db2.gz CDAQLUOXBRRQBV-MRVPVSSYSA-N 0 1 394.132 3.193 10 0 GGAEMN CC(C)N1CCN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000618952140 567426193 /nfs/dbraw/zinc/42/61/93/567426193.db2.gz RRYMKBGWEKQZFU-OAHLLOKOSA-N 0 1 382.302 3.008 10 0 GGAEMN COCC[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1ccco1 ZINC000502348217 567429672 /nfs/dbraw/zinc/42/96/72/567429672.db2.gz YGEQLJYAYYSVGZ-LBPRGKRZSA-N 0 1 378.226 3.426 10 0 GGAEMN CCN(CCOCCO)Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000502373423 567430564 /nfs/dbraw/zinc/43/05/64/567430564.db2.gz LIURQLCKZPYBDF-UHFFFAOYSA-N 0 1 385.327 3.403 10 0 GGAEMN CO[C@@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550209203 567433982 /nfs/dbraw/zinc/43/39/82/567433982.db2.gz GXWZSLRXXIBMSK-QWHCGFSZSA-N 0 1 379.258 3.378 10 0 GGAEMN O=C(CC(F)(F)F)N1CCC(NC(=O)c2c(O)cc(Cl)cc2Cl)CC1 ZINC000436572578 567434788 /nfs/dbraw/zinc/43/47/88/567434788.db2.gz ZPQPGQKERREFAP-UHFFFAOYSA-N 0 1 399.196 3.372 10 0 GGAEMN C[C@@H]1CCN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)C[C@H](C)O1 ZINC000619121592 567435738 /nfs/dbraw/zinc/43/57/38/567435738.db2.gz VTVMGINIOAOIBZ-NEPJUHHUSA-N 0 1 378.270 3.479 10 0 GGAEMN C[C@@H](CN1CCOCC1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F ZINC000619126113 567435761 /nfs/dbraw/zinc/43/57/61/567435761.db2.gz FAYLQDCGENRSPG-NSHDSACASA-N 0 1 378.357 3.125 10 0 GGAEMN COc1ccc(S(=O)(=O)NC[C@@H]2CCN2C2CCCC2)c(Cl)c1Cl ZINC000528556464 567437555 /nfs/dbraw/zinc/43/75/55/567437555.db2.gz ZOJRZACNAFEPSC-LBPRGKRZSA-N 0 1 393.336 3.297 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 ZINC000662499918 567443002 /nfs/dbraw/zinc/44/30/02/567443002.db2.gz AHEQVHQUUFWHIB-KRWDZBQOSA-N 0 1 389.323 3.253 10 0 GGAEMN OC[C@H]1CCC2(CCOCC2)CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000528635827 567443100 /nfs/dbraw/zinc/44/31/00/567443100.db2.gz BTHKPJGKFZGUTN-CQSZACIVSA-N 0 1 394.313 3.079 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@H](C)c1n[nH]c(C)n1 ZINC000502588214 567443921 /nfs/dbraw/zinc/44/39/21/567443921.db2.gz LNHLJYCCJJIGAR-RKDXNWHRSA-N 0 1 382.262 3.006 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@@H](C)c1n[nH]c(C)n1 ZINC000502588211 567444217 /nfs/dbraw/zinc/44/42/17/567444217.db2.gz LNHLJYCCJJIGAR-BDAKNGLRSA-N 0 1 382.262 3.006 10 0 GGAEMN O=C(c1cc(Br)cc(N2CCCC2)c1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000662516011 567444823 /nfs/dbraw/zinc/44/48/23/567444823.db2.gz YHCNHHUNDCVXEP-IYBDPMFKSA-N 0 1 378.314 3.016 10 0 GGAEMN OC[C@H]1CCC2(CCOCC2)CN1Cc1nc2ccc(Br)cc2o1 ZINC000528645839 567444790 /nfs/dbraw/zinc/44/47/90/567444790.db2.gz QGJGKJCQHUZAJR-CQSZACIVSA-N 0 1 395.297 3.344 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)c3cc(Cl)cc(Br)c3)[C@H]2C1 ZINC000502620116 567445114 /nfs/dbraw/zinc/44/51/14/567445114.db2.gz WNCRIHVUDHPNEY-LSDHHAIUSA-N 0 1 387.705 3.038 10 0 GGAEMN CC(C)c1n[nH]c(C(N)=O)c1NC(=O)CCOc1cccc(Cl)c1Cl ZINC000457162517 567445744 /nfs/dbraw/zinc/44/57/44/567445744.db2.gz JKCBHYXBDUOCHI-UHFFFAOYSA-N 0 1 385.251 3.346 10 0 GGAEMN CCc1c(NC(=O)[C@@H](N)COC(C)C)n[nH]c1-c1ccc(Br)cc1 ZINC000662530079 567446131 /nfs/dbraw/zinc/44/61/31/567446131.db2.gz LTMCMBHIJKPQJK-AWEZNQCLSA-N 0 1 395.301 3.092 10 0 GGAEMN CCN(Cc1cc(Br)ccc1F)C(=O)c1cc(C(C)(C)N)no1 ZINC000662552906 567447644 /nfs/dbraw/zinc/44/76/44/567447644.db2.gz FTFPIZPKFILQJG-UHFFFAOYSA-N 0 1 384.249 3.432 10 0 GGAEMN Cc1cccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1O ZINC000436731943 567447815 /nfs/dbraw/zinc/44/78/15/567447815.db2.gz RPMMEFROMULMMY-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN Cc1cccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1O ZINC000436731943 567447818 /nfs/dbraw/zinc/44/78/18/567447818.db2.gz RPMMEFROMULMMY-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN C[C@@H](NCCNS(=O)(=O)c1ccc(F)cc1F)c1ccc(Cl)c(F)c1 ZINC000570006347 567450764 /nfs/dbraw/zinc/45/07/64/567450764.db2.gz QSZNYYNPGJJFCI-SNVBAGLBSA-N 0 1 392.830 3.386 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCCCc2ccc(Br)cc2F)on1 ZINC000662608461 567452318 /nfs/dbraw/zinc/45/23/18/567452318.db2.gz AIKSEOABRWSBAZ-UHFFFAOYSA-N 0 1 384.249 3.133 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCC2(c3ccccc3Br)CC2)on1 ZINC000662624697 567452516 /nfs/dbraw/zinc/45/25/16/567452516.db2.gz WIWZGKCFIPTTCT-UHFFFAOYSA-N 0 1 378.270 3.093 10 0 GGAEMN Cc1cc(C(=O)N2CCN(C(=O)c3cc(Cl)cc(Cl)c3)[C@H](C)C2)n[nH]1 ZINC000457279869 567452698 /nfs/dbraw/zinc/45/26/98/567452698.db2.gz JOWAUKOWWUCCLS-LLVKDONJSA-N 0 1 381.263 3.012 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000528751400 567453274 /nfs/dbraw/zinc/45/32/74/567453274.db2.gz CONVIWDYNNFOSY-JRATXPSKSA-N 0 1 380.535 3.115 10 0 GGAEMN CN(C)C[C@@H](NCc1cc(=O)n2ccsc2n1)c1ccc(Cl)c(Cl)c1 ZINC000528763690 567453388 /nfs/dbraw/zinc/45/33/88/567453388.db2.gz IAHSZHIOQQBMPC-OAHLLOKOSA-N 0 1 397.331 3.455 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N2CC[C@H](Oc3ccc(Cl)c(Cl)c3)C2)on1 ZINC000662646542 567453531 /nfs/dbraw/zinc/45/35/31/567453531.db2.gz QURPNGFNIPRQTA-NSHDSACASA-N 0 1 384.263 3.469 10 0 GGAEMN CN1CCCC[C@H]1C(=O)NCc1ccc(I)cc1Cl ZINC000619458443 567454079 /nfs/dbraw/zinc/45/40/79/567454079.db2.gz KILFHHVCIWHGQP-ZDUSSCGKSA-N 0 1 392.668 3.045 10 0 GGAEMN CN(C)C[C@@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000528766535 567454674 /nfs/dbraw/zinc/45/46/74/567454674.db2.gz NLFAIIFPJLPOKJ-ZIAGYGMSSA-N 0 1 398.256 3.349 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787627 567456113 /nfs/dbraw/zinc/45/61/13/567456113.db2.gz BULGSLHFZZEIFZ-SWLSCSKDSA-N 0 1 384.263 3.066 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787626 567456224 /nfs/dbraw/zinc/45/62/24/567456224.db2.gz BULGSLHFZZEIFZ-IUODEOHRSA-N 0 1 384.263 3.066 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@H](O)COc2cc(Cl)ccc2Cl)n[nH]1 ZINC000528792749 567456275 /nfs/dbraw/zinc/45/62/75/567456275.db2.gz VJGOLDJPXPLNIB-WFASDCNBSA-N 0 1 384.263 3.066 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@H](O)COc2cc(Cl)ccc2Cl)n[nH]1 ZINC000528792745 567456625 /nfs/dbraw/zinc/45/66/25/567456625.db2.gz VJGOLDJPXPLNIB-SWLSCSKDSA-N 0 1 384.263 3.066 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787625 567456989 /nfs/dbraw/zinc/45/69/89/567456989.db2.gz BULGSLHFZZEIFZ-DOMZBBRYSA-N 0 1 384.263 3.066 10 0 GGAEMN Cc1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)ccc1OCCO ZINC000502859041 567458022 /nfs/dbraw/zinc/45/80/22/567458022.db2.gz GNOHDWQUSVTVNX-UHFFFAOYSA-N 0 1 390.237 3.257 10 0 GGAEMN C[C@@H](Cc1ccc(Br)cc1)NC(=O)N1CCN(C2CCC2)CC1 ZINC000502848406 567458029 /nfs/dbraw/zinc/45/80/29/567458029.db2.gz UWUVHOWYDLTUCN-AWEZNQCLSA-N 0 1 380.330 3.260 10 0 GGAEMN Cn1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)c(C(F)(F)F)n1 ZINC000502847930 567458175 /nfs/dbraw/zinc/45/81/75/567458175.db2.gz RYWYHJFBSBTPGB-UHFFFAOYSA-N 0 1 388.147 3.330 10 0 GGAEMN C[S@](=O)Cc1ccccc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000502865411 567459177 /nfs/dbraw/zinc/45/91/77/567459177.db2.gz YRPUXHKGTVWNJS-QHCPKHFHSA-N 0 1 392.278 3.456 10 0 GGAEMN CC[N@@H+]1CC[C@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C[C@H]1C ZINC000662743904 567460523 /nfs/dbraw/zinc/46/05/23/567460523.db2.gz WZXTUZKPQNZWEZ-MNOVXSKESA-N 0 1 386.359 3.059 10 0 GGAEMN Cc1nc(S(=O)(=O)NC2CCC(C(F)F)CC2)sc1Br ZINC000570145870 567461660 /nfs/dbraw/zinc/46/16/60/567461660.db2.gz FOSPXFBRDOXUIT-UHFFFAOYSA-N 0 1 389.287 3.316 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1nc(C(C)(C)C)no1 ZINC000502972944 567462613 /nfs/dbraw/zinc/46/26/13/567462613.db2.gz XJDOYXJYMGFMNE-MRVPVSSYSA-N 0 1 392.257 3.497 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)Nc2ccc(Br)cc2)CC1 ZINC000528852500 567462655 /nfs/dbraw/zinc/46/26/55/567462655.db2.gz RUAJPVWEWQPFET-UHFFFAOYSA-N 0 1 382.302 3.168 10 0 GGAEMN COCCOc1c(Cl)cc(NC(=O)c2cc(C(C)(C)N)no2)cc1Cl ZINC000662801067 567462689 /nfs/dbraw/zinc/46/26/89/567462689.db2.gz AICZTRMVJHEUPB-UHFFFAOYSA-N 0 1 388.251 3.453 10 0 GGAEMN O=C(Cc1c(F)ccc(Br)c1F)N1CCC(c2cnc[nH]2)CC1 ZINC000502998625 567463882 /nfs/dbraw/zinc/46/38/82/567463882.db2.gz NBMGJGMOZVVVPL-UHFFFAOYSA-N 0 1 384.224 3.399 10 0 GGAEMN CCO[C@H]1C[C@@H](NC(=O)c2cc(Br)cc3nc[nH]c32)C12CCC2 ZINC000502992669 567463935 /nfs/dbraw/zinc/46/39/35/567463935.db2.gz AATXPYWZBYTWAH-KGLIPLIRSA-N 0 1 378.270 3.403 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000528872077 567464006 /nfs/dbraw/zinc/46/40/06/567464006.db2.gz ZFVGCWDROOYFPR-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N2CCN(c3cc(Cl)ccc3Cl)CC2)on1 ZINC000662829032 567464693 /nfs/dbraw/zinc/46/46/93/567464693.db2.gz OZCPDOUGIDPSSX-UHFFFAOYSA-N 0 1 383.279 3.138 10 0 GGAEMN COC[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1ccc(C)o1 ZINC000503026794 567465177 /nfs/dbraw/zinc/46/51/77/567465177.db2.gz XRVJRFXGWKTHAL-CYBMUJFWSA-N 0 1 378.226 3.344 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)on1 ZINC000662857139 567466122 /nfs/dbraw/zinc/46/61/22/567466122.db2.gz FQFZVNQQEFLQMH-UHFFFAOYSA-N 0 1 383.279 3.138 10 0 GGAEMN Cc1ccc(Br)cc1NC(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000528921358 567468094 /nfs/dbraw/zinc/46/80/94/567468094.db2.gz QUNSARQIBAPAOV-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN C[N@@H+]1CC[C@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000550952568 567469509 /nfs/dbraw/zinc/46/95/09/567469509.db2.gz UBPHDYWEKHGSDL-KBPBESRZSA-N 0 1 377.901 3.058 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000550952568 567469511 /nfs/dbraw/zinc/46/95/11/567469511.db2.gz UBPHDYWEKHGSDL-KBPBESRZSA-N 0 1 377.901 3.058 10 0 GGAEMN Cc1ccn2cc(CNC(=O)c3cc(Br)cc4nc[nH]c43)nc2c1 ZINC000503172740 567470728 /nfs/dbraw/zinc/47/07/28/567470728.db2.gz NWNSKSRAVKOIMT-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN O=C(c1[nH]nc2ccc(Cl)cc21)N1CCN(c2ccc(Cl)cn2)CC1 ZINC000570266971 567472157 /nfs/dbraw/zinc/47/21/57/567472157.db2.gz SGACLHFWSUICRQ-UHFFFAOYSA-N 0 1 376.247 3.227 10 0 GGAEMN C[NH+](C)Cc1ccc(NC(=O)[C@@H](C(=O)[O-])C2CCCC2)cc1Br ZINC000663047012 567474863 /nfs/dbraw/zinc/47/48/63/567474863.db2.gz YZWZLFHCWBHZRA-HNNXBMFYSA-N 0 1 383.286 3.340 10 0 GGAEMN COc1cccc([C@@H]2[C@H](NC(=O)[C@@H]3C[C@@]3(C)Br)CCN2C2CC2)c1 ZINC000528983308 567475047 /nfs/dbraw/zinc/47/50/47/567475047.db2.gz UMAZMVKOLJEKKC-DODZYUBVSA-N 0 1 393.325 3.263 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1cccc2c1CCO2 ZINC000478696392 567475117 /nfs/dbraw/zinc/47/51/17/567475117.db2.gz PYKULHQZMGXCOC-UHFFFAOYSA-N 0 1 384.251 3.193 10 0 GGAEMN CC(=O)NCCN(CC[C@@H]1CCCCO1)Cc1ccc(Br)s1 ZINC000503248367 567476649 /nfs/dbraw/zinc/47/66/49/567476649.db2.gz YYVNPHGMHGKJCY-AWEZNQCLSA-N 0 1 389.359 3.408 10 0 GGAEMN CC(=O)NCCN(CC[C@H]1CCCCO1)Cc1ccc(Br)s1 ZINC000503248368 567477339 /nfs/dbraw/zinc/47/73/39/567477339.db2.gz YYVNPHGMHGKJCY-CQSZACIVSA-N 0 1 389.359 3.408 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@H](C)C1)c1nc(-c2ccc(Br)cc2)no1 ZINC000570343524 567477681 /nfs/dbraw/zinc/47/76/81/567477681.db2.gz QRFHFVHDAKIBQP-RYUDHWBXSA-N 0 1 393.285 3.018 10 0 GGAEMN O=C(N[C@@H](c1nn[nH]n1)c1ccc(Cl)c(F)c1)[C@@H]1C[C@H]1c1ccsc1 ZINC000529046118 567480299 /nfs/dbraw/zinc/48/02/99/567480299.db2.gz UVMMTOPQBMMMKT-MISXGVKJSA-N 0 1 377.832 3.063 10 0 GGAEMN COC(=O)c1ccc2c(c1)[C@H](NCc1ccc(S(C)(=O)=O)s1)CCC2 ZINC000594499755 567481367 /nfs/dbraw/zinc/48/13/67/567481367.db2.gz IKPHYIVNYQDWHQ-MRXNPFEDSA-N 0 1 379.503 3.105 10 0 GGAEMN CC(C)c1noc(CCCNC(=O)c2cc(Br)cc3nc[nH]c32)n1 ZINC000503336731 567481528 /nfs/dbraw/zinc/48/15/28/567481528.db2.gz AKPOYEPWUHBISZ-UHFFFAOYSA-N 0 1 392.257 3.194 10 0 GGAEMN CC[C@@H](NCc1cccc(Br)c1)c1cccc(S(N)(=O)=O)c1 ZINC000570426887 567484661 /nfs/dbraw/zinc/48/46/61/567484661.db2.gz DKFDXCUTIIOFHA-MRXNPFEDSA-N 0 1 383.311 3.337 10 0 GGAEMN CSCC(C)(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000503458744 567486040 /nfs/dbraw/zinc/48/60/40/567486040.db2.gz AQTWHDOLVQMGGR-UHFFFAOYSA-N 0 1 383.315 3.240 10 0 GGAEMN CSCC(C)(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000503458744 567486046 /nfs/dbraw/zinc/48/60/46/567486046.db2.gz AQTWHDOLVQMGGR-UHFFFAOYSA-N 0 1 383.315 3.240 10 0 GGAEMN C[C@H]1COC2(CCCC2)CN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000619927465 567486832 /nfs/dbraw/zinc/48/68/32/567486832.db2.gz SGEQCWNYZORZHK-NSHDSACASA-N 0 1 378.270 3.499 10 0 GGAEMN O=S(=O)(N[C@@H]1CCCc2cn[nH]c21)c1cccc(Br)c1Cl ZINC000551212480 567487985 /nfs/dbraw/zinc/48/79/85/567487985.db2.gz GTADAYOSCBIIII-SNVBAGLBSA-N 0 1 390.690 3.182 10 0 GGAEMN O=C1CCCc2cc(S(=O)(=O)Nc3cc(Cl)c(Cl)cn3)ccc2N1 ZINC000437300113 567489494 /nfs/dbraw/zinc/48/94/94/567489494.db2.gz YWILPAOYPZVJON-UHFFFAOYSA-N 0 1 386.260 3.464 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(Cc2cn(-c3ccccc3Cl)nc2C)C1 ZINC000594606312 567489799 /nfs/dbraw/zinc/48/97/99/567489799.db2.gz KGTYJGDNNCNSKO-HNNXBMFYSA-N 0 1 379.913 3.172 10 0 GGAEMN COC(=O)[C@H]1CSCCN(Cc2cn(-c3ccccc3Cl)nc2C)C1 ZINC000594606314 567490132 /nfs/dbraw/zinc/49/01/32/567490132.db2.gz KGTYJGDNNCNSKO-OAHLLOKOSA-N 0 1 379.913 3.172 10 0 GGAEMN CN(CCC(F)(F)F)[C@H](CNCc1cn(C)nn1)c1ccc(Cl)cc1 ZINC000551236558 567490812 /nfs/dbraw/zinc/49/08/12/567490812.db2.gz QWNAMHWICKOLRU-OAHLLOKOSA-N 0 1 375.826 3.184 10 0 GGAEMN COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503516928 567491334 /nfs/dbraw/zinc/49/13/34/567491334.db2.gz CQMZNIXKNZRTFV-YVEFUNNKSA-N 0 1 394.269 3.177 10 0 GGAEMN Cc1nn(C)c(C)c1CCCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503529416 567491527 /nfs/dbraw/zinc/49/15/27/567491527.db2.gz MWHYAZOGOUSRTR-UHFFFAOYSA-N 0 1 390.285 3.038 10 0 GGAEMN O=C(N[C@H](CO)c1c(F)cccc1F)c1cc(Br)cc2nc[nH]c21 ZINC000503516507 567491728 /nfs/dbraw/zinc/49/17/28/567491728.db2.gz BCYQAMPYWHKCJQ-CYBMUJFWSA-N 0 1 396.191 3.067 10 0 GGAEMN CCc1ccc([C@@H](COC)N[C@H](C)Cn2cc(Br)ccc2=O)o1 ZINC000551282874 567494203 /nfs/dbraw/zinc/49/42/03/567494203.db2.gz GJCKCITUZDSRAK-IUODEOHRSA-N 0 1 383.286 3.132 10 0 GGAEMN CCc1nc(S(=O)(=O)Nc2nccc(C)c2Br)cn1CC1CC1 ZINC000663300627 567494275 /nfs/dbraw/zinc/49/42/75/567494275.db2.gz UJIRTUWCIBUXOI-UHFFFAOYSA-N 0 1 399.314 3.122 10 0 GGAEMN CC(C)(C)S(=O)(=O)CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000503570515 567495393 /nfs/dbraw/zinc/49/53/93/567495393.db2.gz ASKJXDVLAQRYHL-AWEZNQCLSA-N 0 1 383.901 3.093 10 0 GGAEMN CN1C(=O)N([C@@H]2CCc3nc[nH]c3C2)C(=O)[C@@H]1c1cccc(Cl)c1Cl ZINC000663318761 567495939 /nfs/dbraw/zinc/49/59/39/567495939.db2.gz MQSSWMBSSIARNX-PSLIRLAXSA-N 0 1 379.247 3.209 10 0 GGAEMN NC(=O)[C@@H](NCCc1ccc2ccccc2n1)c1cccc(Br)c1 ZINC000479027290 567497000 /nfs/dbraw/zinc/49/70/00/567497000.db2.gz ZJQLOHNETXBMKG-SFHVURJKSA-N 0 1 384.277 3.356 10 0 GGAEMN O=C(c1cc(F)cc2nn[nH]c21)N1CCc2cccc(Br)c2C1 ZINC000503636318 567497313 /nfs/dbraw/zinc/49/73/13/567497313.db2.gz NRXIHXXREZIMBK-UHFFFAOYSA-N 0 1 375.201 3.058 10 0 GGAEMN O=C(Nc1cnn(CC(F)(F)F)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503652278 567499698 /nfs/dbraw/zinc/49/96/98/567499698.db2.gz JLTOIOFKTVKEMK-UHFFFAOYSA-N 0 1 388.147 3.337 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC(C)(C)C ZINC000503683715 567500483 /nfs/dbraw/zinc/50/04/83/567500483.db2.gz GYVSGTULKJGHBI-CYBMUJFWSA-N 0 1 396.285 3.422 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)[C@@H]1Cc3ccccc3CN1)CC2 ZINC000570633454 567500837 /nfs/dbraw/zinc/50/08/37/567500837.db2.gz WESSDXQLGYBBNK-IBGZPJMESA-N 0 1 385.305 3.357 10 0 GGAEMN CC(C)OCC[C@H](O)CNCc1cc(Cl)ccc1I ZINC000594717909 567502140 /nfs/dbraw/zinc/50/21/40/567502140.db2.gz HGKFMGBZGNYPTE-ZDUSSCGKSA-N 0 1 397.684 3.210 10 0 GGAEMN O[C@@H](CNCc1cc(Cl)ccc1I)CC(F)(F)F ZINC000594718273 567502402 /nfs/dbraw/zinc/50/24/02/567502402.db2.gz MUMUNTMREQEEJU-SECBINFHSA-N 0 1 393.574 3.348 10 0 GGAEMN CNS(=O)(=O)CCCN(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000551404853 567502825 /nfs/dbraw/zinc/50/28/25/567502825.db2.gz BPOLBQWUYVNCGI-UHFFFAOYSA-N 0 1 392.365 3.095 10 0 GGAEMN Cc1c(Br)c2ccccc2n1CC(=O)N1CCN(CC2CC2)CC1 ZINC000620201347 567503504 /nfs/dbraw/zinc/50/35/04/567503504.db2.gz QPYYEAPSPBUOHA-UHFFFAOYSA-N 0 1 390.325 3.266 10 0 GGAEMN C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)Cc1ccccc1 ZINC000503717583 567503669 /nfs/dbraw/zinc/50/36/69/567503669.db2.gz PFMGLIFQIVCJQB-NSHDSACASA-N 0 1 386.249 3.256 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCNC[C@@H]1C(C)C ZINC000529326119 567505738 /nfs/dbraw/zinc/50/57/38/567505738.db2.gz XHRPXSBWWGDEII-IUODEOHRSA-N 0 1 384.318 3.158 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1cc2c(c(Br)c1)OCO2 ZINC000551429104 567506005 /nfs/dbraw/zinc/50/60/05/567506005.db2.gz XYGATQSPSRIVEA-CYBMUJFWSA-N 0 1 383.286 3.059 10 0 GGAEMN COC(=O)c1csc(S(=O)(=O)N[C@H](c2ccc(F)cc2)C(F)(F)F)c1 ZINC000479126253 567506063 /nfs/dbraw/zinc/50/60/63/567506063.db2.gz XDEAHQHFWWHAOG-GFCCVEGCSA-N 0 1 397.371 3.256 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1nc2ccc(Br)cc2n1C ZINC000551428365 567506195 /nfs/dbraw/zinc/50/61/95/567506195.db2.gz RLQHJMJQPOKWCG-CQSZACIVSA-N 0 1 393.329 3.217 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)NCc2cc(F)cc(Br)c2)n[nH]1 ZINC000457968295 567509470 /nfs/dbraw/zinc/50/94/70/567509470.db2.gz XLXOUSDLTUMXJI-UHFFFAOYSA-N 0 1 384.253 3.003 10 0 GGAEMN COC[C@](C)(NS(=O)(=O)c1ccc(OC)c(Cl)c1Cl)C(F)(F)F ZINC000479155387 567509699 /nfs/dbraw/zinc/50/96/99/567509699.db2.gz MONAEQWNWZZQMH-NSHDSACASA-N 0 1 396.214 3.248 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)Cc2c(F)ccc(Br)c2F)n[nH]1 ZINC000458028616 567514497 /nfs/dbraw/zinc/51/44/97/567514497.db2.gz NVKOKGXKAZCLIB-UHFFFAOYSA-N 0 1 387.228 3.002 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NC[C@@]1(C)CC1(F)F ZINC000594856552 567521183 /nfs/dbraw/zinc/52/11/83/567521183.db2.gz HQRZNEDPFNJMMV-GFCCVEGCSA-N 0 1 388.219 3.104 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)N[C@H]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000663678593 567521358 /nfs/dbraw/zinc/52/13/58/567521358.db2.gz MXKOMEZYTHUSRR-GDNZZTSVSA-N 0 1 375.357 3.099 10 0 GGAEMN CC(C)(C(=O)N1CC[C@H](c2nc[nH]n2)C1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000529509235 567521946 /nfs/dbraw/zinc/52/19/46/567521946.db2.gz WPNGTJKEGRPGNE-HZMBPMFUSA-N 0 1 383.279 3.187 10 0 GGAEMN COC(=O)[C@@](C)(CCF)NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000594867070 567522615 /nfs/dbraw/zinc/52/26/15/567522615.db2.gz UNGGUBRSSMNCFV-GFCCVEGCSA-N 0 1 392.663 3.216 10 0 GGAEMN Cc1[nH]ncc1CNC(=O)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000663688299 567523099 /nfs/dbraw/zinc/52/30/99/567523099.db2.gz DGDYTRTYXWPOFH-UHFFFAOYSA-N 0 1 377.286 3.303 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H](C(=O)OC)c1ccccc1Br ZINC000594882379 567524131 /nfs/dbraw/zinc/52/41/31/567524131.db2.gz TUOSCTBNEMKNER-LLVKDONJSA-N 0 1 386.271 3.163 10 0 GGAEMN Brc1cccc(-c2n[nH]c(-c3noc(C=C[C@@H]4CCCO4)n3)n2)c1 ZINC000643966523 567525084 /nfs/dbraw/zinc/52/50/84/567525084.db2.gz XVSPJWVSRMXIDO-SYTKJHMZSA-N 0 1 388.225 3.476 10 0 GGAEMN COC(=O)[C@@H]1C[C@@H]1[C@@H](C)N[C@H](C)c1cc2c(cc1Br)OCCO2 ZINC000594922656 567525170 /nfs/dbraw/zinc/52/51/70/567525170.db2.gz GYYRJHRVLSSBPW-PRULPYPASA-N 0 1 384.270 3.069 10 0 GGAEMN CCN1CCN(c2nnc([C@H]3CCCS3)n2Cc2cccs2)C[C@H]1C ZINC000643965960 567525594 /nfs/dbraw/zinc/52/55/94/567525594.db2.gz XPYQKIGQFKRWBL-GDBMZVCRSA-N 0 1 377.583 3.486 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@@H](c2cncc(Br)c2)C2CC2)CC1 ZINC000551641399 567526364 /nfs/dbraw/zinc/52/63/64/567526364.db2.gz NQXOKPLCZRRHOV-QGZVFWFLSA-N 0 1 393.329 3.246 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@H](c2cncc(Br)c2)C2CC2)CC1 ZINC000551641398 567526381 /nfs/dbraw/zinc/52/63/81/567526381.db2.gz NQXOKPLCZRRHOV-KRWDZBQOSA-N 0 1 393.329 3.246 10 0 GGAEMN Brc1cccc(OCCSCCNCc2cc3n(n2)CCC3)c1 ZINC000594926821 567527325 /nfs/dbraw/zinc/52/73/25/567527325.db2.gz SFHLFBFCOSLBRY-UHFFFAOYSA-N 0 1 396.354 3.494 10 0 GGAEMN Brc1cnc(C2CC2)nc1N1CCC[C@H](c2nc(C3CC3)n[nH]2)C1 ZINC000663758974 567528533 /nfs/dbraw/zinc/52/85/33/567528533.db2.gz BVNGMDWHABNXPW-LBPRGKRZSA-N 0 1 389.301 3.496 10 0 GGAEMN Brc1cnc(C2CC2)nc1N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000663758974 567528541 /nfs/dbraw/zinc/52/85/41/567528541.db2.gz BVNGMDWHABNXPW-LBPRGKRZSA-N 0 1 389.301 3.496 10 0 GGAEMN CN(C(=O)c1[nH]nc2ccc(I)cc21)C1CC(C)(C)C1 ZINC000458181744 567529010 /nfs/dbraw/zinc/52/90/10/567529010.db2.gz INFMFOURINIKBO-UHFFFAOYSA-N 0 1 383.233 3.428 10 0 GGAEMN Clc1cc(I)cc(CNCc2cnn3c2CCC3)c1 ZINC000594950580 567529459 /nfs/dbraw/zinc/52/94/59/567529459.db2.gz NPBXBMQFTMFPBZ-UHFFFAOYSA-N 0 1 387.652 3.377 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000504326361 567530305 /nfs/dbraw/zinc/53/03/05/567530305.db2.gz WKCKNFUQPAJGPT-CQSZACIVSA-N 0 1 376.254 3.164 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1ccc(OC)c(OC)c1Br ZINC000551720784 567531748 /nfs/dbraw/zinc/53/17/48/567531748.db2.gz IVDXPVFBYUNRPC-AWEZNQCLSA-N 0 1 399.329 3.347 10 0 GGAEMN C[C@H](N(C)C(=O)c1[nH]nc2ccc(I)cc21)C1(C)CC1 ZINC000438464297 567532208 /nfs/dbraw/zinc/53/22/08/567532208.db2.gz GOKULGSBILOTRL-VIFPVBQESA-N 0 1 383.233 3.428 10 0 GGAEMN Cc1nnc(SCCC(=O)N2Cc3ccc(C)c(Br)c3C2)[nH]1 ZINC000620654488 567534009 /nfs/dbraw/zinc/53/40/09/567534009.db2.gz SCHBEMVYCAQVPZ-UHFFFAOYSA-N 0 1 381.299 3.209 10 0 GGAEMN COc1ncccc1CN[C@H]1CCc2ccc(I)cc21 ZINC000595006215 567534017 /nfs/dbraw/zinc/53/40/17/567534017.db2.gz HEGOUFJCDNMFQT-HNNXBMFYSA-N 0 1 380.229 3.472 10 0 GGAEMN CN(C)CCN(Cc1cccs1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000438540585 567534369 /nfs/dbraw/zinc/53/43/69/567534369.db2.gz LVGBRCAQZJTLCF-UHFFFAOYSA-N 0 1 395.322 3.284 10 0 GGAEMN C[C@H](NC[C@@H]1CCC(C)(C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479430527 567535074 /nfs/dbraw/zinc/53/50/74/567535074.db2.gz KZUMLGXFYHTSMC-UWVGGRQHSA-N 0 1 381.325 3.249 10 0 GGAEMN CCS(=O)(=O)c1c(Cl)cccc1CNCCc1cnc(C2CC2)nc1 ZINC000479456409 567535734 /nfs/dbraw/zinc/53/57/34/567535734.db2.gz PKUVIEVONKZQQG-UHFFFAOYSA-N 0 1 379.913 3.133 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOc2cc(Br)ccc2C1 ZINC000620708485 567538541 /nfs/dbraw/zinc/53/85/41/567538541.db2.gz MADBURVHWILYBH-CYBMUJFWSA-N 0 1 376.254 3.013 10 0 GGAEMN CN(CC(=O)N(C)[C@H]1CCOc2ccc(Br)cc21)[C@@H]1CCSC1 ZINC000438636746 567538687 /nfs/dbraw/zinc/53/86/87/567538687.db2.gz LNAAHNDUOOTRLB-HIFRSBDPSA-N 0 1 399.354 3.168 10 0 GGAEMN CC1CCN(CC(=O)N(C)[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000438627628 567538877 /nfs/dbraw/zinc/53/88/77/567538877.db2.gz MUTUVPUBIPWSRX-INIZCTEOSA-N 0 1 381.314 3.463 10 0 GGAEMN CN(CC(=O)N(C)[C@H]1CCOc2ccc(Br)cc21)[C@H]1CCSC1 ZINC000438636750 567538897 /nfs/dbraw/zinc/53/88/97/567538897.db2.gz LNAAHNDUOOTRLB-ZFWWWQNUSA-N 0 1 399.354 3.168 10 0 GGAEMN C[NH+](C)CCOc1ccc([N-]S(=O)(=O)c2ccc3ncsc3c2)cc1 ZINC000479487878 567539020 /nfs/dbraw/zinc/53/90/20/567539020.db2.gz FWKDZFMAIRBRFT-UHFFFAOYSA-N 0 1 377.491 3.038 10 0 GGAEMN CN(C(=O)c1ccc2[nH]nnc2c1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000438640236 567539390 /nfs/dbraw/zinc/53/93/90/567539390.db2.gz GJNLGTSJNJHSKD-OAHLLOKOSA-N 0 1 387.237 3.316 10 0 GGAEMN O=S(=O)(Nc1cc(Cl)ccc1-n1cncn1)c1ccc2ncsc2c1 ZINC000479503698 567540687 /nfs/dbraw/zinc/54/06/87/567540687.db2.gz OTSQQJLLFBNMRD-UHFFFAOYSA-N 0 1 391.865 3.331 10 0 GGAEMN COc1cc(OC)c(OC)cc1NS(=O)(=O)c1ccc2ncsc2c1 ZINC000479529349 567541788 /nfs/dbraw/zinc/54/17/88/567541788.db2.gz REDRALTZHMPXQQ-UHFFFAOYSA-N 0 1 380.447 3.123 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)NC[C@@H]1CCN1Cc1ccccc1 ZINC000620778671 567542312 /nfs/dbraw/zinc/54/23/12/567542312.db2.gz HGPKXKYDXYLRCN-KRWDZBQOSA-N 0 1 389.293 3.088 10 0 GGAEMN O=S(=O)(Nc1cccc(Cl)c1-n1cncn1)c1ccc2ncsc2c1 ZINC000479522043 567542218 /nfs/dbraw/zinc/54/22/18/567542218.db2.gz LSXJNOXFDQYQON-UHFFFAOYSA-N 0 1 391.865 3.331 10 0 GGAEMN CCc1nc(CNC(=O)N(C)C2CCN(CCC(F)(F)F)CC2)cs1 ZINC000458344606 567542280 /nfs/dbraw/zinc/54/22/80/567542280.db2.gz QDTMMWDQFOBCON-UHFFFAOYSA-N 0 1 378.464 3.264 10 0 GGAEMN O=C(Cc1cscc1Br)NC[C@@H]1CCN1Cc1ccccc1 ZINC000620778154 567542376 /nfs/dbraw/zinc/54/23/76/567542376.db2.gz GIEAJDXTJUGPIJ-HNNXBMFYSA-N 0 1 379.323 3.444 10 0 GGAEMN COC[C@@H](CN1CCC[C@H]1c1ccc(I)cc1)OC ZINC000595333574 567554475 /nfs/dbraw/zinc/55/44/75/567554475.db2.gz KMUGHOSHGMTNGI-CABCVRRESA-N 0 1 375.250 3.090 10 0 GGAEMN CO[C@@H](C)c1cccc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)c1 ZINC000438769013 567542862 /nfs/dbraw/zinc/54/28/62/567542862.db2.gz FYWMEINTZKWSPK-VIFPVBQESA-N 0 1 382.825 3.283 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000551921897 567543695 /nfs/dbraw/zinc/54/36/95/567543695.db2.gz HOTUVJDTFDCQMQ-ONGXEEELSA-N 0 1 398.688 3.267 10 0 GGAEMN CC(F)(F)CCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000458422879 567545839 /nfs/dbraw/zinc/54/58/39/567545839.db2.gz KFNBLDGSSPYZOU-UHFFFAOYSA-N 0 1 388.216 3.079 10 0 GGAEMN CC(F)(F)CCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000458422879 567545844 /nfs/dbraw/zinc/54/58/44/567545844.db2.gz KFNBLDGSSPYZOU-UHFFFAOYSA-N 0 1 388.216 3.079 10 0 GGAEMN CC(C)(C)C1CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000458413146 567546452 /nfs/dbraw/zinc/54/64/52/567546452.db2.gz BILWOMHYYZTKQA-UHFFFAOYSA-N 0 1 392.301 3.422 10 0 GGAEMN CC(C)(C)C1CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000458413146 567546459 /nfs/dbraw/zinc/54/64/59/567546459.db2.gz BILWOMHYYZTKQA-UHFFFAOYSA-N 0 1 392.301 3.422 10 0 GGAEMN COCc1nc(CNC(=O)NCC(C)(C)c2c(Cl)cccc2Cl)n[nH]1 ZINC000663996867 567547006 /nfs/dbraw/zinc/54/70/06/567547006.db2.gz KTJISPBGPJLXAJ-UHFFFAOYSA-N 0 1 386.283 3.035 10 0 GGAEMN COCc1nnc(CNC(=O)NCC(C)(C)c2c(Cl)cccc2Cl)[nH]1 ZINC000663996867 567547010 /nfs/dbraw/zinc/54/70/10/567547010.db2.gz KTJISPBGPJLXAJ-UHFFFAOYSA-N 0 1 386.283 3.035 10 0 GGAEMN CC(C)[C@H]1CN(C(=O)c2s[n-]c(=O)c2Cl)CC[N@H+]1Cc1ccccc1 ZINC000529801739 567547243 /nfs/dbraw/zinc/54/72/43/567547243.db2.gz CYGYYRDXZLJYGT-CQSZACIVSA-N 0 1 379.913 3.485 10 0 GGAEMN NS(=O)(=O)C[C@H]1CCCN(Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000552043460 567552892 /nfs/dbraw/zinc/55/28/92/567552892.db2.gz NWVZIKXTODYHNJ-KRWDZBQOSA-N 0 1 376.547 3.338 10 0 GGAEMN Cc1cc(Br)ccc1C(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000529913281 567554311 /nfs/dbraw/zinc/55/43/11/567554311.db2.gz GJHMBVXDSFAIRF-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN COC[C@@H](CN1CCC[C@@H]1c1ccccc1I)OC ZINC000595326236 567554308 /nfs/dbraw/zinc/55/43/08/567554308.db2.gz YQJMDIVZDQWOTA-IUODEOHRSA-N 0 1 375.250 3.090 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC(C)(N3CCOCC3)CC2)c(Br)c1 ZINC000529909043 567554515 /nfs/dbraw/zinc/55/45/15/567554515.db2.gz KITGEPWGTSVYJK-UHFFFAOYSA-N 0 1 395.341 3.013 10 0 GGAEMN COC[C@H](CN1CCC[C@H]1c1ccc(I)cc1)OC ZINC000595333575 567554828 /nfs/dbraw/zinc/55/48/28/567554828.db2.gz KMUGHOSHGMTNGI-GJZGRUSLSA-N 0 1 375.250 3.090 10 0 GGAEMN O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCN([C@H]2CCC[C@@H]2O)CC1 ZINC000644521617 567554802 /nfs/dbraw/zinc/55/48/02/567554802.db2.gz BHGZRBRLVAAWEQ-ILXRZTDVSA-N 0 1 383.945 3.020 10 0 GGAEMN O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCN([C@@H]2CCC[C@@H]2O)CC1 ZINC000644521618 567554852 /nfs/dbraw/zinc/55/48/52/567554852.db2.gz BHGZRBRLVAAWEQ-KFWWJZLASA-N 0 1 383.945 3.020 10 0 GGAEMN Cc1cc(Br)cc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1C ZINC000529908435 567554739 /nfs/dbraw/zinc/55/47/39/567554739.db2.gz HCIVXSMTAXLQLB-UHFFFAOYSA-N 0 1 395.341 3.393 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)CCc2ccccc2Br)CC1 ZINC000529914916 567555300 /nfs/dbraw/zinc/55/53/00/567555300.db2.gz ZTWLZDHVPKDTPB-UHFFFAOYSA-N 0 1 395.341 3.095 10 0 GGAEMN Cc1ccc(Br)cc1C(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000529914505 567555409 /nfs/dbraw/zinc/55/54/09/567555409.db2.gz RWQFPHZXKAUGGQ-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN Cc1cc(Br)cc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1 ZINC000529911594 567555470 /nfs/dbraw/zinc/55/54/70/567555470.db2.gz VBFSCDXGGHBXJQ-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN COc1cc2nccc(N3CC[C@@H](Cn4ccnn4)C3)c2cc1Br ZINC000664166188 567555651 /nfs/dbraw/zinc/55/56/51/567555651.db2.gz RNDVBTKVDFJWGA-GFCCVEGCSA-N 0 1 388.269 3.124 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCc2nc(C3CC3)ncc2C1 ZINC000529928525 567556216 /nfs/dbraw/zinc/55/62/16/567556216.db2.gz PYGKJZMKOJUIGG-UHFFFAOYSA-N 0 1 398.264 3.191 10 0 GGAEMN COc1cc2nccc(N3CC[C@H](Cn4ccnn4)C3)c2cc1Br ZINC000664166189 567556511 /nfs/dbraw/zinc/55/65/11/567556511.db2.gz RNDVBTKVDFJWGA-LBPRGKRZSA-N 0 1 388.269 3.124 10 0 GGAEMN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1Br ZINC000552097187 567559539 /nfs/dbraw/zinc/55/95/39/567559539.db2.gz VTXJCDPFJDAHCQ-WCQYABFASA-N 0 1 393.322 3.053 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)CC1 ZINC000552124576 567560213 /nfs/dbraw/zinc/56/02/13/567560213.db2.gz YVAVOCUVJKHKQX-HNNXBMFYSA-N 0 1 382.291 3.256 10 0 GGAEMN C[C@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@](C)(C(F)F)O1 ZINC000621129699 567561313 /nfs/dbraw/zinc/56/13/13/567561313.db2.gz NPBXZPDAIDHBKP-VXJOIVPMSA-N 0 1 388.212 3.210 10 0 GGAEMN CN1C(=O)Cc2cc(NC(=O)c3cc(Br)cc4nc[nH]c43)ccc21 ZINC000505131706 567561407 /nfs/dbraw/zinc/56/14/07/567561407.db2.gz XXQRLLPVINSAGB-UHFFFAOYSA-N 0 1 385.221 3.097 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCO[C@@](C)(C(F)F)C1)c1ccc(Cl)cc1 ZINC000664291840 567561949 /nfs/dbraw/zinc/56/19/49/567561949.db2.gz JIRVJEUUJJKHCD-RHSMWYFYSA-N 0 1 375.847 3.008 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2cc(Br)cnc2OCC2CC2)n[nH]1 ZINC000552127091 567562073 /nfs/dbraw/zinc/56/20/73/567562073.db2.gz RNIFWDDHVGAVPA-JTQLQIEISA-N 0 1 393.285 3.025 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1cc(C(N)=O)cs1)c1ccc(Cl)c(Cl)c1 ZINC000530032350 567563189 /nfs/dbraw/zinc/56/31/89/567563189.db2.gz QTSGKGKRPIVURX-CYBMUJFWSA-N 0 1 386.304 3.187 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@@H]1CCCC12OCCO2)c1ccc(Cl)c(Cl)c1 ZINC000530032929 567563241 /nfs/dbraw/zinc/56/32/41/567563241.db2.gz LRDBIWREKZDSOD-BBRMVZONSA-N 0 1 387.307 3.256 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)CC1 ZINC000552143580 567563527 /nfs/dbraw/zinc/56/35/27/567563527.db2.gz DETFKZZGUMHRCJ-OAHLLOKOSA-N 0 1 382.291 3.256 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@H]1CCC[C@H](C(N)=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000530032772 567564003 /nfs/dbraw/zinc/56/40/03/567564003.db2.gz JVZSGKMXQLURFB-XEZPLFJOSA-N 0 1 386.323 3.004 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1cc2c([nH]1)CCOC2)c1ccc(Cl)c(Cl)c1 ZINC000530032814 567564170 /nfs/dbraw/zinc/56/41/70/567564170.db2.gz KCCQROVZGYRRJR-KRWDZBQOSA-N 0 1 382.291 3.427 10 0 GGAEMN Cn1cc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c(C(F)(F)F)n1 ZINC000644604499 567565155 /nfs/dbraw/zinc/56/51/55/567565155.db2.gz FXVHETNNWMHYOK-SNVBAGLBSA-N 0 1 398.212 3.275 10 0 GGAEMN Cn1c(=O)[nH]c2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc21 ZINC000505215301 567565501 /nfs/dbraw/zinc/56/55/01/567565501.db2.gz AOAHTLGABRTVMB-UHFFFAOYSA-N 0 1 386.209 3.170 10 0 GGAEMN CCOC(=O)c1c(C)[nH]nc1CN[C@H]1CCOc2c(Br)cccc21 ZINC000595471875 567566475 /nfs/dbraw/zinc/56/64/75/567566475.db2.gz FWJXGSLBOAZVID-ZDUSSCGKSA-N 0 1 394.269 3.271 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccccc1NC(=O)c1cccs1)C1CC1 ZINC000571524334 567568665 /nfs/dbraw/zinc/56/86/65/567568665.db2.gz WLMMWPLGHIKUDT-HNNXBMFYSA-N 0 1 380.491 3.167 10 0 GGAEMN Nc1ccncc1C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000571523038 567569408 /nfs/dbraw/zinc/56/94/08/567569408.db2.gz HGUNNUXZXNWZGW-UHFFFAOYSA-N 0 1 379.291 3.195 10 0 GGAEMN O=C(N[C@H]1CCCc2cn[nH]c21)N1CCOc2cc(Br)ccc2C1 ZINC000664471302 567569925 /nfs/dbraw/zinc/56/99/25/567569925.db2.gz ZNUHCODKAFHGID-AWEZNQCLSA-N 0 1 391.269 3.154 10 0 GGAEMN O=S1(=O)CC[C@H](N(CCCCc2cccc(Cl)c2)C[C@@H]2CCCO2)C1 ZINC000621271102 567571208 /nfs/dbraw/zinc/57/12/08/567571208.db2.gz XCCGOEXYJKGORX-OALUTQOASA-N 0 1 385.957 3.331 10 0 GGAEMN NC(=O)[C@@H](NC[C@@H]1CCN1C1CCCCC1)c1ccc(Br)cc1F ZINC000530128911 567571270 /nfs/dbraw/zinc/57/12/70/567571270.db2.gz DDMJAOFIEYWJKR-YOEHRIQHSA-N 0 1 398.320 3.111 10 0 GGAEMN CN(C(=O)NCC1(C(F)(F)F)CC1)C1CCN(CCC(F)(F)F)CC1 ZINC000458767048 567573986 /nfs/dbraw/zinc/57/39/86/567573986.db2.gz LLEAPXQHONGQKK-UHFFFAOYSA-N 0 1 375.357 3.387 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)NCCc1csc(-c2ccc(Cl)cc2)n1 ZINC000664543713 567575304 /nfs/dbraw/zinc/57/53/04/567575304.db2.gz PVKNQDGWZXHTJJ-UHFFFAOYSA-N 0 1 378.929 3.209 10 0 GGAEMN C[C@@H]1C[C@@H](S(=O)(=O)NCC(F)(F)c2ccc(Br)cc2)CCO1 ZINC000621304926 567575895 /nfs/dbraw/zinc/57/58/95/567575895.db2.gz LILKDWGRKWNHSF-MFKMUULPSA-N 0 1 398.269 3.028 10 0 GGAEMN C[C@H]1C[C@H](S(=O)(=O)NCC(F)(F)c2ccc(Br)cc2)CCO1 ZINC000621304925 567576657 /nfs/dbraw/zinc/57/66/57/567576657.db2.gz LILKDWGRKWNHSF-GXFFZTMASA-N 0 1 398.269 3.028 10 0 GGAEMN O=S(=O)(NCC[C@H]1CC1(F)F)c1cc(F)c(Br)cc1F ZINC000621303350 567576957 /nfs/dbraw/zinc/57/69/57/567576957.db2.gz DBRCGZNQSMWOBL-LURJTMIESA-N 0 1 376.169 3.051 10 0 GGAEMN COC(C)(C)CS(=O)(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1 ZINC000439256567 567577680 /nfs/dbraw/zinc/57/76/80/567577680.db2.gz IXVLIVICRMKPSG-UHFFFAOYSA-N 0 1 377.388 3.058 10 0 GGAEMN FC(F)(F)[C@H](CN[C@H]1CCCOc2ccc(Cl)cc21)N1CCOCC1 ZINC000552338565 567578848 /nfs/dbraw/zinc/57/88/48/567578848.db2.gz HYHSCAWOXKVHAF-HOCLYGCPSA-N 0 1 378.822 3.406 10 0 GGAEMN Cc1ccc(OC(F)F)c([C@@H](C)NC[C@@H]2CCCCN2S(C)(=O)=O)c1 ZINC000552338441 567578977 /nfs/dbraw/zinc/57/89/77/567578977.db2.gz FSEHMGLXRSMWPM-KGLIPLIRSA-N 0 1 376.469 3.061 10 0 GGAEMN O=C(NCCc1nc2ccc(F)cc2[nH]1)C(=O)c1ccc(Br)cc1 ZINC000480055869 567579063 /nfs/dbraw/zinc/57/90/63/567579063.db2.gz HTBURQIBDOVORQ-UHFFFAOYSA-N 0 1 390.212 3.006 10 0 GGAEMN O=C(CN1CC[C@H](Sc2cccc(Cl)c2)C1)N1CCOC[C@@H]1C1CC1 ZINC000644786079 567579103 /nfs/dbraw/zinc/57/91/03/567579103.db2.gz FPCLRWCDUBZHHI-ZWKOTPCHSA-N 0 1 380.941 3.144 10 0 GGAEMN O=C([O-])[C@@H]1c2ccoc2CC[N@@H+]1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000530170629 567579674 /nfs/dbraw/zinc/57/96/74/567579674.db2.gz UJPAXUOPXTXUJP-ZBEGNZNMSA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1F ZINC000552340437 567580199 /nfs/dbraw/zinc/58/01/99/567580199.db2.gz URTNLDSVGIWHDA-YPMHNXCESA-N 0 1 393.322 3.053 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@H+](C[C@@H](O)c1cccc(Br)c1)CC2 ZINC000530167682 567580307 /nfs/dbraw/zinc/58/03/07/567580307.db2.gz HHNSZDKSUVOFCX-QGZVFWFLSA-N 0 1 394.240 3.378 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@@H+](C[C@@H](O)c1cccc(Br)c1)CC2 ZINC000530167682 567580312 /nfs/dbraw/zinc/58/03/12/567580312.db2.gz HHNSZDKSUVOFCX-QGZVFWFLSA-N 0 1 394.240 3.378 10 0 GGAEMN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cc(Cl)ccc1OC(F)F ZINC000552340020 567580503 /nfs/dbraw/zinc/58/05/03/567580503.db2.gz JFDMUGLEJKAPCQ-AAEUAGOBSA-N 0 1 396.887 3.406 10 0 GGAEMN O=C([O-])[C@@H]1c2ccoc2CC[N@@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000530171147 567580592 /nfs/dbraw/zinc/58/05/92/567580592.db2.gz WITOHVHUQCQSRO-BZNIZROVSA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1nc(-c2ccccc2)cs1 ZINC000552340452 567580798 /nfs/dbraw/zinc/58/07/98/567580798.db2.gz VICJRXLQVYBZLO-GDBMZVCRSA-N 0 1 379.551 3.275 10 0 GGAEMN CCc1nc(CNC(=O)N2CCC[C@@H]2c2ccc(Br)cc2)n[nH]1 ZINC000458878953 567581712 /nfs/dbraw/zinc/58/17/12/567581712.db2.gz VDASPPWQHZMKNA-CYBMUJFWSA-N 0 1 378.274 3.176 10 0 GGAEMN O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1nc(C2CC2)ncc1Br ZINC000530190948 567581860 /nfs/dbraw/zinc/58/18/60/567581860.db2.gz WJFAQIRHDNVQBW-AWEZNQCLSA-N 0 1 393.329 3.253 10 0 GGAEMN CN(C[C@H](O)Cc1ccccc1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000552357320 567582162 /nfs/dbraw/zinc/58/21/62/567582162.db2.gz TZHVWGLUFKFBCZ-CQSZACIVSA-N 0 1 388.265 3.001 10 0 GGAEMN O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1nc(C2CC2)ncc1Br ZINC000530190949 567582090 /nfs/dbraw/zinc/58/20/90/567582090.db2.gz WJFAQIRHDNVQBW-CQSZACIVSA-N 0 1 393.329 3.253 10 0 GGAEMN CC(C)c1nn(-c2ccc(Br)cc2)cc1CNC1COCCOC1 ZINC000644836871 567582497 /nfs/dbraw/zinc/58/24/97/567582497.db2.gz KCNGUNCDMXPFIY-UHFFFAOYSA-N 0 1 394.313 3.263 10 0 GGAEMN CC(C)(C(=O)NCc1c(F)c(F)c(Br)c(F)c1F)c1cnc[nH]1 ZINC000644849087 567583719 /nfs/dbraw/zinc/58/37/19/567583719.db2.gz SOWHUNUATQRZEZ-UHFFFAOYSA-N 0 1 394.166 3.323 10 0 GGAEMN CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2F)s1 ZINC000644851249 567583922 /nfs/dbraw/zinc/58/39/22/567583922.db2.gz DQXNLVTYIMOGJJ-ZETCQYMHSA-N 0 1 378.397 3.163 10 0 GGAEMN Ic1ccc(CN[C@H](c2nnc[nH]2)c2ccccc2)cc1 ZINC000439441807 567586527 /nfs/dbraw/zinc/58/65/27/567586527.db2.gz RCKRUOUTBGWUIA-HNNXBMFYSA-N 0 1 390.228 3.289 10 0 GGAEMN Cc1csc([C@@H](C)NC[C@H](O)COc2cc(F)cc(Br)c2)n1 ZINC000439451102 567587375 /nfs/dbraw/zinc/58/73/75/567587375.db2.gz LIQYFQBKERBHNI-MFKMUULPSA-N 0 1 389.290 3.444 10 0 GGAEMN Cn1c(CN[C@H](c2nnc[nH]2)c2ccccc2)nc2ccc(Br)cc21 ZINC000439444219 567587493 /nfs/dbraw/zinc/58/74/93/567587493.db2.gz BAOUGHTVCZPPQA-KRWDZBQOSA-N 0 1 397.280 3.333 10 0 GGAEMN C[C@H](O)CN1CCN(c2nnc(-c3cc(Cl)cc(Cl)c3)s2)[C@@H](C)C1 ZINC000480197956 567587750 /nfs/dbraw/zinc/58/77/50/567587750.db2.gz HSOURFCNVXKOMT-QWRGUYRKSA-N 0 1 387.336 3.403 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@H](c2cncc(Br)c2)C2CC2)cn1 ZINC000552423859 567588938 /nfs/dbraw/zinc/58/89/38/567588938.db2.gz YINZNBXOCRSZKU-KRWDZBQOSA-N 0 1 389.297 3.182 10 0 GGAEMN COC(=O)c1sc2c(c1Br)CN(Cc1n[nH]c(C(C)C)n1)C2 ZINC000595905094 567589984 /nfs/dbraw/zinc/58/99/84/567589984.db2.gz IUNFGGADOWYJKO-UHFFFAOYSA-N 0 1 385.287 3.055 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000552448887 567591016 /nfs/dbraw/zinc/59/10/16/567591016.db2.gz GOTPFLKAEHFLCT-UHFFFAOYSA-N 0 1 393.241 3.055 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000552448887 567591019 /nfs/dbraw/zinc/59/10/19/567591019.db2.gz GOTPFLKAEHFLCT-UHFFFAOYSA-N 0 1 393.241 3.055 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)c1cc(C(C)(C)N)no1 ZINC000595930210 567592644 /nfs/dbraw/zinc/59/26/44/567592644.db2.gz NWUYIRXBYIFSRJ-UHFFFAOYSA-N 0 1 385.205 3.034 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CC[C@@H](Cc3ccc(Br)cc3)C2)C1 ZINC000644943369 567593265 /nfs/dbraw/zinc/59/32/65/567593265.db2.gz JWNXCPWEZOPHIU-RDJZCZTQSA-N 0 1 380.330 3.117 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000530413854 567599467 /nfs/dbraw/zinc/59/94/67/567599467.db2.gz MUNTYMOPIRUVKA-DZGCQCFKSA-N 0 1 379.917 3.133 10 0 GGAEMN CCCc1n[n-]c(=NC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000530413854 567599475 /nfs/dbraw/zinc/59/94/75/567599475.db2.gz MUNTYMOPIRUVKA-DZGCQCFKSA-N 0 1 379.917 3.133 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(C)c(Br)c(Cl)c2)CC1 ZINC000571943860 567601431 /nfs/dbraw/zinc/60/14/31/567601431.db2.gz HNESFYOPSDVCTA-UHFFFAOYSA-N 0 1 389.721 3.205 10 0 GGAEMN Cc1cc(-c2nc(-c3nc(-c4cccc(Br)c4)n[nH]3)no2)cnn1 ZINC000571959352 567602201 /nfs/dbraw/zinc/60/22/01/567602201.db2.gz BRAXFSJVAGLAIA-UHFFFAOYSA-N 0 1 384.197 3.050 10 0 GGAEMN CCc1nc(CNC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)n[nH]1 ZINC000664970276 567602284 /nfs/dbraw/zinc/60/22/84/567602284.db2.gz BMLASVRDSHTYCF-UHFFFAOYSA-N 0 1 375.317 3.220 10 0 GGAEMN Cc1cc(C(=O)N2CCC[C@@H]2c2ccccc2I)n[nH]1 ZINC000505964672 567604991 /nfs/dbraw/zinc/60/49/91/567604991.db2.gz POTONSXMACLTKM-CQSZACIVSA-N 0 1 381.217 3.300 10 0 GGAEMN CCN(CC)[C@H](C(=O)N[C@@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552732416 567605868 /nfs/dbraw/zinc/60/58/68/567605868.db2.gz WZPORVHPQUWNDX-BBRMVZONSA-N 0 1 391.313 3.499 10 0 GGAEMN CCN(CC)[C@@H](C(=O)N[C@@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552732419 567606087 /nfs/dbraw/zinc/60/60/87/567606087.db2.gz WZPORVHPQUWNDX-XJKSGUPXSA-N 0 1 391.313 3.499 10 0 GGAEMN CCOC(=O)C[C@@](C)(NC(=O)c1cc(Br)cc2nc[nH]c21)C(C)C ZINC000506019758 567607730 /nfs/dbraw/zinc/60/77/30/567607730.db2.gz OMVPDKHHTNLHTE-QGZVFWFLSA-N 0 1 396.285 3.423 10 0 GGAEMN CCOC(=O)C[C@](C)(NC(=O)c1cc(Br)cc2nc[nH]c21)C(C)C ZINC000506019757 567608093 /nfs/dbraw/zinc/60/80/93/567608093.db2.gz OMVPDKHHTNLHTE-KRWDZBQOSA-N 0 1 396.285 3.423 10 0 GGAEMN C[C@H](CN[C@H](c1ccc(Br)cc1)C(F)F)CN1CCOCC1 ZINC000621752958 567608692 /nfs/dbraw/zinc/60/86/92/567608692.db2.gz FQSOVIXOPFPXQP-IUODEOHRSA-N 0 1 377.273 3.313 10 0 GGAEMN COCCN1CCC[C@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621752313 567608817 /nfs/dbraw/zinc/60/88/17/567608817.db2.gz XUXRABSCPDCKHL-GJZGRUSLSA-N 0 1 377.273 3.456 10 0 GGAEMN COC1CCN(CCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621754974 567609026 /nfs/dbraw/zinc/60/90/26/567609026.db2.gz QFGIOMACWHUJEB-HNNXBMFYSA-N 0 1 377.273 3.456 10 0 GGAEMN CN1CCN(C(C)(C)CN[C@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750617 567609235 /nfs/dbraw/zinc/60/92/35/567609235.db2.gz SZURXKZPNSKBLK-OAHLLOKOSA-N 0 1 390.316 3.371 10 0 GGAEMN OCCCN1CCC[C@@H]1CN[C@H](c1ccc(Br)cc1)C(F)F ZINC000621763471 567610361 /nfs/dbraw/zinc/61/03/61/567610361.db2.gz YHVLWFQNTOZLFW-HUUCEWRRSA-N 0 1 377.273 3.192 10 0 GGAEMN OCCCN1CCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621763469 567610543 /nfs/dbraw/zinc/61/05/43/567610543.db2.gz YHVLWFQNTOZLFW-CABCVRRESA-N 0 1 377.273 3.192 10 0 GGAEMN CN(C(=O)c1n[nH]c(-c2ccccc2)c1Br)[C@H]1CC[C@H](O)CC1 ZINC000440022436 567611253 /nfs/dbraw/zinc/61/12/53/567611253.db2.gz CDPSUQFJUQPXQM-JOCQHMNTSA-N 0 1 378.270 3.215 10 0 GGAEMN COC(=O)[C@@H]1CC12CCN(Cc1nc3cc(Br)ccc3[nH]1)CC2 ZINC000480561897 567612540 /nfs/dbraw/zinc/61/25/40/567612540.db2.gz ZJQMKRRGKAGLNH-LBPRGKRZSA-N 0 1 378.270 3.101 10 0 GGAEMN CC(=O)NCc1ccc(C(=O)NC[C@@H](c2ccc(Cl)cc2)N(C)C)s1 ZINC000530590722 567612911 /nfs/dbraw/zinc/61/29/11/567612911.db2.gz PUKYZZUFXJFTFB-INIZCTEOSA-N 0 1 379.913 3.070 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2c(F)cccc2Cl)c(Cl)c1 ZINC000572087437 567612984 /nfs/dbraw/zinc/61/29/84/567612984.db2.gz PEYYMRXKGNOPIF-UHFFFAOYSA-N 0 1 379.196 3.115 10 0 GGAEMN CC(=O)NCc1ccc(C(=O)NC[C@H](c2ccc(Cl)cc2)N(C)C)s1 ZINC000530590723 567613611 /nfs/dbraw/zinc/61/36/11/567613611.db2.gz PUKYZZUFXJFTFB-MRXNPFEDSA-N 0 1 379.913 3.070 10 0 GGAEMN Cc1cc(I)cnc1NC(=O)c1cc(-c2ccoc2)n[nH]1 ZINC000530627579 567615151 /nfs/dbraw/zinc/61/51/51/567615151.db2.gz IPBVQKGTKKVZGX-UHFFFAOYSA-N 0 1 394.172 3.230 10 0 GGAEMN C[C@@H](c1ccc(Br)cc1)N1CCN(CCc2cncn2C)CC1 ZINC000459337996 567616757 /nfs/dbraw/zinc/61/67/57/567616757.db2.gz KGGRWAXSPAONEJ-HNNXBMFYSA-N 0 1 377.330 3.104 10 0 GGAEMN CC(C)C[C@@H](C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000506259773 567618585 /nfs/dbraw/zinc/61/85/85/567618585.db2.gz NLOZTVPUKWPPLY-LLVKDONJSA-N 0 1 380.290 3.468 10 0 GGAEMN CC(C)C[C@@H](C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000506259773 567618591 /nfs/dbraw/zinc/61/85/91/567618591.db2.gz NLOZTVPUKWPPLY-LLVKDONJSA-N 0 1 380.290 3.468 10 0 GGAEMN O=C([O-])[C@]12COC[C@H]1C[N@@H+](Cc1ccc(-c3cccc(Br)c3)o1)C2 ZINC000665344630 567619646 /nfs/dbraw/zinc/61/96/46/567619646.db2.gz QQGYFDHFJCSTEI-FZKQIMNGSA-N 0 1 392.249 3.242 10 0 GGAEMN CCOc1cc(CNCc2ccccc2OCCO)cc(Br)c1O ZINC000459424545 567623286 /nfs/dbraw/zinc/62/32/86/567623286.db2.gz GSYQSKZDNIZTPR-UHFFFAOYSA-N 0 1 396.281 3.214 10 0 GGAEMN Cc1n[nH]c(C(=O)NCc2ccc(I)c(Cl)c2)c1C ZINC000506368029 567624022 /nfs/dbraw/zinc/62/40/22/567624022.db2.gz HHMZAHJPIQEPJH-UHFFFAOYSA-N 0 1 389.624 3.215 10 0 GGAEMN O=S(=O)(CCCC1CCOCC1)NC[C@@H](c1cccs1)N1CCCC1 ZINC000645434239 567624654 /nfs/dbraw/zinc/62/46/54/567624654.db2.gz KSNYMNYAQATUCU-KRWDZBQOSA-N 0 1 386.583 3.011 10 0 GGAEMN O=S(=O)(N[C@H]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cscn1 ZINC000645465374 567628098 /nfs/dbraw/zinc/62/80/98/567628098.db2.gz WIONJOMZRWUFJH-JIGDXULJSA-N 0 1 382.351 3.331 10 0 GGAEMN CC(C)NC(=O)CC[N@H+]1CCC[C@@H]1c1ccccc1I ZINC000506474894 567628372 /nfs/dbraw/zinc/62/83/72/567628372.db2.gz QLKLUGSILYXRKM-OAHLLOKOSA-N 0 1 386.277 3.343 10 0 GGAEMN CC(C)NC(=O)CCN1CCC[C@@H]1c1ccccc1I ZINC000506474894 567628378 /nfs/dbraw/zinc/62/83/78/567628378.db2.gz QLKLUGSILYXRKM-OAHLLOKOSA-N 0 1 386.277 3.343 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NC[C@H](c1cccc(F)c1)N(C)C ZINC000665536067 567628989 /nfs/dbraw/zinc/62/89/89/567628989.db2.gz HNEKQPGOPRYLOM-MRXNPFEDSA-N 0 1 380.261 3.324 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2ccsc2Cl)C1 ZINC000596394660 567629224 /nfs/dbraw/zinc/62/92/24/567629224.db2.gz VXEWKWKKXLDKMI-CQSZACIVSA-N 0 1 376.975 3.108 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2ccsc2Cl)C1 ZINC000596394654 567629387 /nfs/dbraw/zinc/62/93/87/567629387.db2.gz VXEWKWKKXLDKMI-AWEZNQCLSA-N 0 1 376.975 3.108 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSC[C@@H]2CCCCC2(F)F)C1 ZINC000596397845 567629655 /nfs/dbraw/zinc/62/96/55/567629655.db2.gz YDMOQNAIFVKDHU-HOTGVXAUSA-N 0 1 378.529 3.018 10 0 GGAEMN O[C@@H]([C@@H]1CCCN1Cc1nc2ccc(Br)cc2[nH]1)C(F)(F)F ZINC000480781035 567630678 /nfs/dbraw/zinc/63/06/78/567630678.db2.gz QEZATQJBJLRIGF-AAEUAGOBSA-N 0 1 378.192 3.213 10 0 GGAEMN C[C@H](CN1CCC(C)(c2ccc(Br)cc2)CC1)CS(C)(=O)=O ZINC000440507728 567630848 /nfs/dbraw/zinc/63/08/48/567630848.db2.gz UKXGRXLINUTZJB-CQSZACIVSA-N 0 1 388.371 3.483 10 0 GGAEMN O[C@@H]([C@H]1CCCN1Cc1nc2ccc(Br)cc2[nH]1)C(F)(F)F ZINC000480781038 567631107 /nfs/dbraw/zinc/63/11/07/567631107.db2.gz QEZATQJBJLRIGF-YPMHNXCESA-N 0 1 378.192 3.213 10 0 GGAEMN O[C@H]([C@H]1CCCN1Cc1nc2ccc(Br)cc2[nH]1)C(F)(F)F ZINC000480781036 567631506 /nfs/dbraw/zinc/63/15/06/567631506.db2.gz QEZATQJBJLRIGF-DGCLKSJQSA-N 0 1 378.192 3.213 10 0 GGAEMN CC(C)OC[C@@H](O)CN1CCC[C@@H]1c1ccccc1I ZINC000506597385 567632283 /nfs/dbraw/zinc/63/22/83/567632283.db2.gz VJABKZMFHKHQMT-XJKSGUPXSA-N 0 1 389.277 3.214 10 0 GGAEMN C[C@H](NCCNC(=O)c1ccccc1)c1ccccc1I ZINC000480819184 567632708 /nfs/dbraw/zinc/63/27/08/567632708.db2.gz MYVPVZGZCFJLRJ-ZDUSSCGKSA-N 0 1 394.256 3.372 10 0 GGAEMN CC1=CCN(CCNC(=O)CSCc2cc(-c3cccs3)on2)CC1 ZINC000506654819 567637084 /nfs/dbraw/zinc/63/70/84/567637084.db2.gz QHJFVMIOGHWXNX-UHFFFAOYSA-N 0 1 377.535 3.405 10 0 GGAEMN Cc1c2cc(Br)cc(C)c2oc1C(=O)N(C)Cc1n[nH]c(=O)o1 ZINC000622117169 567638060 /nfs/dbraw/zinc/63/80/60/567638060.db2.gz UMMHYRAZLDTHFT-UHFFFAOYSA-N 0 1 380.198 3.173 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1ccc(Br)cc1C(F)(F)F ZINC000665800751 567638564 /nfs/dbraw/zinc/63/85/64/567638564.db2.gz WJTBAQJXFIXPOA-UHFFFAOYSA-N 0 1 380.208 3.493 10 0 GGAEMN Fc1cccnc1N1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000480885190 567638868 /nfs/dbraw/zinc/63/88/68/567638868.db2.gz VLBASESHFKDRDK-UHFFFAOYSA-N 0 1 390.260 3.182 10 0 GGAEMN CC1(C)CN(C(=O)C2CC2)CCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000480872130 567638897 /nfs/dbraw/zinc/63/88/97/567638897.db2.gz AXTLILVGCAXCKU-UHFFFAOYSA-N 0 1 391.313 3.158 10 0 GGAEMN C[C@@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@H](c1ccccc1)N(C)C ZINC000480895411 567640131 /nfs/dbraw/zinc/64/01/31/567640131.db2.gz IFRNFEVSYWUIOH-FZKQIMNGSA-N 0 1 375.519 3.266 10 0 GGAEMN Cc1ccc(NC(=O)[C@H]2CCc3[nH]cnc3C2)cc1I ZINC000596648929 567646575 /nfs/dbraw/zinc/64/65/75/567646575.db2.gz BJESOYXDODHIFO-JTQLQIEISA-N 0 1 381.217 3.066 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H]2CCc3[nH]cnc3C2)cc1I ZINC000596648930 567647150 /nfs/dbraw/zinc/64/71/50/567647150.db2.gz BJESOYXDODHIFO-SNVBAGLBSA-N 0 1 381.217 3.066 10 0 GGAEMN COCCN1CC[C@H](NC(=O)N2CCC[C@H]2c2ccc(Br)cc2)C1 ZINC000531228838 567647702 /nfs/dbraw/zinc/64/77/02/567647702.db2.gz YDPAKPXCFPYESX-IRXDYDNUSA-N 0 1 396.329 3.016 10 0 GGAEMN O=C(NC1(c2ccc(Cl)cc2)CCOCC1)c1csc(=NC2CC2)[nH]1 ZINC000622342399 567647896 /nfs/dbraw/zinc/64/78/96/567647896.db2.gz ONULXKKMLGECPN-UHFFFAOYSA-N 0 1 377.897 3.228 10 0 GGAEMN COCCN1CC[C@@H](NC(=O)N2CCC[C@@H]2c2ccc(Br)cc2)C1 ZINC000531228837 567647959 /nfs/dbraw/zinc/64/79/59/567647959.db2.gz YDPAKPXCFPYESX-IAGOWNOFSA-N 0 1 396.329 3.016 10 0 GGAEMN COc1c(Br)cc(Cl)cc1NC(=O)N(C)CC1CN(C)C1 ZINC000666007537 567648688 /nfs/dbraw/zinc/64/86/88/567648688.db2.gz KKUYNJPKTDFBQD-UHFFFAOYSA-N 0 1 376.682 3.136 10 0 GGAEMN Brc1ccc(N2CCN(Cc3ccc(-n4ccnc4)cc3)CC2)nc1 ZINC000506954279 567651170 /nfs/dbraw/zinc/65/11/70/567651170.db2.gz KDHZLWFAMUQSTM-UHFFFAOYSA-N 0 1 398.308 3.352 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000481014480 567651389 /nfs/dbraw/zinc/65/13/89/567651389.db2.gz ONUDSNOBOPXZFI-KBPBESRZSA-N 0 1 378.460 3.333 10 0 GGAEMN CCN(Cc1cc(Br)ccc1F)C(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000666087059 567653963 /nfs/dbraw/zinc/65/39/63/567653963.db2.gz MHLALDOWUDZYOL-LLVKDONJSA-N 0 1 380.261 3.465 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1COc2c1cccc2Cl ZINC000666107952 567654374 /nfs/dbraw/zinc/65/43/74/567654374.db2.gz MOUQWYVIFKUQED-HZMBPMFUSA-N 0 1 383.673 3.376 10 0 GGAEMN COCc1nc(CNC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000666122310 567655669 /nfs/dbraw/zinc/65/56/69/567655669.db2.gz LPDMUMQNINQFFF-ZDUSSCGKSA-N 0 1 384.267 3.305 10 0 GGAEMN COCc1nnc(CNC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000666122310 567655673 /nfs/dbraw/zinc/65/56/73/567655673.db2.gz LPDMUMQNINQFFF-ZDUSSCGKSA-N 0 1 384.267 3.305 10 0 GGAEMN Cc1ccn([C@H](C)CC(=O)Nc2nc(-c3ccccc3Br)n[nH]2)n1 ZINC000622773921 567655854 /nfs/dbraw/zinc/65/58/54/567655854.db2.gz OLERVQLHRWCWSS-LLVKDONJSA-N 0 1 389.257 3.329 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)N[C@H]1COc2c1cccc2Cl ZINC000666108025 567656259 /nfs/dbraw/zinc/65/62/59/567656259.db2.gz MOUQWYVIFKUQED-YGRLFVJLSA-N 0 1 383.673 3.376 10 0 GGAEMN C[C@H](NCCCOc1cccc(I)c1)c1ccn(C)n1 ZINC000459771686 567657607 /nfs/dbraw/zinc/65/76/07/567657607.db2.gz ZCXJJWNNYVVVTG-LBPRGKRZSA-N 0 1 385.249 3.144 10 0 GGAEMN O=C(NCCc1c[nH]c2cccc(Br)c12)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000572739175 567661728 /nfs/dbraw/zinc/66/17/28/567661728.db2.gz WSCAICCLPDDHGF-OKILXGFUSA-N 0 1 391.313 3.009 10 0 GGAEMN COc1cc(Br)c(C[NH2+][C@@H](CC(=O)[O-])c2ccncc2)cc1OC ZINC000572736215 567661752 /nfs/dbraw/zinc/66/17/52/567661752.db2.gz MIUHHUGLTQJOPN-AWEZNQCLSA-N 0 1 395.253 3.167 10 0 GGAEMN C[C@H]1CCNC(=O)[C@H]1NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000441380522 567662256 /nfs/dbraw/zinc/66/22/56/567662256.db2.gz HJUUZUKKCPICQX-HZMBPMFUSA-N 0 1 380.311 3.187 10 0 GGAEMN C[C@@H]1CCNC(=O)[C@H]1NCc1cnc(-c2ccc(Br)cc2)s1 ZINC000441380531 567662792 /nfs/dbraw/zinc/66/27/92/567662792.db2.gz HJUUZUKKCPICQX-YGRLFVJLSA-N 0 1 380.311 3.187 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cnc3c(cnn3C(C)C)c2)ccc1Cl ZINC000666298061 567665031 /nfs/dbraw/zinc/66/50/31/567665031.db2.gz ZVLPMBUQUDCWII-UHFFFAOYSA-N 0 1 380.857 3.475 10 0 GGAEMN CCSCCCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000507201360 567665404 /nfs/dbraw/zinc/66/54/04/567665404.db2.gz FDRIUIKHZGLAJS-UHFFFAOYSA-N 0 1 398.330 3.177 10 0 GGAEMN CCSCCCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000507201360 567665411 /nfs/dbraw/zinc/66/54/11/567665411.db2.gz FDRIUIKHZGLAJS-UHFFFAOYSA-N 0 1 398.330 3.177 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCO[C@@H](COc2ccccc2)C1 ZINC000572813218 567667815 /nfs/dbraw/zinc/66/78/15/567667815.db2.gz CEOPLPKNYVJEOQ-CQSZACIVSA-N 0 1 392.249 3.075 10 0 GGAEMN CCN1CCN(CC(=O)N[C@](C)(c2ccc(Br)cc2)C(C)C)CC1 ZINC000481294882 567669234 /nfs/dbraw/zinc/66/92/34/567669234.db2.gz MLEFIONKEPOLNM-IBGZPJMESA-N 0 1 396.373 3.074 10 0 GGAEMN Cc1nc([C@H](C)NC(=O)N[C@@H]2CSCc3ccc(Br)cc32)n[nH]1 ZINC000666400081 567672727 /nfs/dbraw/zinc/67/27/27/567672727.db2.gz AWJNMUKSESYFBS-ISVAXAHUSA-N 0 1 396.314 3.224 10 0 GGAEMN O=S1(=O)CCc2cc(CNCc3ccc(Br)c(F)c3)ccc21 ZINC000531661472 567673198 /nfs/dbraw/zinc/67/31/98/567673198.db2.gz PZFRFICYSIWHGI-UHFFFAOYSA-N 0 1 384.270 3.208 10 0 GGAEMN CCCN(C)[C@H](CNC(=O)NCC[C@@H](C)[S@](C)=O)c1ccc(Cl)cc1 ZINC000553677713 567675473 /nfs/dbraw/zinc/67/54/73/567675473.db2.gz RVZNRMKSQAEDTK-DZSJAMLCSA-N 0 1 387.977 3.179 10 0 GGAEMN CCn1c(COc2ccc(Cl)cc2Cl)nnc1N1CCN(CC)CC1 ZINC000460213899 567679739 /nfs/dbraw/zinc/67/97/39/567679739.db2.gz TYDIOVPBSHDOGY-UHFFFAOYSA-N 0 1 384.311 3.326 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCC(F)(F)c2ccc(Br)cc2)cn1 ZINC000623034588 567682050 /nfs/dbraw/zinc/68/20/50/567682050.db2.gz YMERXODGDFUEJN-UHFFFAOYSA-N 0 1 398.251 3.428 10 0 GGAEMN COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1c(F)cncc1Br ZINC000597120322 567682848 /nfs/dbraw/zinc/68/28/48/567682848.db2.gz FKJDHHJREKLEIW-JSGCOSHPSA-N 0 1 395.272 3.493 10 0 GGAEMN COC(=O)CCN(Cc1cnn2c1CCC2)Cc1cccc(Br)c1 ZINC000597112753 567683277 /nfs/dbraw/zinc/68/32/77/567683277.db2.gz GHDGQKIURQYKPO-UHFFFAOYSA-N 0 1 392.297 3.157 10 0 GGAEMN COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1c(F)cncc1Br ZINC000597120324 567683605 /nfs/dbraw/zinc/68/36/05/567683605.db2.gz FKJDHHJREKLEIW-TZMCWYRMSA-N 0 1 395.272 3.493 10 0 GGAEMN COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1c(F)cncc1Br ZINC000597120320 567684054 /nfs/dbraw/zinc/68/40/54/567684054.db2.gz FKJDHHJREKLEIW-GXTWGEPZSA-N 0 1 395.272 3.493 10 0 GGAEMN CSc1ncc(Cl)c(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)n1 ZINC000531893754 567685451 /nfs/dbraw/zinc/68/54/51/567685451.db2.gz QYWYAAUNQKNJCC-CQSZACIVSA-N 0 1 376.913 3.198 10 0 GGAEMN CC(C)C(=O)NC1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000460385620 567686490 /nfs/dbraw/zinc/68/64/90/567686490.db2.gz IGGKPPWVJATYHY-UHFFFAOYSA-N 0 1 379.302 3.062 10 0 GGAEMN COC(=O)[C@@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000531900333 567686514 /nfs/dbraw/zinc/68/65/14/567686514.db2.gz QGVRGLYEYXNYAY-CJNGLKHVSA-N 0 1 385.291 3.152 10 0 GGAEMN OC1([C@@H]2CCCC[N@H+]2Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000573081617 567686784 /nfs/dbraw/zinc/68/67/84/567686784.db2.gz PCFGLLIPMSBDMB-AWEZNQCLSA-N 0 1 378.270 3.379 10 0 GGAEMN OC1([C@@H]2CCCCN2Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000573081617 567686790 /nfs/dbraw/zinc/68/67/90/567686790.db2.gz PCFGLLIPMSBDMB-AWEZNQCLSA-N 0 1 378.270 3.379 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)Cc3ccccc3Br)[nH]c2c1 ZINC000553837019 567688807 /nfs/dbraw/zinc/68/88/07/567688807.db2.gz DCXFRLNIDMWUBU-UHFFFAOYSA-N 0 1 394.294 3.253 10 0 GGAEMN Cc1nc2ccc(Cn3nnnc3Cc3ccc(Br)cc3)cc2[nH]1 ZINC000460457144 567689142 /nfs/dbraw/zinc/68/91/42/567689142.db2.gz VOMYOFIMVJWLJO-UHFFFAOYSA-N 0 1 383.253 3.259 10 0 GGAEMN CNC(=O)Nc1cc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)ccc1F ZINC000507600533 567689170 /nfs/dbraw/zinc/68/91/70/567689170.db2.gz ZQRJGUXGDIHKAJ-UHFFFAOYSA-N 0 1 389.811 3.479 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCc3c(Br)ccc(F)c3C2)cn1 ZINC000573109565 567689867 /nfs/dbraw/zinc/68/98/67/567689867.db2.gz BQMULNSFJVKXGL-UHFFFAOYSA-N 0 1 392.272 3.243 10 0 GGAEMN CC(=O)c1cc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)ccc1F ZINC000507612936 567690745 /nfs/dbraw/zinc/69/07/45/567690745.db2.gz LISWBEZPTLNLAG-UHFFFAOYSA-N 0 1 385.800 3.254 10 0 GGAEMN Cc1cc(Br)c(CNC(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)s1 ZINC000666640884 567690795 /nfs/dbraw/zinc/69/07/95/567690795.db2.gz YRWDTAAFZNHYPA-OCCSQVGLSA-N 0 1 386.359 3.445 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN(Cc2cccc(I)c2)C1 ZINC000597231556 567690917 /nfs/dbraw/zinc/69/09/17/567690917.db2.gz LTOIGWABGJDAEB-AWEZNQCLSA-N 0 1 386.277 3.028 10 0 GGAEMN C[C@H]1Cc2c[nH]nc2[C@H](C(=O)N2CCOc3cccc(Br)c3C2)C1 ZINC000623224313 567692453 /nfs/dbraw/zinc/69/24/53/567692453.db2.gz CBFAODOIQGNNLJ-WCQYABFASA-N 0 1 390.281 3.259 10 0 GGAEMN O=S1(=O)NC(CNC2(c3cccc(Cl)c3)CCC2)=Nc2ccccc21 ZINC000646095570 567692818 /nfs/dbraw/zinc/69/28/18/567692818.db2.gz WXLDMABZTNPEJV-UHFFFAOYSA-N 0 1 375.881 3.331 10 0 GGAEMN CCCCN(Cc1csc(CC(=O)NC)n1)[C@@H]1CCc2ncsc2C1 ZINC000646129382 567695573 /nfs/dbraw/zinc/69/55/73/567695573.db2.gz BERFDJDGNDEMSF-CQSZACIVSA-N 0 1 378.567 3.048 10 0 GGAEMN C[C@@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1cc2cc(Cl)ccc2o1 ZINC000573211299 567696506 /nfs/dbraw/zinc/69/65/06/567696506.db2.gz KSKYAXXNPIZADP-IUODEOHRSA-N 0 1 385.917 3.008 10 0 GGAEMN O=C(CCN1CCc2nccc(Br)c2C1)N1CCc2ccccc21 ZINC000623286537 567698270 /nfs/dbraw/zinc/69/82/70/567698270.db2.gz WOZGYRSLCYOKIH-UHFFFAOYSA-N 0 1 386.293 3.182 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)C[C@@H]1C(=O)[O-] ZINC000573249140 567699215 /nfs/dbraw/zinc/69/92/15/567699215.db2.gz WPVLDAITSXYIOX-WBMJQRKESA-N 0 1 378.270 3.177 10 0 GGAEMN CCOC(=O)C[C@@H]1C[C@H](OC)CN1CCCc1ccccc1Br ZINC000481737747 567699587 /nfs/dbraw/zinc/69/95/87/567699587.db2.gz PQOOFNDIVROONA-HOTGVXAUSA-N 0 1 384.314 3.424 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000460718429 567699620 /nfs/dbraw/zinc/69/96/20/567699620.db2.gz LEWYCWYWCAYYOB-KBPBESRZSA-N 0 1 383.330 3.237 10 0 GGAEMN CCOC(=O)C[C@H]1C[C@@H](OC)CN1CCCc1ccccc1Br ZINC000481737748 567700191 /nfs/dbraw/zinc/70/01/91/567700191.db2.gz PQOOFNDIVROONA-HZPDHXFCSA-N 0 1 384.314 3.424 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@H](c1ccsc1)N(C)C ZINC000460766722 567702606 /nfs/dbraw/zinc/70/26/06/567702606.db2.gz DESADAYJYALIQI-OAHLLOKOSA-N 0 1 397.338 3.481 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000597522421 567702881 /nfs/dbraw/zinc/70/28/81/567702881.db2.gz JLHOAFNSSZIRDF-SNVBAGLBSA-N 0 1 381.217 3.066 10 0 GGAEMN Cc1cc(Br)c(CNCCNC(=O)C(C)C)cc1Br ZINC000623338590 567703207 /nfs/dbraw/zinc/70/32/07/567703207.db2.gz HNYXRKVNCHTMKY-UHFFFAOYSA-N 0 1 392.135 3.382 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@@H](c1cccs1)N(C)C ZINC000460820347 567703189 /nfs/dbraw/zinc/70/31/89/567703189.db2.gz XXXNKKKLOIYJCB-AWEZNQCLSA-N 0 1 397.338 3.481 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(Br)c(F)c2)cc1 ZINC000460821094 567703321 /nfs/dbraw/zinc/70/33/21/567703321.db2.gz FRYJRVQFSDBEGG-UHFFFAOYSA-N 0 1 388.214 3.176 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)N1CCN(CC2CC2)CC1 ZINC000507777947 567704919 /nfs/dbraw/zinc/70/49/19/567704919.db2.gz JVMYDXMXMRNUMT-INIZCTEOSA-N 0 1 394.313 3.010 10 0 GGAEMN COc1cccc([C@H]2CN(C(=O)c3cccc(Br)c3O)CCO2)c1 ZINC000532266528 567705829 /nfs/dbraw/zinc/70/58/29/567705829.db2.gz VWSHKXVBRARQGR-MRXNPFEDSA-N 0 1 392.249 3.377 10 0 GGAEMN O=C(Nc1nccc2cc(Br)ccc21)c1cccc(-c2nnc[nH]2)c1 ZINC000646307176 567706167 /nfs/dbraw/zinc/70/61/67/567706167.db2.gz LFJONSPYZVDTJI-UHFFFAOYSA-N 0 1 394.232 3.457 10 0 GGAEMN O=C(Nc1cc(Cl)c(O)cc1F)c1cnn2cc(Br)cnc12 ZINC000554036012 567706294 /nfs/dbraw/zinc/70/62/94/567706294.db2.gz HGSQGZZKMHFKAA-UHFFFAOYSA-N 0 1 385.580 3.242 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1Cc2ccccc21 ZINC000460852724 567706703 /nfs/dbraw/zinc/70/67/03/567706703.db2.gz DXHPWNMBDNDXMD-OAHLLOKOSA-N 0 1 383.249 3.190 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1Cc2ccccc21 ZINC000460852724 567706707 /nfs/dbraw/zinc/70/67/07/567706707.db2.gz DXHPWNMBDNDXMD-OAHLLOKOSA-N 0 1 383.249 3.190 10 0 GGAEMN O[C@@H](CNCc1ccsc1Br)COc1ccc(F)c(F)c1 ZINC000623406333 567707131 /nfs/dbraw/zinc/70/71/31/567707131.db2.gz UMVYXQGJPDDRSS-JTQLQIEISA-N 0 1 378.238 3.318 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)N1CCN(C2CCC2)CC1 ZINC000507796092 567707363 /nfs/dbraw/zinc/70/73/63/567707363.db2.gz LQKIBSPTAUDHPC-INIZCTEOSA-N 0 1 394.313 3.152 10 0 GGAEMN Cc1cc(I)cc(NC(=O)[C@H]2CCc3[nH]cnc3C2)c1 ZINC000597647850 567710239 /nfs/dbraw/zinc/71/02/39/567710239.db2.gz BVECLRDGCXFMFQ-JTQLQIEISA-N 0 1 381.217 3.066 10 0 GGAEMN Cc1cc(I)cc(NC(=O)[C@@H]2CCc3[nH]cnc3C2)c1 ZINC000597647852 567710456 /nfs/dbraw/zinc/71/04/56/567710456.db2.gz BVECLRDGCXFMFQ-SNVBAGLBSA-N 0 1 381.217 3.066 10 0 GGAEMN COCc1ccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)cc1 ZINC000442838912 567710709 /nfs/dbraw/zinc/71/07/09/567710709.db2.gz ULRAGWRVPYRVCM-UHFFFAOYSA-N 0 1 377.340 3.238 10 0 GGAEMN CC[C@@H](c1ccc(Br)cc1)N1CCN(CCC(=O)NC(C)C)CC1 ZINC000507872440 567711826 /nfs/dbraw/zinc/71/18/26/567711826.db2.gz JLVPCPAPJQKPEE-SFHVURJKSA-N 0 1 396.373 3.433 10 0 GGAEMN O=C(c1ccc(Br)cc1Br)N1CCN2CCC1CC2 ZINC000507879312 567712310 /nfs/dbraw/zinc/71/23/10/567712310.db2.gz YOTKHIQQSFRDTQ-UHFFFAOYSA-N 0 1 388.103 3.132 10 0 GGAEMN CCCCCc1nnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)s1 ZINC000666969119 567715257 /nfs/dbraw/zinc/71/52/57/567715257.db2.gz GHDHVPQTYCAUHK-GHMZBOCLSA-N 0 1 381.420 3.193 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2csc3ccccc32)cc1S(C)(=O)=O ZINC000507977548 567720255 /nfs/dbraw/zinc/72/02/55/567720255.db2.gz BVPWMRCTYBZYCI-UHFFFAOYSA-N 0 1 381.500 3.414 10 0 GGAEMN O=C(Nc1[nH]nc2c1cccc2Cl)C(=O)c1ccc(Br)cc1 ZINC000532527940 567721327 /nfs/dbraw/zinc/72/13/27/567721327.db2.gz BRWOQBLIGYYZPF-UHFFFAOYSA-N 0 1 378.613 3.222 10 0 GGAEMN CN1CCCC[C@@H]1C(=O)NCc1cc(Cl)ccc1I ZINC000597898593 567723903 /nfs/dbraw/zinc/72/39/03/567723903.db2.gz SJIPCYABUOEDBM-CYBMUJFWSA-N 0 1 392.668 3.045 10 0 GGAEMN C[N@@H+]1CCC[C@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@@H]1c1cccs1 ZINC000532640811 567725468 /nfs/dbraw/zinc/72/54/68/567725468.db2.gz HNLNWDJGIFTOQP-MLGOLLRUSA-N 0 1 376.551 3.014 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)c2csc(=NC3CC3)[n-]2)[C@@H]1c1cccs1 ZINC000532640811 567725475 /nfs/dbraw/zinc/72/54/75/567725475.db2.gz HNLNWDJGIFTOQP-MLGOLLRUSA-N 0 1 376.551 3.014 10 0 GGAEMN OCCOC1(CNCc2cc(O)ccc2Br)CCC(F)(F)CC1 ZINC000623637273 567726669 /nfs/dbraw/zinc/72/66/69/567726669.db2.gz UPEQEPRWOLSEKP-UHFFFAOYSA-N 0 1 394.256 3.201 10 0 GGAEMN OCCOC1(CNCc2c(F)cncc2Br)CCC(F)(F)CC1 ZINC000623638126 567726995 /nfs/dbraw/zinc/72/69/95/567726995.db2.gz VMXNZVHUQBHQOR-UHFFFAOYSA-N 0 1 397.235 3.030 10 0 GGAEMN O=C(Nc1cnc(-c2ccc(Cl)s2)nc1)N1CC[C@@H](N2CC=CC2)C1 ZINC000646543609 567727781 /nfs/dbraw/zinc/72/77/81/567727781.db2.gz ZUQDASJMOBKFRN-CYBMUJFWSA-N 0 1 375.885 3.337 10 0 GGAEMN COc1ncc(Br)cc1CN[C@@H](C)CC(=O)Nc1ccccc1 ZINC000623663960 567729922 /nfs/dbraw/zinc/72/99/22/567729922.db2.gz JORRFNYFEFCBPK-LBPRGKRZSA-N 0 1 378.270 3.360 10 0 GGAEMN Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@H]1CCNC1=O ZINC000532705190 567730392 /nfs/dbraw/zinc/73/03/92/567730392.db2.gz ZQGXGGPMNCABFE-RNCFNFMXSA-N 0 1 380.311 3.420 10 0 GGAEMN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)N[C@@H]1CCCN(C)C1 ZINC000623717372 567733400 /nfs/dbraw/zinc/73/34/00/567733400.db2.gz XNUILWSMZTZFLE-ZBFHGGJFSA-N 0 1 396.329 3.398 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCc2cc(F)c(Br)cc2F)n[nH]1 ZINC000623778884 567736638 /nfs/dbraw/zinc/73/66/38/567736638.db2.gz GFGUPSDYMQXBHE-MRVPVSSYSA-N 0 1 387.228 3.189 10 0 GGAEMN O=C(Nc1nncn1Cc1ccccc1)c1cc(Br)cc2nc[nH]c21 ZINC000554568368 567737079 /nfs/dbraw/zinc/73/70/79/567737079.db2.gz HAZSYBZZUMVDKU-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN Cc1noc(C)c1C[C@@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000554568727 567737166 /nfs/dbraw/zinc/73/71/66/567737166.db2.gz XODOKFRGAOPZCY-MRVPVSSYSA-N 0 1 377.242 3.291 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)Cc2cc(Br)ccc2F)n[nH]1 ZINC000532848326 567738533 /nfs/dbraw/zinc/73/85/33/567738533.db2.gz GBMCNNZEOCJAET-MNOVXSKESA-N 0 1 397.292 3.481 10 0 GGAEMN O[C@H](CCNCc1c(F)cncc1Br)COCc1ccccc1 ZINC000623828253 567739797 /nfs/dbraw/zinc/73/97/97/567739797.db2.gz PWNACBXJVPYETD-CQSZACIVSA-N 0 1 383.261 3.041 10 0 GGAEMN CCOc1c(Br)cc(CN[C@@H]2CCN(C3CCC3)C2=O)cc1OC ZINC000623839956 567741607 /nfs/dbraw/zinc/74/16/07/567741607.db2.gz ITALCMRZXWIWLS-OAHLLOKOSA-N 0 1 397.313 3.099 10 0 GGAEMN Cn1nccc1[C@H]1CCCCN1C[C@H](O)COc1ccc(Br)cc1 ZINC000532888134 567741583 /nfs/dbraw/zinc/74/15/83/567741583.db2.gz SNCKTWIHMNWGJZ-MAUKXSAKSA-N 0 1 394.313 3.150 10 0 GGAEMN Cc1c([C@@H](C)N[C@@H]2COCC2(C)C)nnn1-c1cccc(Br)c1 ZINC000573894638 567742129 /nfs/dbraw/zinc/74/21/29/567742129.db2.gz JAHRCVGJBNHQMC-IAQYHMDHSA-N 0 1 379.302 3.414 10 0 GGAEMN CN1CCN(c2ccc(Br)cc2NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000667350818 567743122 /nfs/dbraw/zinc/74/31/22/567743122.db2.gz UPJFCYXHIGTGHB-WDNDVIMCSA-N 0 1 378.314 3.186 10 0 GGAEMN C[C@H](CC(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCCO1 ZINC000667425824 567746002 /nfs/dbraw/zinc/74/60/02/567746002.db2.gz OJGQOJAUMNVGOF-ZWNOBZJWSA-N 0 1 379.258 3.378 10 0 GGAEMN C[C@@H](CC(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCCO1 ZINC000667425822 567746593 /nfs/dbraw/zinc/74/65/93/567746593.db2.gz OJGQOJAUMNVGOF-GXFFZTMASA-N 0 1 379.258 3.378 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cccc3ccncc32)cc1Cl ZINC000533069982 567749595 /nfs/dbraw/zinc/74/95/95/567749595.db2.gz UKFWGQMTGBOGBO-UHFFFAOYSA-N 0 1 376.821 3.476 10 0 GGAEMN Cc1ncsc1-c1ccc(CN2CCCC[C@H]2CNS(C)(=O)=O)cc1 ZINC000667503975 567752983 /nfs/dbraw/zinc/75/29/83/567752983.db2.gz CRXHKHSEIQZWDN-KRWDZBQOSA-N 0 1 379.551 3.022 10 0 GGAEMN CS(=O)(=O)c1ccc(CNC(=O)c2n[nH]c3ccc(Cl)cc32)cc1Cl ZINC000508556289 567753207 /nfs/dbraw/zinc/75/32/07/567753207.db2.gz KTIBTAMEICMWRJ-UHFFFAOYSA-N 0 1 398.271 3.203 10 0 GGAEMN CCOc1c(Br)cc(Br)cc1CN(C)[C@@H](C)CO ZINC000554884478 567754187 /nfs/dbraw/zinc/75/41/87/567754187.db2.gz SCALXKIHAAWVMY-VIFPVBQESA-N 0 1 381.108 3.423 10 0 GGAEMN CCc1nc(C(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)o1 ZINC000508572915 567755229 /nfs/dbraw/zinc/75/52/29/567755229.db2.gz YGQGGOZHJYETLJ-UHFFFAOYSA-N 0 1 376.214 3.345 10 0 GGAEMN C[C@@H]1CN(C[C@H]2CCCN2Cc2c(F)cncc2Br)C[C@@H](C)O1 ZINC000667558890 567756160 /nfs/dbraw/zinc/75/61/60/567756160.db2.gz VHXJAEOATUAMFW-MGPQQGTHSA-N 0 1 386.309 3.057 10 0 GGAEMN C[C@@H]1CN(C[C@H]2CCCN2Cc2c(F)cncc2Br)C[C@H](C)O1 ZINC000667558888 567756996 /nfs/dbraw/zinc/75/69/96/567756996.db2.gz VHXJAEOATUAMFW-HZSPNIEDSA-N 0 1 386.309 3.057 10 0 GGAEMN COc1ncc(S(=O)(=O)Nc2ccc(NC(=O)C(C)C)cc2)cc1Cl ZINC000647123126 567761075 /nfs/dbraw/zinc/76/10/75/567761075.db2.gz WYIAIVNIHPXSCP-UHFFFAOYSA-N 0 1 383.857 3.139 10 0 GGAEMN COc1ncc(Br)cc1CN[C@@H](c1nnc[nH]1)C1CCCCC1 ZINC000624134465 567761770 /nfs/dbraw/zinc/76/17/70/567761770.db2.gz VZQFLLQNVZHCLG-CQSZACIVSA-N 0 1 380.290 3.382 10 0 GGAEMN CC(C)c1nc(CNC(=O)Nc2ccc(-c3ccc(Cl)s3)nn2)n[nH]1 ZINC000667677541 567764188 /nfs/dbraw/zinc/76/41/88/567764188.db2.gz VHKAANVSOBNDLU-UHFFFAOYSA-N 0 1 377.861 3.422 10 0 GGAEMN Clc1cc(Cl)cc([C@H](c2nc([C@H]3CCCN3)no2)N2CCOCC2)c1 ZINC000647145629 567764539 /nfs/dbraw/zinc/76/45/39/567764539.db2.gz ABGULJDTHAMLNL-HUUCEWRRSA-N 0 1 383.279 3.223 10 0 GGAEMN O=C(CC[C@@H]1CCCO1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598422578 567764689 /nfs/dbraw/zinc/76/46/89/567764689.db2.gz FTFPPIMKIAMBHV-JTQLQIEISA-N 0 1 385.205 3.065 10 0 GGAEMN CC[C@@H](SC)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598424923 567764815 /nfs/dbraw/zinc/76/48/15/567764815.db2.gz RZUHVXAGNPUCNF-SNVBAGLBSA-N 0 1 375.235 3.248 10 0 GGAEMN C[C@@H](C(=O)Nc1nc2ccc(I)cc2[nH]1)C(F)(F)F ZINC000598423118 567765008 /nfs/dbraw/zinc/76/50/08/567765008.db2.gz KLTHBRJENBYMMS-YFKPBYRVSA-N 0 1 383.111 3.304 10 0 GGAEMN C[C@@H]1CC(=O)CC[C@@H]1C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598423099 567765274 /nfs/dbraw/zinc/76/52/74/567765274.db2.gz KAFOWJKVEBNJNT-KCJUWKMLSA-N 0 1 397.216 3.111 10 0 GGAEMN O=S1(=O)NC(CN2CC[C@H](c3cccc(Cl)c3)C2)=Nc2ccccc21 ZINC000574230814 567765304 /nfs/dbraw/zinc/76/53/04/567765304.db2.gz WSYWAPJMDLQNFA-AWEZNQCLSA-N 0 1 375.881 3.151 10 0 GGAEMN C[C@@H]1CC(=O)CC[C@H]1C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598423101 567765419 /nfs/dbraw/zinc/76/54/19/567765419.db2.gz KAFOWJKVEBNJNT-LDYMZIIASA-N 0 1 397.216 3.111 10 0 GGAEMN CC(C)(C(=O)Nc1nc2ccc(I)cc2[nH]1)C(F)F ZINC000598428102 567766031 /nfs/dbraw/zinc/76/60/31/567766031.db2.gz LYNSTFQBEXGWKJ-UHFFFAOYSA-N 0 1 379.148 3.397 10 0 GGAEMN O=C(COC1CCCC1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598426250 567766220 /nfs/dbraw/zinc/76/62/20/567766220.db2.gz ZCAWKOGACUCBOC-UHFFFAOYSA-N 0 1 385.205 3.065 10 0 GGAEMN O=C(NCCOc1cncc(Cl)c1)c1n[nH]c2ccc(Br)cc21 ZINC000508793443 567766228 /nfs/dbraw/zinc/76/62/28/567766228.db2.gz HZPXYWGFGBTQRX-UHFFFAOYSA-N 0 1 395.644 3.183 10 0 GGAEMN C[C@H](CC(=O)Nc1nc2ccc(I)cc2[nH]1)[C@H]1CCCO1 ZINC000598427038 567766273 /nfs/dbraw/zinc/76/62/73/567766273.db2.gz DXLZOKQDHYLWSE-NOZJJQNGSA-N 0 1 399.232 3.311 10 0 GGAEMN CS[C@@H](C)CC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598424988 567766301 /nfs/dbraw/zinc/76/63/01/567766301.db2.gz SQWPLLDLJLOYRI-ZETCQYMHSA-N 0 1 375.235 3.248 10 0 GGAEMN C[C@@H](CC(=O)Nc1nc2ccc(I)cc2[nH]1)[C@H]1CCCO1 ZINC000598427040 567766355 /nfs/dbraw/zinc/76/63/55/567766355.db2.gz DXLZOKQDHYLWSE-TVQRCGJNSA-N 0 1 399.232 3.311 10 0 GGAEMN O=S(=O)(C1CC1)N1CCCN(CCCSc2ccccc2Cl)CC1 ZINC000555069578 567766466 /nfs/dbraw/zinc/76/64/66/567766466.db2.gz JBIIHDJSHCWOIF-UHFFFAOYSA-N 0 1 388.986 3.322 10 0 GGAEMN C[C@@H](CC(=O)Nc1nc2ccc(I)cc2[nH]1)[C@@H]1CCCO1 ZINC000598427041 567766511 /nfs/dbraw/zinc/76/65/11/567766511.db2.gz DXLZOKQDHYLWSE-ZANVPECISA-N 0 1 399.232 3.311 10 0 GGAEMN CO[C@H]1CCC[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)C1 ZINC000598428187 567767508 /nfs/dbraw/zinc/76/75/08/567767508.db2.gz MQUKEQLBLHBSGG-KOLCDFICSA-N 0 1 399.232 3.311 10 0 GGAEMN CC1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC(=O)CC1 ZINC000598429329 567767617 /nfs/dbraw/zinc/76/76/17/567767617.db2.gz XXRNXFMIENIGLM-UHFFFAOYSA-N 0 1 397.216 3.255 10 0 GGAEMN O=C(C[C@@H]1CCCC[C@H]1O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428865 567767682 /nfs/dbraw/zinc/76/76/82/567767682.db2.gz TZGUFSHQSBXRSG-TVQRCGJNSA-N 0 1 399.232 3.047 10 0 GGAEMN COc1ccccc1[C@@H](N)CNS(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000647187144 567768212 /nfs/dbraw/zinc/76/82/12/567768212.db2.gz DYDHEAJWUFICQP-HNNXBMFYSA-N 0 1 389.304 3.121 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285270 567769127 /nfs/dbraw/zinc/76/91/27/567769127.db2.gz KDYFQVHOYMBTQF-NEPJUHHUSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285270 567769130 /nfs/dbraw/zinc/76/91/30/567769130.db2.gz KDYFQVHOYMBTQF-NEPJUHHUSA-N 0 1 394.212 3.115 10 0 GGAEMN Cc1cc(C(F)(F)F)ccc1CNCc1ccc(S(N)(=O)=O)cc1F ZINC000647205100 567769295 /nfs/dbraw/zinc/76/92/95/567769295.db2.gz FRSRMEDVJRAGIK-UHFFFAOYSA-N 0 1 376.375 3.090 10 0 GGAEMN O=S(=O)(c1ccc(C(F)(F)F)s1)N1CCCC[C@H](N2CCCC2)C1 ZINC000462100537 567770813 /nfs/dbraw/zinc/77/08/13/567770813.db2.gz HOAMLTFLXAZMFJ-LBPRGKRZSA-N 0 1 382.473 3.406 10 0 GGAEMN C[C@@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1ccccc1Br ZINC000624266363 567770844 /nfs/dbraw/zinc/77/08/44/567770844.db2.gz MGIZRGDOSDROIZ-NVXWUHKLSA-N 0 1 390.325 3.396 10 0 GGAEMN CCN1CC[C@@H](NCC(=O)Nc2nccs2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000555125789 567770863 /nfs/dbraw/zinc/77/08/63/567770863.db2.gz LUXGAOSVJBNPGM-GDBMZVCRSA-N 0 1 382.892 3.299 10 0 GGAEMN C[C@@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1sccc1Br ZINC000624266069 567771452 /nfs/dbraw/zinc/77/14/52/567771452.db2.gz FLFLJVUWEACKRK-UKRRQHHQSA-N 0 1 396.354 3.457 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000533504422 567771612 /nfs/dbraw/zinc/77/16/12/567771612.db2.gz AOJBGMDZRYRGHA-NWDGAFQWSA-N 0 1 378.270 3.214 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000533504421 567771870 /nfs/dbraw/zinc/77/18/70/567771870.db2.gz AOJBGMDZRYRGHA-NEPJUHHUSA-N 0 1 378.270 3.214 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1cc(OC(F)F)ccc1Br ZINC000647209398 567771958 /nfs/dbraw/zinc/77/19/58/567771958.db2.gz HEPUVWHJRUBZSU-SMDDNHRTSA-N 0 1 396.272 3.298 10 0 GGAEMN COc1ccc([C@H](C)N[C@@H]2CCO[C@@H]2c2nc(C)no2)c(Br)c1 ZINC000624305091 567774056 /nfs/dbraw/zinc/77/40/56/567774056.db2.gz VWADMJBUNOTRCJ-AMFBXLIHSA-N 0 1 382.258 3.330 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@@H](C2CCC2)C1 ZINC000574420454 567776590 /nfs/dbraw/zinc/77/65/90/567776590.db2.gz YDADZRVHRDPZRU-CQSZACIVSA-N 0 1 390.281 3.480 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)NCc2ccc(Cl)c(Cl)c2)CC1 ZINC000624369932 567776855 /nfs/dbraw/zinc/77/68/55/567776855.db2.gz WENJRGLPRXOJJK-UHFFFAOYSA-N 0 1 386.323 3.390 10 0 GGAEMN C[C@@H](NC[C@H](O)COc1ccccc1Br)c1cc2n(n1)CCCC2 ZINC000647295096 567777451 /nfs/dbraw/zinc/77/74/51/567777451.db2.gz ZRJGIBVPYBCRNR-HIFRSBDPSA-N 0 1 394.313 3.072 10 0 GGAEMN C[C@H](NCCNC(=O)c1cccc(Br)c1)c1cc2n(n1)CCCC2 ZINC000647292743 567778091 /nfs/dbraw/zinc/77/80/91/567778091.db2.gz CPPRGALXQLDXFG-ZDUSSCGKSA-N 0 1 391.313 3.063 10 0 GGAEMN COC(=O)c1cccc(CS(=O)(=O)N[C@@H](C(F)F)C2CCCCC2)c1 ZINC000598628967 567779657 /nfs/dbraw/zinc/77/96/57/567779657.db2.gz VZTZVAGTMZCDQW-OAHLLOKOSA-N 0 1 375.437 3.107 10 0 GGAEMN COC(=O)c1ccc(CS(=O)(=O)N[C@H](C(F)F)C2CCCCC2)cc1 ZINC000598629144 567780150 /nfs/dbraw/zinc/78/01/50/567780150.db2.gz YDDFXKXABOGAAS-HNNXBMFYSA-N 0 1 375.437 3.107 10 0 GGAEMN COCCN(CC(C)C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000443950445 567781515 /nfs/dbraw/zinc/78/15/15/567781515.db2.gz HKYBTKAAZKHQAH-UHFFFAOYSA-N 0 1 381.270 3.035 10 0 GGAEMN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000533716309 567783969 /nfs/dbraw/zinc/78/39/69/567783969.db2.gz JVMSICJMAOCYLF-GWCFXTLKSA-N 0 1 380.261 3.479 10 0 GGAEMN CO[C@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CCCC1 ZINC000667947358 567784780 /nfs/dbraw/zinc/78/47/80/567784780.db2.gz NRLLBPQJOBHRGJ-HNNXBMFYSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCCC1 ZINC000667947358 567784784 /nfs/dbraw/zinc/78/47/84/567784784.db2.gz NRLLBPQJOBHRGJ-HNNXBMFYSA-N 0 1 393.285 3.056 10 0 GGAEMN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N1[C@H](C)CN(C)C[C@@H]1C ZINC000533755427 567785207 /nfs/dbraw/zinc/78/52/07/567785207.db2.gz CRBDQTYZVJGOPG-TXEJJXNPSA-N 0 1 378.314 3.332 10 0 GGAEMN Cc1cc(I)cc(C(=O)N2[C@H](C)CN(C)C[C@@H]2C)c1C ZINC000533778675 567786006 /nfs/dbraw/zinc/78/60/06/567786006.db2.gz WVPAPKKMSJBCMY-TXEJJXNPSA-N 0 1 386.277 3.073 10 0 GGAEMN COCC[C@H](Cc1cccc(Br)c1)C(=O)N1[C@H](C)CN(C)C[C@H]1C ZINC000533778584 567786144 /nfs/dbraw/zinc/78/61/44/567786144.db2.gz YJPBXGKVBNZPIU-BFYDXBDKSA-N 0 1 397.357 3.195 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc(OC(F)(F)F)c(Cl)c2)CC1 ZINC000624619980 567791790 /nfs/dbraw/zinc/79/17/90/567791790.db2.gz RFEKPZPVTBEXHK-UHFFFAOYSA-N 0 1 380.794 3.033 10 0 GGAEMN CC(C)(Cc1ccc(Br)cc1)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000668042425 567792929 /nfs/dbraw/zinc/79/29/29/567792929.db2.gz SOOUFYBSJZCQHJ-ZDUSSCGKSA-N 0 1 376.298 3.415 10 0 GGAEMN COc1ccc(Br)cc1CNC[C@@H]1CS(=O)(=O)c2ccccc21 ZINC000574718933 567793105 /nfs/dbraw/zinc/79/31/05/567793105.db2.gz LTTYITRJIMZVRO-CYBMUJFWSA-N 0 1 396.306 3.118 10 0 GGAEMN CC1(CC(F)F)CN(C[C@H](O)COc2cc(F)cc(Br)c2)C1 ZINC000647614450 567793313 /nfs/dbraw/zinc/79/33/13/567793313.db2.gz YQBYUULCSMSXPI-LBPRGKRZSA-N 0 1 382.220 3.305 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc(OC)ccc2Br)[C@H]1n1cccn1 ZINC000555646771 567793506 /nfs/dbraw/zinc/79/35/06/567793506.db2.gz FMIRKLSSEDCUIT-BRWVUGGUSA-N 0 1 380.286 3.163 10 0 GGAEMN CN(Cc1nnc[nH]1)C(=O)N[C@@H]1CCCSc2ccc(Br)cc21 ZINC000624638811 567793616 /nfs/dbraw/zinc/79/36/16/567793616.db2.gz QDMKKVMPTCCQKL-GFCCVEGCSA-N 0 1 396.314 3.336 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc(OC)ccc2Br)[C@@H]1n1cccn1 ZINC000555646773 567793554 /nfs/dbraw/zinc/79/35/54/567793554.db2.gz FMIRKLSSEDCUIT-ZACQAIPSSA-N 0 1 380.286 3.163 10 0 GGAEMN COc1ccccc1[C@@H](N)CNC(=O)[C@@H]1CCc2cc(Br)ccc21 ZINC000647633771 567795155 /nfs/dbraw/zinc/79/51/55/567795155.db2.gz BORSCXPEPJXPKG-WBVHZDCISA-N 0 1 389.293 3.304 10 0 GGAEMN C[N@H+]1C[C@@H]2CCN(Cc3cc(Br)c([O-])c(Br)c3)[C@@H]2C1 ZINC000668186572 567799096 /nfs/dbraw/zinc/79/90/96/567799096.db2.gz MHHRWRNLFGRQMD-GXFFZTMASA-N 0 1 390.119 3.053 10 0 GGAEMN CCOC(=O)c1[nH]c(C)c(CN[C@H](CO)c2cccc(Br)c2)c1C ZINC000598968291 567800758 /nfs/dbraw/zinc/80/07/58/567800758.db2.gz WYBFGJCIVKZBPC-MRXNPFEDSA-N 0 1 395.297 3.394 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNCc1ccc(I)cc1 ZINC000598989542 567802021 /nfs/dbraw/zinc/80/20/21/567802021.db2.gz LHTABCKPQWBEMR-UHFFFAOYSA-N 0 1 395.166 3.333 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)NCC1(N2CCSCC2)CCCC1 ZINC000624848232 567802686 /nfs/dbraw/zinc/80/26/86/567802686.db2.gz YCYSDBZKGKKOIC-UHFFFAOYSA-N 0 1 398.585 3.339 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000624871796 567803694 /nfs/dbraw/zinc/80/36/94/567803694.db2.gz CBPROAGVDOJXIE-UHFFFAOYSA-N 0 1 380.501 3.353 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000534257736 567804999 /nfs/dbraw/zinc/80/49/99/567804999.db2.gz XANAFPZAGAGFRO-WDEREUQCSA-N 0 1 380.290 3.121 10 0 GGAEMN COC(=O)CCNC(=O)CCN[C@@H]1CCCc2c(Cl)sc(Cl)c21 ZINC000599090210 567805080 /nfs/dbraw/zinc/80/50/80/567805080.db2.gz YTMLDCJBZHWZDA-SNVBAGLBSA-N 0 1 379.309 3.091 10 0 GGAEMN COC(=O)CCNC(=O)CCN[C@@H](C)c1ccc(Cl)c(Cl)c1Cl ZINC000599088901 567805101 /nfs/dbraw/zinc/80/51/01/567805101.db2.gz QUZNDNXIGKJSRU-VIFPVBQESA-N 0 1 381.687 3.367 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2cc3ccccc3o2)[C@@H]1O ZINC000574973907 567807096 /nfs/dbraw/zinc/80/70/96/567807096.db2.gz GIKXTJMSWOLTAF-ZBFHGGJFSA-N 0 1 379.459 3.046 10 0 GGAEMN CCOCC[C@@H](O)CN1CCC[C@@H]1c1ccccc1I ZINC000444645872 567809773 /nfs/dbraw/zinc/80/97/73/567809773.db2.gz IHZNECXWKKOEGZ-CZUORRHYSA-N 0 1 389.277 3.216 10 0 GGAEMN FC(F)Oc1ccc(CN2CC[C@@H](Cn3ccnn3)C2)cc1Br ZINC000668453328 567810059 /nfs/dbraw/zinc/81/00/59/567810059.db2.gz SIHLCJIUCKBIPF-GFCCVEGCSA-N 0 1 387.228 3.164 10 0 GGAEMN CN(CCOc1ccc(Cl)cc1)C(=O)CN1CC[C@H](CC(F)(F)F)C1 ZINC000444695359 567810234 /nfs/dbraw/zinc/81/02/34/567810234.db2.gz MGMQWBPYEQSZMK-CYBMUJFWSA-N 0 1 378.822 3.452 10 0 GGAEMN C[C@]1(c2ccccc2)CC[C@@H](N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)C1 ZINC000668469882 567810656 /nfs/dbraw/zinc/81/06/56/567810656.db2.gz MMTFVFYVRRZCNA-QZWWFDLISA-N 0 1 375.456 3.404 10 0 GGAEMN FC(F)Oc1ccc(Br)c(CNC2(c3nn[nH]n3)CCCC2)c1 ZINC000648020841 567811018 /nfs/dbraw/zinc/81/10/18/567811018.db2.gz NTTYGWQJNRCARM-UHFFFAOYSA-N 0 1 388.216 3.123 10 0 GGAEMN FC(F)Oc1ccc(Br)c(C[NH2+]C2(c3nnn[n-]3)CCCC2)c1 ZINC000648020841 567811019 /nfs/dbraw/zinc/81/10/19/567811019.db2.gz NTTYGWQJNRCARM-UHFFFAOYSA-N 0 1 388.216 3.123 10 0 GGAEMN CC1(C)CN(C[C@H](O)COc2c(Cl)cccc2Cl)C[C@]2(CCOC2)O1 ZINC000575060241 567811426 /nfs/dbraw/zinc/81/14/26/567811426.db2.gz WTSSUXVLNUFOBC-UGSOOPFHSA-N 0 1 390.307 3.003 10 0 GGAEMN CC1(C)CN(C[C@@H](O)COc2c(Cl)cccc2Cl)C[C@@]2(CCOC2)O1 ZINC000575060239 567811444 /nfs/dbraw/zinc/81/14/44/567811444.db2.gz WTSSUXVLNUFOBC-FZKQIMNGSA-N 0 1 390.307 3.003 10 0 GGAEMN O=C(Nc1nc(-c2ccco2)cs1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000668474941 567811729 /nfs/dbraw/zinc/81/17/29/567811729.db2.gz IYBIULLQARUSHO-NXEZZACHSA-N 0 1 376.356 3.326 10 0 GGAEMN CN(Cc1cnc(-c2ccc(Br)cc2)s1)C[C@@H]1COCCO1 ZINC000668544817 567813064 /nfs/dbraw/zinc/81/30/64/567813064.db2.gz HWNMMTKCZGRQBA-CQSZACIVSA-N 0 1 383.311 3.420 10 0 GGAEMN CN(C(=O)c1cc(-c2ccc(Br)cc2)no1)[C@H]1CN2CCC1CC2 ZINC000668588032 567814170 /nfs/dbraw/zinc/81/41/70/567814170.db2.gz DDGMPNCWFIDRRS-INIZCTEOSA-N 0 1 390.281 3.270 10 0 GGAEMN COc1ccc(-c2nc3c([nH]2)CN(CCC(=O)N2CCC(C)CC2)CC3)cc1 ZINC000096149831 570215019 /nfs/dbraw/zinc/21/50/19/570215019.db2.gz PGMXFCIIMCFORB-UHFFFAOYSA-N 0 1 382.508 3.092 10 0 GGAEMN C[C@@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@@H](C)C1 ZINC000012809835 570221827 /nfs/dbraw/zinc/22/18/27/570221827.db2.gz PCJRGBRXXORJRI-KGLIPLIRSA-N 0 1 385.430 3.223 10 0 GGAEMN Cc1cccc(-c2n[nH]c(SCc3cc(=O)n4nc(C5CC5)sc4n3)n2)c1 ZINC000015731886 570223151 /nfs/dbraw/zinc/22/31/51/570223151.db2.gz PDGLTVHYXIRUNJ-UHFFFAOYSA-N 0 1 396.501 3.414 10 0 GGAEMN Cc1nnc(NC(=O)c2ccc([C@H]3CCC[N@@H+]3Cc3cccc(O)c3)s2)[n-]1 ZINC000019839764 570224325 /nfs/dbraw/zinc/22/43/25/570224325.db2.gz VXIOCYVWWIYPCS-OAHLLOKOSA-N 0 1 383.477 3.470 10 0 GGAEMN Cc1nnc(NC(=O)c2ccc([C@H]3CCC[N@H+]3Cc3cccc(O)c3)s2)[n-]1 ZINC000019839764 570224326 /nfs/dbraw/zinc/22/43/26/570224326.db2.gz VXIOCYVWWIYPCS-OAHLLOKOSA-N 0 1 383.477 3.470 10 0 GGAEMN COC(=O)c1ccc(NC(=O)c2[nH]nc3c2CCc2cc(OC)ccc2-3)cc1 ZINC000015772879 570241223 /nfs/dbraw/zinc/24/12/23/570241223.db2.gz AWOAVIMSQTYSNF-UHFFFAOYSA-N 0 1 377.400 3.223 10 0 GGAEMN COCCN1CCCN(C(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)CC1 ZINC000048429026 570250889 /nfs/dbraw/zinc/25/08/89/570250889.db2.gz WWRDLHALSAWBTH-IBGZPJMESA-N 0 1 382.504 3.302 10 0 GGAEMN O=C([O-])c1c[nH+]cn1CCNC(=O)OCC1c2ccccc2-c2ccccc21 ZINC000400042555 570253850 /nfs/dbraw/zinc/25/38/50/570253850.db2.gz BFVKPEYVWBEKJC-UHFFFAOYSA-N 0 1 377.400 3.120 10 0 GGAEMN C[C@H](CN1CCN(Cc2ccccc2)CC1)N(C(=O)C1CCC1)c1ccccn1 ZINC000020432302 570255719 /nfs/dbraw/zinc/25/57/19/570255719.db2.gz OJXXKKCOHLAMIY-HXUWFJFHSA-N 0 1 392.547 3.421 10 0 GGAEMN Cc1ccc2c(c1)nc(-c1cnn(C)c1)cc2C(=O)N1CCN2CCCC[C@@H]2C1 ZINC000020863335 570282597 /nfs/dbraw/zinc/28/25/97/570282597.db2.gz GOWKTUYDDZUYFG-GOSISDBHSA-N 0 1 389.503 3.254 10 0 GGAEMN Cc1ccc2c(c1)nc(-c1cnn(C)c1)cc2C(=O)N1CCN2CCCC[C@H]2C1 ZINC000020863340 570282714 /nfs/dbraw/zinc/28/27/14/570282714.db2.gz GOWKTUYDDZUYFG-SFHVURJKSA-N 0 1 389.503 3.254 10 0 GGAEMN O=C(CCN1CCN(c2ccc(C(F)(F)F)cn2)CC1)Nc1ccccc1 ZINC000012884970 570284841 /nfs/dbraw/zinc/28/48/41/570284841.db2.gz DFKXVZPKAVAOPC-UHFFFAOYSA-N 0 1 378.398 3.251 10 0 GGAEMN Cc1ccc(CN(C)C(=O)CN2CCC(C(=O)Nc3ccccc3O)CC2)cc1 ZINC000012911972 570291185 /nfs/dbraw/zinc/29/11/85/570291185.db2.gz BRSJSWDEZZNKGW-UHFFFAOYSA-N 0 1 395.503 3.010 10 0 GGAEMN O=C(Cc1ccccc1)N1CCC[C@H](N2CCN(c3ccc(F)cc3)CC2)C1 ZINC000034676477 570293737 /nfs/dbraw/zinc/29/37/37/570293737.db2.gz WOPMEQUXFYDIFQ-QFIPXVFZSA-N 0 1 381.495 3.181 10 0 GGAEMN C[C@H](Cc1ccc2c(c1)OCO2)CN1CCc2nc(-c3cccnc3)[nH]c2C1 ZINC000216368278 570300185 /nfs/dbraw/zinc/30/01/85/570300185.db2.gz MOIXHQRHEVNGOU-OAHLLOKOSA-N 0 1 376.460 3.437 10 0 GGAEMN COc1ccccc1NC(=O)CCN1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000022199166 570307190 /nfs/dbraw/zinc/30/71/90/570307190.db2.gz OSYJSGQHVXDEIF-UHFFFAOYSA-N 0 1 387.911 3.495 10 0 GGAEMN Cc1c(C(=O)N2CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC2)sc2cccc(F)c12 ZINC000186656801 570310527 /nfs/dbraw/zinc/31/05/27/570310527.db2.gz HZBKZHNGQAMSMG-CYBMUJFWSA-N 0 1 378.469 3.360 10 0 GGAEMN COc1ccc2sc(C(=O)N3CCC[C@H]([N@@H+](C)CC(=O)[O-])CC3)c(C)c2c1 ZINC000186664761 570310835 /nfs/dbraw/zinc/31/08/35/570310835.db2.gz AEKUWOJYMNJJHI-AWEZNQCLSA-N 0 1 390.505 3.229 10 0 GGAEMN Cc1nc(-c2ccc(CN[C@H](C)C(=O)Nc3ccc(C(N)=O)cc3)cc2)cs1 ZINC000012945543 570317007 /nfs/dbraw/zinc/31/70/07/570317007.db2.gz KKRVIOINPDYOEQ-CYBMUJFWSA-N 0 1 394.500 3.334 10 0 GGAEMN C[C@@H](NC(=O)CN1CCN(Cc2cccc3ccccc32)CC1)c1ccco1 ZINC000022790560 570328168 /nfs/dbraw/zinc/32/81/68/570328168.db2.gz WQPYKCYRNPCGKZ-GOSISDBHSA-N 0 1 377.488 3.428 10 0 GGAEMN O=C(CN1CCN(Cc2cccc3ccccc32)CC1)NCCc1cccs1 ZINC000022803552 570329269 /nfs/dbraw/zinc/32/92/69/570329269.db2.gz ZMDIRJFQTUQAHK-UHFFFAOYSA-N 0 1 393.556 3.378 10 0 GGAEMN O=C(Nc1ccc(N2CCOCC2)nc1)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000022995597 570339942 /nfs/dbraw/zinc/33/99/42/570339942.db2.gz UBHYFPCCMSDERF-UHFFFAOYSA-N 0 1 383.839 3.214 10 0 GGAEMN O=C(NCCN1CCCCC1)c1nc(Cc2ccccc2)n(-c2ccccc2)n1 ZINC000034911054 570340880 /nfs/dbraw/zinc/34/08/80/570340880.db2.gz GBGWTJUNQIUPNE-UHFFFAOYSA-N 0 1 389.503 3.074 10 0 GGAEMN Cc1cccc(-n2nc(C(=O)N(C)[C@H]3CCN(C)C3)nc2-c2ccccc2)c1 ZINC000034911002 570340913 /nfs/dbraw/zinc/34/09/13/570340913.db2.gz QWEWYUXAYXMCDO-IBGZPJMESA-N 0 1 375.476 3.019 10 0 GGAEMN CCOC(=O)c1nc2ccccc2nc1NCCN1CCc2ccccc2C1 ZINC000035479384 570366595 /nfs/dbraw/zinc/36/65/95/570366595.db2.gz WNFAFGJIXWZEOM-UHFFFAOYSA-N 0 1 376.460 3.277 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NC(=O)Cc2c(C)[nH]c3ccc(F)cc32)c1 ZINC000024571774 570385856 /nfs/dbraw/zinc/38/58/56/570385856.db2.gz SOCBWAVSMVHGSW-UHFFFAOYSA-N 0 1 390.436 3.296 10 0 GGAEMN CC(=O)c1cccc(NC(=O)CCc2c(C)[nH]n(-c3ccc(F)cc3)c2=O)c1 ZINC000024923983 570398440 /nfs/dbraw/zinc/39/84/40/570398440.db2.gz QGIFXVOENSKJFF-UHFFFAOYSA-N 0 1 381.407 3.387 10 0 GGAEMN O=C([O-])C[C@]1(NC(=O)OCc2ccccc2)CCC[N@@H+](Cc2ccccc2)C1 ZINC000584883462 570405484 /nfs/dbraw/zinc/40/54/84/570405484.db2.gz ONKPFYLIYUVUBJ-JOCHJYFZSA-N 0 1 382.460 3.422 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2)n[nH]1)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 ZINC000025156223 570407563 /nfs/dbraw/zinc/40/75/63/570407563.db2.gz AVHKKEHVTGJISH-CYBMUJFWSA-N 0 1 381.823 3.117 10 0 GGAEMN Cc1nn(C)c2nc(C(C)C)cc(C(=O)NC[C@@H](c3ccsc3)N(C)C)c12 ZINC000025332032 570411510 /nfs/dbraw/zinc/41/15/10/570411510.db2.gz KPKLWAKGFCPNTQ-KRWDZBQOSA-N 0 1 385.537 3.494 10 0 GGAEMN CN1CCN(Cc2cn(-c3ccccc3)nc2-c2ccc3c(c2)OCCO3)CC1 ZINC000025539179 570415656 /nfs/dbraw/zinc/41/56/56/570415656.db2.gz YDPXGBUMCWJPFU-UHFFFAOYSA-N 0 1 390.487 3.058 10 0 GGAEMN O=C([C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)N1CCN2CCCC[C@H]2C1 ZINC000248002571 570434829 /nfs/dbraw/zinc/43/48/29/570434829.db2.gz RKFPLJBINYJPPP-LSDHHAIUSA-N 0 1 396.318 3.043 10 0 GGAEMN O=C(NCC1CC1)[C@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@H]12 ZINC000035870019 570468316 /nfs/dbraw/zinc/46/83/16/570468316.db2.gz YCAAGSKTEKPAIL-JTHBVZDNSA-N 0 1 393.506 3.215 10 0 GGAEMN Cc1[nH]c(S(=O)(=O)[C@@H](C)c2nnc(CC(C)C)o2)nc1Cc1ccccc1 ZINC000072283208 570472719 /nfs/dbraw/zinc/47/27/19/570472719.db2.gz HUQCIBFWBGVJPC-AWEZNQCLSA-N 0 1 388.493 3.425 10 0 GGAEMN C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)o1 ZINC000252477477 570474015 /nfs/dbraw/zinc/47/40/15/570474015.db2.gz OOIAGFVFXYNQEW-VELGLUOQSA-N 0 1 382.504 3.087 10 0 GGAEMN O=C(C[N@H+]1CCC[C@@H](c2nnc[nH]2)C1)Nc1ccc(Oc2ccccc2)cc1 ZINC000252552762 570477510 /nfs/dbraw/zinc/47/75/10/570477510.db2.gz UYOYYEOWYHJWGE-MRXNPFEDSA-N 0 1 377.448 3.415 10 0 GGAEMN CCN1CCN([C@@H](c2ccccc2Cl)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022696966 570529463 /nfs/dbraw/zinc/52/94/63/570529463.db2.gz NTNCKMSHXMTSRH-FQEVSTJZSA-N 0 1 389.927 3.263 10 0 GGAEMN CCN1CCN([C@H](c2cccc(Cl)c2)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022697002 570529744 /nfs/dbraw/zinc/52/97/44/570529744.db2.gz MHVIBPXDMLMSGP-HXUWFJFHSA-N 0 1 389.927 3.263 10 0 GGAEMN O=C([O-])C[N@H+]1CCCN(C(=O)OCC2c3ccccc3-c3ccccc32)CC1 ZINC000070915606 570596362 /nfs/dbraw/zinc/59/63/62/570596362.db2.gz HUVMLXYFRAJCRU-UHFFFAOYSA-N 0 1 380.444 3.028 10 0 GGAEMN O=C(NC1CCCCCC1)[C@@H]1CCCN(C(=O)c2cc(-c3cccnc3)[nH]n2)C1 ZINC000096324731 570619771 /nfs/dbraw/zinc/61/97/71/570619771.db2.gz GOKPAQQOCXSWBF-QGZVFWFLSA-N 0 1 395.507 3.163 10 0 GGAEMN COc1ccccc1N1CCN(CCC(=O)N2CCCc3ccccc32)CC1 ZINC000005798522 570692077 /nfs/dbraw/zinc/69/20/77/570692077.db2.gz AAAJMCMXAZQJNF-UHFFFAOYSA-N 0 1 379.504 3.187 10 0 GGAEMN Cc1c(C(=O)N[C@H](C)c2ccccc2)sc2ncnc(N3CCN(C)CC3)c12 ZINC000033048293 570699309 /nfs/dbraw/zinc/69/93/09/570699309.db2.gz KUQSULVRDIVAEZ-OAHLLOKOSA-N 0 1 395.532 3.243 10 0 GGAEMN C[C@@H](NCC(=O)NCC(=O)Nc1ccc(F)cc1)c1cccc(C(F)(F)F)c1 ZINC000058160031 570712376 /nfs/dbraw/zinc/71/23/76/570712376.db2.gz ORSGXPYUVNQJDE-GFCCVEGCSA-N 0 1 397.372 3.250 10 0 GGAEMN CCCN1CCN(C(=O)c2nc3ccccn3c2-c2ccc(OC)cc2)CC1 ZINC000065232122 570742014 /nfs/dbraw/zinc/74/20/14/570742014.db2.gz LNEDNSLTHFSDQP-UHFFFAOYSA-N 0 1 378.476 3.178 10 0 GGAEMN Cc1noc(-c2cccnc2N2CCCN(Cc3cc(F)cc(F)c3)CC2)n1 ZINC000065257893 570758913 /nfs/dbraw/zinc/75/89/13/570758913.db2.gz QEUYIPMHKXXVMH-UHFFFAOYSA-N 0 1 385.418 3.431 10 0 GGAEMN Cc1ccc(-c2nnc(CCNC(=O)c3cc(-c4cccs4)on3)[nH]2)cc1 ZINC000021942886 570773705 /nfs/dbraw/zinc/77/37/05/570773705.db2.gz FQCZGFSSQWLOIQ-UHFFFAOYSA-N 0 1 379.445 3.469 10 0 GGAEMN COC(=O)c1ccccc1NC(=O)CSc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000021943228 570773816 /nfs/dbraw/zinc/77/38/16/570773816.db2.gz AWSOEPUOKNLMPP-UHFFFAOYSA-N 0 1 386.408 3.128 10 0 GGAEMN CCOc1ccc(CN2CCC(OC)(c3nc(C4CC4)no3)CC2)cc1OC ZINC000583615949 570801444 /nfs/dbraw/zinc/80/14/44/570801444.db2.gz UVVSTQRSAXMCJM-UHFFFAOYSA-N 0 1 387.480 3.492 10 0 GGAEMN COc1ccc(CNC(=O)[C@@H]2CCCN(c3nc4ccc(C)cc4[nH]3)C2)cc1 ZINC000033071992 570803668 /nfs/dbraw/zinc/80/36/68/570803668.db2.gz FLOVSWLRTKRUPQ-QGZVFWFLSA-N 0 1 378.476 3.413 10 0 GGAEMN O=C(NC[C@H](O)CN1CCc2ccccc2C1)Nc1cccc2ccccc21 ZINC000031663624 570819235 /nfs/dbraw/zinc/81/92/35/570819235.db2.gz VPXOFEWCBDAUCJ-FQEVSTJZSA-N 0 1 375.472 3.381 10 0 GGAEMN CC(C)c1ccc(CNc2nn3c(nc(CN4CCCCC4)cc3=O)[nH]2)cc1 ZINC000101796817 570834230 /nfs/dbraw/zinc/83/42/30/570834230.db2.gz TWFWLZNWAOPMIF-UHFFFAOYSA-N 0 1 380.496 3.139 10 0 GGAEMN COc1ccc(OC)c(NS(=O)(=O)c2ccc3c(c2)-c2oncc2CO3)c1 ZINC000033171229 570835818 /nfs/dbraw/zinc/83/58/18/570835818.db2.gz FJBRVLIILVZJEG-UHFFFAOYSA-N 0 1 388.401 3.052 10 0 GGAEMN CCOC(=O)C1CCN(C[C@@H](O)COc2ccc(C(C)(C)CC)cc2)CC1 ZINC000003237234 570840434 /nfs/dbraw/zinc/84/04/34/570840434.db2.gz CLVBZZPHOLPDKS-LJQANCHMSA-N 0 1 377.525 3.389 10 0 GGAEMN CC(=O)Nc1cc(C)nn1-c1ccc(NS(=O)(=O)c2ccccc2F)cc1 ZINC000032833579 570845382 /nfs/dbraw/zinc/84/53/82/570845382.db2.gz JMLKYZSGGVUSEL-UHFFFAOYSA-N 0 1 388.424 3.079 10 0 GGAEMN Cc1ccccc1C(=O)NCCC(=O)NC[C@H](c1ccco1)N1CCCCC1 ZINC000032841462 570849973 /nfs/dbraw/zinc/84/99/73/570849973.db2.gz CIDWVFNEKYECEO-LJQANCHMSA-N 0 1 383.492 3.051 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1 ZINC000012549568 570852076 /nfs/dbraw/zinc/85/20/76/570852076.db2.gz ADRVWXKHUCWRNU-UHFFFAOYSA-N 0 1 391.427 3.069 10 0 GGAEMN COc1ccccc1N1CC[C@H](C)N(CC(=O)N2CCc3ccccc3C2)CC1 ZINC000170597285 570855066 /nfs/dbraw/zinc/85/50/66/570855066.db2.gz TXPKHIGTIBNIOA-IBGZPJMESA-N 0 1 393.531 3.181 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc3c2OCC[C@@H]3O)ccc1Br ZINC000170597593 570855516 /nfs/dbraw/zinc/85/55/16/570855516.db2.gz JCFUPXQPQDKFMF-HNNXBMFYSA-N 0 1 398.278 3.374 10 0 GGAEMN COc1ccc2nc([C@@H](C)NC(=O)[C@@H]3CC(c4cccc(F)c4)=NO3)[nH]c2c1 ZINC000170600528 570858304 /nfs/dbraw/zinc/85/83/04/570858304.db2.gz MEHASNSEUIJPAW-ZMZPIMSZSA-N 0 1 382.395 3.081 10 0 GGAEMN Cn1c(=O)c2ccc(C(=O)N[C@@H]3CCCC[C@@H]3C(F)(F)F)cc2[nH]c1=S ZINC000102832501 570866297 /nfs/dbraw/zinc/86/62/97/570866297.db2.gz CYXUEIIIUCEKFZ-NWDGAFQWSA-N 0 1 385.411 3.073 10 0 GGAEMN Cc1cc2[nH]ncc2cc1NC(=O)[C@H]1CS[C@@]2(c3ccccc3)CCC(=O)N12 ZINC000170611493 570868330 /nfs/dbraw/zinc/86/83/30/570868330.db2.gz ZUNFQRZLGXDSEV-WIYYLYMNSA-N 0 1 392.484 3.401 10 0 GGAEMN O=C(NC[C@@H](c1c(F)cccc1Cl)N1CCCC1)[C@@H]1CCCN1C1CC1 ZINC000170615868 570873404 /nfs/dbraw/zinc/87/34/04/570873404.db2.gz ICACSGIKIKKWSI-ROUUACIJSA-N 0 1 379.907 3.359 10 0 GGAEMN C[C@@H](NC(=O)CSc1nc(N)cc(N)n1)c1ccc(-c2ccccc2)cc1 ZINC000012608503 570889683 /nfs/dbraw/zinc/88/96/83/570889683.db2.gz WIUHTYXYZLWDPN-CYBMUJFWSA-N 0 1 379.489 3.278 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)c3ccc(-c4ccc(F)cc4)o3)cn2)CC1 ZINC000012613638 570890454 /nfs/dbraw/zinc/89/04/54/570890454.db2.gz IZUPJJZIPQUEIQ-UHFFFAOYSA-N 0 1 380.423 3.485 10 0 GGAEMN O=C(Nc1ccc(F)cc1)[C@H]1CCCN(C(=O)c2cc(-c3ccncc3)[nH]n2)C1 ZINC000085690465 570902989 /nfs/dbraw/zinc/90/29/89/570902989.db2.gz FRXFYFFCJJIVDE-HNNXBMFYSA-N 0 1 393.422 3.102 10 0 GGAEMN CCc1nn2c(nc(CSc3nc(-c4ccc(C)cc4)n[nH]3)cc2=O)s1 ZINC000015731842 570903204 /nfs/dbraw/zinc/90/32/04/570903204.db2.gz ZOOKNBMWIACGTB-UHFFFAOYSA-N 0 1 384.490 3.099 10 0 GGAEMN N=C1Nc2nc3ccccc3n2[C@@H](c2ccc(OCc3cscn3)cc2)N1 ZINC000032907219 570907291 /nfs/dbraw/zinc/90/72/91/570907291.db2.gz GHDOULNYPPGLHV-KRWDZBQOSA-N 0 1 376.445 3.359 10 0 GGAEMN O=C(CSc1nccn1-c1ccccc1)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000032909721 570912464 /nfs/dbraw/zinc/91/24/64/570912464.db2.gz OQRXAPOPPPZZJR-IBGZPJMESA-N 0 1 392.528 3.355 10 0 GGAEMN O=C(Nc1ccc(CN2CCOCC2)cn1)c1cc(-c2ccc(Cl)cc2)n[nH]1 ZINC000097022251 570914835 /nfs/dbraw/zinc/91/48/35/570914835.db2.gz FNGBNWQNXMDMCV-UHFFFAOYSA-N 0 1 397.866 3.210 10 0 GGAEMN Cc1ccc(C(=O)CCC(=O)NCCN2CCN(C)C[C@@H]2c2ccccc2)s1 ZINC000032912039 570914905 /nfs/dbraw/zinc/91/49/05/570914905.db2.gz BIFBDFGDYNYLLC-LJQANCHMSA-N 0 1 399.560 3.124 10 0 GGAEMN Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)Nc1cc(F)cc(F)c1 ZINC000016305793 570921861 /nfs/dbraw/zinc/92/18/61/570921861.db2.gz OAPGUIKMZMBRNW-UHFFFAOYSA-N 0 1 375.350 3.463 10 0 GGAEMN Cc1ccc(C)c(NC(=O)N2CCN(c3nc(C)cc(N4CCCC4)n3)CC2)c1 ZINC000017026394 570924625 /nfs/dbraw/zinc/92/46/25/570924625.db2.gz QIPGOPDAPGFDBJ-UHFFFAOYSA-N 0 1 394.523 3.356 10 0 GGAEMN CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1 ZINC000106141239 570948937 /nfs/dbraw/zinc/94/89/37/570948937.db2.gz UPJGJCFDZFADIK-LZLYRXPVSA-N 0 1 377.504 3.020 10 0 GGAEMN CCc1c(NC(=O)CN2CCCc3sccc3C2=O)[nH]nc1-c1ccncc1 ZINC000083817672 570966915 /nfs/dbraw/zinc/96/69/15/570966915.db2.gz HZHPOBPKHZITBR-UHFFFAOYSA-N 0 1 395.488 3.123 10 0 GGAEMN COC[C@@H](c1cccc(C(F)(F)F)c1)N(C)Cc1cccc(OCC(N)=O)c1 ZINC000083864178 570973998 /nfs/dbraw/zinc/97/39/98/570973998.db2.gz UXQSJNIBYKXVQJ-SFHVURJKSA-N 0 1 396.409 3.389 10 0 GGAEMN O=C([O-])C[N@H+]1CCC[C@H](CNC(=O)OCC2c3ccccc3-c3ccccc32)C1 ZINC000725240577 570974905 /nfs/dbraw/zinc/97/49/05/570974905.db2.gz OOCUYEAJEQECMM-MRXNPFEDSA-N 0 1 394.471 3.322 10 0 GGAEMN CN(C)c1ccc(N[C@H]2CCCN(C(=O)c3cccc4[nH]cnc43)CC2)cn1 ZINC000252532841 570989377 /nfs/dbraw/zinc/98/93/77/570989377.db2.gz FIBOESKENFTUCJ-HNNXBMFYSA-N 0 1 378.480 3.131 10 0 GGAEMN COc1cccc([C@H](CNC(=O)c2cnn(CC(F)(F)F)c2)N2CCCC2)c1 ZINC000252539478 570992774 /nfs/dbraw/zinc/99/27/74/570992774.db2.gz OCAYEXZTTYCIKY-KRWDZBQOSA-N 0 1 396.413 3.021 10 0 GGAEMN O=C(NCc1ccc(N2CCCC2)nc1)N1CCCN(Cc2cccs2)CC1 ZINC000045844736 570998308 /nfs/dbraw/zinc/99/83/08/570998308.db2.gz MIRPBTZYLKAUNY-UHFFFAOYSA-N 0 1 399.564 3.161 10 0 GGAEMN CCCN(Cc1cc(OC)c(OC)c(OC)c1)Cc1cc(=O)n2ccccc2n1 ZINC000045974056 571007295 /nfs/dbraw/zinc/00/72/95/571007295.db2.gz YEYPDXFTYPQFHU-UHFFFAOYSA-N 0 1 397.475 3.133 10 0 GGAEMN CCOc1ccc(CN(CC)Cc2cc(=O)n3nc(C4CC4)sc3n2)cc1 ZINC000046032462 571014135 /nfs/dbraw/zinc/01/41/35/571014135.db2.gz XUTCBJDKSLZDLD-UHFFFAOYSA-N 0 1 384.505 3.449 10 0 GGAEMN CCCN(Cc1ccc(OC)cc1)Cc1cc(=O)n2nc(C3CC3)sc2n1 ZINC000046032296 571014235 /nfs/dbraw/zinc/01/42/35/571014235.db2.gz AVFIKPOJXCXJKW-UHFFFAOYSA-N 0 1 384.505 3.449 10 0 GGAEMN O=S(=O)(N[C@@H]1CCCN(CCCc2nc3ccccc3o2)C1)c1ccccc1 ZINC000084558669 571023294 /nfs/dbraw/zinc/02/32/94/571023294.db2.gz BACGRVOHSCUGFQ-QGZVFWFLSA-N 0 1 399.516 3.203 10 0 GGAEMN Cc1[nH]nc(CCC(=O)N2CCC(c3nccn3Cc3ccncc3)CC2)c1C ZINC000095503480 571077531 /nfs/dbraw/zinc/07/75/31/571077531.db2.gz KQLKYCIMGREBOI-UHFFFAOYSA-N 0 1 392.507 3.005 10 0 GGAEMN CC(=O)N1CCCSc2ccc(S(=O)(=O)Nc3ncccc3C)cc21 ZINC000035504553 642507327 /nfs/dbraw/zinc/50/73/27/642507327.db2.gz QBPVGQJBGFWIKO-UHFFFAOYSA-N 0 1 377.491 3.040 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)CCCCC(=O)c3ccccc3)nc2)CC1 ZINC000053746093 1406501424 /nfs/dbraw/zinc/50/14/24/1406501424.db2.gz ZTAJGAMUINJXKJ-UHFFFAOYSA-N 0 1 380.492 3.215 10 0 GGAEMN CS(=O)(=O)Nc1cccc(CNCc2cc(Br)cs2)c1 ZINC000055373524 1406941670 /nfs/dbraw/zinc/94/16/70/1406941670.db2.gz DZSWEZZEIBOSOA-UHFFFAOYSA-N 0 1 375.313 3.172 10 0 GGAEMN CCC(=O)c1ccc(OC[C@@H](O)CN2CCC(O)(c3ccccc3)CC2)cc1 ZINC000001729450 1398303102 /nfs/dbraw/zinc/30/31/02/1398303102.db2.gz VBQYVPWJXQKIMF-FQEVSTJZSA-N 0 1 383.488 3.003 10 0 GGAEMN O=C(CCCn1c(=O)c2ccccc2[nH]c1=S)N1CCc2ccccc2C1 ZINC000002971413 1398323018 /nfs/dbraw/zinc/32/30/18/1398323018.db2.gz PCJQPZPSCMTEDI-UHFFFAOYSA-N 0 1 379.485 3.424 10 0 GGAEMN O=C(NCc1ccco1)c1ccc(Cn2c(=O)c3ccccc3[nH]c2=S)cc1 ZINC000002973355 1398323724 /nfs/dbraw/zinc/32/37/24/1398323724.db2.gz HIZSUNOZFDJREP-UHFFFAOYSA-N 0 1 391.452 3.257 10 0 GGAEMN O=C(Cn1c(=O)c2ccccc2[nH]c1=S)NCCSCc1ccccc1 ZINC000003043610 1398325470 /nfs/dbraw/zinc/32/54/70/1398325470.db2.gz GMFGDAAENXRCRB-UHFFFAOYSA-N 0 1 385.514 3.109 10 0 GGAEMN CCOC(=O)C1=C(c2ccccc2)NC(=O)N[C@@H]1c1ccc(O)c(OCC)c1 ZINC000003253461 1398330852 /nfs/dbraw/zinc/33/08/52/1398330852.db2.gz MJZXWGQYRWOMMF-LJQANCHMSA-N 0 1 382.416 3.119 10 0 GGAEMN CCn1c(C)nc2cc(C(=O)n3cc(C(=O)c4cc(F)ccc4O)cn3)ccc21 ZINC000003316063 1398334282 /nfs/dbraw/zinc/33/42/82/1398334282.db2.gz PZJYOFLEHPCGFM-UHFFFAOYSA-N 0 1 392.390 3.325 10 0 GGAEMN C[C@@H](N[C@@H](C)c1nnn[n-]1)c1ccc(Br)cc1Br ZINC000044925887 1423530998 /nfs/dbraw/zinc/53/09/98/1423530998.db2.gz NTXNFWYACVKYJC-RQJHMYQMSA-N 0 1 375.068 3.137 10 0 GGAEMN C[C@@H]([NH2+][C@@H](C)c1nnn[n-]1)c1ccc(Br)cc1Br ZINC000044925887 1423531000 /nfs/dbraw/zinc/53/10/00/1423531000.db2.gz NTXNFWYACVKYJC-RQJHMYQMSA-N 0 1 375.068 3.137 10 0 GGAEMN CCOC(=O)c1cnn(-c2ccccc2)c1NS(=O)(=O)c1ccc(C)cc1 ZINC000005923489 1398492243 /nfs/dbraw/zinc/49/22/43/1398492243.db2.gz JPRDWVZYPGGFFQ-UHFFFAOYSA-N 0 1 385.445 3.158 10 0 GGAEMN Cc1c2ccccc2[nH]c1CN(C)[C@H]1CN(C(=O)Nc2ccccc2C)C[C@@H]1O ZINC000012432284 1399041940 /nfs/dbraw/zinc/04/19/40/1399041940.db2.gz BXXPMGFYPUCZNH-VXKWHMMOSA-N 0 1 392.503 3.494 10 0 GGAEMN O=C(C1=CCN(Cc2ccc(F)cc2)CC1)N1CCN(c2ccccc2)CC1 ZINC000013362652 1399079510 /nfs/dbraw/zinc/07/95/10/1399079510.db2.gz GHKPNYZBKQOPMB-UHFFFAOYSA-N 0 1 379.479 3.307 10 0 GGAEMN COc1cccc(-c2cc(C(=O)N3CCN(Cc4ccc(F)cc4)CC3)n[nH]2)c1 ZINC000013366680 1399079523 /nfs/dbraw/zinc/07/95/23/1399079523.db2.gz MZOHRDOHDAIKLQ-UHFFFAOYSA-N 0 1 394.450 3.182 10 0 GGAEMN Cc1cccc(NC(=S)N(CCCN2CCN(C)CC2)Cc2ccco2)c1 ZINC000020107812 1399342212 /nfs/dbraw/zinc/34/22/12/1399342212.db2.gz LUEOQGIZQJEKEF-UHFFFAOYSA-N 0 1 386.565 3.425 10 0 GGAEMN CC(C)c1cc(CN2CCC(n3nccc3NC(=O)c3cccnc3)CC2)n[nH]1 ZINC000020207147 1399343503 /nfs/dbraw/zinc/34/35/03/1399343503.db2.gz SMLWZNITWHEVRK-UHFFFAOYSA-N 0 1 393.495 3.214 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cncc(C(=O)NCc3cccs3)c2)cc1 ZINC000020532761 1399347983 /nfs/dbraw/zinc/34/79/83/1399347983.db2.gz YXNVTRPAQZHMQD-UHFFFAOYSA-N 0 1 387.486 3.182 10 0 GGAEMN CCOC(=O)C1C(CN2CCc3ccccc32)=NC(=O)N[C@@H]1c1ccc(F)cc1 ZINC000020557840 1399348470 /nfs/dbraw/zinc/34/84/70/1399348470.db2.gz IDRLPOJQRTUBDK-HXUWFJFHSA-N 0 1 395.434 3.060 10 0 GGAEMN CCOC(=O)C1=C(CN(C)c2ccccc2)NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020560308 1399349481 /nfs/dbraw/zinc/34/94/81/1399349481.db2.gz FXAFZMCYAXABCI-HXUWFJFHSA-N 0 1 379.460 3.303 10 0 GGAEMN CCn1c(CN2CCN(CC)CC2)nc2cc(NC(=O)c3ccco3)ccc21 ZINC000020677878 1399352231 /nfs/dbraw/zinc/35/22/31/1399352231.db2.gz NMFWBSFEQJITTG-UHFFFAOYSA-N 0 1 381.480 3.039 10 0 GGAEMN Cc1c(C(=O)N2CCCCCC2)c(S(=O)(=O)Nc2ccccc2)c(C)n1C ZINC000020989990 1399359756 /nfs/dbraw/zinc/35/97/56/1399359756.db2.gz VOSHBQJLUJFSCM-UHFFFAOYSA-N 0 1 389.521 3.459 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2cc(C)ccc2C)c(C)n1C ZINC000021154073 1399367271 /nfs/dbraw/zinc/36/72/71/1399367271.db2.gz SGDRJTDLAKNZEU-UHFFFAOYSA-N 0 1 389.521 3.296 10 0 GGAEMN O=C(Nc1ccc(C(=O)NCCc2cnc[nH]2)cc1)c1nsc2ccccc21 ZINC000021714450 1399402951 /nfs/dbraw/zinc/40/29/51/1399402951.db2.gz NGKYFTYNCAMREQ-UHFFFAOYSA-N 0 1 391.456 3.244 10 0 GGAEMN O=C(Nc1ccccc1F)c1cncc(NS(=O)(=O)c2ccc(F)cc2)c1 ZINC000021748347 1399406078 /nfs/dbraw/zinc/40/60/78/1399406078.db2.gz VPBCCJLXQUOOKF-UHFFFAOYSA-N 0 1 389.383 3.413 10 0 GGAEMN CCCN1CCN(c2nc3c(cnn3C)c(Nc3cccc(Cl)c3)n2)CC1 ZINC000021928958 1399424353 /nfs/dbraw/zinc/42/43/53/1399424353.db2.gz DSSYLJUEGJDALF-UHFFFAOYSA-N 0 1 385.903 3.292 10 0 GGAEMN Cc1cc(NC(=O)c2cncc(NS(=O)(=O)c3ccc(Cl)cc3)c2)no1 ZINC000021931290 1399424729 /nfs/dbraw/zinc/42/47/29/1399424729.db2.gz ZOKREWVEORSJPS-UHFFFAOYSA-N 0 1 392.824 3.085 10 0 GGAEMN O=S(=O)(NCC1CCN(Cc2ccncc2)CC1)c1cccc2ccccc21 ZINC000023000177 1399523988 /nfs/dbraw/zinc/52/39/88/1399523988.db2.gz XYBFFFOWJONCEP-UHFFFAOYSA-N 0 1 395.528 3.425 10 0 GGAEMN CC(C)(C)OC(=O)N[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1 ZINC000056316180 1407295480 /nfs/dbraw/zinc/29/54/80/1407295480.db2.gz HGCIZEUALCLVFX-HOTGVXAUSA-N 0 1 384.904 3.069 10 0 GGAEMN COC(=O)c1cc(OC)c(OC)cc1NS(=O)(=O)c1cccc(Cl)c1C ZINC000042986234 1403683429 /nfs/dbraw/zinc/68/34/29/1403683429.db2.gz DMUCQIXMSTZPGL-UHFFFAOYSA-N 0 1 399.852 3.253 10 0 GGAEMN C[C@H](C[C@@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCCCc1nnn[n-]1 ZINC000708195119 1428215106 /nfs/dbraw/zinc/21/51/06/1428215106.db2.gz KLMAPPIWOORKKS-CVEARBPZSA-N 0 1 380.537 3.070 10 0 GGAEMN CC[C@H](NCc1ccc(OC)c(OC)c1)c1ccccc1OCC(=O)N(C)C ZINC000048750606 1405281635 /nfs/dbraw/zinc/28/16/35/1405281635.db2.gz BPAAAUIFYMXMND-SFHVURJKSA-N 0 1 386.492 3.412 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)NCCN2CCc3ccccc3C2)c(OC)c1 ZINC000048993494 1405331117 /nfs/dbraw/zinc/33/11/17/1405331117.db2.gz FXMKZGHTKYWNTE-MRXNPFEDSA-N 0 1 383.492 3.122 10 0 GGAEMN Cc1ccc(C)c([C@@H](C)NC(=O)NC[C@@H](O)CN2CCc3ccccc3C2)c1 ZINC000049166078 1405347513 /nfs/dbraw/zinc/34/75/13/1405347513.db2.gz FHPINUHTFQVSCH-WIYYLYMNSA-N 0 1 381.520 3.083 10 0 GGAEMN C[C@H](NC(=O)NC[C@@H](O)CN1CCc2ccccc2C1)c1ccc(Cl)s1 ZINC000049169827 1405348709 /nfs/dbraw/zinc/34/87/09/1405348709.db2.gz BNWBJMFBJJRSFK-XJKSGUPXSA-N 0 1 393.940 3.181 10 0 GGAEMN COCC(=O)N1CCCc2ccc(NC(=O)c3cc(-c4cccs4)n[nH]3)cc21 ZINC000049505836 1405381085 /nfs/dbraw/zinc/38/10/85/1405381085.db2.gz CDWIWUYPYRZWRC-UHFFFAOYSA-N 0 1 396.472 3.316 10 0 GGAEMN CCCNC(=O)[C@@H]1CCCN([C@@H](C)C(=O)N[C@@H](C)c2cc3ccccc3o2)C1 ZINC000050996357 1405698599 /nfs/dbraw/zinc/69/85/99/1405698599.db2.gz HBQDIQORCFQHBC-XYJFISCASA-N 0 1 385.508 3.237 10 0 GGAEMN O=C(CN1CCC(c2ccc(O)cc2)CC1)NC[C@@H]1CCN(c2ccccc2)C1 ZINC000052467954 1406061470 /nfs/dbraw/zinc/06/14/70/1406061470.db2.gz GEEHEVWOEGOVSV-IBGZPJMESA-N 0 1 393.531 3.214 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)C1)c1ccsc1 ZINC000056864567 1407458939 /nfs/dbraw/zinc/45/89/39/1407458939.db2.gz AKFYOGUJPVZFMH-JKSUJKDBSA-N 0 1 396.557 3.050 10 0 GGAEMN CN1C(=O)Cc2cc(S(=O)(=O)Nc3ccc(-c4ccccc4)nc3)ccc21 ZINC000062061529 1408205349 /nfs/dbraw/zinc/20/53/49/1408205349.db2.gz MANCRYAFUQUARV-UHFFFAOYSA-N 0 1 379.441 3.068 10 0 GGAEMN CN1C(=O)Cc2cc(S(=O)(=O)Nc3ccc(-c4ccccc4)cn3)ccc21 ZINC000062545684 1408275904 /nfs/dbraw/zinc/27/59/04/1408275904.db2.gz ZGRSPMQZGSJCNB-UHFFFAOYSA-N 0 1 379.441 3.068 10 0 GGAEMN CCNC(=O)COc1ccc(CNCc2cnc(C(C)(C)C)s2)cc1OC ZINC000063521526 1408367070 /nfs/dbraw/zinc/36/70/70/1408367070.db2.gz AKLIAEDUOVXCIR-UHFFFAOYSA-N 0 1 391.537 3.254 10 0 GGAEMN CCN(C(=O)CCc1nc2cccc(C)c2[nH]1)[C@@H]1CCN(c2ccccc2)C1=O ZINC000176424596 1428315579 /nfs/dbraw/zinc/31/55/79/1428315579.db2.gz KEDZMCFOQDXRFM-LJQANCHMSA-N 0 1 390.487 3.458 10 0 GGAEMN CCN(CC)[C@H](CNC(=O)NCc1ccc(NC(=O)OC)cc1)c1ccco1 ZINC000065482076 1408676692 /nfs/dbraw/zinc/67/66/92/1408676692.db2.gz AKDKPITUTHRLLZ-QGZVFWFLSA-N 0 1 388.468 3.340 10 0 GGAEMN C[C@@H](N[C@@H](C)C(=O)NC(=O)NCC(F)(F)F)c1ccccc1C(F)(F)F ZINC000066391044 1408828640 /nfs/dbraw/zinc/82/86/40/1408828640.db2.gz BJWLFEYUGZSUER-BDAKNGLRSA-N 0 1 385.308 3.133 10 0 GGAEMN C[C@@H](NC(=O)NCc1cccnc1N1CCN(C)CC1)c1ccc(Cl)s1 ZINC000066891879 1408943601 /nfs/dbraw/zinc/94/36/01/1408943601.db2.gz FWFNPDPYNQXCJE-CYBMUJFWSA-N 0 1 393.944 3.109 10 0 GGAEMN CC[C@H](C)NC(=O)c1cccc(CNCc2ccccc2N2CCOCC2)c1 ZINC000066973312 1408969450 /nfs/dbraw/zinc/96/94/50/1408969450.db2.gz CDTUXOVNXHNNNE-SFHVURJKSA-N 0 1 381.520 3.341 10 0 GGAEMN C[C@H](NCc1nc2ccccc2n1C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000066973234 1408969494 /nfs/dbraw/zinc/96/94/94/1408969494.db2.gz HCSCTAZKXURFAD-HNNXBMFYSA-N 0 1 378.476 3.082 10 0 GGAEMN CN1CCN(c2ccc(CNCc3csc(-c4ccsc4)n3)cn2)CC1 ZINC000067186793 1409036116 /nfs/dbraw/zinc/03/61/16/1409036116.db2.gz AJTRTDSKMKIREB-UHFFFAOYSA-N 0 1 385.562 3.308 10 0 GGAEMN COc1cccc(CNC[C@@H](O)COc2ccc(C(F)(F)F)cc2)c1OC ZINC000067255205 1409054888 /nfs/dbraw/zinc/05/48/88/1409054888.db2.gz HMXSBEHRUJXVNL-OAHLLOKOSA-N 0 1 385.382 3.252 10 0 GGAEMN COc1cc(CNCc2ccnc(OCC(F)(F)F)c2)cc(OC)c1OC ZINC000067669781 1409204106 /nfs/dbraw/zinc/20/41/06/1409204106.db2.gz GOEUNIVXEIPBPY-UHFFFAOYSA-N 0 1 386.370 3.338 10 0 GGAEMN CC(C)CC(=O)Nc1cccc(CNCc2ccccc2OCC(=O)N(C)C)c1 ZINC000068258275 1409342796 /nfs/dbraw/zinc/34/27/96/1409342796.db2.gz CAQMNKBWSAMXHX-UHFFFAOYSA-N 0 1 397.519 3.428 10 0 GGAEMN CC(=O)Nc1cccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)c1 ZINC000069680997 1409674156 /nfs/dbraw/zinc/67/41/56/1409674156.db2.gz APWXMOZSFXUHDO-UHFFFAOYSA-N 0 1 378.432 3.096 10 0 GGAEMN Cc1nn(C(F)F)c(C)c1CC(=O)N1CCCN(Cc2cccs2)CC1 ZINC000069930160 1409726419 /nfs/dbraw/zinc/72/64/19/1409726419.db2.gz RSCPNFIWGVIAQG-UHFFFAOYSA-N 0 1 382.480 3.234 10 0 GGAEMN CCN1CCc2ccc(NC(=O)c3cccc(CN4CCN(C)CC4)c3)cc21 ZINC000073339753 1409860631 /nfs/dbraw/zinc/86/06/31/1409860631.db2.gz CKITVSHJLGJNRV-UHFFFAOYSA-N 0 1 378.520 3.069 10 0 GGAEMN FC(F)(F)c1ccc(-c2noc(CN3CCN([C@@H]4CCSC4)CC3)n2)cc1 ZINC000079025737 1409951465 /nfs/dbraw/zinc/95/14/65/1409951465.db2.gz CLYPVXSEYYANAD-OAHLLOKOSA-N 0 1 398.454 3.379 10 0 GGAEMN CCOC(=O)c1cnn2ccc(NS(=O)(=O)c3cccc(Cl)c3C)cc12 ZINC000090653972 1410066620 /nfs/dbraw/zinc/06/66/20/1410066620.db2.gz VPMBGZFWLSFIIV-UHFFFAOYSA-N 0 1 393.852 3.274 10 0 GGAEMN CC(=O)N(C)C1CCN(Cc2cccc3c2N(C(=O)OC(C)(C)C)CC3)CC1 ZINC000092538482 1410171043 /nfs/dbraw/zinc/17/10/43/1410171043.db2.gz SENXMZUUPWXMFT-UHFFFAOYSA-N 0 1 387.524 3.427 10 0 GGAEMN CC[C@@H](C)NC(=O)[C@@H](C)NCc1ccc(OC(F)F)c(Br)c1 ZINC000092564390 1410173399 /nfs/dbraw/zinc/17/33/99/1410173399.db2.gz CTSPRALOYMFPOE-NXEZZACHSA-N 0 1 379.245 3.443 10 0 GGAEMN CC(C)N1CC[C@H](NCc2ccc(OC(F)F)c(Br)c2)C1=O ZINC000092565695 1410173445 /nfs/dbraw/zinc/17/34/45/1410173445.db2.gz FMCMCHOTUILDOM-LBPRGKRZSA-N 0 1 377.229 3.149 10 0 GGAEMN COC(=O)CCn1nc(C)c(CN2CCC(Oc3ccc(F)cc3)CC2)c1C ZINC000092661013 1410184138 /nfs/dbraw/zinc/18/41/38/1410184138.db2.gz PEMVYVJIQRPFMG-UHFFFAOYSA-N 0 1 389.471 3.246 10 0 GGAEMN Cc1ccccc1C(=O)NCCC(=O)N1CCN(Cc2ccccc2)C(C)(C)C1 ZINC000095351032 1410309899 /nfs/dbraw/zinc/30/98/99/1410309899.db2.gz HRGIMILDEXIGAW-UHFFFAOYSA-N 0 1 393.531 3.238 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCN1C[C@@H](C)O ZINC000095408119 1410310448 /nfs/dbraw/zinc/31/04/48/1410310448.db2.gz BZHPCWHKQXLQCJ-AEFFLSMTSA-N 0 1 384.480 3.183 10 0 GGAEMN COCCCn1ccc(NC(=O)N2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)n1 ZINC000095454971 1410311836 /nfs/dbraw/zinc/31/18/36/1410311836.db2.gz BYEWULWSWRSEAZ-MRXNPFEDSA-N 0 1 395.467 3.074 10 0 GGAEMN COCCCn1ccc(NC(=O)N2CCC[C@@H]2c2nc(-c3ccccc3)n[nH]2)n1 ZINC000095454971 1410311841 /nfs/dbraw/zinc/31/18/41/1410311841.db2.gz BYEWULWSWRSEAZ-MRXNPFEDSA-N 0 1 395.467 3.074 10 0 GGAEMN COc1ccccc1CNC(=O)CN[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000095462586 1410312502 /nfs/dbraw/zinc/31/25/02/1410312502.db2.gz CZIYRNXHDZWNGV-HNNXBMFYSA-N 0 1 396.466 3.295 10 0 GGAEMN COc1ccccc1CNC(=O)CN[C@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000095462585 1410312682 /nfs/dbraw/zinc/31/26/82/1410312682.db2.gz CZIYRNXHDZWNGV-OAHLLOKOSA-N 0 1 396.466 3.295 10 0 GGAEMN CC(C)Cc1ccc(C(=O)C2CCN(C(=O)[C@@H]3C[C@@H]3c3nc[nH]n3)CC2)cc1 ZINC000095465162 1410312767 /nfs/dbraw/zinc/31/27/67/1410312767.db2.gz IUXUZYFGODYFFA-RBUKOAKNSA-N 0 1 380.492 3.228 10 0 GGAEMN Cc1cnn(-c2ccc(S(=O)(=O)Nc3ccnc(C(C)(C)C)n3)cc2F)c1 ZINC000095944148 1410316124 /nfs/dbraw/zinc/31/61/24/1410316124.db2.gz MXVVECNAXROLOH-UHFFFAOYSA-N 0 1 389.456 3.208 10 0 GGAEMN O=C(CNC1(c2ccc(F)cc2)CCOCC1)N1CCC(c2ccccc2)=N1 ZINC000095953322 1410317173 /nfs/dbraw/zinc/31/71/73/1410317173.db2.gz APPKJCQDXRAWPY-UHFFFAOYSA-N 0 1 381.451 3.058 10 0 GGAEMN O=C(Nc1cc(F)ccc1-n1cccn1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000095980558 1410318053 /nfs/dbraw/zinc/31/80/53/1410318053.db2.gz OHJXMCQAOVFLPK-AWEZNQCLSA-N 0 1 395.442 3.418 10 0 GGAEMN O=C(NCc1nc2ccc(F)cc2[nH]1)[C@H]1CCn2c(cnc2-c2ccccc2)C1 ZINC000095993239 1410319449 /nfs/dbraw/zinc/31/94/49/1410319449.db2.gz NWCMWMXFWPLAQH-HNNXBMFYSA-N 0 1 389.434 3.444 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)[C@@H]2CCn3c(cnc3-c3ccccc3)C2)c1 ZINC000095993243 1410319512 /nfs/dbraw/zinc/31/95/12/1410319512.db2.gz RSHBOLQJSUKPNO-GOSISDBHSA-N 0 1 375.476 3.208 10 0 GGAEMN COc1ccc(C(=O)Nc2c[nH]nc2[C@@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000096000193 1410320631 /nfs/dbraw/zinc/32/06/31/1410320631.db2.gz QMPOMJMRPWJUNG-GOSISDBHSA-N 0 1 391.475 3.445 10 0 GGAEMN COCC(=O)Nc1c[nH]nc1[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1 ZINC000096000126 1410320692 /nfs/dbraw/zinc/32/06/92/1410320692.db2.gz OBLWXEBIGASVER-CQSZACIVSA-N 0 1 396.413 3.393 10 0 GGAEMN O=C(NC1CCCCC1)N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC000096078224 1410322439 /nfs/dbraw/zinc/32/24/39/1410322439.db2.gz RSNLRGUWDJEZOM-UHFFFAOYSA-N 0 1 386.540 3.038 10 0 GGAEMN COCCN1C(=O)[C@@H](c2ccccc2)CC12CCN(Cc1ccncc1)CC2 ZINC000096061361 1410322777 /nfs/dbraw/zinc/32/27/77/1410322777.db2.gz QEBOAUJJBIANQU-OAQYLSRUSA-N 0 1 379.504 3.079 10 0 GGAEMN Cc1ccc(C(=O)NC[C@@H]2CCCO2)c(C2CCN(Cc3ccccn3)CC2)n1 ZINC000096281655 1410326271 /nfs/dbraw/zinc/32/62/71/1410326271.db2.gz SKWVGUKHAHOCCD-FQEVSTJZSA-N 0 1 394.519 3.073 10 0 GGAEMN Cc1ccc(C(=O)NC[C@H]2CCCO2)c(C2CCN(Cc3cccnc3)CC2)n1 ZINC000096281658 1410326330 /nfs/dbraw/zinc/32/63/30/1410326330.db2.gz KPBCTIFVJCVRKB-HXUWFJFHSA-N 0 1 394.519 3.073 10 0 GGAEMN Cc1ccc(C(=O)NC[C@@H]2CCCO2)c(C2CCN(Cc3cccnc3)CC2)n1 ZINC000096281657 1410326661 /nfs/dbraw/zinc/32/66/61/1410326661.db2.gz KPBCTIFVJCVRKB-FQEVSTJZSA-N 0 1 394.519 3.073 10 0 GGAEMN O=C(Nc1ccc(F)cc1)C1CCN(C(=O)c2cc(-c3cccnc3)[nH]n2)CC1 ZINC000096324665 1410327456 /nfs/dbraw/zinc/32/74/56/1410327456.db2.gz KZACNNAITZWCLP-UHFFFAOYSA-N 0 1 393.422 3.102 10 0 GGAEMN Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)c1 ZINC000096324801 1410327778 /nfs/dbraw/zinc/32/77/78/1410327778.db2.gz JACDKSSYZLIYPG-KRWDZBQOSA-N 0 1 389.459 3.271 10 0 GGAEMN Cc1cccc(NC(=O)C2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)CC2)c1 ZINC000096324622 1410327791 /nfs/dbraw/zinc/32/77/91/1410327791.db2.gz KSKUFNBMBIYXJG-UHFFFAOYSA-N 0 1 389.459 3.271 10 0 GGAEMN O=C(NCCc1ccncc1)c1cccc2[nH]cc(CN3CCSCC3)c21 ZINC000096363706 1410328100 /nfs/dbraw/zinc/32/81/00/1410328100.db2.gz ZBKCDUFURXXPEH-UHFFFAOYSA-N 0 1 380.517 3.084 10 0 GGAEMN COc1cccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nnc(C3CC3)o2)c1 ZINC000096379623 1410329766 /nfs/dbraw/zinc/32/97/66/1410329766.db2.gz FGTFKUQVXNDSKK-UHFFFAOYSA-N 0 1 388.449 3.368 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2-c2nc(CC)no2)cc1 ZINC000096379786 1410329925 /nfs/dbraw/zinc/32/99/25/1410329925.db2.gz SASGQFOCLYUFRW-UHFFFAOYSA-N 0 1 390.465 3.443 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2ccc(F)c(C)c2)n1 ZINC000096379810 1410329968 /nfs/dbraw/zinc/32/99/68/1410329968.db2.gz UNALEIWMRIULHW-UHFFFAOYSA-N 0 1 378.429 3.492 10 0 GGAEMN Cc1ccccc1-c1cc(C(=O)N2CCC(NC(=O)C3CCCC3)CC2)n[nH]1 ZINC000096400032 1410332242 /nfs/dbraw/zinc/33/22/42/1410332242.db2.gz NDRALDAPKPGTEE-UHFFFAOYSA-N 0 1 380.492 3.296 10 0 GGAEMN O=C(NC1CCN(C(=O)c2cc(-c3cccs3)[nH]n2)CC1)c1cccs1 ZINC000096400017 1410332383 /nfs/dbraw/zinc/33/23/83/1410332383.db2.gz QPINMCGZMQYKBO-UHFFFAOYSA-N 0 1 386.502 3.234 10 0 GGAEMN Cc1cccnc1NC(=O)C1CCN([C@H](C(=O)NC2CC2)c2ccccc2)CC1 ZINC000096747839 1410335740 /nfs/dbraw/zinc/33/57/40/1410335740.db2.gz OPITZEZPKWWAKX-FQEVSTJZSA-N 0 1 392.503 3.060 10 0 GGAEMN O=C(CSc1nc(C=Cc2ccc(F)cc2)n[nH]1)NCCOc1ccccc1 ZINC000096942221 1410338314 /nfs/dbraw/zinc/33/83/14/1410338314.db2.gz TZCRZGXMSSXYNN-FLIBITNWSA-N 0 1 398.463 3.402 10 0 GGAEMN COc1ccc(C2=NN(C(=O)CN3CCCC3)[C@H](c3cccc(OC)c3)C2)cc1 ZINC000097165217 1410356232 /nfs/dbraw/zinc/35/62/32/1410356232.db2.gz CRSNSNOJMJAAJE-QFIPXVFZSA-N 0 1 393.487 3.477 10 0 GGAEMN CC(C)N(C)C(=O)C1CCN(C(=O)CN[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000097473809 1410370295 /nfs/dbraw/zinc/37/02/95/1410370295.db2.gz GQWSAABXIGRVFT-OAHLLOKOSA-N 0 1 379.932 3.096 10 0 GGAEMN CCn1cnnc1[C@@H]1CCCN(CC(=O)N(Cc2ccccc2)C(C)(C)C)C1 ZINC000103477157 1410862306 /nfs/dbraw/zinc/86/23/06/1410862306.db2.gz QGXMLVHAZUDCSY-LJQANCHMSA-N 0 1 383.540 3.305 10 0 GGAEMN Cc1oc2c(c1C(=O)N1CCCN(C)CC1)CN(Cc1cccc(F)c1)CC2 ZINC000105111466 1411030219 /nfs/dbraw/zinc/03/02/19/1411030219.db2.gz KAUXLWYWJWUKRY-UHFFFAOYSA-N 0 1 385.483 3.063 10 0 GGAEMN O=C(Nc1ccc(F)cc1)N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC000109222150 1411719746 /nfs/dbraw/zinc/71/97/46/1411719746.db2.gz ZNHSNNXYHMXKPL-UHFFFAOYSA-N 0 1 398.482 3.367 10 0 GGAEMN COc1ccc(-c2n[nH]c(CNC(=O)N[C@@H]3CCCc4ccccc43)n2)cc1 ZINC000111792102 1412029765 /nfs/dbraw/zinc/02/97/65/1412029765.db2.gz FLKIUKHDKDKAJK-GOSISDBHSA-N 0 1 377.448 3.357 10 0 GGAEMN COc1ccc(-c2nc(CNC(=O)N[C@@H]3CCCc4ccccc43)n[nH]2)cc1 ZINC000111792102 1412029772 /nfs/dbraw/zinc/02/97/72/1412029772.db2.gz FLKIUKHDKDKAJK-GOSISDBHSA-N 0 1 377.448 3.357 10 0 GGAEMN COc1cc(CN[C@@H]2CCN(c3ccccc3F)C2=O)ccc1OC(F)F ZINC000112366460 1412135396 /nfs/dbraw/zinc/13/53/96/1412135396.db2.gz CTOMSQAIIKNWCV-CQSZACIVSA-N 0 1 380.366 3.331 10 0 GGAEMN COc1cc([C@@H](C)N[C@H](C)C(=O)Nc2ncccn2)ccc1OC1CCCC1 ZINC000112529032 1412163129 /nfs/dbraw/zinc/16/31/29/1412163129.db2.gz GREHBEDAEUYXHO-HUUCEWRRSA-N 0 1 384.480 3.484 10 0 GGAEMN COc1ccc(OC(F)F)c(CNCc2ccc(N3CCO[C@H](C)C3)nc2)c1 ZINC000112709721 1412200809 /nfs/dbraw/zinc/20/08/09/1412200809.db2.gz GMMKWNXBLTZCJY-CQSZACIVSA-N 0 1 393.434 3.207 10 0 GGAEMN CCc1ccccc1NC(=O)CS(=O)(=O)c1nc(Cc2ccccc2)c(C)[nH]1 ZINC000113636642 1412324972 /nfs/dbraw/zinc/32/49/72/1412324972.db2.gz HFUBIQHAMUTQOU-UHFFFAOYSA-N 0 1 397.500 3.284 10 0 GGAEMN CC(=O)Nc1cccc(CS(=O)(=O)c2nc(Cc3ccccc3)c(C)[nH]2)c1 ZINC000113636548 1412325086 /nfs/dbraw/zinc/32/50/86/1412325086.db2.gz AMAJTJWYULPUGT-UHFFFAOYSA-N 0 1 383.473 3.241 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cccc(CNCc3cccc(O)c3)c2)cc1 ZINC000115627081 1412738785 /nfs/dbraw/zinc/73/87/85/1412738785.db2.gz CAQIFCQGMQQSSU-UHFFFAOYSA-N 0 1 398.484 3.491 10 0 GGAEMN COc1ccccc1[C@@H](C)NC(=O)[C@H](C)Sc1nc(-c2ccccn2)n[nH]1 ZINC000117114067 1413001500 /nfs/dbraw/zinc/00/15/00/1413001500.db2.gz CZKTYVZODCLPOG-OLZOCXBDSA-N 0 1 383.477 3.233 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(Oc3ncccn3)cc2)cnc1Cl ZINC000117228665 1413015790 /nfs/dbraw/zinc/01/57/90/1413015790.db2.gz CFBQOEUHCHGQMJ-UHFFFAOYSA-N 0 1 376.825 3.427 10 0 GGAEMN Cc1ncc(CNc2cccc(CN3CCC[C@@H]3C(N)=O)c2)n1-c1ccccc1 ZINC000120037445 1413663288 /nfs/dbraw/zinc/66/32/88/1413663288.db2.gz DMVRWKVDHBQZOH-JOCHJYFZSA-N 0 1 389.503 3.243 10 0 GGAEMN NC(=O)[C@H]1CCCN1Cc1cccc(NCc2c(F)cccc2N2CCCC2)c1 ZINC000120069708 1413675244 /nfs/dbraw/zinc/67/52/44/1413675244.db2.gz FOUQMKDMGRJWQL-JOCHJYFZSA-N 0 1 396.510 3.488 10 0 GGAEMN C[C@H](Cc1ccc(Cl)cc1)N(C)CC(=O)NCCCN1CCCCCC1=O ZINC000121009524 1413975576 /nfs/dbraw/zinc/97/55/76/1413975576.db2.gz FTDSKYIPJYHAQA-QGZVFWFLSA-N 0 1 393.959 3.112 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000121429985 1414119097 /nfs/dbraw/zinc/11/90/97/1414119097.db2.gz ICVNNXCBTMBWEU-MPGHIAIKSA-N 0 1 383.467 3.390 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)[N@H+]2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000121430146 1414119212 /nfs/dbraw/zinc/11/92/12/1414119212.db2.gz ICVNNXCBTMBWEU-RVKKMQEKSA-N 0 1 383.467 3.390 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000121430146 1414119216 /nfs/dbraw/zinc/11/92/16/1414119216.db2.gz ICVNNXCBTMBWEU-RVKKMQEKSA-N 0 1 383.467 3.390 10 0 GGAEMN COCCCOC1CCN([C@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)CC1 ZINC000122624110 1414521149 /nfs/dbraw/zinc/52/11/49/1414521149.db2.gz AGSGRNPRHUPBMX-GOSISDBHSA-N 0 1 389.540 3.131 10 0 GGAEMN COCCCOC1CCN([C@@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)CC1 ZINC000122623886 1414521651 /nfs/dbraw/zinc/52/16/51/1414521651.db2.gz AGSGRNPRHUPBMX-SFHVURJKSA-N 0 1 389.540 3.131 10 0 GGAEMN COc1ccc2nc(NC(=O)N3CCC(N4CCO[C@@H](C)C4)CC3)sc2c1 ZINC000124176196 1414900429 /nfs/dbraw/zinc/90/04/29/1414900429.db2.gz DZROZEQHXGHLOA-ZDUSSCGKSA-N 0 1 390.509 3.022 10 0 GGAEMN COc1ccc2nc(NC(=O)N3CCC(N4CCO[C@H](C)C4)CC3)sc2c1 ZINC000124175980 1414900647 /nfs/dbraw/zinc/90/06/47/1414900647.db2.gz DZROZEQHXGHLOA-CYBMUJFWSA-N 0 1 390.509 3.022 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC(CC(=O)N2CCCC2)CC1 ZINC000124180845 1414901514 /nfs/dbraw/zinc/90/15/14/1414901514.db2.gz FXYMRRDDWRONST-RBUKOAKNSA-N 0 1 397.563 3.467 10 0 GGAEMN CNS(=O)(=O)c1ccc([C@@H](C)NCc2cnc(-c3ccc(C)o3)s2)cc1 ZINC000126070889 1415350684 /nfs/dbraw/zinc/35/06/84/1415350684.db2.gz CNNIQTWIFLAITD-CYBMUJFWSA-N 0 1 391.518 3.470 10 0 GGAEMN C[C@H](NCC(=O)N[C@@H](c1ccccc1)C1CC1)c1ccc(S(C)(=O)=O)cc1 ZINC000127279416 1415714814 /nfs/dbraw/zinc/71/48/14/1415714814.db2.gz HMWPUQCNGWMAIO-BTYIYWSLSA-N 0 1 386.517 3.008 10 0 GGAEMN C[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1cnn(Cc2ccccc2)c1 ZINC000178288150 1429043381 /nfs/dbraw/zinc/04/33/81/1429043381.db2.gz FUYFDYNAPIJLCW-QGZVFWFLSA-N 0 1 383.517 3.327 10 0 GGAEMN COc1ccc(CNCc2cccnc2N2CCOCC2)cc1OCC(C)C ZINC000128911352 1416099431 /nfs/dbraw/zinc/09/94/31/1416099431.db2.gz GCWHFEPRWHDTKR-UHFFFAOYSA-N 0 1 385.508 3.251 10 0 GGAEMN C[C@@H]1CCN(CC(=O)NCc2ccc(F)cc2C(F)(F)F)C[C@@H]1n1ccnc1 ZINC000129442458 1416210163 /nfs/dbraw/zinc/21/01/63/1416210163.db2.gz BDOHURDCXPATKE-DYVFJYSZSA-N 0 1 398.404 3.240 10 0 GGAEMN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc1 ZINC000129460512 1416213334 /nfs/dbraw/zinc/21/33/34/1416213334.db2.gz ATRXPYDRROUYMO-UWVAXJGDSA-N 0 1 398.507 3.358 10 0 GGAEMN C[C@@H]1CCN(CC(=O)Nc2ccc(N3CCCCC3)cc2)C[C@@H]1n1ccnc1 ZINC000129559111 1416228355 /nfs/dbraw/zinc/22/83/55/1416228355.db2.gz HNTKVMPZFJGQKY-NQIIRXRSSA-N 0 1 381.524 3.395 10 0 GGAEMN CCCCOCCCNS(=O)(=O)c1c(F)cc(F)cc1Br ZINC000130333473 1416359907 /nfs/dbraw/zinc/35/99/07/1416359907.db2.gz UXZHEPCSAWMCLZ-UHFFFAOYSA-N 0 1 386.258 3.212 10 0 GGAEMN Cc1nccn1CCC[N@H+](C)[C@H](C)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000130703943 1416429066 /nfs/dbraw/zinc/42/90/66/1416429066.db2.gz FRMUIVODFVBGMN-CQSZACIVSA-N 0 1 380.895 3.353 10 0 GGAEMN CC[C@@H](CS(=O)(=O)c1ccccc1)NCc1cnn(Cc2ccccc2)c1 ZINC000131045802 1416500658 /nfs/dbraw/zinc/50/06/58/1416500658.db2.gz GOIRVYPETDDOJA-FQEVSTJZSA-N 0 1 383.517 3.274 10 0 GGAEMN CN1CCN(c2ccc(NCc3ccc(Oc4cnccn4)cc3)nc2)CC1 ZINC000131568924 1416577633 /nfs/dbraw/zinc/57/76/33/1416577633.db2.gz CFTPLEYJBSFXGW-UHFFFAOYSA-N 0 1 376.464 3.028 10 0 GGAEMN CC(C)c1ncc(CNCc2ccccc2OCCN2CCOCC2)s1 ZINC000131694346 1416598895 /nfs/dbraw/zinc/59/88/95/1416598895.db2.gz GKBUUXDKEOXZNF-UHFFFAOYSA-N 0 1 375.538 3.267 10 0 GGAEMN CCN(CC)C(=O)c1ccc(NC(=O)CN(C)C2Cc3ccccc3C2)cc1 ZINC000141245559 1417531261 /nfs/dbraw/zinc/53/12/61/1417531261.db2.gz CPNBPJKIGZHIMI-UHFFFAOYSA-N 0 1 379.504 3.206 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2csc(Br)c2)C1=O ZINC000151540580 1418018342 /nfs/dbraw/zinc/01/83/42/1418018342.db2.gz AEHPOCMVBSWZMZ-GFCCVEGCSA-N 0 1 381.295 3.414 10 0 GGAEMN Cc1cc(C)n(-c2ccccc2CNCc2ccccc2OCC(=O)N(C)C)n1 ZINC000152287825 1418195659 /nfs/dbraw/zinc/19/56/59/1418195659.db2.gz HDADUHBSMMUWOQ-UHFFFAOYSA-N 0 1 392.503 3.246 10 0 GGAEMN Cc1[nH]c2ccc(Cl)cc2c1C(=O)NCc1ccc(N2CCN(C)CC2)nc1 ZINC000154484432 1422895273 /nfs/dbraw/zinc/89/52/73/1422895273.db2.gz FUGBRXBRKKUTLR-UHFFFAOYSA-N 0 1 397.910 3.207 10 0 GGAEMN C[N@@H+](Cc1cnccn1)Cc1cc(Br)cc(Br)c1[O-] ZINC000179885986 1429624975 /nfs/dbraw/zinc/62/49/75/1429624975.db2.gz COYDAHAZQWJGDQ-UHFFFAOYSA-N 0 1 387.075 3.339 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCC(Cn2ccnn2)CC1 ZINC000155617237 1423448484 /nfs/dbraw/zinc/44/84/84/1423448484.db2.gz BRKUNUZPPVHLNQ-ZWKOTPCHSA-N 0 1 391.519 3.409 10 0 GGAEMN Cc1oc2ccccc2c1CNCc1cccnc1N1CCC(C(N)=O)CC1 ZINC000155845389 1423558117 /nfs/dbraw/zinc/55/81/17/1423558117.db2.gz HCSXGDPKIGWSRG-UHFFFAOYSA-N 0 1 378.476 3.128 10 0 GGAEMN CNS(=O)(=O)c1cccc(CNCc2ccc(F)cc2C(F)(F)F)c1 ZINC000156077726 1423662332 /nfs/dbraw/zinc/66/23/32/1423662332.db2.gz CPLWKACVQIFKQV-UHFFFAOYSA-N 0 1 376.375 3.042 10 0 GGAEMN C[C@@H](C[C@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCCCc1nnn[n-]1 ZINC000708195127 1423867225 /nfs/dbraw/zinc/86/72/25/1423867225.db2.gz KLMAPPIWOORKKS-JKSUJKDBSA-N 0 1 380.537 3.070 10 0 GGAEMN CCN(C[C@@H](O)c1ccc(C)cc1)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000159868613 1424545800 /nfs/dbraw/zinc/54/58/00/1424545800.db2.gz GLWJAGSIMXZXJA-HRAATJIYSA-N 0 1 383.492 3.336 10 0 GGAEMN O=C([C@H](Cc1ccccc1)NCc1cccc2c1OCCCO2)N1CCCC1 ZINC000159924614 1424553417 /nfs/dbraw/zinc/55/34/17/1424553417.db2.gz ACOGHGRSBOMFPB-FQEVSTJZSA-N 0 1 380.488 3.171 10 0 GGAEMN O=C([C@@H](Cc1ccccc1)NCc1cccc2c1OCCCO2)N1CCCC1 ZINC000159924757 1424553686 /nfs/dbraw/zinc/55/36/86/1424553686.db2.gz ACOGHGRSBOMFPB-HXUWFJFHSA-N 0 1 380.488 3.171 10 0 GGAEMN COc1cc([C@H](C)N[C@H](CCO)c2ccccc2)ccc1S(=O)(=O)C(F)F ZINC000161041906 1424654368 /nfs/dbraw/zinc/65/43/68/1424654368.db2.gz FFQWIPYWBKESFQ-XJKSGUPXSA-N 0 1 399.459 3.466 10 0 GGAEMN COc1ccc(CN(C)C(=O)CN[C@H](C)c2cc(C)ccc2OC)cc1OC ZINC000161544977 1424706022 /nfs/dbraw/zinc/70/60/22/1424706022.db2.gz HEGUKLPPIYDKAE-MRXNPFEDSA-N 0 1 386.492 3.330 10 0 GGAEMN [O-]c1c(Br)cc(Br)cc1CN1CC[N@H+]2CCC[C@@H]2C1 ZINC000180146863 1429760218 /nfs/dbraw/zinc/76/02/18/1429760218.db2.gz XTIGLBHRTOCRQK-GFCCVEGCSA-N 0 1 390.119 3.197 10 0 GGAEMN COc1cc(OC)cc(N2CC[C@@H](NCc3cnc(CC(C)C)s3)C2=O)c1 ZINC000162719378 1424884544 /nfs/dbraw/zinc/88/45/44/1424884544.db2.gz GDVJXQXNEPFAGP-GOSISDBHSA-N 0 1 389.521 3.254 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)[C@H]1COc2ccc(Cl)cc2C1 ZINC000162846184 1424896224 /nfs/dbraw/zinc/89/62/24/1424896224.db2.gz QRZGCHSIVSJTRT-OAHLLOKOSA-N 0 1 382.851 3.035 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(OC[C@@H]2CCCO2)cc1 ZINC000162961401 1424913076 /nfs/dbraw/zinc/91/30/76/1424913076.db2.gz QBQGOTQGRVAGBD-IBGZPJMESA-N 0 1 392.459 3.002 10 0 GGAEMN COc1cc(C(=O)NCCc2nnc(-c3ccccc3)[nH]2)ccc1OC(C)C ZINC000162964059 1424914094 /nfs/dbraw/zinc/91/40/94/1424914094.db2.gz LUEMOSYREOOILZ-UHFFFAOYSA-N 0 1 380.448 3.240 10 0 GGAEMN O=C(c1cccc(CNCc2ccc(Br)cc2)c1)N1CCOCC1 ZINC000166283614 1425210309 /nfs/dbraw/zinc/21/03/09/1425210309.db2.gz CFPBIPHEHCHPGS-UHFFFAOYSA-N 0 1 389.293 3.211 10 0 GGAEMN CC(C)CN1CCN(C(=O)[C@H]2CCc3ncc(-c4ccc(F)cc4)n3C2)CC1 ZINC000169761277 1425248276 /nfs/dbraw/zinc/24/82/76/1425248276.db2.gz ZUALLSHQNBWSHF-SFHVURJKSA-N 0 1 384.499 3.052 10 0 GGAEMN O=C(NCc1ccc(F)cc1)N1CC(c2noc([C@@H]3CCCN3CC3CC3)n2)C1 ZINC000169782969 1425256173 /nfs/dbraw/zinc/25/61/73/1425256173.db2.gz AAAVPVNYMJAZGE-SFHVURJKSA-N 0 1 399.470 3.065 10 0 GGAEMN Cc1ccc(OCc2nc(C3CN(C(=O)c4[nH]nc5ccccc54)C3)no2)cc1 ZINC000169784880 1425256920 /nfs/dbraw/zinc/25/69/20/1425256920.db2.gz KMYQZAZANNYVOC-UHFFFAOYSA-N 0 1 389.415 3.073 10 0 GGAEMN CCn1cc(CN2CCC[C@@H](c3nc(CCOCc4ccccc4)no3)C2)cn1 ZINC000169788453 1425257913 /nfs/dbraw/zinc/25/79/13/1425257913.db2.gz VMTHEONOGHZKKD-HXUWFJFHSA-N 0 1 395.507 3.425 10 0 GGAEMN Brc1ccccc1-c1nnc(CN2CCC[C@@H](C3OCCO3)C2)o1 ZINC000171144128 1425506139 /nfs/dbraw/zinc/50/61/39/1425506139.db2.gz HDSOAIPKJWGPGW-GFCCVEGCSA-N 0 1 394.269 3.084 10 0 GGAEMN Brc1ccccc1-c1nnc(CN2CCC[C@H](C3OCCO3)C2)o1 ZINC000171144122 1425506163 /nfs/dbraw/zinc/50/61/63/1425506163.db2.gz HDSOAIPKJWGPGW-LBPRGKRZSA-N 0 1 394.269 3.084 10 0 GGAEMN CCN(C)[C@H](C(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1 ZINC000171480267 1425700512 /nfs/dbraw/zinc/70/05/12/1425700512.db2.gz BLMKXUPZSVPNJZ-NRFANRHFSA-N 0 1 379.504 3.100 10 0 GGAEMN CCN(C)[C@@H](C(=O)NC1CCN(C(=O)c2ccccc2)CC1)c1ccccc1 ZINC000171480270 1425700575 /nfs/dbraw/zinc/70/05/75/1425700575.db2.gz BLMKXUPZSVPNJZ-OAQYLSRUSA-N 0 1 379.504 3.100 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000171620395 1425760013 /nfs/dbraw/zinc/76/00/13/1425760013.db2.gz ANEXWMYGJPMREL-SCTDSRPQSA-N 0 1 393.535 3.160 10 0 GGAEMN CCCn1c(C)c(C(=O)N2CCO[C@H](c3n[nH]c(C)n3)C2)c2cc(OC)ccc21 ZINC000173089200 1426337771 /nfs/dbraw/zinc/33/77/71/1426337771.db2.gz JEXMUGPGIZFTDX-SFHVURJKSA-N 0 1 397.479 3.009 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2cccc(NC(=O)c3ccccc3)c2)[nH]1 ZINC000174003940 1426936631 /nfs/dbraw/zinc/93/66/31/1426936631.db2.gz CWXDGAXDYWTWSV-UHFFFAOYSA-N 0 1 381.461 3.486 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2ccc(Oc3cccc(F)c3)nc2)[nH]1 ZINC000174434919 1427154857 /nfs/dbraw/zinc/15/48/57/1427154857.db2.gz HIVJHFDPYQDVFS-UHFFFAOYSA-N 0 1 387.440 3.238 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)no2)[nH]1 ZINC000174691544 1427312090 /nfs/dbraw/zinc/31/20/90/1427312090.db2.gz CKLFUTVBSPZCPJ-HNNXBMFYSA-N 0 1 398.492 3.399 10 0 GGAEMN O=C(NCc1nc2ccc(F)cc2[nH]1)C(O)(c1ccccc1)c1ccccc1 ZINC000176112135 1428090198 /nfs/dbraw/zinc/09/01/98/1428090198.db2.gz DIYNYYMFYNVWTI-UHFFFAOYSA-N 0 1 375.403 3.254 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)[C@H]3CCCCN3S(=O)(=O)c3ccccc3)ccc12 ZINC000180319353 1429835518 /nfs/dbraw/zinc/83/55/18/1429835518.db2.gz KYKPCHFJOPLYQH-LJQANCHMSA-N 0 1 398.488 3.053 10 0 GGAEMN CC(C)c1noc(CCC(=O)N2CCC[C@H](c3nnc(-c4ccccc4)[nH]3)C2)n1 ZINC000181350578 1430279922 /nfs/dbraw/zinc/27/99/22/1430279922.db2.gz BFOPQUXDMYEODZ-INIZCTEOSA-N 0 1 394.479 3.317 10 0 GGAEMN CNC(=O)[C@H](NC(=O)CN[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000181531588 1430316162 /nfs/dbraw/zinc/31/61/62/1430316162.db2.gz IAUOVVVIAJRYMR-KPZWWZAWSA-N 0 1 394.302 3.248 10 0 GGAEMN COc1ccc(Nc2nc(C(=O)N3CCCC[C@H]3c3nnc[nH]3)cs2)cc1 ZINC000182108765 1430413329 /nfs/dbraw/zinc/41/33/29/1430413329.db2.gz CBNCCXCKYUUOHB-HNNXBMFYSA-N 0 1 384.465 3.381 10 0 GGAEMN COc1cc(OC)c(CNC(=O)CN[C@@H](C)c2ccc(Cl)s2)c(OC)c1 ZINC000182984539 1430585626 /nfs/dbraw/zinc/58/56/26/1430585626.db2.gz BPQZCLDFWUYTCF-NSHDSACASA-N 0 1 398.912 3.394 10 0 GGAEMN CCO[C@@H](C)c1noc(CN2CCN([C@H](C)CCc3cccc(F)c3)CC2)n1 ZINC000183365164 1430690964 /nfs/dbraw/zinc/69/09/64/1430690964.db2.gz FJPHAHGNGDSWKO-SJORKVTESA-N 0 1 390.503 3.445 10 0 GGAEMN COc1cc(N[C@H]2CCCN(Cc3cc(-c4cnn(C)c4)no3)C2)cc(OC)c1 ZINC000185039020 1431047101 /nfs/dbraw/zinc/04/71/01/1431047101.db2.gz FAGBGKKHTYRAHV-INIZCTEOSA-N 0 1 397.479 3.169 10 0 GGAEMN COc1ccc([C@@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)c(OC)c1 ZINC000185293269 1431102255 /nfs/dbraw/zinc/10/22/55/1431102255.db2.gz FYYKNTLBGQUCEN-OAHLLOKOSA-N 0 1 390.505 3.095 10 0 GGAEMN COc1ccc([C@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)c(OC)c1 ZINC000185293251 1431102291 /nfs/dbraw/zinc/10/22/91/1431102291.db2.gz FYYKNTLBGQUCEN-HNNXBMFYSA-N 0 1 390.505 3.095 10 0 GGAEMN CCOC(=O)c1nn(C)cc1CN1CCCCC[C@@H]1C[C@H](O)c1ccccc1 ZINC000186265396 1431366171 /nfs/dbraw/zinc/36/61/71/1431366171.db2.gz DLJNDWNQFSLOTM-UXHICEINSA-N 0 1 385.508 3.465 10 0 GGAEMN Cc1cc(=O)n(C)cc1NC(=O)NNC(=O)c1sc2ccccc2c1Cl ZINC000186419416 1431411943 /nfs/dbraw/zinc/41/19/43/1431411943.db2.gz GOEINUHDHUABBV-UHFFFAOYSA-N 0 1 390.852 3.028 10 0 GGAEMN C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)COC(c1ccccc1)c1ccccc1 ZINC000186950823 1431575201 /nfs/dbraw/zinc/57/52/01/1431575201.db2.gz IAMZBPFZWIOLOT-LJQANCHMSA-N 0 1 396.531 3.096 10 0 GGAEMN CN1Cc2cc(NS(=O)(=O)c3cnc(Cl)c(Cl)c3)ccc2NC1=O ZINC000187065321 1431604096 /nfs/dbraw/zinc/60/40/96/1431604096.db2.gz UGRBLWASLVCFRR-UHFFFAOYSA-N 0 1 387.248 3.167 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)[nH]1 ZINC000187423881 1431725938 /nfs/dbraw/zinc/72/59/38/1431725938.db2.gz HPSXWAZFEBHESS-GFCCVEGCSA-N 0 1 399.442 3.009 10 0 GGAEMN O=C(NC1CCC(Oc2ncccc2Cl)CC1)N1CCN2CCCC[C@H]2C1 ZINC000187542513 1431762069 /nfs/dbraw/zinc/76/20/69/1431762069.db2.gz FYGBEGVKXJPKAL-CGZBRXJRSA-N 0 1 392.931 3.305 10 0 GGAEMN Cc1cc(N2CC[C@H](NCc3ccc(F)nc3)C2=O)ccc1Br ZINC000189182627 1432059610 /nfs/dbraw/zinc/05/96/10/1432059610.db2.gz CWYBLLDAZIPBKZ-HNNXBMFYSA-N 0 1 378.245 3.187 10 0 GGAEMN CC(=O)Nc1ccc(Cl)c(C(=O)NCCc2nnc(-c3ccccc3)[nH]2)c1 ZINC000189781278 1432233682 /nfs/dbraw/zinc/23/36/82/1432233682.db2.gz FPRHLBJYTUROBM-UHFFFAOYSA-N 0 1 383.839 3.056 10 0 GGAEMN Cc1nc(C(F)(F)F)ccc1C(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000189794795 1432237063 /nfs/dbraw/zinc/23/70/63/1432237063.db2.gz SBTRZBMUMVZHNN-UHFFFAOYSA-N 0 1 375.354 3.166 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)N2CCC([C@H]3CCCO3)CC2)CC1 ZINC000190405279 1432374959 /nfs/dbraw/zinc/37/49/59/1432374959.db2.gz BEOIDVZBWKBZRD-OAQYLSRUSA-N 0 1 386.540 3.251 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)N2CCC([C@@H]3CCCO3)CC2)CC1 ZINC000190405255 1432374988 /nfs/dbraw/zinc/37/49/88/1432374988.db2.gz BEOIDVZBWKBZRD-NRFANRHFSA-N 0 1 386.540 3.251 10 0 GGAEMN CCCCNC(=O)C1CCN([C@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)CC1 ZINC000192869292 1432901288 /nfs/dbraw/zinc/90/12/88/1432901288.db2.gz CWGJAYSSEBIKIW-ZWKOTPCHSA-N 0 1 385.552 3.371 10 0 GGAEMN C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000193588655 1433024777 /nfs/dbraw/zinc/02/47/77/1433024777.db2.gz AMTVNJPQVZSRSP-KBPBESRZSA-N 0 1 378.879 3.429 10 0 GGAEMN Cc1ccc(CN2CCCN(C(=O)CSC(=S)N3CCCC3)CC2)cc1 ZINC000193658553 1433035546 /nfs/dbraw/zinc/03/55/46/1433035546.db2.gz BWXMDYJBWACVFE-UHFFFAOYSA-N 0 1 391.606 3.143 10 0 GGAEMN CC(C)(C)OC(=O)N1CCC2(CCN2C[C@@H](O)c2ccc(F)c(F)c2)CC1 ZINC000193751925 1433052040 /nfs/dbraw/zinc/05/20/40/1433052040.db2.gz NVRJURIJOOBSJH-QGZVFWFLSA-N 0 1 382.451 3.474 10 0 GGAEMN CC(C)(C)OC(=O)N1CCC2(CCN2C[C@H](O)c2ccc(F)c(F)c2)CC1 ZINC000193751907 1433052136 /nfs/dbraw/zinc/05/21/36/1433052136.db2.gz NVRJURIJOOBSJH-KRWDZBQOSA-N 0 1 382.451 3.474 10 0 GGAEMN C/C=C\c1ccc(OC[C@@H](O)CN2CCN(Cc3ccccc3)CC2)c(OC)c1 ZINC000210122587 1433356560 /nfs/dbraw/zinc/35/65/60/1433356560.db2.gz GXTSPQLTLPKKOH-CDKWRECCSA-N 0 1 396.531 3.286 10 0 GGAEMN Cc1cnccc1-c1noc(-c2cc(I)ccc2O)n1 ZINC000235798352 1433373774 /nfs/dbraw/zinc/37/37/74/1433373774.db2.gz ILFRWTUUBWHEQV-UHFFFAOYSA-N 0 1 379.157 3.417 10 0 GGAEMN CC(C)(C)N1C[C@@H](NCc2cc(Br)c3c(c2)OCCCO3)CC1=O ZINC000236648483 1433375098 /nfs/dbraw/zinc/37/50/98/1433375098.db2.gz AMFWGGYWDYTOBG-ZDUSSCGKSA-N 0 1 397.313 3.099 10 0 GGAEMN CCOc1c(Cl)cc(CNCC(=O)NCCc2ccccc2)cc1OC ZINC000236842553 1433380724 /nfs/dbraw/zinc/38/07/24/1433380724.db2.gz AWAQPRAEYXNAJS-UHFFFAOYSA-N 0 1 376.884 3.196 10 0 GGAEMN CC(C)n1ncc2cc(CN[C@@H](CN3CCOCC3)c3ccccc3)cnc21 ZINC000236863395 1433381224 /nfs/dbraw/zinc/38/12/24/1433381224.db2.gz BWMPGKLNVYPTEJ-NRFANRHFSA-N 0 1 379.508 3.175 10 0 GGAEMN FC(F)Oc1ccc(CNCc2ccccc2OCCN2CCOCC2)cc1 ZINC000237881715 1433431041 /nfs/dbraw/zinc/43/10/41/1433431041.db2.gz DSVUHJFQHDMIHP-UHFFFAOYSA-N 0 1 392.446 3.289 10 0 GGAEMN O[C@@H](CNCc1cc(Br)ccc1F)COc1ccc(F)c(F)c1 ZINC000238023929 1433439488 /nfs/dbraw/zinc/43/94/88/1433439488.db2.gz HYULZLCAGJVEJV-LBPRGKRZSA-N 0 1 390.199 3.396 10 0 GGAEMN O=C([C@H]1Cc2ccccc2CN1)N1CCC(c2nc(-c3ccccc3)no2)CC1 ZINC000238031818 1433440048 /nfs/dbraw/zinc/44/00/48/1433440048.db2.gz IEPQYXVBVXQPBA-HXUWFJFHSA-N 0 1 388.471 3.157 10 0 GGAEMN CC1CCN(C(=O)c2ccc(N3CCN(Cc4ccccc4)CC3)nc2)CC1 ZINC000242755706 1433447020 /nfs/dbraw/zinc/44/70/20/1433447020.db2.gz DJKPCCBKRUSSSN-UHFFFAOYSA-N 0 1 378.520 3.276 10 0 GGAEMN CCN(CC)c1ccc(NC(=O)c2cncc(N3CCN(C)CC3)c2)c(C)c1 ZINC000243499390 1433449978 /nfs/dbraw/zinc/44/99/78/1433449978.db2.gz NUNZWDHRVBPDSU-UHFFFAOYSA-N 0 1 381.524 3.240 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N(C)C[C@H]1CCCC[C@@H]1O ZINC000245527012 1433481407 /nfs/dbraw/zinc/48/14/07/1433481407.db2.gz AWAUOGSYBUJFIE-NSHGMRRFSA-N 0 1 384.524 3.299 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@@H](C)[C@H](n3ccnc3)C2)C2CC2)cc1 ZINC000245561844 1433485453 /nfs/dbraw/zinc/48/54/53/1433485453.db2.gz CIMFADQUIBKWON-BSLALVQMSA-N 0 1 382.508 3.042 10 0 GGAEMN CCN(C[C@@H](O)c1ccc(C)cc1)[C@H](C)C(=O)Nc1cc(C(=O)OC)ccc1C ZINC000245743263 1433509677 /nfs/dbraw/zinc/50/96/77/1433509677.db2.gz FKSJMMHXLWXAPQ-DYESRHJHSA-N 0 1 398.503 3.473 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1 ZINC000245808897 1433520893 /nfs/dbraw/zinc/52/08/93/1433520893.db2.gz BXASEDOWLBMWTF-QRVBRYPASA-N 0 1 380.536 3.431 10 0 GGAEMN CCC[C@@H]1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CCN1CCOC ZINC000245857872 1433528109 /nfs/dbraw/zinc/52/81/09/1433528109.db2.gz DXEJHXYWLWVAEY-WIYYLYMNSA-N 0 1 399.539 3.076 10 0 GGAEMN CCN(C)[C@H](C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000246294637 1433591055 /nfs/dbraw/zinc/59/10/55/1433591055.db2.gz CJQPAWGPOHRIOG-HKUYNNGSSA-N 0 1 389.540 3.443 10 0 GGAEMN C[C@@H]1CCN([C@@H]2CC(=O)N(c3cccc4ccccc43)C2=O)C[C@H]1n1ccnc1 ZINC000246409156 1433608679 /nfs/dbraw/zinc/60/86/79/1433608679.db2.gz BYCSFFDNQWZEDF-MAODMQOUSA-N 0 1 388.471 3.251 10 0 GGAEMN COCCN1[C@H](C)CN([C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C[C@@H]1C ZINC000246550532 1433629713 /nfs/dbraw/zinc/62/97/13/1433629713.db2.gz DLFKPBPTHCWINS-ZGXWSNOMSA-N 0 1 397.563 3.447 10 0 GGAEMN C[C@H](CCc1cccc(F)c1)N1CCN(CC(=O)N2C[C@H](C)C[C@@H](C)C2)CC1 ZINC000248383471 1433790800 /nfs/dbraw/zinc/79/08/00/1433790800.db2.gz AFSBXCNDHVIQOY-VAMGGRTRSA-N 0 1 389.559 3.269 10 0 GGAEMN CC(=O)NC[C@@H]1CCCN([C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000249810255 1433852463 /nfs/dbraw/zinc/85/24/63/1433852463.db2.gz HPIVIIBCNORQHC-SCTDSRPQSA-N 0 1 381.520 3.254 10 0 GGAEMN COc1ccc([C@@H]2CCN([C@H](C)C(=O)Nc3cccc(NC(C)=O)c3)C2)cc1 ZINC000249860573 1433853337 /nfs/dbraw/zinc/85/33/37/1433853337.db2.gz FYJUHFTZEVYYNP-CRAIPNDOSA-N 0 1 381.476 3.470 10 0 GGAEMN CCCNC(=O)[C@@H]1CCCN([C@@H](C)C(=O)N[C@H](C)c2cc3ccccc3o2)C1 ZINC000250428743 1433856295 /nfs/dbraw/zinc/85/62/95/1433856295.db2.gz HBQDIQORCFQHBC-SOLBZPMBSA-N 0 1 385.508 3.237 10 0 GGAEMN Cc1nc(CC(C)C)oc1C(=O)Nc1ccc2nc(CN3CCOCC3)[nH]c2c1 ZINC000252478544 1433863280 /nfs/dbraw/zinc/86/32/80/1433863280.db2.gz APDPUMFTHIVGIC-UHFFFAOYSA-N 0 1 397.479 3.142 10 0 GGAEMN COCCN1CC2(CCN(C(=O)c3ccccc3F)CC2)[C@H]1c1ccncc1 ZINC000257174022 1433893205 /nfs/dbraw/zinc/89/32/05/1433893205.db2.gz BIZDODQBLCHNKJ-HXUWFJFHSA-N 0 1 383.467 3.146 10 0 GGAEMN O=C(CC1CCCC1)N1CCC([N@H+]2C[C@H](OCC3CC3)C23CCOCC3)CC1 ZINC000257185226 1433894174 /nfs/dbraw/zinc/89/41/74/1433894174.db2.gz WGUZPLNELZHSSZ-NRFANRHFSA-N 0 1 390.568 3.218 10 0 GGAEMN O=C(CC1CCCC1)N1CCC(N2C[C@H](OCC3CC3)C23CCOCC3)CC1 ZINC000257185226 1433894175 /nfs/dbraw/zinc/89/41/75/1433894175.db2.gz WGUZPLNELZHSSZ-NRFANRHFSA-N 0 1 390.568 3.218 10 0 GGAEMN CCCS(=O)(=O)N1CCC(Cc2ncc(C)n2Cc2ccc(F)cc2)CC1 ZINC000257188856 1433894352 /nfs/dbraw/zinc/89/43/52/1433894352.db2.gz GTVIPLQZLASCRQ-UHFFFAOYSA-N 0 1 393.528 3.373 10 0 GGAEMN CN(Cc1cc(C(F)(F)F)ccc1Cl)[C@H]1CCc2nn(C)c(=O)n2CC1 ZINC000257190976 1433894460 /nfs/dbraw/zinc/89/44/60/1433894460.db2.gz OMIPJDKIRDOONT-ZDUSSCGKSA-N 0 1 388.821 3.091 10 0 GGAEMN CCC(=O)N[C@@H](CCSC)C(=O)Nc1ccc2nc(-c3ccccn3)[nH]c2c1 ZINC000265047530 1434178711 /nfs/dbraw/zinc/17/87/11/1434178711.db2.gz ATQKLYZLRZYRFR-INIZCTEOSA-N 0 1 397.504 3.211 10 0 GGAEMN CN1CCN(CCOc2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(F)cc3)cc2)CC1 ZINC000266297145 1434317418 /nfs/dbraw/zinc/31/74/18/1434317418.db2.gz HROKCSHQNOSNSP-VXKWHMMOSA-N 0 1 397.494 3.194 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)n1 ZINC000267139788 1434410276 /nfs/dbraw/zinc/41/02/76/1434410276.db2.gz GXIHCXDFDUIMJD-UXHICEINSA-N 0 1 376.460 3.155 10 0 GGAEMN CN(C)Cc1ccsc1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000268081966 1434493364 /nfs/dbraw/zinc/49/33/64/1434493364.db2.gz GQODJTRHLUFVFZ-AWEZNQCLSA-N 0 1 381.542 3.187 10 0 GGAEMN C[C@@H](c1ccncc1)N1CCC(NC(=O)N(C)C2Cc3ccccc3C2)CC1 ZINC000269612880 1434663518 /nfs/dbraw/zinc/66/35/18/1434663518.db2.gz BKMNKCQAILLIAV-KRWDZBQOSA-N 0 1 378.520 3.416 10 0 GGAEMN Cc1cc(C2CCN(C(=O)[C@H]3CCCCN3C(=O)OC(C)(C)C)CC2)n[nH]1 ZINC000272204343 1434877940 /nfs/dbraw/zinc/87/79/40/1434877940.db2.gz HUQQQMKMZWSNOO-QGZVFWFLSA-N 0 1 376.501 3.214 10 0 GGAEMN COc1ccccc1[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000272881147 1434938402 /nfs/dbraw/zinc/93/84/02/1434938402.db2.gz CLLLNZCSTLCMMH-JRIVICBCSA-N 0 1 388.533 3.349 10 0 GGAEMN COc1ccc(COCc2cccc(NC(=O)[C@@H](C)CN3CCOCC3)c2)cc1 ZINC000273007311 1434949190 /nfs/dbraw/zinc/94/91/90/1434949190.db2.gz AOXWSVUVABDCHL-SFHVURJKSA-N 0 1 398.503 3.319 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)[nH]1 ZINC000282256474 1435840360 /nfs/dbraw/zinc/84/03/60/1435840360.db2.gz BQRKJIYFDHQBTA-UHFFFAOYSA-N 0 1 385.415 3.112 10 0 GGAEMN Cc1cc([C@H]2CCCN(C(=O)[C@@H](NC(=O)c3cccc(C)c3)C(C)C)C2)n[nH]1 ZINC000282380218 1435845185 /nfs/dbraw/zinc/84/51/85/1435845185.db2.gz CUBUXIVKRVZBCX-ICSRJNTNSA-N 0 1 382.508 3.187 10 0 GGAEMN Cc1nn(-c2ccccn2)c(C)c1CN1CCCN(Cc2cscn2)CC1 ZINC000282746455 1435858811 /nfs/dbraw/zinc/85/88/11/1435858811.db2.gz GMROCLGPAXLWEX-UHFFFAOYSA-N 0 1 382.537 3.049 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)[nH]1 ZINC000283550746 1435894990 /nfs/dbraw/zinc/89/49/90/1435894990.db2.gz DXNNCNOHLFPLHL-UHFFFAOYSA-N 0 1 386.481 3.331 10 0 GGAEMN CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(C(=O)c2cc3ccc(C(F)(F)F)cc3[nH]2)C1 ZINC000284482996 1436025314 /nfs/dbraw/zinc/02/53/14/1436025314.db2.gz BERXJWJRJXOEPQ-DOMZBBRYSA-N 0 1 393.369 3.215 10 0 GGAEMN Cc1ccnc(Oc2cc(NC(=O)N3CCOC[C@@H]3c3nnc[nH]3)ccc2C)c1 ZINC000284653050 1436037730 /nfs/dbraw/zinc/03/77/30/1436037730.db2.gz SVKABHYFSYXQAB-MRXNPFEDSA-N 0 1 394.435 3.214 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1cccs1 ZINC000379638523 939131454 /nfs/dbraw/zinc/13/14/54/939131454.db2.gz ULEPIHMNWDRJAI-AEFFLSMTSA-N 0 1 387.505 3.228 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)c1cccs1 ZINC000379638527 939131513 /nfs/dbraw/zinc/13/15/13/939131513.db2.gz ULEPIHMNWDRJAI-WMZOPIPTSA-N 0 1 387.505 3.228 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2)[C@H]1c1cccs1 ZINC000780584831 939138694 /nfs/dbraw/zinc/13/86/94/939138694.db2.gz HMIVPYJRLMZZNH-JQHSSLGASA-N 0 1 387.505 3.256 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@@H](C(=O)[O-])C2CCCCC2)[C@@H]1c1cccs1 ZINC000780584489 939138936 /nfs/dbraw/zinc/13/89/36/939138936.db2.gz ABVIEBPVJUUUPQ-KBAYOESNSA-N 0 1 393.553 3.464 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@H](C(=O)[O-])C2CCCCC2)[C@H]1c1cccs1 ZINC000780584491 939138963 /nfs/dbraw/zinc/13/89/63/939138963.db2.gz ABVIEBPVJUUUPQ-NJAFHUGGSA-N 0 1 393.553 3.464 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2)[C@H]1c1cccs1 ZINC000780584837 939139590 /nfs/dbraw/zinc/13/95/90/939139590.db2.gz HMIVPYJRLMZZNH-NXHRZFHOSA-N 0 1 387.505 3.256 10 0 GGAEMN CC(C)C[N@@H+](C)CCCNC(=O)N[C@H](C(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000871645393 939260413 /nfs/dbraw/zinc/26/04/13/939260413.db2.gz BQRNQODFVKQKNC-HNNXBMFYSA-N 0 1 389.418 3.108 10 0 GGAEMN COc1cccc([C@H](NC(=O)NCc2ccccc2C[N@@H+](C)C(C)C)C(=O)[O-])c1 ZINC000908782686 939321059 /nfs/dbraw/zinc/32/10/59/939321059.db2.gz HQTGZKFYNLNSOF-FQEVSTJZSA-N 0 1 399.491 3.161 10 0 GGAEMN CC1(C)CCC[C@](NC(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908847184 939335077 /nfs/dbraw/zinc/33/50/77/939335077.db2.gz KPDZUASZJVWGEU-XMSQKQJNSA-N 0 1 387.524 3.374 10 0 GGAEMN CC1(C)CCC[C@@](NC(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908847181 939335238 /nfs/dbraw/zinc/33/52/38/939335238.db2.gz KPDZUASZJVWGEU-AVRDEDQJSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+]1CCc2sccc2C1 ZINC000908851420 939336715 /nfs/dbraw/zinc/33/67/15/939336715.db2.gz LCISRXLVOZVNOI-JLTOFOAXSA-N 0 1 393.553 3.218 10 0 GGAEMN C[C@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2sccc2C1 ZINC000908851420 939336717 /nfs/dbraw/zinc/33/67/17/939336717.db2.gz LCISRXLVOZVNOI-JLTOFOAXSA-N 0 1 393.553 3.218 10 0 GGAEMN CC(C)[N@H+]1CCC[C@H](CNC(=O)N[C@@H](C(=O)[O-])c2ccc3ccccc3c2)C1 ZINC000908903503 939347976 /nfs/dbraw/zinc/34/79/76/939347976.db2.gz FSIBEBKKFHIOOF-OXQOHEQNSA-N 0 1 383.492 3.385 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)C1CCCCCC1 ZINC000908924875 939353941 /nfs/dbraw/zinc/35/39/41/939353941.db2.gz NCCSJKOPJANZPQ-QUCCMNQESA-N 0 1 387.524 3.231 10 0 GGAEMN C[C@](NC(=O)NC[C@]1(C)CCC[N@H+]1Cc1ccccc1)(C(=O)[O-])c1ccccc1 ZINC000908960005 939361933 /nfs/dbraw/zinc/36/19/33/939361933.db2.gz OOAQVZUHJJNMLN-XZOQPEGZSA-N 0 1 395.503 3.340 10 0 GGAEMN C[C@@]1(CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2)CCC[N@H+]1Cc1ccccc1 ZINC000908960026 939361961 /nfs/dbraw/zinc/36/19/61/939361961.db2.gz PHXRTCJCBUPHJQ-KNQAVFIVSA-N 0 1 381.476 3.166 10 0 GGAEMN C[C@@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+](C)Cc1ccccc1 ZINC000908988985 939366225 /nfs/dbraw/zinc/36/62/25/939366225.db2.gz MKFMQSKTAVEGHR-HRAATJIYSA-N 0 1 375.513 3.230 10 0 GGAEMN C[C@@H]1C[C@@H](NC(=O)N[C@]2(C(=O)[O-])CCCC(C)(C)C2)C[N@H+]1Cc1ccccc1 ZINC000909094219 939379946 /nfs/dbraw/zinc/37/99/46/939379946.db2.gz HPYKRYRRWHQYFY-RADWXHQJSA-N 0 1 387.524 3.372 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@@H](C(=O)[O-])c1ccc(OC)c(Cl)c1 ZINC000909795220 939733333 /nfs/dbraw/zinc/73/33/33/939733333.db2.gz JYFZCODOMYDJTA-PIGZYNQJSA-N 0 1 379.844 3.001 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@H](C(=O)[O-])c1ccc(OC)c(Cl)c1 ZINC000909795219 939733596 /nfs/dbraw/zinc/73/35/96/939733596.db2.gz JYFZCODOMYDJTA-GTNSWQLSSA-N 0 1 379.844 3.001 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@H](C(=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000911062333 939768543 /nfs/dbraw/zinc/76/85/43/939768543.db2.gz VKWQUKPQCDHQLC-ZBEGNZNMSA-N 0 1 383.370 3.358 10 0 GGAEMN C[C@H](NC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041075 939798785 /nfs/dbraw/zinc/79/87/85/939798785.db2.gz MJFGWUVRRQGIHT-CKJXQJPGSA-N 0 1 379.545 3.362 10 0 GGAEMN C[C@H](NC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041077 939798897 /nfs/dbraw/zinc/79/88/97/939798897.db2.gz MJFGWUVRRQGIHT-MRUHUIDDSA-N 0 1 379.545 3.362 10 0 GGAEMN C[C@H](NC(=O)N[C@H](C(=O)[O-])C1CCCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041374 939798944 /nfs/dbraw/zinc/79/89/44/939798944.db2.gz NNLDBZKNRLKRJI-IEZWGBDMSA-N 0 1 379.545 3.362 10 0 GGAEMN CC[C@](NC(=O)NCCC[N@@H+](C)CC(C)C)(C(=O)[O-])c1ccc(Cl)cc1 ZINC000649529100 939833889 /nfs/dbraw/zinc/83/38/89/939833889.db2.gz DXDJWRPXUHSJJL-LJQANCHMSA-N 0 1 383.920 3.307 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000663045483 939850956 /nfs/dbraw/zinc/85/09/56/939850956.db2.gz IFXUQOKAVPCZLP-BBWFWOEESA-N 0 1 382.863 3.230 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@H](C(=O)[O-])C2CC2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000663045483 939850958 /nfs/dbraw/zinc/85/09/58/939850958.db2.gz IFXUQOKAVPCZLP-BBWFWOEESA-N 0 1 382.863 3.230 10 0 GGAEMN CC(C)[N@@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CCCC2)[C@@H]1c1ccc(F)c(F)c1 ZINC000663046927 939851231 /nfs/dbraw/zinc/85/12/31/939851231.db2.gz YESIRZBJBRROGS-FHWLQOOXSA-N 0 1 394.462 3.496 10 0 GGAEMN CC(C)[N@H+]1CC[C@H](NC(=O)[C@@H](C(=O)[O-])C2CCCC2)[C@@H]1c1ccc(F)c(F)c1 ZINC000663046927 939851233 /nfs/dbraw/zinc/85/12/33/939851233.db2.gz YESIRZBJBRROGS-FHWLQOOXSA-N 0 1 394.462 3.496 10 0 GGAEMN O=C([O-])[C@@H](Cc1ccc2c(c1)OCCCO2)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000277373185 1126078815 /nfs/dbraw/zinc/07/88/15/1126078815.db2.gz QKGDXBCFPRESSW-GOSISDBHSA-N 0 1 393.443 3.024 10 0 GGAEMN O=C([O-])[C@@H](Cc1ccc2c(c1)OCO2)[NH2+]Cc1ncc(-c2ccccc2)s1 ZINC000426786951 1126090510 /nfs/dbraw/zinc/09/05/10/1126090510.db2.gz ZNUDTUQFGCKIFS-OAHLLOKOSA-N 0 1 382.441 3.324 10 0 GGAEMN OCC1(NCc2cn(-c3ccc(Cl)cc3Cl)nn2)Cc2ccccc2C1 ZINC000565152691 1126097681 /nfs/dbraw/zinc/09/76/81/1126097681.db2.gz LCASRHJCJPXUMT-UHFFFAOYSA-N 0 1 389.286 3.194 10 0 GGAEMN OCC1(NCc2nn(-c3ccc(F)cc3)c3c2CCC3)Cc2ccccc2C1 ZINC000603940110 1126099225 /nfs/dbraw/zinc/09/92/25/1126099225.db2.gz FQEPYUJEBPBUQS-UHFFFAOYSA-N 0 1 377.463 3.120 10 0 GGAEMN COc1cc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc2c1OCCO2 ZINC000604766678 1126100333 /nfs/dbraw/zinc/10/03/33/1126100333.db2.gz ZCDPVSUGNQZESA-KXBFYZLASA-N 0 1 397.393 3.091 10 0 GGAEMN OCC1(NCc2cn(-c3cccc(Cl)c3Cl)nn2)Cc2ccccc2C1 ZINC000555420596 1126097037 /nfs/dbraw/zinc/09/70/37/1126097037.db2.gz HQTPEJZHQYRIRE-UHFFFAOYSA-N 0 1 389.286 3.194 10 0 GGAEMN Cn1nc(C(F)(F)F)cc1CN[C@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000657362540 1126104489 /nfs/dbraw/zinc/10/44/89/1126104489.db2.gz CQDKXWIKDREKOA-OCCSQVGLSA-N 0 1 381.320 3.063 10 0 GGAEMN O[C@@H]([C@@H](Cc1ccccc1)NCc1cc(-c2cccnc2)n[nH]1)C(F)(F)F ZINC000675100095 1126105035 /nfs/dbraw/zinc/10/50/35/1126105035.db2.gz WBGDKODMJSQAKT-MSOLQXFVSA-N 0 1 376.382 3.096 10 0 GGAEMN C[C@](CO)(Cc1ccc(F)cc1)NCc1csc(-c2ccc(C(N)=O)cc2)n1 ZINC001460858186 1126192431 /nfs/dbraw/zinc/19/24/31/1126192431.db2.gz AOICJINDXKDFAC-OAQYLSRUSA-N 0 1 399.491 3.131 10 0 GGAEMN CCc1cc2c(C[NH2+][C@](C)(CO)Cc3ccc(OC)cc3)cc(=O)oc2cc1[O-] ZINC001473839108 1126199643 /nfs/dbraw/zinc/19/96/43/1126199643.db2.gz RXDTUJQVKQUXIW-QHCPKHFHSA-N 0 1 397.471 3.153 10 0 GGAEMN Cn1nc(C(F)(F)F)c(CN[C@](C)(CO)Cc2ccccc2F)c1Cl ZINC001620623601 1126241132 /nfs/dbraw/zinc/24/11/32/1126241132.db2.gz CBDZAEDQEPHOCW-HNNXBMFYSA-N 0 1 379.785 3.315 10 0 GGAEMN C[C@](CO)(Cc1ccc(Br)cc1)NCc1noc2c1CCCC2 ZINC001620623963 1126241290 /nfs/dbraw/zinc/24/12/90/1126241290.db2.gz LIUCZYKHGMBUBS-GOSISDBHSA-N 0 1 379.298 3.399 10 0 GGAEMN C[C@@](CO)(Cc1ccccc1F)NCc1csc(-c2ccc(C(N)=O)cc2)n1 ZINC001620624391 1126241582 /nfs/dbraw/zinc/24/15/82/1126241582.db2.gz WGRQQJIXRGJLGK-NRFANRHFSA-N 0 1 399.491 3.131 10 0 GGAEMN O[C@H]([C@@H](Cc1ccccc1)NCc1cccc(Br)n1)C(F)(F)F ZINC001648158310 1126250152 /nfs/dbraw/zinc/25/01/52/1126250152.db2.gz KPSMWYNDZFCRHX-UKRRQHHQSA-N 0 1 389.215 3.468 10 0 GGAEMN OC[C@]1(NCc2c(F)cncc2F)CCc2cc(Br)ccc2C1 ZINC001655060915 1126254975 /nfs/dbraw/zinc/25/49/75/1126254975.db2.gz JMYSJKRWTDFICJ-KRWDZBQOSA-N 0 1 383.236 3.132 10 0 GGAEMN C[C@@](CO)(Cc1ccccc1F)NCc1cc2c(cc1Br)OCO2 ZINC001656292575 1126257043 /nfs/dbraw/zinc/25/70/43/1126257043.db2.gz BJOINDKDLNOHLM-SFHVURJKSA-N 0 1 396.256 3.400 10 0 GGAEMN C[C@](CO)(Cc1ccccc1F)NCc1cc2c(cc1Br)OCO2 ZINC001656292574 1126257052 /nfs/dbraw/zinc/25/70/52/1126257052.db2.gz BJOINDKDLNOHLM-GOSISDBHSA-N 0 1 396.256 3.400 10 0 GGAEMN O[C@@H]([C@H](Cc1ccccc1)NCc1ccnc(Br)c1)C(F)(F)F ZINC001659943896 1126263955 /nfs/dbraw/zinc/26/39/55/1126263955.db2.gz MBWRRHSHKDUNKZ-ZFWWWQNUSA-N 0 1 389.215 3.468 10 0 GGAEMN C[N@H+](Cc1cccnc1)C[C@@H]1CCN(C(=O)c2ccc3oc(=S)[n-]c3c2)C1 ZINC000408518197 530006434 /nfs/dbraw/zinc/00/64/34/530006434.db2.gz WQWPISNNYJPJNX-HNNXBMFYSA-N 0 1 382.489 3.106 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2cc(C3CC3)nc3ccc(C)cc32)CC1 ZINC000186630758 206226903 /nfs/dbraw/zinc/22/69/03/206226903.db2.gz AIHSISNUCGCWBP-UHFFFAOYSA-N 0 1 395.503 3.432 10 0 GGAEMN CCn1cc([C@@H]2NC(=O)CC[C@H]2NCc2nc3cc(Cl)ccc3n2C)cn1 ZINC000328632981 206237611 /nfs/dbraw/zinc/23/76/11/206237611.db2.gz LRIAIMCROXVAMK-KUHUBIRLSA-N 0 1 386.887 3.393 10 0 GGAEMN O=C(C=Cc1ccccc1)NCC(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1 ZINC000096257312 206300219 /nfs/dbraw/zinc/30/02/19/206300219.db2.gz RVVGDLPIQOXPBD-KTKRTIGZSA-N 0 1 382.370 3.123 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2cc(C3CC3)nc3ccc(F)cc32)CC1 ZINC000186641018 206306950 /nfs/dbraw/zinc/30/69/50/206306950.db2.gz BVHPWKXKELLPRK-UHFFFAOYSA-N 0 1 399.466 3.262 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@H]1CCCN(C(=O)c2cccc(OCc3ccccc3)c2)CC1 ZINC000186655940 206334294 /nfs/dbraw/zinc/33/42/94/206334294.db2.gz OEVYIQXGZAYPME-FQEVSTJZSA-N 0 1 396.487 3.277 10 0 GGAEMN COc1ccc(NC(=O)NCCCN2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000004791773 206554380 /nfs/dbraw/zinc/55/43/80/206554380.db2.gz NVBORTFKXFHSFK-UHFFFAOYSA-N 0 1 386.471 3.168 10 0 GGAEMN COc1cc2c(cc1CNCc1ccc(CN3CCOCC3)cc1)O[C@@H](C)C2 ZINC000014115780 207010438 /nfs/dbraw/zinc/01/04/38/207010438.db2.gz PSANIQYRWNURTN-KRWDZBQOSA-N 0 1 382.504 3.141 10 0 GGAEMN COc1cccc(CN2C[C@@H]3C[C@@H](c4cnn(C(C)C)c4)N4CCC[C@@]34C2=O)c1 ZINC000014970183 207035733 /nfs/dbraw/zinc/03/57/33/207035733.db2.gz JIVFWEZTDDSLGB-RRPUWOKSSA-N 0 1 394.519 3.411 10 0 GGAEMN O=C(NC1CC1)c1cn(C2CCN(Cc3ccccc3C(F)(F)F)CC2)nn1 ZINC000014992825 207038521 /nfs/dbraw/zinc/03/85/21/207038521.db2.gz MOSGOUKNOUDKHL-UHFFFAOYSA-N 0 1 393.413 3.026 10 0 GGAEMN Cn1nc(C(=O)N2CCN(C3CCCCC3)CC2)c2c1-c1ccccc1OC2 ZINC000015674262 207054416 /nfs/dbraw/zinc/05/44/16/207054416.db2.gz LYYSVFDNDTYPOI-UHFFFAOYSA-N 0 1 380.492 3.070 10 0 GGAEMN COCCCN1C(=O)c2n[nH]c(-c3ccc(OC)cc3)c2[C@@H]1c1ccc(O)cc1 ZINC000015920783 207067709 /nfs/dbraw/zinc/06/77/09/207067709.db2.gz FBDMNISDZKRHPF-NRFANRHFSA-N 0 1 393.443 3.373 10 0 GGAEMN COCCCN1C(=O)c2n[nH]c(-c3ccc(OC)cc3)c2[C@H]1c1ccc(O)cc1 ZINC000015920784 207067741 /nfs/dbraw/zinc/06/77/41/207067741.db2.gz FBDMNISDZKRHPF-OAQYLSRUSA-N 0 1 393.443 3.373 10 0 GGAEMN CC(C)c1nn2c(nc(CSc3nc(-c4ccccc4)n[nH]3)cc2=O)s1 ZINC000015731823 207057850 /nfs/dbraw/zinc/05/78/50/207057850.db2.gz ILVRWLLAYLLPCB-UHFFFAOYSA-N 0 1 384.490 3.352 10 0 GGAEMN CCCc1nn2c(nc(CSc3nc(-c4cccc(C)c4)n[nH]3)cc2=O)s1 ZINC000015732014 207058361 /nfs/dbraw/zinc/05/83/61/207058361.db2.gz BVYABFPEZYLKAB-UHFFFAOYSA-N 0 1 398.517 3.489 10 0 GGAEMN CCc1nn2c(nc(CSc3nc(-c4cccc(C)c4)n[nH]3)cc2=O)s1 ZINC000015731841 207058551 /nfs/dbraw/zinc/05/85/51/207058551.db2.gz UZDVGIVODFSCTF-UHFFFAOYSA-N 0 1 384.490 3.099 10 0 GGAEMN C[C@H](NCC(=O)N(Cc1ccco1)CC(F)(F)F)c1ccc2c(c1)OCCO2 ZINC000016695467 207077936 /nfs/dbraw/zinc/07/79/36/207077936.db2.gz SINZCCGPRBSBKZ-ZDUSSCGKSA-N 0 1 398.381 3.293 10 0 GGAEMN Cc1cc(N(C)C)nc(N2CCN(C(=O)c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC000017012277 207081125 /nfs/dbraw/zinc/08/11/25/207081125.db2.gz QMNGTOOCSGDLSQ-UHFFFAOYSA-N 0 1 381.524 3.111 10 0 GGAEMN COc1cc(C)c(CN2CCC3(CC2)CNC(=O)c2ccccc2O3)cc1OC ZINC000019567067 207137229 /nfs/dbraw/zinc/13/72/29/207137229.db2.gz ILJZTANWNJZTRT-UHFFFAOYSA-N 0 1 396.487 3.169 10 0 GGAEMN Cc1cc(C(=O)NC[C@H](C)Oc2cccc(CN(C)Cc3ccoc3)c2)n(C)n1 ZINC000019732906 207155114 /nfs/dbraw/zinc/15/51/14/207155114.db2.gz UCTKVCPNLILOGC-KRWDZBQOSA-N 0 1 396.491 3.151 10 0 GGAEMN Cc1cnc(SC[C@@H]2CCCO2)nc1[C@@H]1CCCN(Cc2cnn(C)c2)C1 ZINC000019782090 207161049 /nfs/dbraw/zinc/16/10/49/207161049.db2.gz HUGIXZFPEXOJHY-MSOLQXFVSA-N 0 1 387.553 3.169 10 0 GGAEMN Cc1cnc(SC[C@H]2CCCO2)nc1[C@@H]1CCCN(Cc2cnn(C)c2)C1 ZINC000019782091 207161768 /nfs/dbraw/zinc/16/17/68/207161768.db2.gz HUGIXZFPEXOJHY-QZTJIDSGSA-N 0 1 387.553 3.169 10 0 GGAEMN Cc1cc(CN(C)C(=O)c2cc(COc3ccc4ncccc4c3)on2)n[nH]1 ZINC000019800129 207163320 /nfs/dbraw/zinc/16/33/20/207163320.db2.gz YTVRYIVRHIBJFG-UHFFFAOYSA-N 0 1 377.404 3.106 10 0 GGAEMN CCN1CCN(c2cc(C)c3cc(NC(=S)N4CCCC4)ccc3n2)CC1 ZINC000020104842 207177631 /nfs/dbraw/zinc/17/76/31/207177631.db2.gz DJQSHBZDPRLHAI-UHFFFAOYSA-N 0 1 383.565 3.478 10 0 GGAEMN CC(C)(C)n1nnnc1CN1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000020139192 207178798 /nfs/dbraw/zinc/17/87/98/207178798.db2.gz JRPWIKCYHWOKAZ-UHFFFAOYSA-N 0 1 390.535 3.335 10 0 GGAEMN O=C(c1cc(-c2cn[nH]c2)nc2ccc(F)cc21)N1CCN2CCCC[C@H]2C1 ZINC000020209472 207184609 /nfs/dbraw/zinc/18/46/09/207184609.db2.gz CAZXQPAKEYGHHZ-INIZCTEOSA-N 0 1 379.439 3.074 10 0 GGAEMN C[N@H+]1CCc2c(sc(NC(=O)COc3ccccc3Cl)c2C(=O)[O-])C1 ZINC000020335427 207188659 /nfs/dbraw/zinc/18/86/59/207188659.db2.gz WTTYZXPCBMDEFA-UHFFFAOYSA-N 0 1 380.853 3.105 10 0 GGAEMN O=C(CN1CCN(CCCc2c[nH]c3ccc(F)cc23)CC1)Nc1ccccc1 ZINC000020421576 207191530 /nfs/dbraw/zinc/19/15/30/207191530.db2.gz KVUBBFXCRWGLTA-UHFFFAOYSA-N 0 1 394.494 3.496 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cncc(C(=O)N[C@H]3CCCC[C@H]3C)c2)cc1 ZINC000020532762 207201859 /nfs/dbraw/zinc/20/18/59/207201859.db2.gz YIHNAUBYFRMWGS-BEFAXECRSA-N 0 1 387.505 3.499 10 0 GGAEMN CCOC(=O)C1C(CN2C[C@H](C)C[C@H](C)C2)=NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020560266 207203522 /nfs/dbraw/zinc/20/35/22/207203522.db2.gz JOAZBEZPXLZMIT-GQIGUUNPSA-N 0 1 385.508 3.144 10 0 GGAEMN COc1ccc(OC)c(NS(=O)(=O)c2ccc3c(c2)C(=C(C)C)C(=O)N3)c1 ZINC000020577828 207204432 /nfs/dbraw/zinc/20/44/32/207204432.db2.gz MVAXZNWABLBKDU-UHFFFAOYSA-N 0 1 388.445 3.250 10 0 GGAEMN Cc1noc(-c2ccc(C)c(S(=O)(=O)NCCN3CCCCCC3)c2)c1C ZINC000020580693 207205343 /nfs/dbraw/zinc/20/53/43/207205343.db2.gz PUGJAXPWITWVIY-UHFFFAOYSA-N 0 1 391.537 3.421 10 0 GGAEMN CCOc1cc2[n-]c(=S)n(CC[N@H+]3CCCC[C@H]3C)c(=O)c2cc1OCC ZINC000020644605 207209518 /nfs/dbraw/zinc/20/95/18/207209518.db2.gz IULJJIUOFBTKTH-CQSZACIVSA-N 0 1 391.537 3.357 10 0 GGAEMN CCn1c(CN2CCN(Cc3ccccc3)CC2)nc2cc(NC(C)=O)ccc21 ZINC000020678086 207210103 /nfs/dbraw/zinc/21/01/03/207210103.db2.gz DDWUWHMRINKBFJ-UHFFFAOYSA-N 0 1 391.519 3.332 10 0 GGAEMN CCCn1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3ccco3)ccc21 ZINC000020677647 207210246 /nfs/dbraw/zinc/21/02/46/207210246.db2.gz SOYPMLBUPFBJBY-UHFFFAOYSA-N 0 1 381.480 3.039 10 0 GGAEMN COc1cc2ncc(C(=O)c3ccccc3)c(N3CCN(C)CC3)c2cc1OC ZINC000021522498 207230108 /nfs/dbraw/zinc/23/01/08/207230108.db2.gz VIXKABQAFZDVFO-UHFFFAOYSA-N 0 1 391.471 3.235 10 0 GGAEMN COc1cccc(-c2n[nH]c(SCc3cc(=O)n4cc(C)sc4n3)n2)c1 ZINC000020982720 207221381 /nfs/dbraw/zinc/22/13/81/207221381.db2.gz XSRGLOBFXCGREQ-UHFFFAOYSA-N 0 1 385.474 3.150 10 0 GGAEMN COc1ccc2nc(N3CCC[C@@H](C(=O)NCCc4ccccc4)C3)[nH]c2c1 ZINC000021146068 207227393 /nfs/dbraw/zinc/22/73/93/207227393.db2.gz HPGKWFWARQZRHI-QGZVFWFLSA-N 0 1 378.476 3.147 10 0 biogenic GGAEMN Cc1c(C(=O)N(C)c2ccccc2F)sc2ncnc(N3CCN(C)CC3)c12 ZINC000021636637 207232717 /nfs/dbraw/zinc/23/27/17/207232717.db2.gz JFCPSXUMWKVRRU-UHFFFAOYSA-N 0 1 399.495 3.167 10 0 GGAEMN c1cc(CN2CCCC2)n(-c2nnc(N3CCN(c4ccccc4)CC3)s2)c1 ZINC000021880764 207241389 /nfs/dbraw/zinc/24/13/89/207241389.db2.gz GXDSIPCMGCKKAT-UHFFFAOYSA-N 0 1 394.548 3.251 10 0 GGAEMN C[C@H](NCc1ccc(S(N)(=O)=O)cc1)c1ccc(Br)s1 ZINC000038001689 207247652 /nfs/dbraw/zinc/24/76/52/207247652.db2.gz DYNCOGSZNDZKFB-VIFPVBQESA-N 0 1 375.313 3.009 10 0 GGAEMN C[C@@H](NCc1cccc(S(N)(=O)=O)c1)c1ccc(Br)s1 ZINC000038003340 207249961 /nfs/dbraw/zinc/24/99/61/207249961.db2.gz XYCAISWUEZWQEP-SECBINFHSA-N 0 1 375.313 3.009 10 0 GGAEMN CN(C)[C@H](CNC(=O)/C=C/c1ccc(N2CCCC2=O)cc1)c1cccc(F)c1 ZINC000022312743 207252843 /nfs/dbraw/zinc/25/28/43/207252843.db2.gz LCLIKOPIBQIIIQ-QYFOZDBKSA-N 0 1 395.478 3.385 10 0 GGAEMN COc1ccc(NC(=O)CSc2nc(-c3ccc(F)cc3)n[nH]2)c(OC)c1 ZINC000021943212 207244125 /nfs/dbraw/zinc/24/41/25/207244125.db2.gz MDHUYQYGIDXBPL-UHFFFAOYSA-N 0 1 388.424 3.359 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@H]1CCCN(C(=O)c2cccs2)C1)c1ccsc1 ZINC000023133436 207270479 /nfs/dbraw/zinc/27/04/79/207270479.db2.gz RUEHVLCYIGWBHF-HOCLYGCPSA-N 0 1 391.562 3.081 10 0 GGAEMN CC(C)[C@@H](NC(=O)C1CCCCC1)C(=O)NC[C@H](c1ccsc1)N(C)C ZINC000023133351 207270761 /nfs/dbraw/zinc/27/07/61/207270761.db2.gz MYEOOYVRRJEWQP-QZTJIDSGSA-N 0 1 379.570 3.188 10 0 GGAEMN CCOCCNC(=O)c1ccc(-c2cc(-c3cccc4c3OCCO4)n[nH]2)cc1 ZINC000023315556 207273449 /nfs/dbraw/zinc/27/34/49/207273449.db2.gz CVAWLJDJVNAQCU-UHFFFAOYSA-N 0 1 393.443 3.281 10 0 GGAEMN CCn1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3cccc(C)c3)ccc21 ZINC000022936105 207265368 /nfs/dbraw/zinc/26/53/68/207265368.db2.gz QDQDWGFCPQGGKN-UHFFFAOYSA-N 0 1 391.519 3.364 10 0 GGAEMN CCCc1nc(SCC(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)n[nH]1 ZINC000023007886 207266652 /nfs/dbraw/zinc/26/66/52/207266652.db2.gz ORKFZWNEXSQIGE-HNNXBMFYSA-N 0 1 390.509 3.230 10 0 GGAEMN CCCc1n[nH]c(SCC(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)n1 ZINC000023007886 207266657 /nfs/dbraw/zinc/26/66/57/207266657.db2.gz ORKFZWNEXSQIGE-HNNXBMFYSA-N 0 1 390.509 3.230 10 0 GGAEMN COc1ccccc1NC(=O)Cc1noc(CN2CC[C@H]3CCCC[C@@H]3C2)n1 ZINC000025410875 207302838 /nfs/dbraw/zinc/30/28/38/207302838.db2.gz RPPFJUREURQDAI-HZPDHXFCSA-N 0 1 384.480 3.272 10 0 GGAEMN O[C@H](COc1ccccc1Br)CN1CCN(c2ccccc2)CC1 ZINC000026781827 207319911 /nfs/dbraw/zinc/31/99/11/207319911.db2.gz RXRUFWNNLYVYIX-KRWDZBQOSA-N 0 1 391.309 3.011 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)c3csc(-c4cccnc4)n3)cc2)CC1 ZINC000029047037 207353570 /nfs/dbraw/zinc/35/35/70/207353570.db2.gz AYWSFKSJVLAVSG-UHFFFAOYSA-N 0 1 379.489 3.209 10 0 GGAEMN C[C@H](c1ccc2c(c1)OCCO2)N(C)C(=O)Nc1nc(-c2ccccc2)n[nH]1 ZINC000032561834 207397559 /nfs/dbraw/zinc/39/75/59/207397559.db2.gz JMHJYYLMUUFRNE-CYBMUJFWSA-N 0 1 379.420 3.468 10 0 GGAEMN COc1ccc(CN2CCCN(C(=O)/C=C/c3ccc4c(c3)CCO4)CC2)cc1 ZINC000040080085 207573573 /nfs/dbraw/zinc/57/35/73/207573573.db2.gz ZQVGTOHCEFKBCJ-UXBLZVDNSA-N 0 1 392.499 3.378 10 0 GGAEMN O=C(Cc1n[nH]c(Cc2ccc(F)cc2)n1)NCc1ccc(C(F)(F)F)cc1 ZINC000065232790 207849258 /nfs/dbraw/zinc/84/92/58/207849258.db2.gz CJRQXHVMFFRECZ-UHFFFAOYSA-N 0 1 392.356 3.412 10 0 GGAEMN Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)c1 ZINC000085690628 208101897 /nfs/dbraw/zinc/10/18/97/208101897.db2.gz CZENTUDBORWKMP-QGZVFWFLSA-N 0 1 389.459 3.271 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)cc1 ZINC000085690619 208102080 /nfs/dbraw/zinc/10/20/80/208102080.db2.gz DHQGBGZKFJJZBC-QGZVFWFLSA-N 0 1 389.459 3.271 10 0 GGAEMN O=C(NC[C@H](c1ccco1)N1CCCC1)[C@H]1CCCN1C(=O)C1CCCCC1 ZINC000084429544 208092208 /nfs/dbraw/zinc/09/22/08/208092208.db2.gz QQYXVBUNTMCGOP-RTBURBONSA-N 0 1 387.524 3.104 10 0 GGAEMN COc1ccc(-c2n[nH]c(NC(=O)c3ccc4c(n3)CCCC4)n2)c(OC)c1 ZINC000089434871 208105503 /nfs/dbraw/zinc/10/55/03/208105503.db2.gz FFHZSCZDVMKJJU-UHFFFAOYSA-N 0 1 379.420 3.015 10 0 GGAEMN Cc1nc(CNC(=O)[C@@H](C)Oc2ccccc2Br)c2ccccn12 ZINC000089708970 208107426 /nfs/dbraw/zinc/10/74/26/208107426.db2.gz GERODQVDXGXUNR-GFCCVEGCSA-N 0 1 388.265 3.489 10 0 GGAEMN Cc1cnn(-c2ccc(C(=O)NC[C@H](c3cccnc3)N3CCCC3)cc2)c1 ZINC000089702525 208107747 /nfs/dbraw/zinc/10/77/47/208107747.db2.gz HBGKPTDHISIZGA-OAQYLSRUSA-N 0 1 375.476 3.143 10 0 GGAEMN COCCOc1cccc(C(=O)N2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)c1 ZINC000095441903 208181927 /nfs/dbraw/zinc/18/19/27/208181927.db2.gz YWMMATQSZJFMMG-LJQANCHMSA-N 0 1 392.459 3.474 10 0 GGAEMN COCCOc1cccc(C(=O)N2CCC[C@@H]2c2nc(-c3ccccc3)n[nH]2)c1 ZINC000095441903 208181931 /nfs/dbraw/zinc/18/19/31/208181931.db2.gz YWMMATQSZJFMMG-LJQANCHMSA-N 0 1 392.459 3.474 10 0 GGAEMN C[C@@H](OC(=O)[C@H]1CCCc2cn[nH]c21)C(=O)Nc1ccc(Br)cc1 ZINC000095443981 208183301 /nfs/dbraw/zinc/18/33/01/208183301.db2.gz NPHQPRADJSJNLX-YGRLFVJLSA-N 0 1 392.253 3.163 10 0 GGAEMN C[C@H](OC(=O)[C@H]1CCCc2cn[nH]c21)C(=O)Nc1ccc(Br)cc1 ZINC000095443980 208184267 /nfs/dbraw/zinc/18/42/67/208184267.db2.gz NPHQPRADJSJNLX-HZMBPMFUSA-N 0 1 392.253 3.163 10 0 GGAEMN COCCCn1ccc(NC(=O)N2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)n1 ZINC000095454972 208185985 /nfs/dbraw/zinc/18/59/85/208185985.db2.gz BYEWULWSWRSEAZ-INIZCTEOSA-N 0 1 395.467 3.074 10 0 GGAEMN COCCCn1ccc(NC(=O)N2CCC[C@H]2c2nc(-c3ccccc3)n[nH]2)n1 ZINC000095454972 208185992 /nfs/dbraw/zinc/18/59/92/208185992.db2.gz BYEWULWSWRSEAZ-INIZCTEOSA-N 0 1 395.467 3.074 10 0 GGAEMN C[C@H](CS(=O)(=O)c1ccccc1)N[C@H](Cc1nccn1C)c1ccccc1 ZINC000095986461 208247774 /nfs/dbraw/zinc/24/77/74/208247774.db2.gz SJRQXUMPXCMFDE-YLJYHZDGSA-N 0 1 383.517 3.156 10 0 GGAEMN Cc1sc(-c2ccno2)cc1S(=O)(=O)Nc1ccc2c(c1)OCCO2 ZINC000096323610 208307133 /nfs/dbraw/zinc/30/71/33/208307133.db2.gz FEQVEODHGGQPOG-UHFFFAOYSA-N 0 1 378.431 3.284 10 0 GGAEMN O=C(NC1CCCCCC1)[C@H]1CCCN(C(=O)c2cc(-c3cccnc3)[nH]n2)C1 ZINC000096324730 208307656 /nfs/dbraw/zinc/30/76/56/208307656.db2.gz GOKPAQQOCXSWBF-KRWDZBQOSA-N 0 1 395.507 3.163 10 0 GGAEMN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)cc1 ZINC000096324797 208309236 /nfs/dbraw/zinc/30/92/36/208309236.db2.gz SHRILZPRWYJFBM-KRWDZBQOSA-N 0 1 389.459 3.271 10 0 GGAEMN CCC(CC)N1CCN(C(=O)c2ccc3[nH]c4c(c3c2)CN(C(C)=O)CC4)CC1 ZINC000096363736 208310476 /nfs/dbraw/zinc/31/04/76/208310476.db2.gz WHKYMHXDIMOAPP-UHFFFAOYSA-N 0 1 396.535 3.019 10 0 GGAEMN CCOCCN1CCN(C(=O)Nc2cccc(-c3noc(C)n3)c2)C[C@H]1CC ZINC000097164677 208339737 /nfs/dbraw/zinc/33/97/37/208339737.db2.gz LBHGZMJLMNNWGN-GOSISDBHSA-N 0 1 387.484 3.010 10 0 GGAEMN COc1ccc(C2=NN(C(=O)CN3CCCC3)[C@@H](c3cccc(OC)c3)C2)cc1 ZINC000097165218 208341264 /nfs/dbraw/zinc/34/12/64/208341264.db2.gz CRSNSNOJMJAAJE-JOCHJYFZSA-N 0 1 393.487 3.477 10 0 GGAEMN COc1ccccc1-n1c(O)c2c(-c3ccccc3)nn(-c3ccccc3)c2c1O ZINC000100909355 208383266 /nfs/dbraw/zinc/38/32/66/208383266.db2.gz ARQPBWSEFOXJPJ-IRLDBZIGSA-N 0 1 397.434 3.478 10 0 GGAEMN COc1cccc(C(=O)C=C([O-])C(=O)Nc2ccccc2Br)c1 ZINC000101354977 208392681 /nfs/dbraw/zinc/39/26/81/208392681.db2.gz LLDFPRXWUNZRTD-UHFFFAOYSA-N 0 1 376.206 3.238 10 0 GGAEMN COc1cccc(C(=O)C=C(O)C(=O)Nc2ccccc2Br)c1 ZINC000101354977 208392686 /nfs/dbraw/zinc/39/26/86/208392686.db2.gz LLDFPRXWUNZRTD-UHFFFAOYSA-N 0 1 376.206 3.238 10 0 GGAEMN CC(C)(C)c1cc(C[C@@H]2CC[C@H](O)[C@@H](CNCc3ccccc3F)O2)no1 ZINC000096296007 209014284 /nfs/dbraw/zinc/01/42/84/209014284.db2.gz BIZQROSRWJWWRJ-YTQUADARSA-N 0 1 376.472 3.352 10 0 GGAEMN Cc1cc(NC(=O)c2cc(-c3cccnc3)on2)cc(N2CCN(C)CC2)c1 ZINC000241795514 209020319 /nfs/dbraw/zinc/02/03/19/209020319.db2.gz RZUANFFQUALEBS-UHFFFAOYSA-N 0 1 377.448 3.049 10 0 GGAEMN CC[C@H](C)n1ncc(C(=O)Nc2ccc3nc(CN4CCOCC4)[nH]c3c2)c1C ZINC000242292551 209022086 /nfs/dbraw/zinc/02/20/86/209022086.db2.gz YNFFGACCXSKOND-AWEZNQCLSA-N 0 1 396.495 3.123 10 0 GGAEMN CCCCN1CCN(Cc2nc(-c3ccc(N4CCC(C)CC4)nc3)no2)CC1 ZINC000065216197 136160313 /nfs/dbraw/zinc/16/03/13/136160313.db2.gz QDBSVFZPVGJSNY-UHFFFAOYSA-N 0 1 398.555 3.286 10 0 GGAEMN CCN1CCN(c2nc3ccccc3c(NCc3ccc(OC)cc3)n2)CC1 ZINC000072260759 136167750 /nfs/dbraw/zinc/16/77/50/136167750.db2.gz NYPBUQMVZUVXRM-UHFFFAOYSA-N 0 1 377.492 3.392 10 0 GGAEMN Cc1cc(CNC2CCN(c3nccc(-c4ccc(C)nc4C)n3)CC2)no1 ZINC000095519415 136181053 /nfs/dbraw/zinc/18/10/53/136181053.db2.gz QBVOHDXWUUCVQR-UHFFFAOYSA-N 0 1 378.480 3.210 10 0 GGAEMN CC(C)CN1CCN(C(=O)c2ccc(-c3ccnc(N4CCCC4)n3)cc2)CC1 ZINC000065171664 222105500 /nfs/dbraw/zinc/10/55/00/222105500.db2.gz VAMFDSBAUSVNKP-UHFFFAOYSA-N 0 1 393.535 3.158 10 0 GGAEMN CCOC(=O)C1C(CNCc2ccc(Cl)cc2)=NC(=O)N[C@H]1c1ccccc1 ZINC000058056272 520520620 /nfs/dbraw/zinc/52/06/20/520520620.db2.gz LSIRHLISMIBJTB-IBGZPJMESA-N 0 1 399.878 3.301 10 0 GGAEMN Cc1cc(Cl)cc(C)c1OCC(=O)Nc1ccc(N2CCN(C)CC2)nc1 ZINC000012612709 524861178 /nfs/dbraw/zinc/86/11/78/524861178.db2.gz HSCOUBVFJWROLL-UHFFFAOYSA-N 0 1 388.899 3.121 10 0 GGAEMN CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)Nc2ncc(C)o2)CC1 ZINC000072309692 535746190 /nfs/dbraw/zinc/74/61/90/535746190.db2.gz AKPYEZYZYOHQGT-AWEZNQCLSA-N 0 1 375.448 3.147 10 0 GGAEMN CC[C@@H]1CN(C(=O)CCc2cc(Br)cs2)CCN1CCOC ZINC000117299168 564225243 /nfs/dbraw/zinc/22/52/43/564225243.db2.gz IYLSUSLNPKRQSM-CQSZACIVSA-N 0 1 389.359 3.012 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cc(F)cc(Br)c2OC)cc1 ZINC000012819416 564271735 /nfs/dbraw/zinc/27/17/35/564271735.db2.gz BCMYQMLTYLYBAS-UHFFFAOYSA-N 0 1 390.230 3.406 10 0 GGAEMN O=C(CCCc1ccc(Br)s1)NCCCCN1CCOCC1 ZINC000120166122 564308162 /nfs/dbraw/zinc/30/81/62/564308162.db2.gz HRNYHZFVQZXAIG-UHFFFAOYSA-N 0 1 389.359 3.062 10 0 GGAEMN CN(Cc1cc(Br)c([O-])c(Br)c1)C[C@@H]1CC[N@H+](C)C1 ZINC000234350625 565934860 /nfs/dbraw/zinc/93/48/60/565934860.db2.gz HXVOWCCWBREOLL-SNVBAGLBSA-N 0 1 392.135 3.301 10 0 GGAEMN CN(Cc1cc(Br)c([O-])c(Br)c1)C[C@@H]1CC[N@@H+](C)C1 ZINC000234350625 565934865 /nfs/dbraw/zinc/93/48/65/565934865.db2.gz HXVOWCCWBREOLL-SNVBAGLBSA-N 0 1 392.135 3.301 10 0 GGAEMN CN(Cc1cc(Br)c([O-])c(Br)c1)C[C@H]1CC[N@H+](C)C1 ZINC000234323322 565935698 /nfs/dbraw/zinc/93/56/98/565935698.db2.gz HXVOWCCWBREOLL-JTQLQIEISA-N 0 1 392.135 3.301 10 0 GGAEMN CN(Cc1cc(Br)c([O-])c(Br)c1)C[C@H]1CC[N@@H+](C)C1 ZINC000234323322 565935701 /nfs/dbraw/zinc/93/57/01/565935701.db2.gz HXVOWCCWBREOLL-JTQLQIEISA-N 0 1 392.135 3.301 10 0 GGAEMN CC[C@@H](C)[N@@H+](CCCOc1cccc(I)c1)CC(=O)[O-] ZINC000236865204 565946131 /nfs/dbraw/zinc/94/61/31/565946131.db2.gz UUVLYBJOGKIQPJ-GFCCVEGCSA-N 0 1 391.249 3.245 10 0 GGAEMN CCN(CC(=O)NCc1cc(Cl)ccc1I)C1CC1 ZINC000597899002 567723346 /nfs/dbraw/zinc/72/33/46/567723346.db2.gz VIHCJERRBNMYBV-UHFFFAOYSA-N 0 1 392.668 3.045 10 0 GGAEMN CC(C)n1cc2c3c1cccc3[C@H]1C[C@@H](C(=O)O[C@H](C)[C@H](C)O)CN(C)[C@@H]1C2 ZINC000009224254 560211190 /nfs/dbraw/zinc/21/11/90/560211190.db2.gz JQYLIGHHVGCTPR-HFVSKKSMSA-N 0 1 384.520 3.495 10 0 in-vitro GGAEMN Cc1ccc(NC(=O)CSC2=Nc3ccccc3S(=O)(=O)N2)cc1C ZINC000004270550 564202114 /nfs/dbraw/zinc/20/21/14/564202114.db2.gz TZHMVHKQFRNKLT-UHFFFAOYSA-N 0 1 375.475 3.146 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccccc1Br ZINC000116252923 564206197 /nfs/dbraw/zinc/20/61/97/564206197.db2.gz IHVIXMBSAQMEJX-KSSFIOAISA-N 0 1 388.309 3.485 10 0 GGAEMN Cc1cc(NC(=O)[C@@H](C)N2CC[C@H](c3cnn(C)c3)C2)ccc1Br ZINC000116314333 564207676 /nfs/dbraw/zinc/20/76/76/564207676.db2.gz HPHNWMOYNKRFCQ-KGLIPLIRSA-N 0 1 391.313 3.308 10 0 GGAEMN CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN1CC[C@H](c2cnn(C)c2)C1 ZINC000116316662 564207806 /nfs/dbraw/zinc/20/78/06/564207806.db2.gz ZKVBMENTOXZUCP-AWEZNQCLSA-N 0 1 381.307 3.175 10 0 GGAEMN COc1ccc(OC)c(NC(=O)CSc2nc(-c3cccs3)n[nH]2)c1 ZINC000005017779 564211749 /nfs/dbraw/zinc/21/17/49/564211749.db2.gz GUNMAOBPUWNXQA-UHFFFAOYSA-N 0 1 376.463 3.281 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)CCN1CCOC ZINC000117299303 564225339 /nfs/dbraw/zinc/22/53/39/564225339.db2.gz MGBFKFHHFBUZAU-KZNAEPCWSA-N 0 1 395.341 3.122 10 0 GGAEMN CC[C@H]1CN(C(=O)CCc2cc(Br)cs2)CCN1CCOC ZINC000117299169 564225702 /nfs/dbraw/zinc/22/57/02/564225702.db2.gz IYLSUSLNPKRQSM-AWEZNQCLSA-N 0 1 389.359 3.012 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2ccc(F)cc2Br)CCN1CCOC ZINC000117444659 564227862 /nfs/dbraw/zinc/22/78/62/564227862.db2.gz BPEGQCKOLJVVEO-CYBMUJFWSA-N 0 1 388.281 3.163 10 0 GGAEMN CC(=O)NCc1ccc(C(=O)CSc2nc(-c3cccs3)n[nH]2)s1 ZINC000007427608 564237195 /nfs/dbraw/zinc/23/71/95/564237195.db2.gz DIPVALXOHLXIOQ-UHFFFAOYSA-N 0 1 378.504 3.206 10 0 GGAEMN CC(=O)N(C)c1ccccc1NS(=O)(=O)c1cccc(Br)c1 ZINC000118302345 564238974 /nfs/dbraw/zinc/23/89/74/564238974.db2.gz YHRYUCNYUZUPJO-UHFFFAOYSA-N 0 1 383.267 3.233 10 0 GGAEMN CN(Cc1ccc(F)cc1)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000008120262 564246415 /nfs/dbraw/zinc/24/64/15/564246415.db2.gz CHMTYBJYGZTNNV-UHFFFAOYSA-N 0 1 376.229 3.228 10 0 GGAEMN Brc1ccc(-c2nc(CNc3ncnc4ncccc43)n[nH]2)cc1 ZINC000119278129 564262675 /nfs/dbraw/zinc/26/26/75/564262675.db2.gz JCDFWEZDMHHDJR-UHFFFAOYSA-N 0 1 382.225 3.185 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNc3ncnc4ncccc43)n2)cc1 ZINC000119278129 564262678 /nfs/dbraw/zinc/26/26/78/564262678.db2.gz JCDFWEZDMHHDJR-UHFFFAOYSA-N 0 1 382.225 3.185 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)[nH]n1 ZINC000119304799 564265445 /nfs/dbraw/zinc/26/54/45/564265445.db2.gz DEDVNBLRDXWNAN-QWHCGFSZSA-N 0 1 386.253 3.315 10 0 GGAEMN COC(=O)c1c(C)c(C)sc1NC(=O)CSc1nc(C(C)(C)C)n[nH]1 ZINC000012255961 564267155 /nfs/dbraw/zinc/26/71/55/564267155.db2.gz DYHGMVUKDMJRHD-UHFFFAOYSA-N 0 1 382.511 3.298 10 0 GGAEMN O=C(Oc1ccc(/C=C2\NC(=O)NC2=O)cc1)c1ccc(Cl)cc1Cl ZINC000012339329 564267312 /nfs/dbraw/zinc/26/73/12/564267312.db2.gz HZIWBWUNOYNSDL-AUWJEWJLSA-N 0 1 377.183 3.393 10 0 GGAEMN Cc1nccn1-c1ccc([C@H](C)NC(=O)CSc2n[nH]c(=S)s2)cc1 ZINC000119381988 564267690 /nfs/dbraw/zinc/26/76/90/564267690.db2.gz PQFWVHYVFRBKTG-JTQLQIEISA-N 0 1 391.547 3.290 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)[nH]n1 ZINC000119389880 564269206 /nfs/dbraw/zinc/26/92/06/564269206.db2.gz YWXDGIVHQUYPHE-CHWSQXEVSA-N 0 1 386.253 3.315 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)[nH]n1 ZINC000119390146 564269265 /nfs/dbraw/zinc/26/92/65/564269265.db2.gz YWXDGIVHQUYPHE-QWHCGFSZSA-N 0 1 386.253 3.315 10 0 GGAEMN C[C@@H](C(=O)Nc1cc(-c2nccn2C)n[nH]1)c1ccc(Br)s1 ZINC000119436135 564271109 /nfs/dbraw/zinc/27/11/09/564271109.db2.gz KQLUANKIPKMIKW-MRVPVSSYSA-N 0 1 380.271 3.376 10 0 GGAEMN Cc1cccc(C(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c1Br ZINC000119636101 564280251 /nfs/dbraw/zinc/28/02/51/564280251.db2.gz PHSGVZQGJWFROR-CQSZACIVSA-N 0 1 381.314 3.083 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)CCc2ccc(Br)cc2F)[nH]n1 ZINC000119641901 564281179 /nfs/dbraw/zinc/28/11/79/564281179.db2.gz UHDLFIPNLWRWPV-UHFFFAOYSA-N 0 1 392.232 3.283 10 0 GGAEMN CCOCCN1CCN(C(=O)Nc2ccccc2Br)C[C@H]1CC ZINC000119649520 564281236 /nfs/dbraw/zinc/28/12/36/564281236.db2.gz DFMOXUWONKMLAZ-CQSZACIVSA-N 0 1 384.318 3.414 10 0 GGAEMN COc1ccc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1O ZINC000119724701 564284749 /nfs/dbraw/zinc/28/47/49/564284749.db2.gz ZNMVJOFULGYAAT-UHFFFAOYSA-N 0 1 389.253 3.238 10 0 GGAEMN CCCn1cc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)cn1 ZINC000119738389 564286218 /nfs/dbraw/zinc/28/62/18/564286218.db2.gz PARDNATYGTYSKF-UHFFFAOYSA-N 0 1 375.274 3.131 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cc3cc(Br)ccc3[nH]2)[nH]n1 ZINC000119749617 564287302 /nfs/dbraw/zinc/28/73/02/564287302.db2.gz RLQSLZCIUVJBQC-UHFFFAOYSA-N 0 1 385.225 3.306 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCCCc2cccc(Br)c2)n[nH]1 ZINC000119879764 564292935 /nfs/dbraw/zinc/29/29/35/564292935.db2.gz WOVKIZJHCCIGHI-LBPRGKRZSA-N 0 1 379.302 3.344 10 0 GGAEMN CC[NH+]1CCN(c2ccccc2[N-]S(=O)(=O)c2cc(C)sc2C)CC1 ZINC000021890252 564313283 /nfs/dbraw/zinc/31/32/83/564313283.db2.gz PWNMDTYMECQMOZ-UHFFFAOYSA-N 0 1 379.551 3.308 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCCCc2ccc(Br)cc2F)n[nH]1 ZINC000120286199 564313989 /nfs/dbraw/zinc/31/39/89/564313989.db2.gz HRGFFBXCXCMINQ-NSHDSACASA-N 0 1 397.292 3.483 10 0 GGAEMN Cc1nnc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)[nH]1 ZINC000120351151 564316729 /nfs/dbraw/zinc/31/67/29/564316729.db2.gz JOTZMWARIMRGSI-ZDUSSCGKSA-N 0 1 384.267 3.203 10 0 GGAEMN Cc1n[nH]c(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2Cl)n1 ZINC000120351151 564316730 /nfs/dbraw/zinc/31/67/30/564316730.db2.gz JOTZMWARIMRGSI-ZDUSSCGKSA-N 0 1 384.267 3.203 10 0 GGAEMN CCN(CC(C)C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120523894 564324111 /nfs/dbraw/zinc/32/41/11/564324111.db2.gz FRPKDKIEGFZFIX-UHFFFAOYSA-N 0 1 380.290 3.422 10 0 GGAEMN CCN(CC(C)C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120523894 564324113 /nfs/dbraw/zinc/32/41/13/564324113.db2.gz FRPKDKIEGFZFIX-UHFFFAOYSA-N 0 1 380.290 3.422 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCC2(c3ccccc3Br)CC2)n[nH]1 ZINC000120668206 564331626 /nfs/dbraw/zinc/33/16/26/564331626.db2.gz VKCHPEIPXDQTDI-LBPRGKRZSA-N 0 1 391.313 3.443 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(-c3nncn3C)cc2)c(Cl)cc1F ZINC000120847405 564340349 /nfs/dbraw/zinc/34/03/49/564340349.db2.gz ZDNQPAJCGYYERM-UHFFFAOYSA-N 0 1 380.832 3.384 10 0 GGAEMN CCOCCN1CCN(CC2=Cc3cc(Br)ccc3OC2)C[C@@H]1C ZINC000120893137 564342497 /nfs/dbraw/zinc/34/24/97/564342497.db2.gz PDALFMIGKKXKQM-HNNXBMFYSA-N 0 1 395.341 3.268 10 0 GGAEMN CC[C@H]1CN(Cc2cc(Br)c(OC)s2)CCN1CCOC ZINC000120925537 564342859 /nfs/dbraw/zinc/34/28/59/564342859.db2.gz BVVZOOJNZQLILW-LBPRGKRZSA-N 0 1 377.348 3.062 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000028013374 564358768 /nfs/dbraw/zinc/35/87/68/564358768.db2.gz VYSGYBKWBMMFSF-UKRRQHHQSA-N 0 1 389.323 3.234 10 0 GGAEMN COc1cc(NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc(OC)c1Br ZINC000121212283 564359911 /nfs/dbraw/zinc/35/99/11/564359911.db2.gz LZGDMDFNEGALGU-VIFPVBQESA-N 0 1 397.273 3.251 10 0 GGAEMN Cc1ccc(CN2CCCN(Cc3cnn(C)c3)CC2)c(Br)c1 ZINC000121580529 564375773 /nfs/dbraw/zinc/37/57/73/564375773.db2.gz YZZMGEOWPJCIOD-UHFFFAOYSA-N 0 1 377.330 3.199 10 0 GGAEMN O=C(CN1CCCC[C@H]1c1nnc[nH]1)Nc1ccc(Br)cc1Cl ZINC000121671766 564380926 /nfs/dbraw/zinc/38/09/26/564380926.db2.gz VUXCNDJGVPQSNP-ZDUSSCGKSA-N 0 1 398.692 3.386 10 0 GGAEMN Cc1ccc(NC(=O)CN2CCCC[C@@H]2c2nnc[nH]2)c(Br)c1 ZINC000121693969 564381454 /nfs/dbraw/zinc/38/14/54/564381454.db2.gz RZIHBIYXXPZQAI-CQSZACIVSA-N 0 1 378.274 3.041 10 0 GGAEMN Brc1ccc(-c2noc(CN3CCCC[C@@H]3c3nnc[nH]3)n2)s1 ZINC000121706849 564382115 /nfs/dbraw/zinc/38/21/15/564382115.db2.gz UQGFWJWTDKMDJZ-SECBINFHSA-N 0 1 395.286 3.406 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CN1CCCC[C@H]1c1nnc[nH]1 ZINC000121713556 564382733 /nfs/dbraw/zinc/38/27/33/564382733.db2.gz SZRHMZOGAPOOAH-AWEZNQCLSA-N 0 1 378.274 3.041 10 0 GGAEMN C[C@]1(C(=O)Nc2ccc(F)c(NS(=O)(=O)c3cccs3)c2)CCCO1 ZINC000121718461 564383438 /nfs/dbraw/zinc/38/34/38/564383438.db2.gz VQYYVEMGYOCJRK-MRXNPFEDSA-N 0 1 384.454 3.196 10 0 GGAEMN CCc1ccc(CC)c(NS(=O)(=O)c2ccc(S(C)(=O)=O)c(F)c2)c1 ZINC000121790111 564387854 /nfs/dbraw/zinc/38/78/54/564387854.db2.gz XGYTUXVYUINVOV-UHFFFAOYSA-N 0 1 385.482 3.155 10 0 GGAEMN NC(=O)c1ccc(NS(=O)(=O)c2ccccc2C(F)(F)F)cc1Cl ZINC000031721019 564392046 /nfs/dbraw/zinc/39/20/46/564392046.db2.gz PXRODBLOYJLCGX-UHFFFAOYSA-N 0 1 378.759 3.259 10 0 GGAEMN COC(=O)CCc1nnc(NC(=O)c2cc(-c3ccc(Cl)s3)on2)s1 ZINC000121906686 564392197 /nfs/dbraw/zinc/39/21/97/564392197.db2.gz UQECKWJYRHNMBK-UHFFFAOYSA-N 0 1 398.853 3.266 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H](C)Cc2ccc(F)c(Br)c2)n[nH]1 ZINC000122160867 564402483 /nfs/dbraw/zinc/40/24/83/564402483.db2.gz YJYQFEWKRWVSEL-GHMZBOCLSA-N 0 1 397.292 3.481 10 0 GGAEMN O[C@H](COC[C@H]1CCCO1)CN1CCc2sccc2[C@@H]1c1cccs1 ZINC000032774595 564405570 /nfs/dbraw/zinc/40/55/70/564405570.db2.gz NCGJDGRFJALOFT-QMTMVMCOSA-N 0 1 379.547 3.314 10 0 GGAEMN O[C@H](COC[C@@H]1CCCO1)CN1CCc2sccc2[C@@H]1c1cccs1 ZINC000032774593 564405814 /nfs/dbraw/zinc/40/58/14/564405814.db2.gz NCGJDGRFJALOFT-YZVOILCLSA-N 0 1 379.547 3.314 10 0 GGAEMN C[C@@H](NCc1csc(Br)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000036954939 564419859 /nfs/dbraw/zinc/41/98/59/564419859.db2.gz FPRLLQWIMDKLOL-SECBINFHSA-N 0 1 375.313 3.009 10 0 GGAEMN Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)CN(C)C)c(Br)c1 ZINC000040692835 564428274 /nfs/dbraw/zinc/42/82/74/564428274.db2.gz SMJRYQSAUKBECH-ZDUSSCGKSA-N 0 1 377.348 3.012 10 0 GGAEMN C[C@@H](NC[C@H]1COCCO1)c1ccc(Br)cc1Br ZINC000041660427 564435794 /nfs/dbraw/zinc/43/57/94/564435794.db2.gz HQVINFRCYIEZJG-KOLCDFICSA-N 0 1 379.092 3.278 10 0 GGAEMN C[C@H](NCCCS(C)(=O)=O)c1ccc(Br)cc1Br ZINC000041660301 564435832 /nfs/dbraw/zinc/43/58/32/564435832.db2.gz WWQILYWNHWKQQY-VIFPVBQESA-N 0 1 399.148 3.297 10 0 GGAEMN C[C@H]1C[C@@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)CCN1C ZINC000123440977 564448425 /nfs/dbraw/zinc/44/84/25/564448425.db2.gz OPHMSWANQMJLNS-JSGCOSHPSA-N 0 1 379.353 3.182 10 0 GGAEMN CCOc1cc(NCc2n[nH]c(-c3ccc(Br)cc3)n2)ncn1 ZINC000123488284 564450980 /nfs/dbraw/zinc/45/09/80/564450980.db2.gz DREPTDLZFCNSMT-UHFFFAOYSA-N 0 1 375.230 3.035 10 0 GGAEMN CCOc1cc(NCc2nc(-c3ccc(Br)cc3)n[nH]2)ncn1 ZINC000123488284 564450985 /nfs/dbraw/zinc/45/09/85/564450985.db2.gz DREPTDLZFCNSMT-UHFFFAOYSA-N 0 1 375.230 3.035 10 0 GGAEMN C[C@@H](C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCOCC1 ZINC000123972096 564467518 /nfs/dbraw/zinc/46/75/18/564467518.db2.gz VWJWEAZNKMCMEI-SNVBAGLBSA-N 0 1 379.258 3.235 10 0 GGAEMN C[C@H]1CN(C2CCN(C(=O)Nc3ccccc3Br)CC2)CCO1 ZINC000124184111 564474429 /nfs/dbraw/zinc/47/44/29/564474429.db2.gz FDVYECWFAJKIHG-ZDUSSCGKSA-N 0 1 382.302 3.166 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3c(Br)cccc3C2)n[nH]1 ZINC000124359136 564479748 /nfs/dbraw/zinc/47/97/48/564479748.db2.gz GHVZDCQMAATJGI-LLVKDONJSA-N 0 1 377.286 3.180 10 0 GGAEMN Cc1cccc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)n1 ZINC000124350859 564479949 /nfs/dbraw/zinc/47/99/49/564479949.db2.gz JDOVGPKIVDKICU-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1cccc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000124350859 564479952 /nfs/dbraw/zinc/47/99/52/564479952.db2.gz JDOVGPKIVDKICU-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000124386807 564480487 /nfs/dbraw/zinc/48/04/87/564480487.db2.gz IUPVVYPNQMYLTC-CQSZACIVSA-N 0 1 396.329 3.475 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3cc4cc(Br)ccc4o3)cc21 ZINC000124481503 564483549 /nfs/dbraw/zinc/48/35/49/564483549.db2.gz LDDVAWCYZRQYJD-UHFFFAOYSA-N 0 1 399.204 3.423 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000124504597 564484487 /nfs/dbraw/zinc/48/44/87/564484487.db2.gz RPZGTIPTZASGBN-CMPLNLGQSA-N 0 1 380.261 3.479 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000124569458 564485790 /nfs/dbraw/zinc/48/57/90/564485790.db2.gz GELKHIHCKZNXQZ-MEBBXXQBSA-N 0 1 393.285 3.235 10 0 GGAEMN COC(=O)c1cc(NS(=O)(=O)c2c(F)cccc2Cl)c(F)cc1F ZINC000125418144 564513964 /nfs/dbraw/zinc/51/39/64/564513964.db2.gz NSNZVVIBEABXRJ-UHFFFAOYSA-N 0 1 379.743 3.345 10 0 GGAEMN C[C@@H](NCc1cccnc1-n1cncn1)c1ccc(Br)cc1F ZINC000125909565 564531138 /nfs/dbraw/zinc/53/11/38/564531138.db2.gz WPQQMVDWWWIPAF-LLVKDONJSA-N 0 1 376.233 3.415 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1csc(-c2ccc(Cl)cc2)n1 ZINC000048285345 564535558 /nfs/dbraw/zinc/53/55/58/564535558.db2.gz XLNCWMCHLMJLNU-UHFFFAOYSA-N 0 1 379.913 3.306 10 0 GGAEMN CN1CC[C@@H](NC(=O)c2ccc(Oc3cccc(Br)c3)nc2)C1 ZINC000048275175 564535656 /nfs/dbraw/zinc/53/56/56/564535656.db2.gz IVTYPMBWAAEHTK-CQSZACIVSA-N 0 1 376.254 3.070 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCC(Oc3ccccc3Cl)CC2)[nH]1 ZINC000126077512 564536103 /nfs/dbraw/zinc/53/61/03/564536103.db2.gz BHRDEKBRAVGXQH-UHFFFAOYSA-N 0 1 380.901 3.319 10 0 GGAEMN C[C@H](N[C@@H](C)c1cccc(Cl)c1)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000126214593 564540807 /nfs/dbraw/zinc/54/08/07/564540807.db2.gz YCGIMYRVGIUOJP-STQMWFEESA-N 0 1 380.897 3.421 10 0 GGAEMN CN(C)C[C@@H](NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000049379204 564551338 /nfs/dbraw/zinc/55/13/38/564551338.db2.gz JWDNVQPILJYAQC-MRXNPFEDSA-N 0 1 380.275 3.351 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(C1CC1)C1CC1 ZINC000126775409 564561625 /nfs/dbraw/zinc/56/16/25/564561625.db2.gz CTNSZVWFGYHVHZ-UHFFFAOYSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(C1CC1)C1CC1 ZINC000126775409 564561630 /nfs/dbraw/zinc/56/16/30/564561630.db2.gz CTNSZVWFGYHVHZ-UHFFFAOYSA-N 0 1 375.270 3.287 10 0 GGAEMN CN1CCC[C@H](NC(=O)CSCc2ccc(Br)cc2F)C1 ZINC000051377036 564564251 /nfs/dbraw/zinc/56/42/51/564564251.db2.gz JWTXMEAJHGVUGO-ZDUSSCGKSA-N 0 1 375.307 3.032 10 0 GGAEMN Cc1cc(C(=O)N2[C@H](C)CN(C)C[C@H]2C)c2ccc(Br)cc2n1 ZINC000127298118 564580081 /nfs/dbraw/zinc/58/00/81/564580081.db2.gz OXYJXTKKSSQMBW-CHWSQXEVSA-N 0 1 376.298 3.470 10 0 GGAEMN O=C(CCCCc1ccc(Br)cc1)NCCCCN1CCOCC1 ZINC000053450536 564588806 /nfs/dbraw/zinc/58/88/06/564588806.db2.gz HTVMJOVREGBKTE-UHFFFAOYSA-N 0 1 397.357 3.391 10 0 GGAEMN Cn1ccnc1[C@@H](NCCC(=O)Nc1ccc(Br)cc1)C1CC1 ZINC000127648398 564590802 /nfs/dbraw/zinc/59/08/02/564590802.db2.gz QRINUJDLXLLFBT-INIZCTEOSA-N 0 1 377.286 3.252 10 0 GGAEMN Cc1nn2c(nc(CN(C)CCCOc3ccc(Cl)cc3)cc2=O)s1 ZINC000053681847 564593133 /nfs/dbraw/zinc/59/31/33/564593133.db2.gz NMEWQMPDTGKSMI-UHFFFAOYSA-N 0 1 378.885 3.014 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C[C@@H](C)O ZINC000127810891 564597392 /nfs/dbraw/zinc/59/73/92/564597392.db2.gz CBURVFWDBTXUMF-ABAIWWIYSA-N 0 1 378.822 3.276 10 0 GGAEMN COc1ccc(Cl)cc1NC(=O)CN(C)C(=O)c1ccc(O)c(Cl)c1 ZINC000127832183 564598396 /nfs/dbraw/zinc/59/83/96/564598396.db2.gz KVVXRHXCYQQRLN-UHFFFAOYSA-N 0 1 383.231 3.418 10 0 GGAEMN C[C@H](NCCNC(=O)C1CC1)c1ccc(Br)cc1Br ZINC000128318265 564614183 /nfs/dbraw/zinc/61/41/83/564614183.db2.gz LLIMORVPDHRANF-VIFPVBQESA-N 0 1 390.119 3.388 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000128441354 564618753 /nfs/dbraw/zinc/61/87/53/564618753.db2.gz ZEDPLJCYNNPSJG-VQIMIIECSA-N 0 1 395.341 3.035 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc3ccccc32)cc1 ZINC000055548402 564623211 /nfs/dbraw/zinc/62/32/11/564623211.db2.gz IUZGDDHQPQZDGT-UHFFFAOYSA-N 0 1 375.471 3.434 10 0 GGAEMN CS(=O)(=O)c1cc(C(=O)Nc2nc3ccc(C(F)(F)F)cc3[nH]2)cs1 ZINC000128867563 564631863 /nfs/dbraw/zinc/63/18/63/564631863.db2.gz SWTDTBDYVBZRSD-UHFFFAOYSA-N 0 1 389.380 3.299 10 0 GGAEMN CCc1nc([C@@H]2CN(Cc3cc(Cl)ccc3Br)CCO2)n[nH]1 ZINC000129142979 564639905 /nfs/dbraw/zinc/63/99/05/564639905.db2.gz MNFWXXJQLSCBRV-ZDUSSCGKSA-N 0 1 385.693 3.357 10 0 GGAEMN C[C@@H](NCc1ccc(F)cc1C(F)(F)F)c1ccc(S(N)(=O)=O)cc1 ZINC000129423563 564648093 /nfs/dbraw/zinc/64/80/93/564648093.db2.gz FWZVCZVSXYSAOX-SNVBAGLBSA-N 0 1 376.375 3.343 10 0 GGAEMN CCCCn1c(=O)[nH]nc1S(=O)(=O)[C@H](C)c1cccc(Br)c1 ZINC000129526038 564651102 /nfs/dbraw/zinc/65/11/02/564651102.db2.gz UCIXPQZCAZGMCO-SNVBAGLBSA-N 0 1 388.287 3.081 10 0 GGAEMN C[C@H](Sc1nc2ccccc2s1)C(=O)NCCCCN1CCOCC1 ZINC000129504079 564651252 /nfs/dbraw/zinc/65/12/52/564651252.db2.gz HRJGMZRLRZOCKC-AWEZNQCLSA-N 0 1 379.551 3.006 10 0 GGAEMN Cc1nc([C@@H](NC(=O)c2ccc(C)nc2Br)c2ccccc2)n[nH]1 ZINC000129523984 564651429 /nfs/dbraw/zinc/65/14/29/564651429.db2.gz VDDFQYVCYBRSDP-AWEZNQCLSA-N 0 1 386.253 3.098 10 0 GGAEMN COCCN1CCCN(C(=O)CSCc2ccc(Cl)cc2Cl)CC1 ZINC000056982578 564655502 /nfs/dbraw/zinc/65/55/02/564655502.db2.gz TZZYQMFYURDRKG-UHFFFAOYSA-N 0 1 391.364 3.407 10 0 GGAEMN CC[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000129771264 564660028 /nfs/dbraw/zinc/66/00/28/564660028.db2.gz USDYWGSBYRGMEK-LLVKDONJSA-N 0 1 378.274 3.176 10 0 GGAEMN CC[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000129771264 564660033 /nfs/dbraw/zinc/66/00/33/564660033.db2.gz USDYWGSBYRGMEK-LLVKDONJSA-N 0 1 378.274 3.176 10 0 GGAEMN CCCN1C(=O)N=NC1SCCC(=O)Nc1cccc(Br)c1 ZINC000129909935 564664267 /nfs/dbraw/zinc/66/42/67/564664267.db2.gz NCZMCGMYIBIASG-UHFFFAOYSA-N 0 1 385.287 3.277 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3cccc(Br)c3)[nH]c21 ZINC000129947393 564665967 /nfs/dbraw/zinc/66/59/67/564665967.db2.gz WTYWJCAGUPPTIP-UHFFFAOYSA-N 0 1 380.267 3.112 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3cc4cc(Br)ccc4[nH]3)cc21 ZINC000130385666 564679518 /nfs/dbraw/zinc/67/95/18/564679518.db2.gz GSNQHUGWLFPBNE-UHFFFAOYSA-N 0 1 398.220 3.158 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1ccc(Br)cc1Cl ZINC000058561842 564685692 /nfs/dbraw/zinc/68/56/92/564685692.db2.gz ZMGPFFOTWFVLPK-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN Cc1c(Br)cccc1CN1CCCN(Cc2cnn(C)c2)CC1 ZINC000131848144 564725951 /nfs/dbraw/zinc/72/59/51/564725951.db2.gz SXIUVDNSMRNMQA-UHFFFAOYSA-N 0 1 377.330 3.199 10 0 GGAEMN CC(=O)c1cccc(NS(=O)(=O)c2cc(-c3noc(C)n3)sc2C)c1 ZINC000064844586 564735224 /nfs/dbraw/zinc/73/52/24/564735224.db2.gz JZHMILLRCNDUFF-UHFFFAOYSA-N 0 1 377.447 3.418 10 0 GGAEMN Cc1ccc(Cc2nc(CCNC(=O)c3ccc(Br)o3)n[nH]2)cc1 ZINC000064969359 564737701 /nfs/dbraw/zinc/73/77/01/564737701.db2.gz RZWNDBZWZMMVJI-UHFFFAOYSA-N 0 1 389.253 3.032 10 0 GGAEMN Cc1nnc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2cccc(Cl)c2)o1 ZINC000065194056 564740332 /nfs/dbraw/zinc/74/03/32/564740332.db2.gz VHJOGVFIYMONES-UHFFFAOYSA-N 0 1 380.857 3.455 10 0 GGAEMN Cn1nc(-c2csc(S(=O)(=O)Nc3ccc(Cl)cc3F)c2)ccc1=O ZINC000065128947 564740645 /nfs/dbraw/zinc/74/06/45/564740645.db2.gz LRGKGGOYLMFMEH-UHFFFAOYSA-N 0 1 399.856 3.102 10 0 GGAEMN CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)[C@H]1CCCc2[nH]ncc21 ZINC000133054109 564761828 /nfs/dbraw/zinc/76/18/28/564761828.db2.gz GEMQYUNOLDGJHK-NSHDSACASA-N 0 1 381.263 3.234 10 0 GGAEMN O=C1CCCN1C[C@@H](O)CN(Cc1ccccc1Br)C1CCCC1 ZINC000133450231 564773758 /nfs/dbraw/zinc/77/37/58/564773758.db2.gz GKNOOCGEIRZILL-QGZVFWFLSA-N 0 1 395.341 3.177 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000133547870 564777598 /nfs/dbraw/zinc/77/75/98/564777598.db2.gz INYYWXWOCAWWOR-PBHICJAKSA-N 0 1 390.281 3.192 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@H](C)NCc2cccc(Br)c2)c1 ZINC000067010475 564781546 /nfs/dbraw/zinc/78/15/46/564781546.db2.gz OZZBURXRILDIND-LBPRGKRZSA-N 0 1 383.311 3.208 10 0 GGAEMN CC(=O)NCc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)s1 ZINC000067140137 564784968 /nfs/dbraw/zinc/78/49/68/564784968.db2.gz APDJRRODOYEYNI-HNNXBMFYSA-N 0 1 377.535 3.013 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000134148235 564795606 /nfs/dbraw/zinc/79/56/06/564795606.db2.gz JPSYAKVECNBLRH-WMLDXEAASA-N 0 1 390.281 3.192 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000134148018 564795673 /nfs/dbraw/zinc/79/56/73/564795673.db2.gz JPSYAKVECNBLRH-YOEHRIQHSA-N 0 1 390.281 3.192 10 0 GGAEMN CN(c1cccnn1)C1CCN(C[C@@H](O)c2ccc(Cl)cc2Cl)CC1 ZINC000134321764 564799955 /nfs/dbraw/zinc/79/99/55/564799955.db2.gz GFUFRBKDJVBBGH-QGZVFWFLSA-N 0 1 381.307 3.418 10 0 GGAEMN CN(c1cccnn1)C1CCN(C[C@H](O)c2ccc(Cl)cc2Cl)CC1 ZINC000134321737 564800141 /nfs/dbraw/zinc/80/01/41/564800141.db2.gz GFUFRBKDJVBBGH-KRWDZBQOSA-N 0 1 381.307 3.418 10 0 GGAEMN OCC[C@@]1(CNCc2csc(-c3cccc(Br)c3)n2)CCOC1 ZINC000134426767 564802685 /nfs/dbraw/zinc/80/26/85/564802685.db2.gz DLHRWVPCBZGSLP-KRWDZBQOSA-N 0 1 397.338 3.451 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)[C@H]1COc2ccc(Br)cc21 ZINC000134703156 564812846 /nfs/dbraw/zinc/81/28/46/564812846.db2.gz VHKOADUVGBOIDJ-AWEZNQCLSA-N 0 1 385.221 3.349 10 0 GGAEMN CC(C)N(C)CC(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000068466383 564819484 /nfs/dbraw/zinc/81/94/84/564819484.db2.gz AYGJOUWZVUZFHH-UHFFFAOYSA-N 0 1 382.291 3.482 10 0 GGAEMN Cc1nn(CCS(C)(=O)=O)c(C)c1[C@H](C)N[C@H]1CCCc2sccc21 ZINC000134965656 564820526 /nfs/dbraw/zinc/82/05/26/564820526.db2.gz NWXONNBYYKNETP-LRDDRELGSA-N 0 1 381.567 3.334 10 0 GGAEMN CCOc1cccc(CCN[C@H](C(N)=O)c2ccc(Br)cc2)c1 ZINC000135134145 564823772 /nfs/dbraw/zinc/82/37/72/564823772.db2.gz IEMDPNGDRIOGFE-KRWDZBQOSA-N 0 1 377.282 3.207 10 0 GGAEMN O[C@H]1CCCC[C@H]1CNCc1ncc(Br)cc1Br ZINC000135304004 564828220 /nfs/dbraw/zinc/82/82/20/564828220.db2.gz FMJGZKYAZVBRPS-ZANVPECISA-N 0 1 378.108 3.247 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1cnc(-c2ccccc2Cl)s1 ZINC000069502347 564841209 /nfs/dbraw/zinc/84/12/09/564841209.db2.gz ZDANBFHFRMKHLB-ZDUSSCGKSA-N 0 1 379.913 3.304 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc3ncccc3c2)cc1Cl ZINC000135925078 564843099 /nfs/dbraw/zinc/84/30/99/564843099.db2.gz MHQOUSPUWTZJHV-UHFFFAOYSA-N 0 1 376.821 3.476 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2cc(F)ccc2Br)CCN1CCOC ZINC000136403289 564849798 /nfs/dbraw/zinc/84/97/98/564849798.db2.gz PSHPNVNVXOJHHL-ZDUSSCGKSA-N 0 1 388.281 3.163 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2cc(F)ccc2Br)CCN1CCOC ZINC000136403244 564850268 /nfs/dbraw/zinc/85/02/68/564850268.db2.gz PSHPNVNVXOJHHL-CYBMUJFWSA-N 0 1 388.281 3.163 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc3oc(C)nc3c2)cc1Cl ZINC000137177197 564859477 /nfs/dbraw/zinc/85/94/77/564859477.db2.gz DZCZUBWCBGTVBS-UHFFFAOYSA-N 0 1 380.809 3.377 10 0 GGAEMN C[C@@H](Cc1ccc(O)cc1)N(C)CC(=O)Nc1ccc(Br)cn1 ZINC000138357714 564865936 /nfs/dbraw/zinc/86/59/36/564865936.db2.gz HCTSGTMXOBEKSA-LBPRGKRZSA-N 0 1 378.270 3.051 10 0 GGAEMN CC[C@@H]1CCCC[N@H+]1CCNC(=O)N[C@@H](CO)c1cccc(Br)c1 ZINC000141417195 564873279 /nfs/dbraw/zinc/87/32/79/564873279.db2.gz DJAJCEARBZMTCF-SJORKVTESA-N 0 1 398.345 3.046 10 0 GGAEMN CC[C@H]1CCCC[N@H+]1CCNC(=O)N[C@@H](CO)c1cccc(Br)c1 ZINC000141417373 564873437 /nfs/dbraw/zinc/87/34/37/564873437.db2.gz DJAJCEARBZMTCF-IRXDYDNUSA-N 0 1 398.345 3.046 10 0 GGAEMN CCn1c2ccc(Br)cc2[nH]c1=NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000092104473 564875340 /nfs/dbraw/zinc/87/53/40/564875340.db2.gz ISOVJEDKSABKET-NSHDSACASA-N 0 1 388.269 3.022 10 0 GGAEMN O=C(c1ccc(I)cc1)N1CCC(c2cnc[nH]2)CC1 ZINC000144270658 564877458 /nfs/dbraw/zinc/87/74/58/564877458.db2.gz JGIGHTUXKGYPIU-UHFFFAOYSA-N 0 1 381.217 3.034 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1Cc1nc(-c2ccc(Br)cc2)c[nH]1 ZINC000092588793 564878135 /nfs/dbraw/zinc/87/81/35/564878135.db2.gz SGNUXJFIFOLQSK-CQSZACIVSA-N 0 1 377.286 3.069 10 0 GGAEMN CCC(=O)N[C@@H]1CCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000092705676 564881389 /nfs/dbraw/zinc/88/13/89/564881389.db2.gz VSQDTBGIFAMPOC-MRXNPFEDSA-N 0 1 379.298 3.216 10 0 GGAEMN O=C(C1CCN(CCOc2ccccc2Br)CC1)N1CCCC1 ZINC000093291272 564885445 /nfs/dbraw/zinc/88/54/45/564885445.db2.gz GKZHWROGYXPOBS-UHFFFAOYSA-N 0 1 381.314 3.162 10 0 GGAEMN Brc1ccccc1OCCN1CCCC[C@@H]1CN1CCOCC1 ZINC000093792336 564890058 /nfs/dbraw/zinc/89/00/58/564890058.db2.gz ASVAYPYDHXWVMV-MRXNPFEDSA-N 0 1 383.330 3.015 10 0 GGAEMN C[N@@H+](Cc1ccc(-n2cncn2)cc1)[C@@H](CO)c1cccc(Br)c1 ZINC000093815631 564890573 /nfs/dbraw/zinc/89/05/73/564890573.db2.gz GFHATDWNJSFUPX-SFHVURJKSA-N 0 1 387.281 3.195 10 0 GGAEMN COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc3c(C)[nH]nc3c2)c1 ZINC000093909311 564892580 /nfs/dbraw/zinc/89/25/80/564892580.db2.gz LJHSTFIUZUCUCU-UHFFFAOYSA-N 0 1 379.825 3.112 10 0 GGAEMN COc1ccc(CCN[C@H](C(N)=O)c2ccc(Br)cc2)c(Cl)c1 ZINC000151035506 564902388 /nfs/dbraw/zinc/90/23/88/564902388.db2.gz VTNOWCKIDQHJAO-INIZCTEOSA-N 0 1 397.700 3.470 10 0 GGAEMN C[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=S)n(C)c2=O)c1ccc(Cl)s1 ZINC000102309687 564928350 /nfs/dbraw/zinc/92/83/50/564928350.db2.gz UDECSSRIOQANFR-MRVPVSSYSA-N 0 1 379.894 3.428 10 0 GGAEMN CO[C@H](C)c1cccc(NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)c1 ZINC000102747901 564934506 /nfs/dbraw/zinc/93/45/06/564934506.db2.gz RAUVZCQLDXQMCO-SNVBAGLBSA-N 0 1 380.853 3.343 10 0 GGAEMN COCCOc1ncccc1NS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000102748410 564934547 /nfs/dbraw/zinc/93/45/47/564934547.db2.gz KAOPLJRFBAQABZ-UHFFFAOYSA-N 0 1 377.249 3.214 10 0 GGAEMN Cc1ccc(C(=O)Nc2nc(-c3ccco3)n[nH]2)cc1I ZINC000102783707 564935705 /nfs/dbraw/zinc/93/57/05/564935705.db2.gz HQPFRKOKISIGHS-UHFFFAOYSA-N 0 1 394.172 3.230 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)CCC(=O)c1cc(Cl)sc1Cl ZINC000151963326 564942459 /nfs/dbraw/zinc/94/24/59/564942459.db2.gz FJRNQMMPTSCFOF-NSHDSACASA-N 0 1 393.336 3.245 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3ccc(Br)c(C)c3)CCO2)n[nH]1 ZINC000151995773 564943455 /nfs/dbraw/zinc/94/34/55/564943455.db2.gz IWKIRQHWLHOTOJ-CYBMUJFWSA-N 0 1 394.273 3.043 10 0 GGAEMN COCc1csc(NC(=O)CSc2nc(-c3ccc(C)cc3)n[nH]2)n1 ZINC000152006064 564944291 /nfs/dbraw/zinc/94/42/91/564944291.db2.gz SQVAHRVVLAWHIY-UHFFFAOYSA-N 0 1 375.479 3.114 10 0 GGAEMN C[C@H]1CC[C@@H](C(N)=O)CN1CCOc1ccc(Cl)cc1Br ZINC000103286248 564945465 /nfs/dbraw/zinc/94/54/65/564945465.db2.gz ARJNBEPWVQJIHE-WDEREUQCSA-N 0 1 375.694 3.067 10 0 GGAEMN Cc1nnc(NC(=O)c2cccnc2Oc2ccc(F)cc2Br)[nH]1 ZINC000103256959 564945474 /nfs/dbraw/zinc/94/54/74/564945474.db2.gz LYIBPRREUCQJOC-UHFFFAOYSA-N 0 1 392.188 3.454 10 0 GGAEMN Cc1n[nH]c(NC(=O)c2cccnc2Oc2ccc(F)cc2Br)n1 ZINC000103256959 564945477 /nfs/dbraw/zinc/94/54/77/564945477.db2.gz LYIBPRREUCQJOC-UHFFFAOYSA-N 0 1 392.188 3.454 10 0 GGAEMN C[C@H]1CC[C@H](C(N)=O)CN1CCOc1ccc(Cl)cc1Br ZINC000103286242 564945721 /nfs/dbraw/zinc/94/57/21/564945721.db2.gz ARJNBEPWVQJIHE-QWRGUYRKSA-N 0 1 375.694 3.067 10 0 GGAEMN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000103283406 564945787 /nfs/dbraw/zinc/94/57/87/564945787.db2.gz QXWVYWIDPQXQOP-YPMHNXCESA-N 0 1 378.270 3.190 10 0 GGAEMN O[C@H](COc1cc(Cl)ccc1Cl)CN1CC[C@@H](Oc2cccnc2)C1 ZINC000152220342 564951278 /nfs/dbraw/zinc/95/12/78/564951278.db2.gz NVJRGLSHVPSAPG-GOEBONIOSA-N 0 1 383.275 3.281 10 0 GGAEMN O[C@@H](COc1c(Cl)cccc1Cl)CN1CC[C@H](Oc2cccnc2)C1 ZINC000152299990 564953645 /nfs/dbraw/zinc/95/36/45/564953645.db2.gz VKVSTWYCGJAFPR-HIFRSBDPSA-N 0 1 383.275 3.281 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)N1CCN2CCCC[C@@H]2C1 ZINC000104971999 564961624 /nfs/dbraw/zinc/96/16/24/564961624.db2.gz DDQJSYOHRJWUPY-CQSZACIVSA-N 0 1 399.276 3.302 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)N1CCN2CCCC[C@H]2C1 ZINC000104972001 564962033 /nfs/dbraw/zinc/96/20/33/564962033.db2.gz DDQJSYOHRJWUPY-AWEZNQCLSA-N 0 1 399.276 3.302 10 0 GGAEMN NC(=O)[C@@H](NC1CCN(c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000105401697 564967048 /nfs/dbraw/zinc/96/70/48/564967048.db2.gz KOLZOEJFIFIOBB-SFHVURJKSA-N 0 1 388.309 3.234 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NC[C@@H]1CC=CCC1 ZINC000105570310 564968863 /nfs/dbraw/zinc/96/88/63/564968863.db2.gz IEEMKTCZZBSCTO-GFCCVEGCSA-N 0 1 390.285 3.390 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NC[C@@H]1CC=CCC1 ZINC000105570310 564968866 /nfs/dbraw/zinc/96/88/66/564968866.db2.gz IEEMKTCZZBSCTO-GFCCVEGCSA-N 0 1 390.285 3.390 10 0 GGAEMN CCN1CCC[C@H](NC(=O)C(=O)Nc2cc(Cl)ccc2SC(C)C)C1 ZINC000105534228 564969004 /nfs/dbraw/zinc/96/90/04/564969004.db2.gz HBFJSQROMOKXTO-AWEZNQCLSA-N 0 1 383.945 3.380 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@@]3(C)CC3(Cl)Cl)cc2)C[C@@H](C)O1 ZINC000105722810 564973244 /nfs/dbraw/zinc/97/32/44/564973244.db2.gz XWCNEOOMLOPCRM-HBUWYVDXSA-N 0 1 385.335 3.496 10 0 GGAEMN CN(Cc1ccc(Br)cc1F)[C@@H]1CCCN(c2cccnn2)C1 ZINC000106079488 564976899 /nfs/dbraw/zinc/97/68/99/564976899.db2.gz AEMZNYJVGNSXJE-OAHLLOKOSA-N 0 1 379.277 3.479 10 0 GGAEMN CN(Cc1cc(Br)ccc1F)[C@H]1CCCN(c2cccnn2)C1 ZINC000106075461 564977242 /nfs/dbraw/zinc/97/72/42/564977242.db2.gz RIODJACVLJRYJT-HNNXBMFYSA-N 0 1 379.277 3.479 10 0 GGAEMN COc1cc(OC)c(NC(=O)[C@@H]2CCCc3[nH]ncc32)cc1Br ZINC000152938722 564978005 /nfs/dbraw/zinc/97/80/05/564978005.db2.gz IWTHLFLWMOPXJV-SECBINFHSA-N 0 1 380.242 3.248 10 0 GGAEMN C[C@@H](O)CN1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)C[C@@H]1C ZINC000106098488 564978536 /nfs/dbraw/zinc/97/85/36/564978536.db2.gz UEAXFVJBBWLNKU-LSDHHAIUSA-N 0 1 379.957 3.274 10 0 GGAEMN O=C(CN(C[C@@H]1CCCO1)C1CCCC1)Nc1ccc(Br)cn1 ZINC000152969039 564978798 /nfs/dbraw/zinc/97/87/98/564978798.db2.gz VZIRRBNISQPINR-HNNXBMFYSA-N 0 1 382.302 3.206 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Cl)c(Cl)c1)N1CCC[C@H](Cn2cncn2)C1 ZINC000106173464 564979087 /nfs/dbraw/zinc/97/90/87/564979087.db2.gz RFHRQSYBPCNODX-OLZOCXBDSA-N 0 1 382.295 3.324 10 0 GGAEMN CCn1cc(CN2CCCN(Cc3ccccc3Br)CC2)cn1 ZINC000106158409 564979382 /nfs/dbraw/zinc/97/93/82/564979382.db2.gz FFZMVMVIKGDAEA-UHFFFAOYSA-N 0 1 377.330 3.373 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(Br)c1)N1CCC(Cn2cccn2)CC1 ZINC000106184397 564980537 /nfs/dbraw/zinc/98/05/37/564980537.db2.gz KSBSYLQUQYLBFP-CQSZACIVSA-N 0 1 391.313 3.385 10 0 GGAEMN CC(C)(C)OC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000153292095 564991302 /nfs/dbraw/zinc/99/13/02/564991302.db2.gz LRVKIKRXAYGMOH-INIZCTEOSA-N 0 1 389.367 3.330 10 0 GGAEMN CN(C)[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Br)c(F)c1 ZINC000106912431 564991477 /nfs/dbraw/zinc/99/14/77/564991477.db2.gz AIOAUKFNPHJLPE-KRWDZBQOSA-N 0 1 379.273 3.377 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cc(Br)cc3cccnc32)[nH]n1 ZINC000534789179 564996663 /nfs/dbraw/zinc/99/66/63/564996663.db2.gz LOBSGPDSMLETMM-UHFFFAOYSA-N 0 1 397.236 3.373 10 0 GGAEMN O=S(=O)(c1ccc(Br)s1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000107708520 565002607 /nfs/dbraw/zinc/00/26/07/565002607.db2.gz DSNRZCVJDSZLFV-GFCCVEGCSA-N 0 1 393.372 3.150 10 0 GGAEMN COC(=O)[C@H]1CCCN(Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000153930671 565017534 /nfs/dbraw/zinc/01/75/34/565017534.db2.gz ARJXPKHTKWRRKI-AWEZNQCLSA-N 0 1 390.281 3.291 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)Nc3ccc(Br)cc3C)CCO2)n[nH]1 ZINC000154035752 565022819 /nfs/dbraw/zinc/02/28/19/565022819.db2.gz ZGKBEHZKNBAILM-ZDUSSCGKSA-N 0 1 394.273 3.043 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2sccc2Br)c(F)c1 ZINC000110590199 565042789 /nfs/dbraw/zinc/04/27/89/565042789.db2.gz BWBICVKMGIXOGK-UHFFFAOYSA-N 0 1 394.243 3.237 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)CCN1C ZINC000154698183 565049624 /nfs/dbraw/zinc/04/96/24/565049624.db2.gz ODDTWDNRIZBJDX-PWSUYJOCSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Br)c(Cl)c2)CCN1C ZINC000154696801 565049736 /nfs/dbraw/zinc/04/97/36/565049736.db2.gz MUABOXVIZRWDLW-WDEREUQCSA-N 0 1 395.750 3.206 10 0 GGAEMN O=S1(=O)NC(CN2CC[C@@H](c3ccc(Cl)cc3)C2)=Nc2ccccc21 ZINC000111305920 565051707 /nfs/dbraw/zinc/05/17/07/565051707.db2.gz RSSLPQKVRJZLOA-CQSZACIVSA-N 0 1 375.881 3.151 10 0 GGAEMN CS(=O)(=O)c1ccc([C@@H](O)CN2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000111305513 565051966 /nfs/dbraw/zinc/05/19/66/565051966.db2.gz VFTLUMGSTSRRBY-LPHOPBHVSA-N 0 1 379.909 3.266 10 0 GGAEMN CCCN(C[C@@H](O)CN1CCCC1=O)[C@@H](C)c1ccccc1Br ZINC000111684288 565056895 /nfs/dbraw/zinc/05/68/95/565056895.db2.gz DEQVANPCKBZXJA-LSDHHAIUSA-N 0 1 383.330 3.205 10 0 GGAEMN COc1cccc(Br)c1OC[C@@H](O)CN1CCc2ccccc2C1 ZINC000154954306 565058188 /nfs/dbraw/zinc/05/81/88/565058188.db2.gz XUJNBVDLEBYASV-INIZCTEOSA-N 0 1 392.293 3.256 10 0 GGAEMN C[C@H](CSc1nc(-c2ccccc2Br)n[nH]1)CS(C)(=O)=O ZINC000154968844 565058566 /nfs/dbraw/zinc/05/85/66/565058566.db2.gz ARXGPOJRIKQFTK-SECBINFHSA-N 0 1 390.328 3.007 10 0 GGAEMN CSc1ccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)o1 ZINC000112283916 565061996 /nfs/dbraw/zinc/06/19/96/565061996.db2.gz SVOQMABYSFXQSX-UHFFFAOYSA-N 0 1 393.266 3.479 10 0 GGAEMN CSc1ccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)o1 ZINC000112283916 565061997 /nfs/dbraw/zinc/06/19/97/565061997.db2.gz SVOQMABYSFXQSX-UHFFFAOYSA-N 0 1 393.266 3.479 10 0 GGAEMN C[C@@H](c1ccc(Br)cc1)N1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000112337937 565062724 /nfs/dbraw/zinc/06/27/24/565062724.db2.gz JYSAAVGLXWGPJP-HOCLYGCPSA-N 0 1 381.314 3.081 10 0 GGAEMN C[C@@H](c1ccc(Br)cc1)N1CCCN(Cc2cnn(C)c2)CC1 ZINC000112345511 565062775 /nfs/dbraw/zinc/06/27/75/565062775.db2.gz ITWMVGUHMDQHNB-HNNXBMFYSA-N 0 1 377.330 3.452 10 0 GGAEMN Cc1cccc2nc(CNC(=O)[C@H]3COc4ccc(Br)cc43)[nH]c21 ZINC000155201166 565064176 /nfs/dbraw/zinc/06/41/76/565064176.db2.gz FKJCGQBVXVTNJW-ZDUSSCGKSA-N 0 1 386.249 3.426 10 0 GGAEMN CCn1cc(CN2CCCN(Cc3cccc(Br)c3)CC2)cn1 ZINC000112731347 565065964 /nfs/dbraw/zinc/06/59/64/565065964.db2.gz JGMMGWABTMDBMA-UHFFFAOYSA-N 0 1 377.330 3.373 10 0 GGAEMN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2coc(Br)c2)CC1 ZINC000155582295 565069314 /nfs/dbraw/zinc/06/93/14/565069314.db2.gz RDXNIQPDXHQGDP-LBPRGKRZSA-N 0 1 378.270 3.393 10 0 GGAEMN C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000113305423 565069403 /nfs/dbraw/zinc/06/94/03/565069403.db2.gz HBDLBULIPSKRTD-ZYHUDNBSSA-N 0 1 382.835 3.216 10 0 GGAEMN C[C@H](c1ccncc1)N1CCC(NC(=O)c2coc(Br)c2)CC1 ZINC000155582407 565069536 /nfs/dbraw/zinc/06/95/36/565069536.db2.gz RDXNIQPDXHQGDP-GFCCVEGCSA-N 0 1 378.270 3.393 10 0 GGAEMN Cc1cc(S(C)(=O)=O)ccc1NS(=O)(=O)c1ccccc1C(F)(F)F ZINC000114313411 565073633 /nfs/dbraw/zinc/07/36/33/565073633.db2.gz KHASDVNDCAOGCU-UHFFFAOYSA-N 0 1 393.408 3.218 10 0 GGAEMN COc1cccc([C@H](CNC(=O)Cc2ccc(Br)s2)N(C)C)c1 ZINC000114315168 565073668 /nfs/dbraw/zinc/07/36/68/565073668.db2.gz RVPVFLFSIVLSQL-HNNXBMFYSA-N 0 1 397.338 3.481 10 0 GGAEMN CC[C@@H]1C[C@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCO1 ZINC000183597493 565080713 /nfs/dbraw/zinc/08/07/13/565080713.db2.gz JZOMQWWDBSHHSR-TZMCWYRMSA-N 0 1 393.285 3.056 10 0 GGAEMN CC[C@@H]1C[C@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCO1 ZINC000183597493 565080719 /nfs/dbraw/zinc/08/07/19/565080719.db2.gz JZOMQWWDBSHHSR-TZMCWYRMSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@@H](CNC(=O)c1cnccc1N(C)C)Oc1ccccc1Br ZINC000183599705 565080892 /nfs/dbraw/zinc/08/08/92/565080892.db2.gz FIUVBXDLIGIXEY-LBPRGKRZSA-N 0 1 378.270 3.107 10 0 GGAEMN Cn1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)c(-c2ccccn2)n1 ZINC000369225521 565082070 /nfs/dbraw/zinc/08/20/70/565082070.db2.gz PSLSWYOWYCJIIV-UHFFFAOYSA-N 0 1 397.236 3.373 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc3c(c2)CCN3C(N)=O)c(Cl)cc1F ZINC000156395201 565084424 /nfs/dbraw/zinc/08/44/24/565084424.db2.gz PJAYNBJXFFTHTP-UHFFFAOYSA-N 0 1 383.832 3.030 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 ZINC000291899024 565085057 /nfs/dbraw/zinc/08/50/57/565085057.db2.gz PTSIEHJUQFFPEG-SNVBAGLBSA-N 0 1 397.551 3.323 10 0 GGAEMN CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(Cc2c(C)nn(C)c2Cl)C1 ZINC000266583560 565085547 /nfs/dbraw/zinc/08/55/47/565085547.db2.gz IRXGSJJANWZMAN-GFCCVEGCSA-N 0 1 380.842 3.005 10 0 GGAEMN C[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CC2(CCOCC2)O1 ZINC000369313328 565086853 /nfs/dbraw/zinc/08/68/53/565086853.db2.gz ZGDMOEDRDGYOGR-LBPRGKRZSA-N 0 1 380.286 3.095 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)Cc2cc(Br)cs2)[nH]1 ZINC000266695897 565088829 /nfs/dbraw/zinc/08/88/29/565088829.db2.gz DUEOSVWUTHECQK-UHFFFAOYSA-N 0 1 375.317 3.078 10 0 GGAEMN C[C@@H](CN[C@@H](c1ccco1)c1ccc(Br)cc1)N1CCOCC1 ZINC000183692472 565088936 /nfs/dbraw/zinc/08/89/36/565088936.db2.gz UIIILEDAMJWQAZ-KBXCAEBGSA-N 0 1 379.298 3.442 10 0 GGAEMN CCN(Cc1cccc(Br)c1)C(=O)CCSc1nnc(C)[nH]1 ZINC000266801961 565091473 /nfs/dbraw/zinc/09/14/73/565091473.db2.gz HCZFZTVDPXEJGQ-UHFFFAOYSA-N 0 1 383.315 3.407 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H]2CCc3cc(Br)ccc32)[nH]1 ZINC000266838289 565092612 /nfs/dbraw/zinc/09/26/12/565092612.db2.gz LURIOQKAPNUEHI-CYBMUJFWSA-N 0 1 381.299 3.162 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3c(Br)ccc(F)c3C2)n[nH]1 ZINC000183767669 565094393 /nfs/dbraw/zinc/09/43/93/565094393.db2.gz FTZQTESKZUOPIJ-SNVBAGLBSA-N 0 1 395.276 3.319 10 0 GGAEMN COC(=O)c1ccc(CN[C@H](CO)c2cccc(Br)c2)cc1F ZINC000183912480 565102735 /nfs/dbraw/zinc/10/27/35/565102735.db2.gz RLGLUQPFIQJOKD-MRXNPFEDSA-N 0 1 382.229 3.198 10 0 GGAEMN Cc1cnc(C(C)(C)NC[C@@H](O)COc2cccc(Br)c2)s1 ZINC000183943214 565105383 /nfs/dbraw/zinc/10/53/83/565105383.db2.gz UTAGEPXBZSUMOI-CYBMUJFWSA-N 0 1 385.327 3.479 10 0 GGAEMN O=C(CN[C@H](c1nnc[nH]1)c1ccccc1)Nc1cccc(Cl)c1Cl ZINC000370071530 565126286 /nfs/dbraw/zinc/12/62/86/565126286.db2.gz HLQKDLUDXFXTOT-INIZCTEOSA-N 0 1 376.247 3.429 10 0 GGAEMN O=C(NCCOc1cccc(Br)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000370226089 565134371 /nfs/dbraw/zinc/13/43/71/565134371.db2.gz BVPJDEBMJYHLRM-UHFFFAOYSA-N 0 1 393.285 3.140 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)Cc3csc4ccc(Cl)cc34)CCO2)n[nH]1 ZINC000157582358 565137399 /nfs/dbraw/zinc/13/73/99/565137399.db2.gz XAYOIQCAMAKYAO-AWEZNQCLSA-N 0 1 376.869 3.124 10 0 GGAEMN COc1cc(C(=O)Nc2nc(C3CCC3)n[nH]2)cc(OC)c1Br ZINC000184575415 565145391 /nfs/dbraw/zinc/14/53/91/565145391.db2.gz MWNAORWXFGGGFN-UHFFFAOYSA-N 0 1 381.230 3.104 10 0 GGAEMN COc1cc(C(=O)Nc2n[nH]c(C3CCC3)n2)cc(OC)c1Br ZINC000184575415 565145395 /nfs/dbraw/zinc/14/53/95/565145395.db2.gz MWNAORWXFGGGFN-UHFFFAOYSA-N 0 1 381.230 3.104 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCc3ccc(C(C)=O)cc3CC2)c1Br ZINC000370507438 565146847 /nfs/dbraw/zinc/14/68/47/565146847.db2.gz HWFOPPJTBJZSSH-UHFFFAOYSA-N 0 1 390.281 3.178 10 0 GGAEMN Cc1ccc(I)cc1C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000370559820 565149337 /nfs/dbraw/zinc/14/93/37/565149337.db2.gz ZLYPVUJPLLXYJJ-UHFFFAOYSA-N 0 1 395.244 3.343 10 0 GGAEMN COc1ccsc1S(=O)(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@H]21 ZINC000268388409 565149694 /nfs/dbraw/zinc/14/96/94/565149694.db2.gz LPAALUAIXFCKFG-GOEBONIOSA-N 0 1 378.519 3.062 10 0 GGAEMN COc1ccsc1S(=O)(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@H]21 ZINC000268388404 565149747 /nfs/dbraw/zinc/14/97/47/565149747.db2.gz LPAALUAIXFCKFG-GDBMZVCRSA-N 0 1 378.519 3.062 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)N[C@@H]2CCc3nc[nH]c3C2)cc1Br ZINC000370672129 565155518 /nfs/dbraw/zinc/15/55/18/565155518.db2.gz BOAHKJFUOOTNBT-CMPLNLGQSA-N 0 1 393.285 3.099 10 0 GGAEMN O=C(Nc1ccccc1Br)C1CCN(C[C@H](O)C(F)(F)F)CC1 ZINC000158207726 565160283 /nfs/dbraw/zinc/16/02/83/565160283.db2.gz KBICIBRYVQNNTQ-ZDUSSCGKSA-N 0 1 395.219 3.023 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000370814442 565162080 /nfs/dbraw/zinc/16/20/80/565162080.db2.gz KQWJGXZCUGWTCA-LBPRGKRZSA-N 0 1 376.247 3.190 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC2(c3cccc(Br)c3)CC2)n[nH]1 ZINC000158303212 565164798 /nfs/dbraw/zinc/16/47/98/565164798.db2.gz DCFBNFBLMPKVQN-LLVKDONJSA-N 0 1 377.286 3.400 10 0 GGAEMN CCCCNC(=O)C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000184966335 565168712 /nfs/dbraw/zinc/16/87/12/565168712.db2.gz WFVJIMUXELCPBD-UHFFFAOYSA-N 0 1 393.329 3.454 10 0 GGAEMN Brc1ccc2nc(CN3CCC(OC[C@@H]4CCCO4)CC3)[nH]c2c1 ZINC000184980056 565168734 /nfs/dbraw/zinc/16/87/34/565168734.db2.gz CMKDKNHUQQPCIF-HNNXBMFYSA-N 0 1 394.313 3.485 10 0 GGAEMN COc1ccc([C@H](CO)N(C)Cc2nc3ccc(Br)cc3[nH]2)cc1 ZINC000184970807 565169152 /nfs/dbraw/zinc/16/91/52/565169152.db2.gz IRMBWXORRNCHCB-KRWDZBQOSA-N 0 1 390.281 3.499 10 0 GGAEMN Brc1ccc2nc(CN3CCO[C@H](c4nccs4)C3)[nH]c2c1 ZINC000184969897 565169614 /nfs/dbraw/zinc/16/96/14/565169614.db2.gz JFDRNFHEHBSOGB-ZDUSSCGKSA-N 0 1 379.283 3.355 10 0 GGAEMN CCO[C@@H]1C[C@@H](O)C12CCN(Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000184974154 565169681 /nfs/dbraw/zinc/16/96/81/565169681.db2.gz VNTZVAFLDONMOC-HZPDHXFCSA-N 0 1 394.313 3.077 10 0 GGAEMN COc1ccc(Br)cc1CN(C)C(=O)N[C@H](C)Cc1cc(C)[nH]n1 ZINC000268955794 565172730 /nfs/dbraw/zinc/17/27/30/565172730.db2.gz ADBKVLBLRWQSMC-LLVKDONJSA-N 0 1 395.301 3.262 10 0 GGAEMN Oc1cccc(N2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)c1 ZINC000158600059 565174658 /nfs/dbraw/zinc/17/46/58/565174658.db2.gz FHPZOQQPYNLQDJ-UHFFFAOYSA-N 0 1 387.281 3.353 10 0 GGAEMN Fc1cc(CNCc2cccc(Br)c2)cnc1N1CCOCC1 ZINC000185079146 565176341 /nfs/dbraw/zinc/17/63/41/565176341.db2.gz SOATWMICBBNMNS-UHFFFAOYSA-N 0 1 380.261 3.110 10 0 GGAEMN Fc1cc(CNCc2ccc(Br)s2)cnc1N1CCOCC1 ZINC000185076864 565176483 /nfs/dbraw/zinc/17/64/83/565176483.db2.gz YLUULWWBLARZOE-UHFFFAOYSA-N 0 1 386.290 3.171 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N(C)CCOc2ccc(Br)cc2)n[nH]1 ZINC000269041294 565176803 /nfs/dbraw/zinc/17/68/03/565176803.db2.gz WVPJBFIAGXHVBM-LBPRGKRZSA-N 0 1 395.301 3.132 10 0 GGAEMN CC[C@@H](NCCCS(=O)(=O)c1ccc(NC(C)=O)cc1)c1nccs1 ZINC000185107943 565178422 /nfs/dbraw/zinc/17/84/22/565178422.db2.gz PYARRTDSSBVAKY-MRXNPFEDSA-N 0 1 381.523 3.006 10 0 GGAEMN CCCn1cc(CN[C@@H]2CCN(c3ccc(Br)c(C)c3)C2=O)cn1 ZINC000185189414 565185271 /nfs/dbraw/zinc/18/52/71/565185271.db2.gz UEZCSZMPWAJSNO-QGZVFWFLSA-N 0 1 391.313 3.259 10 0 GGAEMN CCCn1cc(CN[C@H]2CCN(c3ccc(Br)c(C)c3)C2=O)cn1 ZINC000185189432 565185307 /nfs/dbraw/zinc/18/53/07/565185307.db2.gz UEZCSZMPWAJSNO-KRWDZBQOSA-N 0 1 391.313 3.259 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H]1CCOC2(CCSCC2)C1)c1cccs1 ZINC000269381883 565188532 /nfs/dbraw/zinc/18/85/32/565188532.db2.gz VKTJHIZILWPVOE-LSDHHAIUSA-N 0 1 383.583 3.095 10 0 GGAEMN C[C@@H]1[C@@H](C)CN1C(=O)c1c[nH]c2ccc(I)cc2c1=O ZINC000293901712 565189614 /nfs/dbraw/zinc/18/96/14/565189614.db2.gz CAKMEYAWRMWICP-DTWKUNHWSA-N 0 1 382.201 3.025 10 0 GGAEMN C[C@H]1CN(C(=O)c2c[nH]c3ccc(I)cc3c2=O)[C@H]1C ZINC000293901717 565190020 /nfs/dbraw/zinc/19/00/20/565190020.db2.gz CAKMEYAWRMWICP-IUCAKERBSA-N 0 1 382.201 3.025 10 0 GGAEMN COCc1c(Br)cccc1NC(=O)N[C@H](C)Cc1cc(C)[nH]n1 ZINC000159020842 565191906 /nfs/dbraw/zinc/19/19/06/565191906.db2.gz MROHFONSOOQOMJ-SNVBAGLBSA-N 0 1 381.274 3.380 10 0 GGAEMN O=C(CCOc1ccc(Cl)cc1Br)N[C@H]1CCc2nc[nH]c2C1 ZINC000371443583 565193619 /nfs/dbraw/zinc/19/36/19/565193619.db2.gz RJWAUQFYEFFSJI-NSHDSACASA-N 0 1 398.688 3.268 10 0 GGAEMN CCn1cnnc1[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000159129353 565195643 /nfs/dbraw/zinc/19/56/43/565195643.db2.gz PTFFTVYYYKFGTQ-GFCCVEGCSA-N 0 1 389.301 3.316 10 0 GGAEMN CC(C)n1cc(Br)cc1C(=O)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000371561461 565199710 /nfs/dbraw/zinc/19/97/10/565199710.db2.gz IYKVOUZGFGZVLM-HNNXBMFYSA-N 0 1 388.269 3.469 10 0 GGAEMN FC(F)(F)Cn1nnnc1SCc1nc2ccc(Br)cc2[nH]1 ZINC000185539673 565206676 /nfs/dbraw/zinc/20/66/76/565206676.db2.gz ZVDOBACHKJUBLT-UHFFFAOYSA-N 0 1 393.192 3.167 10 0 GGAEMN O=c1onc(-c2cccs2)n1Cc1nc2ccc(Br)cc2[nH]1 ZINC000185532863 565206801 /nfs/dbraw/zinc/20/68/01/565206801.db2.gz VMFAMYUJWKZJGS-UHFFFAOYSA-N 0 1 377.223 3.252 10 0 GGAEMN O=C(Cc1cc(F)ccc1Br)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000371840445 565212087 /nfs/dbraw/zinc/21/20/87/565212087.db2.gz HZWUNJUVGVUYKK-INIZCTEOSA-N 0 1 389.228 3.155 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccccc2C[S@](C)=O)c(Cl)cc1F ZINC000185653934 565213950 /nfs/dbraw/zinc/21/39/50/565213950.db2.gz DSVNGKKDLJVUPP-QFIPXVFZSA-N 0 1 375.874 3.467 10 0 GGAEMN COC(=O)c1c(C)oc(C)c1S(=O)(=O)N[C@@H](C1CCCC1)C(F)(F)F ZINC000185807838 565222368 /nfs/dbraw/zinc/22/23/68/565222368.db2.gz YLIGENKZKQFYIA-ZDUSSCGKSA-N 0 1 383.388 3.082 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](C2CCOCC2)C1 ZINC000372206326 565225807 /nfs/dbraw/zinc/22/58/07/565225807.db2.gz OVGXALWHXQAMOF-LBPRGKRZSA-N 0 1 378.270 3.214 10 0 GGAEMN NC(=O)[C@@H](Cc1ccc(Cl)cc1)NCc1cc(F)cc(Br)c1 ZINC000185900627 565227228 /nfs/dbraw/zinc/22/72/28/565227228.db2.gz WRTCIKBOAWBYAV-OAHLLOKOSA-N 0 1 385.664 3.428 10 0 GGAEMN NC(=O)[C@H](Cc1ccc(Cl)cc1)NCc1cc(F)cc(Br)c1 ZINC000185900605 565227338 /nfs/dbraw/zinc/22/73/38/565227338.db2.gz WRTCIKBOAWBYAV-HNNXBMFYSA-N 0 1 385.664 3.428 10 0 GGAEMN Cc1nn(C)c(C)c1NS(=O)(=O)c1c(Cl)cc(F)cc1Br ZINC000271027640 565236484 /nfs/dbraw/zinc/23/64/84/565236484.db2.gz HLDDQVPRBPRPMG-UHFFFAOYSA-N 0 1 396.669 3.393 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2cc3cc(Br)ccc3[nH]2)[nH]1 ZINC000186052995 565237395 /nfs/dbraw/zinc/23/73/95/565237395.db2.gz AONLPBASETVYJH-UHFFFAOYSA-N 0 1 394.298 3.156 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)N(C)Cc1cc(Br)cn1C)C2 ZINC000372444876 565238814 /nfs/dbraw/zinc/23/88/14/565238814.db2.gz CHZMVWUUQYZCIJ-LBPRGKRZSA-N 0 1 393.329 3.398 10 0 GGAEMN O=S(=O)(N[C@H](c1nnc[nH]1)c1ccccc1)c1c(Cl)cccc1Cl ZINC000372602217 565246717 /nfs/dbraw/zinc/24/67/17/565246717.db2.gz VXVXBAAXYNULFE-ZDUSSCGKSA-N 0 1 383.260 3.179 10 0 GGAEMN O=C(NCc1cc(Br)cs1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000372614687 565248003 /nfs/dbraw/zinc/24/80/03/565248003.db2.gz YBLPGQQQHBSZOJ-ZDUSSCGKSA-N 0 1 392.282 3.218 10 0 GGAEMN O=S1(=O)CC[C@@H](N[C@H]2CCN(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000186238808 565248263 /nfs/dbraw/zinc/24/82/63/565248263.db2.gz DXLRKXUQPNDMSO-MAUKXSAKSA-N 0 1 376.909 3.427 10 0 GGAEMN O=S1(=O)CC[C@H](N[C@@H]2CCN(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000186238791 565248402 /nfs/dbraw/zinc/24/84/02/565248402.db2.gz DXLRKXUQPNDMSO-QAPCUYQASA-N 0 1 376.909 3.427 10 0 GGAEMN O=S(=O)(C[C@@H]1CCCC1(F)F)NC[C@H](c1cccs1)N1CCCC1 ZINC000295148524 565248467 /nfs/dbraw/zinc/24/84/67/565248467.db2.gz DZJZFZIMNNDZLB-UONOGXRCSA-N 0 1 378.510 3.240 10 0 GGAEMN O=S(=O)(C[C@H]1CCCC1(F)F)NC[C@@H](c1cccs1)N1CCCC1 ZINC000295148522 565248541 /nfs/dbraw/zinc/24/85/41/565248541.db2.gz DZJZFZIMNNDZLB-KGLIPLIRSA-N 0 1 378.510 3.240 10 0 GGAEMN CCNC(=O)C(C)(C)CN[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186348395 565256973 /nfs/dbraw/zinc/25/69/73/565256973.db2.gz JDVUZDHEAAPALT-MRXNPFEDSA-N 0 1 391.313 3.080 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCc2c(F)ccc(Br)c2C1 ZINC000295409905 565264787 /nfs/dbraw/zinc/26/47/87/565264787.db2.gz BTUSJNUEPWZKHW-NSHDSACASA-N 0 1 378.245 3.316 10 0 GGAEMN CC(C)c1nc(CNC(=O)c2cc(F)c(Br)cc2Cl)n[nH]1 ZINC000295436852 565265748 /nfs/dbraw/zinc/26/57/48/565265748.db2.gz NHWOASYGXZLPJN-UHFFFAOYSA-N 0 1 375.629 3.413 10 0 GGAEMN CN1CCC[C@H](NC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)C1 ZINC000617915795 565267610 /nfs/dbraw/zinc/26/76/10/565267610.db2.gz XCRARHCYNPKJNY-ZDUSSCGKSA-N 0 1 381.502 3.185 10 0 GGAEMN C[C@@H]1CN(c2ccc(CNCc3cncc(Br)c3)cn2)C[C@H](C)O1 ZINC000186590390 565270663 /nfs/dbraw/zinc/27/06/63/565270663.db2.gz GRHSRFQIPIGOBX-OKILXGFUSA-N 0 1 391.313 3.143 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)CCCc2cc(Cl)sc2Cl)CC1 ZINC000186622139 565273101 /nfs/dbraw/zinc/27/31/01/565273101.db2.gz BVLPYVHJORMIPW-UHFFFAOYSA-N 0 1 393.336 3.385 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)CC1 ZINC000186622188 565273547 /nfs/dbraw/zinc/27/35/47/565273547.db2.gz UKBZBBYRWGGZDH-HUUCEWRRSA-N 0 1 385.291 3.104 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)/C=C/c2c(Cl)cccc2Cl)CC1 ZINC000186632052 565273614 /nfs/dbraw/zinc/27/36/14/565273614.db2.gz GISKEWHYYUVIOE-VOTSOKGWSA-N 0 1 385.291 3.404 10 0 GGAEMN Brc1ccc2nc(CN3CCC(Oc4cnccn4)CC3)[nH]c2c1 ZINC000373279276 565277863 /nfs/dbraw/zinc/27/78/63/565277863.db2.gz SBAWTZHIRBUGBS-UHFFFAOYSA-N 0 1 388.269 3.159 10 0 GGAEMN Cc1cc(NC(=O)N[C@H](c2nnc[nH]2)c2ccccc2)cnc1Br ZINC000373339969 565280630 /nfs/dbraw/zinc/28/06/30/565280630.db2.gz NSOWGAHOINQQID-ZDUSSCGKSA-N 0 1 387.241 3.182 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@@H]1CCCC1=O ZINC000272218640 565281794 /nfs/dbraw/zinc/28/17/94/565281794.db2.gz SUBODPDLTUTCFW-SMDDNHRTSA-N 0 1 376.254 3.299 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cc(Br)ccc2OC)ccc1F ZINC000186749347 565283065 /nfs/dbraw/zinc/28/30/65/565283065.db2.gz QCHGKUNOKOQDJS-UHFFFAOYSA-N 0 1 390.230 3.406 10 0 GGAEMN Cc1n[nH]c(C)c1[C@H]1COCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000373458477 565286040 /nfs/dbraw/zinc/28/60/40/565286040.db2.gz GVPVJLBWDRLARZ-OAHLLOKOSA-N 0 1 390.285 3.239 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2ccn(-c3cccc(Br)c3)n2)n[nH]1 ZINC000161676881 565289806 /nfs/dbraw/zinc/28/98/06/565289806.db2.gz HIAXVSGNVGIMDH-NSHDSACASA-N 0 1 388.269 3.027 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2[nH]nc(-c3ccccc3)c2Br)n[nH]1 ZINC000161795631 565294329 /nfs/dbraw/zinc/29/43/29/565294329.db2.gz JNUBOALCIZSIGP-SNVBAGLBSA-N 0 1 388.269 3.232 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Cn2c(C)c(Br)c3ccccc32)n[nH]1 ZINC000161855239 565295118 /nfs/dbraw/zinc/29/51/18/565295118.db2.gz FIIHGQWAPCEHEI-LLVKDONJSA-N 0 1 389.297 3.491 10 0 GGAEMN CC(C)N(CC(F)F)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000161882579 565296906 /nfs/dbraw/zinc/29/69/06/565296906.db2.gz PIDLTPAKJWMZJI-UHFFFAOYSA-N 0 1 393.175 3.283 10 0 GGAEMN O=C(NCc1ccc(Br)cc1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000373686854 565298382 /nfs/dbraw/zinc/29/83/82/565298382.db2.gz BPLSDCRNUYJQIX-HNNXBMFYSA-N 0 1 386.253 3.156 10 0 GGAEMN C[C@@H](NC1CCN(c2ncccn2)CC1)c1ncc(Br)cc1F ZINC000187004741 565301624 /nfs/dbraw/zinc/30/16/24/565301624.db2.gz VJXUYOMNGIPIMS-LLVKDONJSA-N 0 1 380.265 3.093 10 0 GGAEMN Cc1nc([C@H]2CN(Cc3nc(-c4ccccc4Cl)cs3)CCO2)n[nH]1 ZINC000187090175 565308430 /nfs/dbraw/zinc/30/84/30/565308430.db2.gz UXRHUJWILQUGTA-OAHLLOKOSA-N 0 1 375.885 3.464 10 0 GGAEMN COc1ccc(CCN[C@@H](C(N)=O)c2cccc(Br)c2)c(Cl)c1 ZINC000162267643 565311738 /nfs/dbraw/zinc/31/17/38/565311738.db2.gz HQNYFJKNDNIGDK-MRXNPFEDSA-N 0 1 397.700 3.470 10 0 GGAEMN C[C@@H]1C[C@@]2(CCO1)CN(Cc1nc3ccc(Br)cc3[nH]1)C[C@H](C)O2 ZINC000374017446 565316351 /nfs/dbraw/zinc/31/63/51/565316351.db2.gz KYZBCWLSSQKIJM-VBHSOAQHSA-N 0 1 394.313 3.484 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3c(Br)cc(C)cc3C2)n[nH]1 ZINC000187218047 565316972 /nfs/dbraw/zinc/31/69/72/565316972.db2.gz DXSSOOCJPAVMFM-GFCCVEGCSA-N 0 1 391.313 3.488 10 0 GGAEMN CS(=O)(=O)c1cccc(Cl)c1CN[C@@H]1CCOC2(CCSCC2)C1 ZINC000273461449 565321725 /nfs/dbraw/zinc/32/17/25/565321725.db2.gz MYRVKGZNURMXRD-CYBMUJFWSA-N 0 1 389.970 3.278 10 0 GGAEMN O=C(NCCN1CCCOCC1)NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000187311261 565323280 /nfs/dbraw/zinc/32/32/80/565323280.db2.gz MBDCHOILHWPRMH-XJKSGUPXSA-N 0 1 386.323 3.118 10 0 GGAEMN CSc1ccc(NC(=O)C(=O)N2CCC(c3cnc[nH]3)CC2)cc1Cl ZINC000374197912 565325155 /nfs/dbraw/zinc/32/51/55/565325155.db2.gz KAIUTUCFCXABOL-UHFFFAOYSA-N 0 1 378.885 3.130 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CCC(c2c[nH]cn2)CC1 ZINC000374199123 565325447 /nfs/dbraw/zinc/32/54/47/565325447.db2.gz WYBCYUUERJRZLR-UHFFFAOYSA-N 0 1 391.313 3.010 10 0 GGAEMN COc1c(Br)cccc1CN[C@@H]1CCCN(c2cccnc2)C1=O ZINC000187358231 565326932 /nfs/dbraw/zinc/32/69/32/565326932.db2.gz ZHTSTWMEIXMUHB-MRXNPFEDSA-N 0 1 390.281 3.138 10 0 GGAEMN O=C(c1cc(Br)cc2nc[nH]c21)N1CCn2c3ccccc3nc21 ZINC000374322365 565331463 /nfs/dbraw/zinc/33/14/63/565331463.db2.gz DNBIBPHGMMBCBE-UHFFFAOYSA-N 0 1 382.221 3.336 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@H](c1nccs1)C(F)(F)F)c1cccs1 ZINC000296723861 565332620 /nfs/dbraw/zinc/33/26/20/565332620.db2.gz BUILROWWTFSXNI-GXSJLCMTSA-N 0 1 378.445 3.410 10 0 GGAEMN C[C@H]1CN(C(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)CCS1 ZINC000187456555 565333612 /nfs/dbraw/zinc/33/36/12/565333612.db2.gz DBVKFYDFYCQBRS-WFASDCNBSA-N 0 1 375.460 3.455 10 0 GGAEMN CC(C)c1nnc2n1C[C@H](N[C@H](C)c1ncc(Br)cc1F)CC2 ZINC000187446274 565333718 /nfs/dbraw/zinc/33/37/18/565333718.db2.gz QAPNNZPSUJWOCX-ZYHUDNBSSA-N 0 1 382.281 3.364 10 0 GGAEMN Cc1cc(Br)cc(NC(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c1 ZINC000187479515 565334802 /nfs/dbraw/zinc/33/48/02/565334802.db2.gz YHZJBFCVGGCGBM-AWEZNQCLSA-N 0 1 396.329 3.475 10 0 GGAEMN O=C(Nc1cccc(Br)c1)C1CCN(C[C@@H](O)C(F)(F)F)CC1 ZINC000273909205 565344994 /nfs/dbraw/zinc/34/49/94/565344994.db2.gz GWGSOPKAHPXEQS-CYBMUJFWSA-N 0 1 395.219 3.023 10 0 GGAEMN Cc1c(I)cccc1C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000374574773 565346295 /nfs/dbraw/zinc/34/62/95/565346295.db2.gz AUANNOJDSDLLDW-UHFFFAOYSA-N 0 1 395.244 3.343 10 0 GGAEMN C[C@H]1CN(Cc2csc(-c3ccc(Br)cc3)n2)CCN1CCO ZINC000187664191 565347914 /nfs/dbraw/zinc/34/79/14/565347914.db2.gz MMPSSJCSOJXNDO-ZDUSSCGKSA-N 0 1 396.354 3.071 10 0 GGAEMN O=C(NCc1ccsc1Br)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000374668800 565349531 /nfs/dbraw/zinc/34/95/31/565349531.db2.gz JOTUPRNRJLVMKU-GFCCVEGCSA-N 0 1 392.282 3.218 10 0 GGAEMN CS(=O)(=O)N1CC[C@@H](CN2CCc3sccc3[C@@H]2c2cccs2)C1 ZINC000374774575 565354498 /nfs/dbraw/zinc/35/44/98/565354498.db2.gz BFRFWKQDHDWBNU-SUMWQHHRSA-N 0 1 382.576 3.039 10 0 GGAEMN O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc(Br)c3cccnc23)CN1 ZINC000374894854 565359615 /nfs/dbraw/zinc/35/96/15/565359615.db2.gz LTBXZSHDMYBWET-WMLDXEAASA-N 0 1 388.309 3.488 10 0 GGAEMN CSC[C@H](O)CN1CCC[C@@H]1c1ccc(I)cc1 ZINC000187912334 565362961 /nfs/dbraw/zinc/36/29/61/565362961.db2.gz NGWMQZMIJGNOQT-ZIAGYGMSSA-N 0 1 377.291 3.152 10 0 GGAEMN C[C@H]1CC[C@@](CO)(N(C)Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000187938361 565364708 /nfs/dbraw/zinc/36/47/08/565364708.db2.gz KUUJYQHROCLIHL-YVEFUNNKSA-N 0 1 380.286 3.482 10 0 GGAEMN C[C@@H]1CC[C@](CO)(N(C)Cc2nc(-c3cccc(Br)c3)no2)C1 ZINC000187973189 565367603 /nfs/dbraw/zinc/36/76/03/565367603.db2.gz BWPWPDXACBTXAE-PXAZEXFGSA-N 0 1 380.286 3.482 10 0 GGAEMN C[C@H]1CC[C@](CO)(N(C)Cc2nc(-c3cccc(Br)c3)no2)C1 ZINC000187973216 565367956 /nfs/dbraw/zinc/36/79/56/565367956.db2.gz BWPWPDXACBTXAE-SJCJKPOMSA-N 0 1 380.286 3.482 10 0 GGAEMN CCOc1cc(CN[C@H](CC(N)=O)c2ccccc2)cc(Br)c1O ZINC000297370022 565369644 /nfs/dbraw/zinc/36/96/44/565369644.db2.gz HOMYCHMYRSAECM-OAHLLOKOSA-N 0 1 393.281 3.260 10 0 GGAEMN C[C@H]1CC[C@](CO)(N(C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1 ZINC000188021741 565372084 /nfs/dbraw/zinc/37/20/84/565372084.db2.gz KRICNTFGPKTEAM-GTNSWQLSSA-N 0 1 376.831 3.363 10 0 GGAEMN O=C(c1ccncc1)N1CCC(NCc2c(F)cccc2Br)CC1 ZINC000297562260 565376497 /nfs/dbraw/zinc/37/64/97/565376497.db2.gz HFXCAQDPZKCUCQ-UHFFFAOYSA-N 0 1 392.272 3.378 10 0 GGAEMN Clc1ccc2c(c1)nccc2SCCN1CCOC[C@@H]1c1nnc[nH]1 ZINC000375284962 565379229 /nfs/dbraw/zinc/37/92/29/565379229.db2.gz XHBZQJKUQPDALU-OAHLLOKOSA-N 0 1 375.885 3.172 10 0 GGAEMN Brc1cccc2c1CC[C@H]2NCc1cccc(N2CCOCC2)n1 ZINC000274756160 565379837 /nfs/dbraw/zinc/37/98/37/565379837.db2.gz HMIUQFRIYJDTNY-GOSISDBHSA-N 0 1 388.309 3.458 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N[C@H](Cc1ccccc1)C(F)(F)F ZINC000168559155 565381196 /nfs/dbraw/zinc/38/11/96/565381196.db2.gz KYXJQCCPGOMEEX-SECBINFHSA-N 0 1 379.454 3.209 10 0 GGAEMN Ic1cccc(CN[C@H](c2nnc[nH]2)c2ccccc2)c1 ZINC000375311908 565381216 /nfs/dbraw/zinc/38/12/16/565381216.db2.gz XNHOEPFFYPGBBG-HNNXBMFYSA-N 0 1 390.228 3.289 10 0 GGAEMN CN(Cc1nnc[nH]1)C(=O)Nc1ccc(C(F)(F)F)cc1Br ZINC000274848312 565383002 /nfs/dbraw/zinc/38/30/02/565383002.db2.gz QNISOABVOJYQIL-UHFFFAOYSA-N 0 1 378.152 3.250 10 0 GGAEMN Cc1c(Br)cccc1CC(=O)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000375458664 565389779 /nfs/dbraw/zinc/38/97/79/565389779.db2.gz QFUGBNOJVVYZFJ-KRWDZBQOSA-N 0 1 385.265 3.324 10 0 GGAEMN CCOc1cc(CN2CC[C@@H](COCCOC)C2)cc(Br)c1O ZINC000297874077 565390455 /nfs/dbraw/zinc/39/04/55/565390455.db2.gz PYINOIZUYUUORH-CYBMUJFWSA-N 0 1 388.302 3.038 10 0 GGAEMN O=C([C@H]1CCc2[nH]nnc2C1)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000375489332 565391786 /nfs/dbraw/zinc/39/17/86/565391786.db2.gz YDTVTLOALYSEKG-QFYYESIMSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@H]1CCc2nn[nH]c2C1)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000375489332 565391791 /nfs/dbraw/zinc/39/17/91/565391791.db2.gz YDTVTLOALYSEKG-QFYYESIMSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@@H]1CCc2[nH]nnc2C1)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000375489333 565391949 /nfs/dbraw/zinc/39/19/49/565391949.db2.gz YDTVTLOALYSEKG-QLJPJBMISA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@@H]1CCc2nn[nH]c2C1)N1CCC[C@@H]1c1cc(F)cc(Br)c1 ZINC000375489333 565391954 /nfs/dbraw/zinc/39/19/54/565391954.db2.gz YDTVTLOALYSEKG-QLJPJBMISA-N 0 1 393.260 3.175 10 0 GGAEMN CCOc1cc(CN2CCC[C@H](C3OCCO3)C2)cc(Br)c1O ZINC000297895829 565392002 /nfs/dbraw/zinc/39/20/02/565392002.db2.gz RHOLUCDQSVZEBZ-ZDUSSCGKSA-N 0 1 386.286 3.138 10 0 GGAEMN CCOc1cc(CN2CCC[C@H](c3nc(C)n[nH]3)C2)cc(Br)c1O ZINC000297931586 565392917 /nfs/dbraw/zinc/39/29/17/565392917.db2.gz UPEPSFJSTGXNBR-ZDUSSCGKSA-N 0 1 395.301 3.360 10 0 GGAEMN CO[C@H](C)c1noc(CN(C)C(=O)c2cn[nH]c2-c2ccc(Cl)s2)n1 ZINC000275130987 565394461 /nfs/dbraw/zinc/39/44/61/565394461.db2.gz JQVZZFVEAWMBEL-MRVPVSSYSA-N 0 1 381.845 3.154 10 0 GGAEMN O=C(CNC1(c2ccc(Br)cc2)CC1)N1CCO[C@H]2CCCC[C@H]21 ZINC000170871919 565397313 /nfs/dbraw/zinc/39/73/13/565397313.db2.gz ZECSVOKQSWZAQH-SJORKVTESA-N 0 1 393.325 3.198 10 0 GGAEMN COc1cc(Br)c(CN2CCC[C@H]2Cn2ccnc2)cc1OC ZINC000188399758 565398806 /nfs/dbraw/zinc/39/88/06/565398806.db2.gz BRFYPWOVZMLCHY-AWEZNQCLSA-N 0 1 380.286 3.327 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)C1(c2cncc(Br)c2)CC1 ZINC000375637862 565398939 /nfs/dbraw/zinc/39/89/39/565398939.db2.gz YUCKHGQSOZILCC-UHFFFAOYSA-N 0 1 384.237 3.300 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1c[nH]c2ccccc2c1=O ZINC000188552447 565407897 /nfs/dbraw/zinc/40/78/97/565407897.db2.gz XAGNJWSAJVJTCG-UHFFFAOYSA-N 0 1 387.233 3.229 10 0 GGAEMN Cc1cc(C)n([C@@H](C)C(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000171099522 565409332 /nfs/dbraw/zinc/40/93/32/565409332.db2.gz XZMBJLUCVFXZMO-NSHDSACASA-N 0 1 389.257 3.247 10 0 GGAEMN CN(C(=O)c1nc(Br)cs1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000275417269 565409404 /nfs/dbraw/zinc/40/94/04/565409404.db2.gz BUMJKMFALPHQNY-ZDUSSCGKSA-N 0 1 380.311 3.252 10 0 GGAEMN Cc1c(Br)cccc1NC(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000171152919 565413718 /nfs/dbraw/zinc/41/37/18/565413718.db2.gz ZEKRHYDUONOGHA-CYBMUJFWSA-N 0 1 396.329 3.475 10 0 GGAEMN O=C(c1coc(-c2ccc(Br)cc2F)n1)N1CCN2CCC1CC2 ZINC000188636127 565414450 /nfs/dbraw/zinc/41/44/50/565414450.db2.gz ZVALTHAIHUITGE-UHFFFAOYSA-N 0 1 394.244 3.163 10 0 GGAEMN C[C@H]1CN(C(=O)C(C)(C)c2cccc(Br)c2)CCN1CC(C)(C)O ZINC000188678045 565416637 /nfs/dbraw/zinc/41/66/37/565416637.db2.gz FOKQEUKXDIQAAL-AWEZNQCLSA-N 0 1 397.357 3.030 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ccc(Br)cn2)CC1 ZINC000171189008 565416704 /nfs/dbraw/zinc/41/67/04/565416704.db2.gz APDQBKUCWLLZLA-UHFFFAOYSA-N 0 1 389.297 3.238 10 0 GGAEMN CC(C)CCO[C@@H](C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171222427 565418798 /nfs/dbraw/zinc/41/87/98/565418798.db2.gz JSGFMFHDGIQBOW-LBPRGKRZSA-N 0 1 395.301 3.302 10 0 GGAEMN CC(C)CCO[C@@H](C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171222427 565418801 /nfs/dbraw/zinc/41/88/01/565418801.db2.gz JSGFMFHDGIQBOW-LBPRGKRZSA-N 0 1 395.301 3.302 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccccc1F ZINC000171223435 565419169 /nfs/dbraw/zinc/41/91/69/565419169.db2.gz ZLOFQDVAPDUNTH-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC(c2ccncn2)CC1 ZINC000298547423 565419118 /nfs/dbraw/zinc/41/91/18/565419118.db2.gz YNCGAZPHNOTDLD-UHFFFAOYSA-N 0 1 386.253 3.135 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccccc1F ZINC000171223435 565419174 /nfs/dbraw/zinc/41/91/74/565419174.db2.gz ZLOFQDVAPDUNTH-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cccc(F)c1F ZINC000171222324 565419429 /nfs/dbraw/zinc/41/94/29/565419429.db2.gz UQTKSNRLCGZNEE-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccc(F)c1F ZINC000171222324 565419432 /nfs/dbraw/zinc/41/94/32/565419432.db2.gz UQTKSNRLCGZNEE-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(Cc1ccc(F)cc1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223550 565419462 /nfs/dbraw/zinc/41/94/62/565419462.db2.gz ASRCWXVIOVHRMT-UHFFFAOYSA-N 0 1 389.228 3.232 10 0 GGAEMN O=C(Cc1ccc(F)cc1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223550 565419468 /nfs/dbraw/zinc/41/94/68/565419468.db2.gz ASRCWXVIOVHRMT-UHFFFAOYSA-N 0 1 389.228 3.232 10 0 GGAEMN O=C(Cc1cccs1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223544 565419635 /nfs/dbraw/zinc/41/96/35/565419635.db2.gz WRGXOOZXFHWTHE-UHFFFAOYSA-N 0 1 377.267 3.155 10 0 GGAEMN O=C(Cc1cccs1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223544 565419639 /nfs/dbraw/zinc/41/96/39/565419639.db2.gz WRGXOOZXFHWTHE-UHFFFAOYSA-N 0 1 377.267 3.155 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cccc2c[nH]nc21 ZINC000171222889 565419702 /nfs/dbraw/zinc/41/97/02/565419702.db2.gz ZBHFXPCJNLXHCA-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccc2c[nH]nc21 ZINC000171222889 565419705 /nfs/dbraw/zinc/41/97/05/565419705.db2.gz ZBHFXPCJNLXHCA-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NCc1ccccc1 ZINC000171247367 565421188 /nfs/dbraw/zinc/42/11/88/565421188.db2.gz MCVJOQCHQRGDML-UHFFFAOYSA-N 0 1 386.253 3.234 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NCc1ccccc1 ZINC000171247367 565421194 /nfs/dbraw/zinc/42/11/94/565421194.db2.gz MCVJOQCHQRGDML-UHFFFAOYSA-N 0 1 386.253 3.234 10 0 GGAEMN Cc1csc(C(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)c1Br ZINC000376095151 565421994 /nfs/dbraw/zinc/42/19/94/565421994.db2.gz HSNODXAZDQJJBQ-GFCCVEGCSA-N 0 1 377.267 3.457 10 0 GGAEMN Cc1cc(C(=O)N2CCN3CCC2CC3)nn1-c1ccc(Cl)c(Cl)c1 ZINC000188839211 565426339 /nfs/dbraw/zinc/42/63/39/565426339.db2.gz FAERILRKTFHSQT-UHFFFAOYSA-N 0 1 379.291 3.408 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1S(=O)(=O)Nc1ccnn1[C@H](C)C1CC1 ZINC000171341612 565427308 /nfs/dbraw/zinc/42/73/08/565427308.db2.gz OSTVLCQKZGZUSH-SNVBAGLBSA-N 0 1 383.857 3.095 10 0 GGAEMN CCN1CCN(c2ccc(Cl)cc2NC(=O)N2CCS[C@@H](C)C2)CC1 ZINC000171361426 565427926 /nfs/dbraw/zinc/42/79/26/565427926.db2.gz WXFBTRCZIUBSOL-AWEZNQCLSA-N 0 1 382.961 3.451 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C1 ZINC000188941157 565434433 /nfs/dbraw/zinc/43/44/33/565434433.db2.gz QHLMASSGKGBYDB-NSHDSACASA-N 0 1 380.901 3.313 10 0 GGAEMN O=C(NCC1(N2CCSCC2)CCCC1)c1csc(C(F)(F)F)n1 ZINC000189089546 565443320 /nfs/dbraw/zinc/44/33/20/565443320.db2.gz VUPPZOMWRFEZSP-UHFFFAOYSA-N 0 1 379.473 3.253 10 0 GGAEMN C[C@@](O)(CN1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1)C(F)(F)F ZINC000376625912 565446153 /nfs/dbraw/zinc/44/61/53/565446153.db2.gz IEUGTKQHASUTPZ-GOEBONIOSA-N 0 1 376.806 3.401 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)c1ccc2[nH]nnc2c1 ZINC000189151522 565448372 /nfs/dbraw/zinc/44/83/72/565448372.db2.gz NDCQJGBLAGNPAQ-VIFPVBQESA-N 0 1 375.226 3.220 10 0 GGAEMN COc1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cc1OC ZINC000171770824 565449020 /nfs/dbraw/zinc/44/90/20/565449020.db2.gz ZWWOXYCTVHXAEF-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN COCCN(Cc1ccco1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000171772280 565449211 /nfs/dbraw/zinc/44/92/11/565449211.db2.gz QXMLLSNCINAFEI-UHFFFAOYSA-N 0 1 378.226 3.207 10 0 GGAEMN Cc1nc2ccccc2n1CCNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000171771530 565449324 /nfs/dbraw/zinc/44/93/24/565449324.db2.gz GUTVMELHBJVRIH-UHFFFAOYSA-N 0 1 398.264 3.414 10 0 GGAEMN O=S(=O)(NCCc1nnc(-c2ccccc2)[nH]1)c1cccc(Cl)c1Cl ZINC000189160627 565449377 /nfs/dbraw/zinc/44/93/77/565449377.db2.gz XYKRKPNGCFMWRQ-UHFFFAOYSA-N 0 1 397.287 3.300 10 0 GGAEMN Cc1noc(C2CCN(C(=O)c3[nH]nc4ccc(Br)cc43)CC2)n1 ZINC000171773072 565450387 /nfs/dbraw/zinc/45/03/87/565450387.db2.gz ZKDYXBOMZNJJHA-UHFFFAOYSA-N 0 1 390.241 3.037 10 0 GGAEMN Cc1noc([C@@H]2CCCN(C(=O)c3[nH]nc4ccc(Br)cc43)C2)n1 ZINC000171773055 565450759 /nfs/dbraw/zinc/45/07/59/565450759.db2.gz URZKXPMZTLSCTB-SNVBAGLBSA-N 0 1 390.241 3.037 10 0 GGAEMN Cc1cccn2cc(CNC(=O)c3n[nH]c4ccc(Br)cc43)nc12 ZINC000171822274 565452697 /nfs/dbraw/zinc/45/26/97/565452697.db2.gz ZRLUSLXQENWEHH-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN CCn1nccc1S(=O)(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)cc1 ZINC000276713209 565457351 /nfs/dbraw/zinc/45/73/51/565457351.db2.gz YRMCXDNVGCTJBD-UHFFFAOYSA-N 0 1 379.873 3.160 10 0 GGAEMN O=C(NCCc1nc2ccccc2[nH]1)c1n[nH]c2ccc(Br)cc21 ZINC000171949425 565458650 /nfs/dbraw/zinc/45/86/50/565458650.db2.gz JWFGYENEHBRWEF-UHFFFAOYSA-N 0 1 384.237 3.174 10 0 GGAEMN CN(Cc1ccc(Br)cn1)C[C@H](c1cccs1)N1CCOCC1 ZINC000171960710 565459926 /nfs/dbraw/zinc/45/99/26/565459926.db2.gz HEOCSPHEVUGELX-MRXNPFEDSA-N 0 1 396.354 3.411 10 0 GGAEMN O=C1OCCN1CCCNCc1csc(COc2ccc(Cl)cc2)n1 ZINC000172118441 565467249 /nfs/dbraw/zinc/46/72/49/565467249.db2.gz AGBGVAKAQNBYST-UHFFFAOYSA-N 0 1 381.885 3.307 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC2(C1)CCCOC2 ZINC000377194006 565470096 /nfs/dbraw/zinc/47/00/96/565470096.db2.gz SAMPMNXPMYSNBK-UHFFFAOYSA-N 0 1 376.254 3.092 10 0 GGAEMN Cc1ccc(I)c(C(=O)N2CCC(c3cnc[nH]3)CC2)c1 ZINC000377272814 565472499 /nfs/dbraw/zinc/47/24/99/565472499.db2.gz HLLUOYJOWLEVNG-UHFFFAOYSA-N 0 1 395.244 3.343 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000172290929 565475527 /nfs/dbraw/zinc/47/55/27/565475527.db2.gz FBQASNULNFTNMC-MRVPVSSYSA-N 0 1 396.148 3.487 10 0 GGAEMN C[C@H]1C[C@H](NC(=O)c2n[nH]c3ccc(Cl)cc32)c2ccsc2S1(=O)=O ZINC000377349156 565476194 /nfs/dbraw/zinc/47/61/94/565476194.db2.gz YMVXAFCUWCQTMK-SDBXPKJASA-N 0 1 395.893 3.315 10 0 GGAEMN Cc1ccc([C@@H]2COCCN2C(=O)c2[nH]nc3ccc(Br)cc32)o1 ZINC000172325504 565477613 /nfs/dbraw/zinc/47/76/13/565477613.db2.gz UKXXYXLNVNCXJC-AWEZNQCLSA-N 0 1 390.237 3.441 10 0 GGAEMN COC(=O)c1cc(N2CCN(C3CC3)CC2)c2cc(Br)ccc2n1 ZINC000301338258 565480114 /nfs/dbraw/zinc/48/01/14/565480114.db2.gz FCEHASLRSWCJAX-UHFFFAOYSA-N 0 1 390.281 3.068 10 0 GGAEMN Cn1nccc1C1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)CC1 ZINC000172380924 565482812 /nfs/dbraw/zinc/48/28/12/565482812.db2.gz PQQAZAXLNDJCOS-UHFFFAOYSA-N 0 1 388.269 3.079 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CCc2cccc(Br)c2C1 ZINC000172467598 565487456 /nfs/dbraw/zinc/48/74/56/565487456.db2.gz QVCCKSOUUXQQIP-UHFFFAOYSA-N 0 1 377.286 3.181 10 0 GGAEMN Brc1c(CN[C@@H](c2nnc[nH]2)c2ccccc2)nc2ccccn12 ZINC000377614685 565488909 /nfs/dbraw/zinc/48/89/09/565488909.db2.gz JQPOLZOPRBBFQV-OAHLLOKOSA-N 0 1 383.253 3.094 10 0 GGAEMN COc1ccc(CN2CCC(c3nnc4n3CCC4)CC2)c(Br)c1 ZINC000377631133 565490258 /nfs/dbraw/zinc/49/02/58/565490258.db2.gz VVSFFRCEXKBVDE-UHFFFAOYSA-N 0 1 391.313 3.375 10 0 GGAEMN C[C@H](NC[C@H](O)CC(F)(F)F)c1cc2c(cc1Br)OCCO2 ZINC000189833682 565491043 /nfs/dbraw/zinc/49/10/43/565491043.db2.gz KCLPKZBIJFBLNL-DTWKUNHWSA-N 0 1 384.192 3.184 10 0 GGAEMN CN(C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CCCC1 ZINC000172660253 565497841 /nfs/dbraw/zinc/49/78/41/565497841.db2.gz DSKXGAGCKRFABE-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN CN(C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CCCC1 ZINC000172660253 565497845 /nfs/dbraw/zinc/49/78/45/565497845.db2.gz DSKXGAGCKRFABE-UHFFFAOYSA-N 0 1 378.274 3.318 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H](C)Cc1cc(C)[nH]n1 ZINC000189965724 565499567 /nfs/dbraw/zinc/49/95/67/565499567.db2.gz DWNHZNNIMWJYNR-PWSUYJOCSA-N 0 1 395.301 3.481 10 0 GGAEMN Cc1ccc(C(=O)C2CCN(C(=O)CSc3n[nH]c(=S)s3)CC2)cc1 ZINC000377946643 565504984 /nfs/dbraw/zinc/50/49/84/565504984.db2.gz DMVSOTUGEWLZBO-UHFFFAOYSA-N 0 1 393.559 3.349 10 0 GGAEMN Cc1cc(Br)c2c(c1)CN(C(=O)N[C@@H]1CCc3nc[nH]c3C1)CC2 ZINC000378044386 565510280 /nfs/dbraw/zinc/51/02/80/565510280.db2.gz ANUAPFUZZRIHBC-CYBMUJFWSA-N 0 1 389.297 3.106 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)NC1(c2ccc(Br)cc2)CC1 ZINC000378113377 565512830 /nfs/dbraw/zinc/51/28/30/565512830.db2.gz PNTMPEFJYWLTHN-CYBMUJFWSA-N 0 1 375.270 3.018 10 0 GGAEMN O=C(NCC1(c2cccc(Br)c2)CC1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378125037 565512893 /nfs/dbraw/zinc/51/28/93/565512893.db2.gz BMOBVLKFYUBSSQ-CQSZACIVSA-N 0 1 389.297 3.061 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@@H]2CCCc3[nH]ncc32)cc(Br)c1F ZINC000277728416 565516172 /nfs/dbraw/zinc/51/61/72/565516172.db2.gz JMZWKCDXQSQXFO-SECBINFHSA-N 0 1 396.216 3.157 10 0 GGAEMN CCOC(=O)c1csc(CCNCc2nc3cc(Cl)ccc3n2C)n1 ZINC000190346249 565523933 /nfs/dbraw/zinc/52/39/33/565523933.db2.gz FWIVIYCERSBSPC-UHFFFAOYSA-N 0 1 378.885 3.192 10 0 GGAEMN C[C@H](CO)N1CCN(c2ccc3cc(Br)cc(Cl)c3n2)CC1 ZINC000301998792 565524545 /nfs/dbraw/zinc/52/45/45/565524545.db2.gz IIBRCRSWSHINKM-LLVKDONJSA-N 0 1 384.705 3.154 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)CCCSc3ccc(Cl)cc3)CCO2)n[nH]1 ZINC000173090865 565526084 /nfs/dbraw/zinc/52/60/84/565526084.db2.gz ZLOZLLDLTGVHAU-OAHLLOKOSA-N 0 1 380.901 3.239 10 0 GGAEMN CCc1nc([C@@H]2CN(C(=O)[C@H](C)Sc3ccccc3Cl)CCO2)n[nH]1 ZINC000173096096 565526650 /nfs/dbraw/zinc/52/66/50/565526650.db2.gz OTLKEICTYFVVMP-AAEUAGOBSA-N 0 1 380.901 3.101 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)c3csc(-c4ccc(Cl)s4)n3)CCO2)n[nH]1 ZINC000173091383 565526777 /nfs/dbraw/zinc/52/67/77/565526777.db2.gz AXSVCXGAJXZVAE-SNVBAGLBSA-N 0 1 395.897 3.165 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)CCc3ccc(Cl)cc3Cl)CCO2)n[nH]1 ZINC000173094039 565526943 /nfs/dbraw/zinc/52/69/43/565526943.db2.gz ZZMHGUZGEPLNRY-CQSZACIVSA-N 0 1 383.279 3.207 10 0 GGAEMN C[C@H](Nc1ccc2nnc(-c3cc(Cl)cc(Cl)c3)n2n1)c1nnc[nH]1 ZINC000302070297 565528306 /nfs/dbraw/zinc/52/83/06/565528306.db2.gz VNFOMXKEXAFVSE-QMMMGPOBSA-N 0 1 375.223 3.389 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1ccc(F)cc1Br ZINC000378532600 565533057 /nfs/dbraw/zinc/53/30/57/565533057.db2.gz YRAQPQLRDZJMTF-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN CC(=O)c1csc(C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)c1 ZINC000190539457 565540465 /nfs/dbraw/zinc/54/04/65/565540465.db2.gz LKCNKCBLHOPGSV-AWEZNQCLSA-N 0 1 377.535 3.310 10 0 GGAEMN CC(C)n1cc(Br)cc1C(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000173252461 565540860 /nfs/dbraw/zinc/54/08/60/565540860.db2.gz UPCSGUQONXVQMH-AWEZNQCLSA-N 0 1 398.345 3.157 10 0 GGAEMN Cc1c(Br)cccc1C(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000173252964 565541091 /nfs/dbraw/zinc/54/10/91/565541091.db2.gz PVIHNLCPHSSSAH-ZDUSSCGKSA-N 0 1 381.314 3.083 10 0 GGAEMN Cc1ncsc1C[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000190545326 565541316 /nfs/dbraw/zinc/54/13/16/565541316.db2.gz OIMVOEOBWWRYDE-ZDUSSCGKSA-N 0 1 379.913 3.405 10 0 GGAEMN Cc1ncsc1C[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(Cl)cc2[O-])C1 ZINC000190545326 565541322 /nfs/dbraw/zinc/54/13/22/565541322.db2.gz OIMVOEOBWWRYDE-ZDUSSCGKSA-N 0 1 379.913 3.405 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)cc1Cl ZINC000173274513 565543543 /nfs/dbraw/zinc/54/35/43/565543543.db2.gz XYLCTXOYTYUUCB-MNOVXSKESA-N 0 1 381.325 3.105 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C ZINC000173277336 565543622 /nfs/dbraw/zinc/54/36/22/565543622.db2.gz RWRDONOSFZFZRU-CMPLNLGQSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(Br)ccc2Cl)CCN1C ZINC000173274306 565543667 /nfs/dbraw/zinc/54/36/67/565543667.db2.gz YPEKDPPJPOXVOI-ZYHUDNBSSA-N 0 1 395.750 3.206 10 0 GGAEMN CN1CCN([C@@H]2CCCCN(C(=O)c3cc(F)c(Cl)cc3Cl)C2)CC1 ZINC000173295870 565545597 /nfs/dbraw/zinc/54/55/97/565545597.db2.gz GMFHPKUAOSECFC-CYBMUJFWSA-N 0 1 388.314 3.375 10 0 GGAEMN CN(C)[C@@H](CNc1nnc(Cc2ccc(Cl)cc2)s1)c1cnn(C)c1 ZINC000302553445 565546053 /nfs/dbraw/zinc/54/60/53/565546053.db2.gz XAAOYAHXTOCQJQ-HNNXBMFYSA-N 0 1 376.917 3.231 10 0 GGAEMN COc1ccccc1S(=O)(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000173323089 565548028 /nfs/dbraw/zinc/54/80/28/565548028.db2.gz OIKCNPWSRBVSBK-RDTXWAMCSA-N 0 1 380.535 3.118 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2cccc(F)c2F)[C@@H]1c1cccs1 ZINC000173324104 565548039 /nfs/dbraw/zinc/54/80/39/565548039.db2.gz CGLGDUZXMGOFNH-SJKOYZFVSA-N 0 1 386.489 3.388 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2ccc(F)cc2F)[C@@H]1c1cccs1 ZINC000173325289 565549434 /nfs/dbraw/zinc/54/94/34/565549434.db2.gz HTNOZOYCNAGHBA-YVEFUNNKSA-N 0 1 386.489 3.388 10 0 GGAEMN CCc1n[nH]c(C2CCN(Cc3ccc(I)cc3)CC2)n1 ZINC000190648169 565549423 /nfs/dbraw/zinc/54/94/23/565549423.db2.gz OCGQOIOCQBJEBJ-UHFFFAOYSA-N 0 1 396.276 3.351 10 0 GGAEMN CCc1nnc(C2CCN(Cc3ccc(I)cc3)CC2)[nH]1 ZINC000190648169 565549426 /nfs/dbraw/zinc/54/94/26/565549426.db2.gz OCGQOIOCQBJEBJ-UHFFFAOYSA-N 0 1 396.276 3.351 10 0 GGAEMN CCc1n[nH]c(C2CCN(CC(=O)Nc3cccc(Cl)c3Cl)CC2)n1 ZINC000190706205 565552642 /nfs/dbraw/zinc/55/26/42/565552642.db2.gz AUCRAGPUBRPDKX-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN CCc1nnc(C2CCN(CC(=O)Nc3cccc(Cl)c3Cl)CC2)[nH]1 ZINC000190706205 565552645 /nfs/dbraw/zinc/55/26/45/565552645.db2.gz AUCRAGPUBRPDKX-UHFFFAOYSA-N 0 1 382.295 3.492 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)Nc1cc(-n2cccn2)nc(N)n1 ZINC000302743541 565554594 /nfs/dbraw/zinc/55/45/94/565554594.db2.gz DOAGAVFWERITMM-SNVBAGLBSA-N 0 1 389.257 3.189 10 0 GGAEMN CC(C)(C)NC(=O)CN1CCC(CNc2ncc(C(F)(F)F)s2)CC1 ZINC000302773430 565555307 /nfs/dbraw/zinc/55/53/07/565555307.db2.gz NSDQEQGJIABTQZ-UHFFFAOYSA-N 0 1 378.464 3.201 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cc(Br)ccc2O)ccc1F ZINC000190791336 565558479 /nfs/dbraw/zinc/55/84/79/565558479.db2.gz CSPFBGKTGVQTHI-UHFFFAOYSA-N 0 1 376.203 3.103 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3ncc(Br)s3)C2)n(C)n1 ZINC000278478813 565560819 /nfs/dbraw/zinc/56/08/19/565560819.db2.gz OMGUJGYGUIBMOT-NWDGAFQWSA-N 0 1 384.347 3.267 10 0 GGAEMN OC[C@@H]1CCC[C@@H](NCc2c(Br)cncc2Br)C1 ZINC000394532219 565570976 /nfs/dbraw/zinc/57/09/76/565570976.db2.gz PGYONUIERAFDAS-NXEZZACHSA-N 0 1 378.108 3.247 10 0 GGAEMN Cn1ncc(Br)c1CNCCc1coc(-c2ccc(F)cc2)n1 ZINC000278543337 565564451 /nfs/dbraw/zinc/56/44/51/565564451.db2.gz UFXNXLOXLISNLZ-UHFFFAOYSA-N 0 1 379.233 3.309 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1cc(Br)ccc1Cl ZINC000303142804 565567620 /nfs/dbraw/zinc/56/76/20/565567620.db2.gz DUEZGZWEYQSKFM-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN COCC[C@H](CO)N[C@@H](C)c1ccc(Br)cc1Br ZINC000305946046 565576416 /nfs/dbraw/zinc/57/64/16/565576416.db2.gz SPOUWJIWTMOLQA-GXSJLCMTSA-N 0 1 381.108 3.260 10 0 GGAEMN CC[C@H](NC(=O)N1CCN2CCCC[C@@H]2C1)c1nc(C(F)(F)F)cs1 ZINC000173732898 565580249 /nfs/dbraw/zinc/58/02/49/565580249.db2.gz OXPPDNJXSKTXJG-NEPJUHHUSA-N 0 1 376.448 3.493 10 0 GGAEMN C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@@]2(CNC(=O)C2)C1 ZINC000278933345 565586117 /nfs/dbraw/zinc/58/61/17/565586117.db2.gz SYOKJCMQEKXZHI-DYZYQPBXSA-N 0 1 381.263 3.316 10 0 GGAEMN C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@@]2(CNC(=O)C2)C1 ZINC000278933338 565586580 /nfs/dbraw/zinc/58/65/80/565586580.db2.gz SYOKJCMQEKXZHI-BMLIUANNSA-N 0 1 381.263 3.316 10 0 GGAEMN COCC[C@H](COC)NCc1cc(Cl)ccc1I ZINC000405345110 565587235 /nfs/dbraw/zinc/58/72/35/565587235.db2.gz PODVLGXKJQJLAE-GFCCVEGCSA-N 0 1 383.657 3.086 10 0 GGAEMN O=C1C[C@@]2(CCN(Cc3csc(-c4ccc(Br)cc4)n3)C2)CN1 ZINC000278971493 565587352 /nfs/dbraw/zinc/58/73/52/565587352.db2.gz XWGZDCYYFHKASS-KRWDZBQOSA-N 0 1 392.322 3.285 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2cc(Cl)cc(Cl)c2)n[nH]1 ZINC000407975265 565588176 /nfs/dbraw/zinc/58/81/76/565588176.db2.gz FWMUWHDQPISMMN-CYBMUJFWSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2ccc(Cl)cc2Cl)n[nH]1 ZINC000407976914 565588292 /nfs/dbraw/zinc/58/82/92/565588292.db2.gz OBCXKACBFSBAOB-GFCCVEGCSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3ccc(C)cc3Br)C2)n[nH]1 ZINC000407976142 565588566 /nfs/dbraw/zinc/58/85/66/565588566.db2.gz JOFASOBFGHKFCK-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2cc(Cl)cc(Cl)c2)n[nH]1 ZINC000407975266 565588693 /nfs/dbraw/zinc/58/86/93/565588693.db2.gz FWMUWHDQPISMMN-ZDUSSCGKSA-N 0 1 375.281 3.336 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)c2ccc(I)cc2)n[nH]1 ZINC000407980762 565589465 /nfs/dbraw/zinc/58/94/65/565589465.db2.gz NWXMYXLUKQAJCG-ZDUSSCGKSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2c(Cl)cc(F)cc2Cl)n[nH]1 ZINC000407977336 565589530 /nfs/dbraw/zinc/58/95/30/565589530.db2.gz QTLJDHMODNAKSH-GFCCVEGCSA-N 0 1 393.271 3.475 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)c2ccc(Br)cc2C)n[nH]1 ZINC000407977973 565589929 /nfs/dbraw/zinc/58/99/29/565589929.db2.gz UUDNBCDABJPROH-CYBMUJFWSA-N 0 1 399.314 3.100 10 0 GGAEMN C[C@@H]1[C@@H](C)N(C(=O)Nc2cnn(-c3ncc(Cl)cc3Cl)c2)CCN1C ZINC000408209356 565599196 /nfs/dbraw/zinc/59/91/96/565599196.db2.gz ZXYYGNVUBYELFC-GHMZBOCLSA-N 0 1 383.283 3.130 10 0 GGAEMN COc1ccccc1N1CCC(NCc2c(Br)c(C)nn2C)CC1 ZINC000279186856 565599997 /nfs/dbraw/zinc/59/99/97/565599997.db2.gz SONQDHGDGLVHLX-UHFFFAOYSA-N 0 1 393.329 3.258 10 0 GGAEMN CCc1nc([C@@H]2CN(Cc3cc(Br)ccc3Cl)CCO2)n[nH]1 ZINC000174100389 565613497 /nfs/dbraw/zinc/61/34/97/565613497.db2.gz IAHJBSNKUNEJHR-ZDUSSCGKSA-N 0 1 385.693 3.357 10 0 GGAEMN Cc1ccc(CN[C@@H]2CCCOc3ccc(Br)cc32)c(=O)n1C ZINC000279479315 565614530 /nfs/dbraw/zinc/61/45/30/565614530.db2.gz KQBGPMFHWOCAJZ-MRXNPFEDSA-N 0 1 377.282 3.460 10 0 GGAEMN O=C([O-])[C@@]1(C(F)(F)F)CC[N@@H+](CCCc2nc(-c3cccs3)no2)C1 ZINC000327403561 565630868 /nfs/dbraw/zinc/63/08/68/565630868.db2.gz KUNRZXHDLWNJCX-CQSZACIVSA-N 0 1 375.372 3.070 10 0 GGAEMN CC(=O)CC(C)(C)CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000191813630 565634264 /nfs/dbraw/zinc/63/42/64/565634264.db2.gz OVLSGKBJSJGDFQ-UHFFFAOYSA-N 0 1 393.285 3.246 10 0 GGAEMN CC(=O)CC(C)(C)CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000191813630 565634267 /nfs/dbraw/zinc/63/42/67/565634267.db2.gz OVLSGKBJSJGDFQ-UHFFFAOYSA-N 0 1 393.285 3.246 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@@H]2CCOc3c(Br)cccc32)C[C@H]1C ZINC000409703981 565634374 /nfs/dbraw/zinc/63/43/74/565634374.db2.gz CJWCTSJJAGOBHT-DVOMOZLQSA-N 0 1 396.329 3.397 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)[C@H]2COc3ccc(Br)cc32)n[nH]1 ZINC000328664205 565636862 /nfs/dbraw/zinc/63/68/62/565636862.db2.gz BKQYKYZVHJADKI-UONOGXRCSA-N 0 1 391.269 3.105 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)[C@@H]2COc3ccc(Br)cc32)n[nH]1 ZINC000328664206 565637164 /nfs/dbraw/zinc/63/71/64/565637164.db2.gz BKQYKYZVHJADKI-ZIAGYGMSSA-N 0 1 391.269 3.105 10 0 GGAEMN Cc1csc([C@H]2CCCCN2CC2=Nc3ccccc3S(=O)(=O)N2)n1 ZINC000328860510 565644635 /nfs/dbraw/zinc/64/46/35/565644635.db2.gz LKUWWXJQYQHMPG-CQSZACIVSA-N 0 1 376.507 3.001 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(C3SCCS3)cc2)CCN1C[C@@H](C)O ZINC000174597664 565645271 /nfs/dbraw/zinc/64/52/71/565645271.db2.gz NNMNWPMPYFSJNV-PBHICJAKSA-N 0 1 380.579 3.082 10 0 GGAEMN NC(=O)[C@@H](Cc1ccc(F)cc1)N[C@H]1CCOc2c(Br)cccc21 ZINC000409874566 565646135 /nfs/dbraw/zinc/64/61/35/565646135.db2.gz KIRWCLYWANHYIA-JKSUJKDBSA-N 0 1 393.256 3.098 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cc(Br)ccc2Cl)CCN1C[C@@H](C)O ZINC000174604226 565647188 /nfs/dbraw/zinc/64/71/88/565647188.db2.gz WUJWUYYVABZAMX-YPMHNXCESA-N 0 1 389.721 3.020 10 0 GGAEMN O=C1[C@@H]([N@@H+]2CCC[C@@H](c3nnc[nH]3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000329235703 565659312 /nfs/dbraw/zinc/65/93/12/565659312.db2.gz IUCQIJGWKMRBJU-ABAIWWIYSA-N 0 1 380.279 3.096 10 0 GGAEMN C[C@@H](NCCc1ccccc1O)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000280231432 565659922 /nfs/dbraw/zinc/65/99/22/565659922.db2.gz VIDLFPNUAJPMHM-SNVBAGLBSA-N 0 1 389.304 3.240 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2nccn2Cc2ccccc2Cl)[nH]1 ZINC000174882491 565664239 /nfs/dbraw/zinc/66/42/39/565664239.db2.gz IDZHHLOHKWPUSH-UHFFFAOYSA-N 0 1 376.873 3.132 10 0 GGAEMN COC(=O)c1ccc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000192159499 565664317 /nfs/dbraw/zinc/66/43/17/565664317.db2.gz YUHFTMJAUTTYFD-RHSMWYFYSA-N 0 1 378.881 3.250 10 0 GGAEMN C[C@H](CO)N(Cc1nnc(-c2ccccc2Br)o1)CC1CCC1 ZINC000280311432 565664378 /nfs/dbraw/zinc/66/43/78/565664378.db2.gz GKAAQTZUUIPABQ-GFCCVEGCSA-N 0 1 380.286 3.482 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC2(C1)CCCOC2 ZINC000329476861 565668804 /nfs/dbraw/zinc/66/88/04/565668804.db2.gz UGFPLXCRYUQNOQ-UHFFFAOYSA-N 0 1 376.254 3.092 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)[C@@H]2CCO[C@H](C)C2)c2cccs2)CC1 ZINC000329629228 565674087 /nfs/dbraw/zinc/67/40/87/565674087.db2.gz VYRFOPGEJZATDB-BRWVUGGUSA-N 0 1 386.583 3.008 10 0 GGAEMN CC1CCN([C@H](CNS(=O)(=O)[C@@H]2CCO[C@@H](C)C2)c2cccs2)CC1 ZINC000329629229 565674243 /nfs/dbraw/zinc/67/42/43/565674243.db2.gz VYRFOPGEJZATDB-GVDBMIGSSA-N 0 1 386.583 3.008 10 0 GGAEMN CC1(C)CN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C[C@@]2(CCOC2)O1 ZINC000280542360 565678825 /nfs/dbraw/zinc/67/88/25/565678825.db2.gz NDQQROQPWUMONK-QGZVFWFLSA-N 0 1 381.885 3.202 10 0 GGAEMN CC[C@H]1CN(C)CCCN1S(=O)(=O)c1cccc(-c2nc(C)cs2)c1 ZINC000329838778 565682214 /nfs/dbraw/zinc/68/22/14/565682214.db2.gz MQVDIWAUAQCSLH-INIZCTEOSA-N 0 1 379.551 3.223 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccoc1Cl ZINC000192416427 565686402 /nfs/dbraw/zinc/68/64/02/565686402.db2.gz KGZKQFATWMHKEC-UHFFFAOYSA-N 0 1 381.617 3.411 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccoc1Cl ZINC000192416427 565686405 /nfs/dbraw/zinc/68/64/05/565686405.db2.gz KGZKQFATWMHKEC-UHFFFAOYSA-N 0 1 381.617 3.411 10 0 GGAEMN CC1(C)CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000175260145 565688586 /nfs/dbraw/zinc/68/85/86/565688586.db2.gz QYCVHYMIWKQTSO-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CC1(C)CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000175260145 565688589 /nfs/dbraw/zinc/68/85/89/565688589.db2.gz QYCVHYMIWKQTSO-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN O=C1[C@@H](N2CCC[C@@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000330023670 565690128 /nfs/dbraw/zinc/69/01/28/565690128.db2.gz JBDFIASMUHDYAK-ABAIWWIYSA-N 0 1 380.279 3.096 10 0 GGAEMN CC[C@@H]1CN(C[C@H](O)COc2c(Cl)cccc2Cl)C[C@]2(CCOC2)O1 ZINC000330083009 565690761 /nfs/dbraw/zinc/69/07/61/565690761.db2.gz BEZAHNRFVXMCCA-IYOUNJFTSA-N 0 1 390.307 3.003 10 0 GGAEMN O=C1C[C@@]2(CCN(Cc3ccc(OC(F)(F)F)c(Br)c3)C2)CN1 ZINC000280731873 565691359 /nfs/dbraw/zinc/69/13/59/565691359.db2.gz YVZRMBGGRFXMRR-AWEZNQCLSA-N 0 1 393.203 3.060 10 0 GGAEMN CC[C@@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccncc1 ZINC000280764591 565694731 /nfs/dbraw/zinc/69/47/31/565694731.db2.gz QYQOJJQYSWATJY-XHDPSFHLSA-N 0 1 398.326 3.293 10 0 GGAEMN C[C@H](N[C@@H]1CCCc2occc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280777983 565694768 /nfs/dbraw/zinc/69/47/68/565694768.db2.gz SBZZHZOJRHOUNJ-IINYFYTJSA-N 0 1 399.310 3.418 10 0 GGAEMN CCC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)[C@@H]2CCN(CC)C[C@H]2C)c1 ZINC000280769311 565695053 /nfs/dbraw/zinc/69/50/53/565695053.db2.gz RQCVHRXOVUGYFT-CZUORRHYSA-N 0 1 386.945 3.284 10 0 GGAEMN CS(=O)(=O)C1(CN[C@@H]2CCCOc3ccc(Br)cc32)CCC1 ZINC000281222694 565718972 /nfs/dbraw/zinc/71/89/72/565718972.db2.gz UDZFJVCTPZUZLA-CQSZACIVSA-N 0 1 388.327 3.220 10 0 GGAEMN C[C@H](C(=O)OC(C)(C)C)N(C)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000175732085 565720583 /nfs/dbraw/zinc/72/05/83/565720583.db2.gz XWHAPWWHBUAQJO-SECBINFHSA-N 0 1 382.258 3.128 10 0 GGAEMN Cc1nn(C)c(C)c1[C@H](NS(=O)(=O)c1cccc(C)c1F)C(F)(F)F ZINC000330800722 565723604 /nfs/dbraw/zinc/72/36/04/565723604.db2.gz ZHGQERNFLFCFIU-AWEZNQCLSA-N 0 1 379.379 3.066 10 0 GGAEMN Cc1nn(C)c(C)c1[C@@H](NS(=O)(=O)c1cccc(C)c1F)C(F)(F)F ZINC000330800723 565724162 /nfs/dbraw/zinc/72/41/62/565724162.db2.gz ZHGQERNFLFCFIU-CQSZACIVSA-N 0 1 379.379 3.066 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(C2CCOCC2)CC1 ZINC000175859824 565728464 /nfs/dbraw/zinc/72/84/64/565728464.db2.gz XEXCKSLXDTVHGP-ZDUSSCGKSA-N 0 1 387.307 3.084 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2Br)CCN1C ZINC000281418641 565730088 /nfs/dbraw/zinc/73/00/88/565730088.db2.gz IREXLIXYZYVDIC-JQWIXIFHSA-N 0 1 395.750 3.206 10 0 GGAEMN CN(C)c1ncc(CN(C)CCC(=O)Nc2c(Cl)cccc2Cl)cn1 ZINC000411492499 565732730 /nfs/dbraw/zinc/73/27/30/565732730.db2.gz CYUWGEKAKMFIAO-UHFFFAOYSA-N 0 1 382.295 3.310 10 0 GGAEMN Cc1nc([C@@H](C)N[C@H](C)c2nc(-c3ccc(Br)cc3)no2)n[nH]1 ZINC000411525311 565734557 /nfs/dbraw/zinc/73/45/57/565734557.db2.gz ASFBQVVVWJNURW-RKDXNWHRSA-N 0 1 377.246 3.337 10 0 GGAEMN Cc1nn(C)c(C)c1[C@H](NS(=O)(=O)c1c(C)cccc1F)C(F)(F)F ZINC000331047620 565736697 /nfs/dbraw/zinc/73/66/97/565736697.db2.gz GLZREPMCIIURGK-AWEZNQCLSA-N 0 1 379.379 3.066 10 0 GGAEMN Cc1nc([C@H](C)N(C)Cc2cccc(Br)c2OCC(C)(C)O)n[nH]1 ZINC000411614629 565739872 /nfs/dbraw/zinc/73/98/72/565739872.db2.gz FMUOUZODXVRMQH-NSHDSACASA-N 0 1 397.317 3.218 10 0 GGAEMN COC(=O)c1cc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cs1 ZINC000411630803 565741211 /nfs/dbraw/zinc/74/12/11/565741211.db2.gz KFIOUBAJEBMCCR-WMLDXEAASA-N 0 1 378.881 3.250 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@H](C)C(=O)N1CCC[C@H](C(N)=O)C1 ZINC000331292645 565753406 /nfs/dbraw/zinc/75/34/06/565753406.db2.gz LNBZACBZYFFWDN-HIFRSBDPSA-N 0 1 396.329 3.352 10 0 GGAEMN O=S(=O)(NCCC[C@H]1CCCC[C@@H]1O)c1cc(C(F)(F)F)ccc1O ZINC000331352283 565756247 /nfs/dbraw/zinc/75/62/47/565756247.db2.gz ZHBKMTWUHFDOEI-YPMHNXCESA-N 0 1 381.416 3.021 10 0 GGAEMN C[C@H](COCC(F)(F)F)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000282036142 565761321 /nfs/dbraw/zinc/76/13/21/565761321.db2.gz FSRLDJRAVIGHSP-SSDOTTSWSA-N 0 1 380.164 3.023 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1ccoc1Br ZINC000193592281 565763542 /nfs/dbraw/zinc/76/35/42/565763542.db2.gz SVJJTROOGNRVKB-WFASDCNBSA-N 0 1 378.270 3.078 10 0 GGAEMN COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc(Br)cc(Cl)c2O)C1 ZINC000412218200 565774191 /nfs/dbraw/zinc/77/41/91/565774191.db2.gz MRLRFVQJSPXYHT-JGVFFNPUSA-N 0 1 376.634 3.336 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ccoc2Br)CC1 ZINC000193775832 565775061 /nfs/dbraw/zinc/77/50/61/565775061.db2.gz INIWKFOHZAEQPF-UHFFFAOYSA-N 0 1 378.270 3.436 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCC[C@@H]1C[C@H](O)c1ccccc1 ZINC000176487208 565776683 /nfs/dbraw/zinc/77/66/83/565776683.db2.gz DMFBMMFCQIILMJ-OLZOCXBDSA-N 0 1 381.548 3.407 10 0 GGAEMN Cc1noc(C)c1[C@H](C)CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000282541256 565785165 /nfs/dbraw/zinc/78/51/65/565785165.db2.gz QZWCFXQQRUEMMX-MRVPVSSYSA-N 0 1 377.242 3.464 10 0 GGAEMN Cc1noc(C)c1[C@@H](C)CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000282541262 565785231 /nfs/dbraw/zinc/78/52/31/565785231.db2.gz QZWCFXQQRUEMMX-QMMMGPOBSA-N 0 1 377.242 3.464 10 0 GGAEMN CO[C@H](C)c1nc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cs1 ZINC000282559829 565785838 /nfs/dbraw/zinc/78/58/38/565785838.db2.gz SOOFHZPEKQEEAX-MRVPVSSYSA-N 0 1 395.282 3.419 10 0 GGAEMN O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cc(Br)cc2nc[nH]c21 ZINC000282649283 565790576 /nfs/dbraw/zinc/79/05/76/565790576.db2.gz ZYTOGGBTXLOOOI-UHFFFAOYSA-N 0 1 390.241 3.195 10 0 GGAEMN CCS(=O)(=O)c1cc(Cl)cc(CNC(=O)c2c(C)n[nH]c2C(C)C)c1 ZINC000412490501 565793751 /nfs/dbraw/zinc/79/37/51/565793751.db2.gz QEVMVSPURVSFFB-UHFFFAOYSA-N 0 1 383.901 3.219 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@H](C)c3cc(Br)cs3)C2=O)n(C)n1 ZINC000194148589 565796795 /nfs/dbraw/zinc/79/67/95/565796795.db2.gz HODQZUHCIQSTIG-DGCLKSJQSA-N 0 1 397.342 3.399 10 0 GGAEMN Cc1ccc(I)c(C(=O)Nc2ccc3[nH]nnc3c2)c1 ZINC000176736867 565799511 /nfs/dbraw/zinc/79/95/11/565799511.db2.gz NXNOAMBJOYIWGL-UHFFFAOYSA-N 0 1 378.173 3.123 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1n[nH]nc1-c1ccccc1 ZINC000194235120 565804073 /nfs/dbraw/zinc/80/40/73/565804073.db2.gz QUMOPCQIUBUZQS-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN CN(C)CCN(Cc1cccs1)S(=O)(=O)c1cccc2ncccc21 ZINC000176795457 565804254 /nfs/dbraw/zinc/80/42/54/565804254.db2.gz TZMLCSMCGWUOQR-UHFFFAOYSA-N 0 1 375.519 3.049 10 0 GGAEMN C[C@@H]1C[NH+](Cc2ccccc2NC(=O)c2s[n-]c(=O)c2Cl)C[C@@H](C)O1 ZINC000283009985 565805935 /nfs/dbraw/zinc/80/59/35/565805935.db2.gz LFKCDCLQZHXFPP-GHMZBOCLSA-N 0 1 381.885 3.364 10 0 GGAEMN Brc1ccc(C2(NCc3cn4cccnc4n3)CCOCC2)cc1 ZINC000194312862 565807959 /nfs/dbraw/zinc/80/79/59/565807959.db2.gz GLHJPVUOSJCIBW-UHFFFAOYSA-N 0 1 387.281 3.287 10 0 GGAEMN CCc1nc(CS(=O)(=O)Cc2nc(-c3ccccc3Cl)cs2)n[nH]1 ZINC000194446877 565815597 /nfs/dbraw/zinc/81/55/97/565815597.db2.gz ABQWXQZKLITTDE-UHFFFAOYSA-N 0 1 382.898 3.259 10 0 GGAEMN C[C@H](NC[C@H]1CCC2(CCOCC2)[C@H]1O)c1ncc(Br)cc1F ZINC000283367249 565817432 /nfs/dbraw/zinc/81/74/32/565817432.db2.gz NSXJXZBUPWGRBW-OZVIIMIRSA-N 0 1 387.293 3.202 10 0 GGAEMN CCc1nnc(CSc2nc(-c3ccccc3Br)n[nH]2)n1C ZINC000194669479 565830181 /nfs/dbraw/zinc/83/01/81/565830181.db2.gz PDYPEDQMBSYWNF-UHFFFAOYSA-N 0 1 379.287 3.217 10 0 GGAEMN Brc1ccc2c(ccnc2N2CC[C@H](CN3CCOCC3)C2)c1 ZINC000413176353 565838748 /nfs/dbraw/zinc/83/87/48/565838748.db2.gz RSHSWVGESCSLBG-CQSZACIVSA-N 0 1 376.298 3.156 10 0 GGAEMN CCS(=O)(=O)c1ccc([C@H](C)NCc2cncc(Br)c2)cc1 ZINC000284022216 565839315 /nfs/dbraw/zinc/83/93/15/565839315.db2.gz NTJGRLOAACVGAV-LBPRGKRZSA-N 0 1 383.311 3.489 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000284127752 565843075 /nfs/dbraw/zinc/84/30/75/565843075.db2.gz UHRCVENFOFEYRE-GOEBONIOSA-N 0 1 396.329 3.087 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@@H]1CCCC[C@H]1F ZINC000413293616 565844910 /nfs/dbraw/zinc/84/49/10/565844910.db2.gz HJVQPBIXULXBET-CHWSQXEVSA-N 0 1 396.264 3.314 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@@H]1CCCC[C@H]1F ZINC000413293616 565844915 /nfs/dbraw/zinc/84/49/15/565844915.db2.gz HJVQPBIXULXBET-CHWSQXEVSA-N 0 1 396.264 3.314 10 0 GGAEMN C[C@H](c1ccccc1Br)N(C)C(=O)NCCCCN1CCOCC1 ZINC000195061061 565855770 /nfs/dbraw/zinc/85/57/70/565855770.db2.gz UQMSEAGWIGFFSG-OAHLLOKOSA-N 0 1 398.345 3.264 10 0 GGAEMN CCSc1ccc(Cl)cc1C(=O)N1CCO[C@@H](c2n[nH]c(CC)n2)C1 ZINC000177502781 565856202 /nfs/dbraw/zinc/85/62/02/565856202.db2.gz HAJZGMPCLLKUTA-CYBMUJFWSA-N 0 1 380.901 3.346 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)CN(Cc1ccccn1)C1CC1 ZINC000195132227 565860920 /nfs/dbraw/zinc/86/09/20/565860920.db2.gz MCWJBXBGLQNRMQ-KRWDZBQOSA-N 0 1 377.282 3.248 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)CN(Cc1ccccn1)C1CC1 ZINC000195132237 565861019 /nfs/dbraw/zinc/86/10/19/565861019.db2.gz MCWJBXBGLQNRMQ-QGZVFWFLSA-N 0 1 377.282 3.248 10 0 GGAEMN CC(C)(C)c1csc(CS(=O)(=O)c2n[nH]c(Cc3cccs3)n2)n1 ZINC000195162901 565863487 /nfs/dbraw/zinc/86/34/87/565863487.db2.gz GZDIVKRBELIQRE-UHFFFAOYSA-N 0 1 382.536 3.185 10 0 GGAEMN COc1cc(Br)cc(C)c1NC(=O)N1CCN2CCCC[C@H]2C1 ZINC000195221918 565867226 /nfs/dbraw/zinc/86/72/26/565867226.db2.gz JBRZOOJXGHEMHK-AWEZNQCLSA-N 0 1 382.302 3.468 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC2(CCOCC2)CC1 ZINC000284788352 565870449 /nfs/dbraw/zinc/87/04/49/565870449.db2.gz VFDFCBNVEBUVFV-UHFFFAOYSA-N 0 1 378.270 3.358 10 0 GGAEMN C[C@@H]1CNCCN1C(=O)N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21 ZINC000333514653 565886164 /nfs/dbraw/zinc/88/61/64/565886164.db2.gz FYSXXBHCGLZPOS-BDJLRTHQSA-N 0 1 391.313 3.311 10 0 GGAEMN Cc1noc2ncnc(NCc3n[nH]c(-c4ccc(Br)cc4)n3)c12 ZINC000195512770 565889080 /nfs/dbraw/zinc/88/90/80/565889080.db2.gz KCOZKCDQJCTASC-UHFFFAOYSA-N 0 1 386.213 3.086 10 0 GGAEMN Cc1noc2ncnc(NCc3nc(-c4ccc(Br)cc4)n[nH]3)c12 ZINC000195512770 565889088 /nfs/dbraw/zinc/88/90/88/565889088.db2.gz KCOZKCDQJCTASC-UHFFFAOYSA-N 0 1 386.213 3.086 10 0 GGAEMN CC1(C)CN(CCCOc2cccc(I)c2)CCO1 ZINC000195651955 565891402 /nfs/dbraw/zinc/89/14/02/565891402.db2.gz OVWYRFRRZJXYGE-UHFFFAOYSA-N 0 1 375.250 3.171 10 0 GGAEMN COc1cccc(Cl)c1CN[C@@H](C)Cn1cc(Br)ccc1=O ZINC000414143144 565899222 /nfs/dbraw/zinc/89/92/22/565899222.db2.gz SIATXZIMPZBFCH-NSHDSACASA-N 0 1 385.689 3.451 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccccc1Br)c1ccc2c(c1)OCO2 ZINC000178167608 565903277 /nfs/dbraw/zinc/90/32/77/565903277.db2.gz REBSKAXPSOPJGM-LLVKDONJSA-N 0 1 377.238 3.467 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 ZINC000220550416 565903832 /nfs/dbraw/zinc/90/38/32/565903832.db2.gz QTPXCUFKXAWHHX-LBPRGKRZSA-N 0 1 379.291 3.170 10 0 GGAEMN C[C@@H](N[C@H](C)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccs1 ZINC000178174027 565904312 /nfs/dbraw/zinc/90/43/12/565904312.db2.gz NDEQQIFEUSLADM-HUUCEWRRSA-N 0 1 380.535 3.181 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3cc(Cl)ccc3SC)CCO2)n[nH]1 ZINC000178180837 565904606 /nfs/dbraw/zinc/90/46/06/565904606.db2.gz FPXIPZXKYZDBLJ-GFCCVEGCSA-N 0 1 381.889 3.348 10 0 GGAEMN CN(C)C[C@@H](NCc1ncc(I)s1)c1ccccc1 ZINC000285474985 565909502 /nfs/dbraw/zinc/90/95/02/565909502.db2.gz OBXSPAWFPQKHGQ-GFCCVEGCSA-N 0 1 387.290 3.140 10 0 GGAEMN COC[C@H](CCO)N[C@H](C)c1ccc(Br)cc1Br ZINC000223952598 565910309 /nfs/dbraw/zinc/91/03/09/565910309.db2.gz JDRMLIAEIPQKDJ-KOLCDFICSA-N 0 1 381.108 3.260 10 0 GGAEMN Cc1cc(CNC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)n[nH]1 ZINC000603559995 565911529 /nfs/dbraw/zinc/91/15/29/565911529.db2.gz XWIWXCPRPNASFW-UHFFFAOYSA-N 0 1 378.458 3.323 10 0 GGAEMN COC(=O)c1cncc(NS(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1 ZINC000178333184 565913969 /nfs/dbraw/zinc/91/39/69/565913969.db2.gz FQECBUGKQSEMKD-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN COC(=O)c1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)s1 ZINC000285634610 565918049 /nfs/dbraw/zinc/91/80/49/565918049.db2.gz AKCMXOCHHAQHQC-MRXNPFEDSA-N 0 1 384.295 3.295 10 0 GGAEMN CN(Cc1ccc([S@](C)=O)cc1)C[C@H](O)COCc1ccc(Cl)cc1 ZINC000178427216 565918777 /nfs/dbraw/zinc/91/87/77/565918777.db2.gz KAQJGFADGFVNBV-BVZFJXPGSA-N 0 1 381.925 3.087 10 0 GGAEMN CN1C(=O)N([C@H]2CCc3nc[nH]c3C2)C(=O)[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000348983289 565920154 /nfs/dbraw/zinc/92/01/54/565920154.db2.gz HSOVESJJSWOXFG-BONVTDFDSA-N 0 1 379.247 3.209 10 0 GGAEMN COc1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc1OC ZINC000285667255 565920324 /nfs/dbraw/zinc/92/03/24/565920324.db2.gz ZNRJZKCGGNYMDR-SFHVURJKSA-N 0 1 380.282 3.464 10 0 GGAEMN COc1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cc1OC ZINC000285667250 565920499 /nfs/dbraw/zinc/92/04/99/565920499.db2.gz ZNRJZKCGGNYMDR-GOSISDBHSA-N 0 1 380.282 3.464 10 0 GGAEMN CN1C(=O)N([C@H]2CCc3nc[nH]c3C2)C(=O)[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000348983291 565920643 /nfs/dbraw/zinc/92/06/43/565920643.db2.gz HSOVESJJSWOXFG-ZUZCIYMTSA-N 0 1 379.247 3.209 10 0 GGAEMN CCS(=O)(=O)N(C)C1CCN(Cc2ccc(C(F)(F)F)c(C)c2)CC1 ZINC000414390222 565922183 /nfs/dbraw/zinc/92/21/83/565922183.db2.gz WBIFQDQQBOXLKD-UHFFFAOYSA-N 0 1 378.460 3.260 10 0 GGAEMN C[NH+](C)Cc1ccc([N-]S(=O)(=O)c2cccnc2C(F)(F)F)c(F)c1 ZINC000414401727 565924776 /nfs/dbraw/zinc/92/47/76/565924776.db2.gz WMYFOVJRYTWIBF-UHFFFAOYSA-N 0 1 377.363 3.102 10 0 GGAEMN O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)c1n[nH]c2ccc(Br)cc21 ZINC000178541510 565925785 /nfs/dbraw/zinc/92/57/85/565925785.db2.gz JBQUBBQTOUJUBW-BZNIZROVSA-N 0 1 396.310 3.110 10 0 GGAEMN O=C(N[C@H]1CCO[C@]2(CCSC2)C1)c1n[nH]c2ccc(Br)cc21 ZINC000178541497 565925876 /nfs/dbraw/zinc/92/58/76/565925876.db2.gz JBQUBBQTOUJUBW-MEDUHNTESA-N 0 1 396.310 3.110 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccc3nnc(C(C)C)n3c2)ccc1Cl ZINC000414452105 565934989 /nfs/dbraw/zinc/93/49/89/565934989.db2.gz KGHHOUFXOITKFB-UHFFFAOYSA-N 0 1 380.857 3.316 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)c1Br ZINC000414471670 565940567 /nfs/dbraw/zinc/94/05/67/565940567.db2.gz QCPGZPPDYSZGOZ-UHFFFAOYSA-N 0 1 398.204 3.441 10 0 GGAEMN COc1cc(-c2noc(CC3CC[NH+](C)CC3)n2)cc(Br)c1[O-] ZINC000350614867 565940605 /nfs/dbraw/zinc/94/06/05/565940605.db2.gz YJBNPWHAHWEWKU-UHFFFAOYSA-N 0 1 382.258 3.098 10 0 GGAEMN CCS(=O)(=O)c1cc(Cl)cc(CNCc2c(C)cc(OC)nc2C)c1 ZINC000414492966 565941815 /nfs/dbraw/zinc/94/18/15/565941815.db2.gz HIHILWSZQCFRPT-UHFFFAOYSA-N 0 1 382.913 3.444 10 0 GGAEMN CC(C)[C@H](NS(=O)(=O)c1ccc(F)cc1Br)C(F)(F)F ZINC000414479176 565942137 /nfs/dbraw/zinc/94/21/37/565942137.db2.gz QZXBZQQVILJJBB-JTQLQIEISA-N 0 1 378.185 3.453 10 0 GGAEMN Cc1c(Br)cc(CNC2(C(=O)N(C)C)CC2)cc1Br ZINC000414480237 565942145 /nfs/dbraw/zinc/94/21/45/565942145.db2.gz BZNQDPAJKYERII-UHFFFAOYSA-N 0 1 390.119 3.230 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)CCN1C ZINC000286097173 565942324 /nfs/dbraw/zinc/94/23/24/565942324.db2.gz UNYBOMMDCSWUSE-CMPLNLGQSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)CCN1C ZINC000286097175 565942694 /nfs/dbraw/zinc/94/26/94/565942694.db2.gz UNYBOMMDCSWUSE-JQWIXIFHSA-N 0 1 384.851 3.462 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2cc(Cl)ccc2F)[C@@H]1c1ccccc1 ZINC000178943669 565947550 /nfs/dbraw/zinc/94/75/50/565947550.db2.gz FALMTGYZMVZRKR-MSOLQXFVSA-N 0 1 382.888 3.344 10 0 GGAEMN CC(C)N(Cc1cnn(-c2ccc(Br)cc2)c1)C[C@@H]1CCC(=O)N1 ZINC000414556621 565947893 /nfs/dbraw/zinc/94/78/93/565947893.db2.gz KJKAFDIFMZJRIO-INIZCTEOSA-N 0 1 391.313 3.124 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2cc(Cl)ccc2F)[C@@H]1c1ccccc1 ZINC000178943657 565947874 /nfs/dbraw/zinc/94/78/74/565947874.db2.gz FALMTGYZMVZRKR-ROUUACIJSA-N 0 1 382.888 3.344 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2ccc(F)c(Cl)c2)[C@@H]1c1ccccc1 ZINC000178947754 565949060 /nfs/dbraw/zinc/94/90/60/565949060.db2.gz URGDFFSEGCLVJQ-MSOLQXFVSA-N 0 1 382.888 3.344 10 0 GGAEMN COC(=O)[C@H]1CSCCN(CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000414570500 565949339 /nfs/dbraw/zinc/94/93/39/565949339.db2.gz ROSXNEAMIJDFEP-CQSZACIVSA-N 0 1 398.322 3.063 10 0 GGAEMN CCOc1cc(CN2CCSC[C@@H](C(=O)OC)C2)ccc1OC(F)F ZINC000414573568 565949465 /nfs/dbraw/zinc/94/94/65/565949465.db2.gz ZDNNUUCYZFUGKX-ZDUSSCGKSA-N 0 1 375.437 3.025 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)[C@H](O)Cc1ccccc1 ZINC000178984270 565949540 /nfs/dbraw/zinc/94/95/40/565949540.db2.gz MQHWIPSXDROHQX-BDJLRTHQSA-N 0 1 388.265 3.047 10 0 GGAEMN FC(F)(F)c1nc(NCc2nnc([C@H]3CCOC3)[nH]2)sc1Br ZINC000631374487 565955612 /nfs/dbraw/zinc/95/56/12/565955612.db2.gz MQVPEBCKTQJIHD-YFKPBYRVSA-N 0 1 398.208 3.159 10 0 GGAEMN FC(F)(F)c1nc(NCc2n[nH]c([C@H]3CCOC3)n2)sc1Br ZINC000631374487 565955615 /nfs/dbraw/zinc/95/56/15/565955615.db2.gz MQVPEBCKTQJIHD-YFKPBYRVSA-N 0 1 398.208 3.159 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H](C)c2ccc(Br)cc2F)[nH]1 ZINC000286410236 565957951 /nfs/dbraw/zinc/95/79/51/565957951.db2.gz FFJMHBPHZCKFDM-QMMMGPOBSA-N 0 1 387.278 3.374 10 0 GGAEMN CN(C)C(=O)Sc1ccc(CN2CC[C@@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286540571 565965974 /nfs/dbraw/zinc/96/59/74/565965974.db2.gz ODGAAKLAUQXBIT-DZGCQCFKSA-N 0 1 376.444 3.453 10 0 GGAEMN CN(C)C(=O)Sc1ccc(CN2CC[C@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286540581 565966088 /nfs/dbraw/zinc/96/60/88/565966088.db2.gz ODGAAKLAUQXBIT-ZFWWWQNUSA-N 0 1 376.444 3.453 10 0 GGAEMN O=C(Nc1cc(Cl)ccc1N1CCSCC1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000415111408 565973339 /nfs/dbraw/zinc/97/33/39/565973339.db2.gz BUSANLGTLOYOIJ-GASCZTMLSA-N 0 1 380.945 3.251 10 0 GGAEMN CC(=O)Nc1cccc(CN[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000286696181 565975224 /nfs/dbraw/zinc/97/52/24/565975224.db2.gz WETBFCPRWRSQGC-GOSISDBHSA-N 0 1 377.282 3.405 10 0 GGAEMN Cc1ccccc1NC(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000286707811 565975788 /nfs/dbraw/zinc/97/57/88/565975788.db2.gz WQJIBOOUWMQROP-GOSISDBHSA-N 0 1 377.282 3.193 10 0 GGAEMN O=C([C@@H]1C[C@@H]1c1ccc(Br)cc1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000179358104 565976696 /nfs/dbraw/zinc/97/66/96/565976696.db2.gz AESLJFKFOBUIDT-RBSFLKMASA-N 0 1 375.270 3.425 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000179358094 565976728 /nfs/dbraw/zinc/97/67/28/565976728.db2.gz AESLJFKFOBUIDT-RRFJBIMHSA-N 0 1 375.270 3.425 10 0 GGAEMN Brc1ccc(-n2cc(CN3CCC[C@H](n4cncn4)C3)cn2)cc1 ZINC000179466880 565981853 /nfs/dbraw/zinc/98/18/53/565981853.db2.gz UFPGDNIEFCOQKA-KRWDZBQOSA-N 0 1 387.285 3.063 10 0 GGAEMN CCCC(=O)N[C@H]1CCC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000245200990 565987485 /nfs/dbraw/zinc/98/74/85/565987485.db2.gz NMGDLKKGEDSELS-LSDHHAIUSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000245200990 565987488 /nfs/dbraw/zinc/98/74/88/565987488.db2.gz NMGDLKKGEDSELS-LSDHHAIUSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000245199348 565987675 /nfs/dbraw/zinc/98/76/75/565987675.db2.gz CGQHNXFEXQSOLV-HUUCEWRRSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000245199348 565987677 /nfs/dbraw/zinc/98/76/77/565987677.db2.gz CGQHNXFEXQSOLV-HUUCEWRRSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000245200987 565987896 /nfs/dbraw/zinc/98/78/96/565987896.db2.gz NMGDLKKGEDSELS-HUUCEWRRSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000245200987 565987901 /nfs/dbraw/zinc/98/79/01/565987901.db2.gz NMGDLKKGEDSELS-HUUCEWRRSA-N 0 1 389.323 3.114 10 0 GGAEMN O=C([C@@H]1C[C@@H]1c1ccc(Br)cc1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000245578179 565997290 /nfs/dbraw/zinc/99/72/90/565997290.db2.gz AESLJFKFOBUIDT-KFWWJZLASA-N 0 1 375.270 3.425 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2cc(Cl)ccc2F)[C@H]1c1ccccc1 ZINC000245620644 565998573 /nfs/dbraw/zinc/99/85/73/565998573.db2.gz FALMTGYZMVZRKR-QZTJIDSGSA-N 0 1 382.888 3.344 10 0 GGAEMN CN1CC[C@@H](CNC(=O)NCc2cscn2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245667293 566000004 /nfs/dbraw/zinc/00/00/04/566000004.db2.gz HGTOPAAJZIARNK-BLLLJJGKSA-N 0 1 382.892 3.428 10 0 GGAEMN CN1CC[C@H](CNC(=O)COCC(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245642254 566000062 /nfs/dbraw/zinc/00/00/62/566000062.db2.gz AOQFVHKUASXWKO-IAQYHMDHSA-N 0 1 382.785 3.167 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)c(Cl)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000179682757 566000058 /nfs/dbraw/zinc/00/00/58/566000058.db2.gz GTSASNRJCBXDHV-ZDUSSCGKSA-N 0 1 375.281 3.169 10 0 GGAEMN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1ccc(OC(F)F)c(Br)c1 ZINC000179719999 566002692 /nfs/dbraw/zinc/00/26/92/566002692.db2.gz RFLXHKOCEMXALA-KOLCDFICSA-N 0 1 377.229 3.136 10 0 GGAEMN O[C@]12CCCC[C@H]1CN(Cc1cc(Br)c3c(c1)OCCO3)CC2 ZINC000245725195 566002775 /nfs/dbraw/zinc/00/27/75/566002775.db2.gz IRVVNVSYQSBMRS-KSSFIOAISA-N 0 1 382.298 3.347 10 0 GGAEMN Cc1nc([C@H]2CN([C@H]3CCCc4ccc(Br)cc43)CCO2)n[nH]1 ZINC000245735149 566005296 /nfs/dbraw/zinc/00/52/96/566005296.db2.gz FOQIGJBOHZANBX-JKSUJKDBSA-N 0 1 377.286 3.327 10 0 GGAEMN C[C@@H]1CN(C(=O)Nc2ccc(Br)cc2OC(F)(F)F)CCN1 ZINC000415574288 566005682 /nfs/dbraw/zinc/00/56/82/566005682.db2.gz DKVBOYDOLUENCK-MRVPVSSYSA-N 0 1 382.180 3.173 10 0 GGAEMN Cc1[nH]ncc1CNC(=O)Nc1cc(C(F)(F)F)cc(Br)n1 ZINC000287229672 566005724 /nfs/dbraw/zinc/00/57/24/566005724.db2.gz ALESXPASICLXNU-UHFFFAOYSA-N 0 1 378.152 3.216 10 0 GGAEMN CN1CC[C@H](CNC(=O)[C@@H]2CSCCS2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245755549 566005791 /nfs/dbraw/zinc/00/57/91/566005791.db2.gz YHURWUIYUBXBLC-UHOFOFEASA-N 0 1 388.961 3.437 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCc2cc(F)c(F)cc2Br)n[nH]1 ZINC000287269253 566008167 /nfs/dbraw/zinc/00/81/67/566008167.db2.gz YBMBCVLBRGFXSH-QMMMGPOBSA-N 0 1 387.228 3.189 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCc2cc(F)c(F)cc2Br)n[nH]1 ZINC000287269246 566008228 /nfs/dbraw/zinc/00/82/28/566008228.db2.gz YBMBCVLBRGFXSH-MRVPVSSYSA-N 0 1 387.228 3.189 10 0 GGAEMN O=C(CC[N@H+]1CCC[C@H](c2ccncn2)C1)Nc1cccc(Br)c1 ZINC000363550279 566009642 /nfs/dbraw/zinc/00/96/42/566009642.db2.gz ZKYYIGHCNSWODK-AWEZNQCLSA-N 0 1 389.297 3.447 10 0 GGAEMN CC(C)C(=O)N1CCC[C@@H]1C(=O)Nc1cc(Cl)cc(Br)c1O ZINC000179819277 566010633 /nfs/dbraw/zinc/01/06/33/566010633.db2.gz PGVSMKCJJLYRRL-GFCCVEGCSA-N 0 1 389.677 3.394 10 0 GGAEMN O[C@H](C[N@H+]1CCC[C@@H](c2nncn2C2CC2)C1)c1cccc(Br)c1 ZINC000245958912 566012255 /nfs/dbraw/zinc/01/22/55/566012255.db2.gz CZXMIFPLOZTULT-RHSMWYFYSA-N 0 1 391.313 3.289 10 0 GGAEMN O[C@H](CN1CCC[C@@H](c2nncn2C2CC2)C1)c1cccc(Br)c1 ZINC000245958912 566012264 /nfs/dbraw/zinc/01/22/64/566012264.db2.gz CZXMIFPLOZTULT-RHSMWYFYSA-N 0 1 391.313 3.289 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)CCc2ccccc2)[C@H]1c1cccs1 ZINC000246099048 566015594 /nfs/dbraw/zinc/01/55/94/566015594.db2.gz HIBNARLHJKKSKD-HKUYNNGSSA-N 0 1 378.563 3.293 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C[C@H](C)O ZINC000246129446 566019065 /nfs/dbraw/zinc/01/90/65/566019065.db2.gz QMCKFNLPWJURME-WCQYABFASA-N 0 1 378.822 3.276 10 0 GGAEMN O=C(CN1CCN2CCCC[C@H]2C1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000246167722 566019677 /nfs/dbraw/zinc/01/96/77/566019677.db2.gz ITSUIMQTKCFNNN-ZDUSSCGKSA-N 0 1 375.822 3.467 10 0 GGAEMN Cc1nnc(SCC(=O)N2CCC[C@@H]2c2ccc(Br)s2)[nH]1 ZINC000363745506 566019824 /nfs/dbraw/zinc/01/98/24/566019824.db2.gz DPQSKYZXVWGRRV-SECBINFHSA-N 0 1 387.328 3.393 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CCC[C@@H]2c2ccc(Br)s2)n1 ZINC000363745506 566019827 /nfs/dbraw/zinc/01/98/27/566019827.db2.gz DPQSKYZXVWGRRV-SECBINFHSA-N 0 1 387.328 3.393 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2ccc(F)c(F)c2)[C@H]1c1cccs1 ZINC000246191347 566020427 /nfs/dbraw/zinc/02/04/27/566020427.db2.gz OBHCTKGQCCQKCJ-PXAZEXFGSA-N 0 1 386.489 3.388 10 0 GGAEMN Cc1nc([C@@H](C)NC(=O)Nc2cc(C(F)(F)F)cc(Br)n2)n[nH]1 ZINC000287487110 566021288 /nfs/dbraw/zinc/02/12/88/566021288.db2.gz GQTYQCWTGOWMSH-RXMQYKEDSA-N 0 1 393.167 3.172 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2cccc(F)c2)[C@H]1c1cccs1 ZINC000246206239 566021491 /nfs/dbraw/zinc/02/14/91/566021491.db2.gz OZUJXFWOVSOZJW-YJBOKZPZSA-N 0 1 382.526 3.390 10 0 GGAEMN COc1ccccc1S(=O)(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000246195258 566021548 /nfs/dbraw/zinc/02/15/48/566021548.db2.gz OIKCNPWSRBVSBK-KDOFPFPSSA-N 0 1 380.535 3.118 10 0 GGAEMN CC(C)[C@H](C)CNC(=O)c1c[nH]c2ccc(I)cc2c1=O ZINC000179961337 566021858 /nfs/dbraw/zinc/02/18/58/566021858.db2.gz AJLMYJLRNYGCEZ-SNVBAGLBSA-N 0 1 398.244 3.155 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000363862517 566024018 /nfs/dbraw/zinc/02/40/18/566024018.db2.gz JNGFXLHWZWHFKP-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN O=C(CCc1cccc(Br)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000363854918 566024083 /nfs/dbraw/zinc/02/40/83/566024083.db2.gz AVCXYCSEBMTAGU-KRWDZBQOSA-N 0 1 385.265 3.406 10 0 GGAEMN CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2F)[C@@H](C)C1 ZINC000246274692 566024511 /nfs/dbraw/zinc/02/45/11/566024511.db2.gz VEJKOOVXBPVYLT-FZMZJTMJSA-N 0 1 382.423 3.195 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1ccc(Br)c(F)c1 ZINC000363862514 566024694 /nfs/dbraw/zinc/02/46/94/566024694.db2.gz JNGFXLHWZWHFKP-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN Cc1cc(Br)oc1C(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000363913593 566026052 /nfs/dbraw/zinc/02/60/52/566026052.db2.gz VFPGDEVZTZPANL-UHFFFAOYSA-N 0 1 375.226 3.108 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)N2CCN3CCCC[C@H]3C2)cc1Br ZINC000246407074 566028287 /nfs/dbraw/zinc/02/82/87/566028287.db2.gz KLTXYHGGSAANST-HIFRSBDPSA-N 0 1 396.329 3.398 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Nc2ccc3nccnc3c2Br)n[nH]1 ZINC000287629762 566030443 /nfs/dbraw/zinc/03/04/43/566030443.db2.gz IPYPFPSRAYLLLY-VIFPVBQESA-N 0 1 389.257 3.177 10 0 GGAEMN Brc1ccc(CN2CCCN(c3cccnn3)CC2)c2ncccc12 ZINC000180092077 566031403 /nfs/dbraw/zinc/03/14/03/566031403.db2.gz DBKKXVUVEMZVCB-UHFFFAOYSA-N 0 1 398.308 3.500 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1occc1Br ZINC000246540818 566032709 /nfs/dbraw/zinc/03/27/09/566032709.db2.gz STJIKUMIIUFKJT-IUODEOHRSA-N 0 1 378.270 3.078 10 0 GGAEMN CCC1(NC(=O)c2c[nH]c3ccc(I)cc3c2=O)CCC1 ZINC000180124084 566035139 /nfs/dbraw/zinc/03/51/39/566035139.db2.gz OZTIVTDHPBMJDK-UHFFFAOYSA-N 0 1 396.228 3.195 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(CCC(=O)Nc3ccc(Br)cc3)[C@H]2C1 ZINC000246807956 566042329 /nfs/dbraw/zinc/04/23/29/566042329.db2.gz PUIQHKHDDUOGET-IKGGRYGDSA-N 0 1 397.313 3.046 10 0 GGAEMN COc1cc(C)c(Br)cc1S(=O)(=O)Nc1ncccc1F ZINC000180265870 566048661 /nfs/dbraw/zinc/04/86/61/566048661.db2.gz OURVGPHEVUMSMG-UHFFFAOYSA-N 0 1 375.219 3.101 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Br)ccc2Cl)CCN1C[C@H](C)O ZINC000247022135 566049839 /nfs/dbraw/zinc/04/98/39/566049839.db2.gz WUJWUYYVABZAMX-WCQYABFASA-N 0 1 389.721 3.020 10 0 GGAEMN O=C(c1coc(Br)c1)N1CCC(CCCN2CCOCC2)CC1 ZINC000180286686 566051556 /nfs/dbraw/zinc/05/15/56/566051556.db2.gz QOFZFCBQSSMRED-UHFFFAOYSA-N 0 1 385.302 3.007 10 0 GGAEMN Cc1[nH]c(=S)sc1CC(=O)N[C@@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000247116554 566053579 /nfs/dbraw/zinc/05/35/79/566053579.db2.gz GCXFKUUOWODKHV-IUODEOHRSA-N 0 1 376.551 3.078 10 0 GGAEMN CS(=O)(=O)N1CCC[C@H](CN2CCc3sccc3[C@H]2c2cccs2)C1 ZINC000247415577 566060427 /nfs/dbraw/zinc/06/04/27/566060427.db2.gz ZYVOSVSCMGSBOX-KDOFPFPSSA-N 0 1 396.603 3.429 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000180438201 566062906 /nfs/dbraw/zinc/06/29/06/566062906.db2.gz BIGQDXTYCYHRGW-GFCCVEGCSA-N 0 1 386.882 3.013 10 0 GGAEMN COC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)c1 ZINC000416417859 566065818 /nfs/dbraw/zinc/06/58/18/566065818.db2.gz PDSJJGUTBMDTNO-JTQLQIEISA-N 0 1 383.857 3.021 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC(c3ccc(C)nc3)CC2)c1Br ZINC000364765848 566067622 /nfs/dbraw/zinc/06/76/22/566067622.db2.gz ANVBTXRZUQZJOT-UHFFFAOYSA-N 0 1 377.286 3.458 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000364814178 566070965 /nfs/dbraw/zinc/07/09/65/566070965.db2.gz OGFCPAGPELOFLW-VIFPVBQESA-N 0 1 377.217 3.080 10 0 GGAEMN CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2ncc(Br)s2)ncn1 ZINC000180573550 566073562 /nfs/dbraw/zinc/07/35/62/566073562.db2.gz CIXJEMWBFYPHMG-QWRGUYRKSA-N 0 1 397.346 3.057 10 0 GGAEMN CC[C@H](C)N[C@H](CNS(=O)(=O)c1ccc(Cl)c(OC)c1)c1ccco1 ZINC000416481607 566074215 /nfs/dbraw/zinc/07/42/15/566074215.db2.gz VORKTZMMXJNUCQ-SWLSCSKDSA-N 0 1 386.901 3.349 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(Br)c1)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000248198299 566075090 /nfs/dbraw/zinc/07/50/90/566075090.db2.gz XUPYBKYLZOYUFF-LBTNJELSSA-N 0 1 381.314 3.403 10 0 GGAEMN O=C1[C@@H](N=c2ccc3c(Cl)ccc(Cl)c3[nH]2)CCN1C1CCOCC1 ZINC000364910680 566075621 /nfs/dbraw/zinc/07/56/21/566075621.db2.gz RWFRTBGCDSITCK-HNNXBMFYSA-N 0 1 380.275 3.155 10 0 GGAEMN O=C(CN1CCN2CCCC[C@H]2C1)Nc1c(Cl)cccc1C(F)(F)F ZINC000248372367 566076072 /nfs/dbraw/zinc/07/60/72/566076072.db2.gz ZVVXOIUKKUQITB-LBPRGKRZSA-N 0 1 375.822 3.467 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1cc(Br)ccc1F ZINC000365021646 566078802 /nfs/dbraw/zinc/07/88/02/566078802.db2.gz ZVTMEDAWVCECHW-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN COCCCCS(=O)(=O)N1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000416528812 566081025 /nfs/dbraw/zinc/08/10/25/566081025.db2.gz DLEOCDSDQRYJLS-INIZCTEOSA-N 0 1 385.917 3.500 10 0 GGAEMN CS[C@H](CO)[C@H](C)N[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000248546066 566081671 /nfs/dbraw/zinc/08/16/71/566081671.db2.gz FMRFCCWKYBHIDR-IUIKQTSFSA-N 0 1 382.327 3.031 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)CN(Cc1cccnc1)C1CC1 ZINC000180727957 566084249 /nfs/dbraw/zinc/08/42/49/566084249.db2.gz YGOSMHRWWSZRTE-QGZVFWFLSA-N 0 1 377.282 3.248 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2ccc(Cl)c(F)c2)[C@H]1c1ccccc1 ZINC000248674729 566085484 /nfs/dbraw/zinc/08/54/84/566085484.db2.gz XJSQZEDWIKEDPF-ZWKOTPCHSA-N 0 1 382.888 3.344 10 0 GGAEMN COc1c(C)cc(C)cc1S(=O)(=O)N(CCN(C)C)Cc1ccsc1 ZINC000416550596 566086150 /nfs/dbraw/zinc/08/61/50/566086150.db2.gz FFEVZNKMUDTJBX-UHFFFAOYSA-N 0 1 382.551 3.126 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000248881568 566091340 /nfs/dbraw/zinc/09/13/40/566091340.db2.gz XATDPXCPYDUXFK-IETSOEAISA-N 0 1 378.270 3.099 10 0 GGAEMN O[C@@H](CC1CCCC1)CN1CCCN(c2nnc(C(F)(F)F)s2)CC1 ZINC000365282381 566094027 /nfs/dbraw/zinc/09/40/27/566094027.db2.gz UEUMRNJRBCJFHN-ZDUSSCGKSA-N 0 1 378.464 3.010 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC(Nc3nc(C)cs3)CC2)c1Br ZINC000365316088 566095688 /nfs/dbraw/zinc/09/56/88/566095688.db2.gz PNBDRYMEBUZWKC-UHFFFAOYSA-N 0 1 398.330 3.216 10 0 GGAEMN C[C@@H](CC(=O)N1CCN(CC(C)(C)O)C[C@H]1C)c1ccc(Br)cc1 ZINC000249351004 566100631 /nfs/dbraw/zinc/10/06/31/566100631.db2.gz KJRCAAIEVLYURT-LSDHHAIUSA-N 0 1 397.357 3.246 10 0 GGAEMN C[C@@H](CC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1)c1ccc(Br)cc1 ZINC000249431798 566101594 /nfs/dbraw/zinc/10/15/94/566101594.db2.gz ZIXHWRMUQVDUOS-LSDHHAIUSA-N 0 1 397.357 3.246 10 0 GGAEMN C[C@@H](CC(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1)c1ccc(Br)cc1 ZINC000249431794 566101805 /nfs/dbraw/zinc/10/18/05/566101805.db2.gz ZIXHWRMUQVDUOS-GJZGRUSLSA-N 0 1 397.357 3.246 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](CCO)c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000289028681 566101878 /nfs/dbraw/zinc/10/18/78/566101878.db2.gz ASTKWLLJTDTCAC-MGPLVRAMSA-N 0 1 385.295 3.379 10 0 GGAEMN O=C1[C@H](N2C[C@@H](c3ccsc3)[C@H](CO)C2)CCN1c1ccc(Cl)cc1 ZINC000249553034 566103669 /nfs/dbraw/zinc/10/36/69/566103669.db2.gz IRZPSACDFZVSRT-JCGIZDLHSA-N 0 1 376.909 3.215 10 0 GGAEMN C[C@H](NC(=O)CN1C[C@@H](c2ccsc2)[C@H](CO)C1)c1ccc(Cl)cc1 ZINC000249565749 566104891 /nfs/dbraw/zinc/10/48/91/566104891.db2.gz MYODXOIGCUKXGB-OWQGQXMQSA-N 0 1 378.925 3.287 10 0 GGAEMN OC[C@@H]1CN(Cc2cc3c(cc2Br)OCO3)C[C@H]1c1ccsc1 ZINC000249596366 566105359 /nfs/dbraw/zinc/10/53/59/566105359.db2.gz WYKASLFURGGZJS-KBPBESRZSA-N 0 1 396.306 3.447 10 0 GGAEMN C[C@@H]1CN(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)[C@@H](C)CN1CCO ZINC000416736903 566105641 /nfs/dbraw/zinc/10/56/41/566105641.db2.gz PWIKRSQJGMCKDL-MNOVXSKESA-N 0 1 379.810 3.278 10 0 GGAEMN CC(=O)Nc1ccc(Cl)c(NS(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)c1 ZINC000416938626 566113012 /nfs/dbraw/zinc/11/30/12/566113012.db2.gz LIBDKWLQLKJJRN-JTQLQIEISA-N 0 1 382.873 3.193 10 0 GGAEMN CC[C@@H]1CN([C@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)CCN1CCOC ZINC000252352753 566114031 /nfs/dbraw/zinc/11/40/31/566114031.db2.gz MJEUEFFCBPTFQD-UKRRQHHQSA-N 0 1 388.339 3.363 10 0 GGAEMN C[C@@H]1CN(CCO)[C@@H](C)CN1C(=O)Nc1ccc(Br)c(Cl)c1 ZINC000416941690 566115098 /nfs/dbraw/zinc/11/50/98/566115098.db2.gz IJPOMYJRKPPLHL-WDEREUQCSA-N 0 1 390.709 3.021 10 0 GGAEMN Cn1cc([C@H]2CCN([C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)C2)cn1 ZINC000181115122 566116638 /nfs/dbraw/zinc/11/66/38/566116638.db2.gz HVFNRBFNKWTDSH-YVEFUNNKSA-N 0 1 379.291 3.322 10 0 GGAEMN CC(C)c1cc(Br)ccc1NC(=O)N1C[C@@H](C)N(CCO)C[C@@H]1C ZINC000416969014 566116946 /nfs/dbraw/zinc/11/69/46/566116946.db2.gz ZRXOXGYIBPUSSI-KGLIPLIRSA-N 0 1 398.345 3.491 10 0 GGAEMN Cc1cccc(S(=O)(=O)[N-]c2cc(N3CCNC3=O)ccc2F)c1Cl ZINC000253432777 566118176 /nfs/dbraw/zinc/11/81/76/566118176.db2.gz NZRZEFCDGAIJPF-UHFFFAOYSA-N 0 1 383.832 3.118 10 0 GGAEMN Cc1nc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](C[N-]C(=O)C(F)(F)F)C2)s1 ZINC000289414400 566121643 /nfs/dbraw/zinc/12/16/43/566121643.db2.gz HGDNQRIBVOQYON-VIFPVBQESA-N 0 1 389.365 3.361 10 0 GGAEMN CCn1cc([C@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cn1 ZINC000181278524 566129617 /nfs/dbraw/zinc/12/96/17/566129617.db2.gz YTOXPMFLHFZMCF-NSHDSACASA-N 0 1 375.274 3.301 10 0 GGAEMN Cc1ccc2c(c1C)OC[C@@H]2NC(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000261729197 566130740 /nfs/dbraw/zinc/13/07/40/566130740.db2.gz KUEQRUMHACHJIY-QFBILLFUSA-N 0 1 389.293 3.490 10 0 GGAEMN Cc1ccc2c(c1C)OC[C@@H]2NC(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261729195 566130765 /nfs/dbraw/zinc/13/07/65/566130765.db2.gz KUEQRUMHACHJIY-LPHOPBHVSA-N 0 1 389.293 3.490 10 0 GGAEMN C[C@H]1OCC[C@@]12CN(Cc1nc3ccc(Br)cc3[nH]1)C[C@@H](C)O2 ZINC000366072867 566134047 /nfs/dbraw/zinc/13/40/47/566134047.db2.gz LIVGVDCZWWDHIR-PSTGCABASA-N 0 1 380.286 3.094 10 0 GGAEMN O=C(COc1ccc(Br)cc1Cl)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181365998 566136493 /nfs/dbraw/zinc/13/64/93/566136493.db2.gz VEZXHTRPGBIZHG-LBPRGKRZSA-N 0 1 399.676 3.353 10 0 GGAEMN C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc(-n2cncn2)cc1 ZINC000181394058 566138519 /nfs/dbraw/zinc/13/85/19/566138519.db2.gz GPSZLEXPPVCATL-ACJLOTCBSA-N 0 1 387.281 3.414 10 0 GGAEMN CCc1cnc(CCNC(=O)[C@](C)(N)c2ccc(Br)cc2)s1 ZINC000261870997 566138601 /nfs/dbraw/zinc/13/86/01/566138601.db2.gz SJYRLLBHBSQRDH-MRXNPFEDSA-N 0 1 382.327 3.001 10 0 GGAEMN Cc1cc2ncc([C@@H](C)N[C@@H](CO)c3cccc(Br)c3)c(C)n2n1 ZINC000181400638 566138690 /nfs/dbraw/zinc/13/86/90/566138690.db2.gz WABFKKASJFCRCW-PXAZEXFGSA-N 0 1 389.297 3.493 10 0 GGAEMN Cc1cc2ncc([C@H](C)N[C@H](CO)c3cccc(Br)c3)c(C)n2n1 ZINC000181400695 566138821 /nfs/dbraw/zinc/13/88/21/566138821.db2.gz WABFKKASJFCRCW-YVEFUNNKSA-N 0 1 389.297 3.493 10 0 GGAEMN Cc1nc([C@H]2CCCOC2)sc1C(=O)NC[C@H](c1cccs1)N(C)C ZINC000366278855 566145102 /nfs/dbraw/zinc/14/51/02/566145102.db2.gz JQAAFYUKSFPDOQ-UONOGXRCSA-N 0 1 379.551 3.440 10 0 GGAEMN Cc1nc(SC(F)(F)F)sc1CC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000366288714 566145238 /nfs/dbraw/zinc/14/52/38/566145238.db2.gz QTWGTDUCZVQDDJ-MRVPVSSYSA-N 0 1 376.429 3.003 10 0 GGAEMN Cn1c(CNC(C)(C)COc2ncccc2Br)nnc1C1CCC1 ZINC000181534807 566148017 /nfs/dbraw/zinc/14/80/17/566148017.db2.gz UAFQRCVQRUJQSX-UHFFFAOYSA-N 0 1 394.317 3.187 10 0 GGAEMN C[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)nc1 ZINC000289953985 566150864 /nfs/dbraw/zinc/15/08/64/566150864.db2.gz WQGADJJXLDLLCI-XJKSGUPXSA-N 0 1 376.298 3.194 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C[C@]2(CCOC2)O1 ZINC000366520717 566155670 /nfs/dbraw/zinc/15/56/70/566155670.db2.gz KIOSJKHKUMYLQP-DIFFPNOSSA-N 0 1 381.885 3.202 10 0 GGAEMN COc1cc(Br)ccc1CCCN1CCN(c2cccnn2)CC1 ZINC000181674648 566157464 /nfs/dbraw/zinc/15/74/64/566157464.db2.gz GQNBPGWZZSHJDI-UHFFFAOYSA-N 0 1 391.313 3.003 10 0 GGAEMN COCc1cnc(C[NH2+][C@@H](CC(=O)[O-])c2cccc(Br)c2)s1 ZINC000417560253 566157654 /nfs/dbraw/zinc/15/76/54/566157654.db2.gz ZMKXIFAJDINWQA-ZDUSSCGKSA-N 0 1 385.283 3.358 10 0 GGAEMN O=C(Nc1nc(-c2ccncc2)n[nH]1)c1[nH]c2ccccc2c1Br ZINC000366589780 566159684 /nfs/dbraw/zinc/15/96/84/566159684.db2.gz FZSAJVZMJPAYLF-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@]2(CCCOC2)O1 ZINC000366598658 566161034 /nfs/dbraw/zinc/16/10/34/566161034.db2.gz VMEMHIPDJHIRSW-SJKOYZFVSA-N 0 1 380.286 3.095 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)C(C)(C)c2cccc(Br)c2)n[nH]1 ZINC000181748116 566163529 /nfs/dbraw/zinc/16/35/29/566163529.db2.gz WYTMZURNZBPMOY-UHFFFAOYSA-N 0 1 380.242 3.265 10 0 GGAEMN COc1cc(F)c(Br)cc1NC(=O)N[C@H](C)Cc1cc(C)[nH]n1 ZINC000417593326 566165869 /nfs/dbraw/zinc/16/58/69/566165869.db2.gz ZLKXSTHOIPAIRJ-MRVPVSSYSA-N 0 1 385.237 3.381 10 0 GGAEMN Cn1cc([C@@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Br)C(=O)[O-])cn1 ZINC000417596488 566166092 /nfs/dbraw/zinc/16/60/92/566166092.db2.gz QFESMOXGVPWGMZ-GFCCVEGCSA-N 0 1 392.175 3.117 10 0 GGAEMN CC[C@@H](N[C@H](C)c1cc2cc(Br)ccc2o1)C(=O)N1CCOCC1 ZINC000181871909 566170391 /nfs/dbraw/zinc/17/03/91/566170391.db2.gz VLXKMBXDZNWIBM-IUODEOHRSA-N 0 1 395.297 3.483 10 0 GGAEMN C[C@@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(Br)nc1 ZINC000290592391 566180787 /nfs/dbraw/zinc/18/07/87/566180787.db2.gz GOLQGDORTOMLKU-WBMJQRKESA-N 0 1 392.272 3.435 10 0 GGAEMN C[C@H](N[C@@H]1CCN(Cc2ccc(F)cc2)C1=O)c1ccc(Br)nc1 ZINC000290592370 566181035 /nfs/dbraw/zinc/18/10/35/566181035.db2.gz GOLQGDORTOMLKU-BLLLJJGKSA-N 0 1 392.272 3.435 10 0 GGAEMN CC(C)c1ncc(C(=O)N2CC[C@H](C)[C@H](NC(=O)C(F)(F)F)[C@@H]2C)s1 ZINC000290733962 566186379 /nfs/dbraw/zinc/18/63/79/566186379.db2.gz YLRUBVRQSFPJGC-NHCYSSNCSA-N 0 1 377.432 3.184 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1Cc1cn2ccc(Br)cc2n1 ZINC000263480345 566186838 /nfs/dbraw/zinc/18/68/38/566186838.db2.gz GEDYMRIQKSEADY-GLQYFDAESA-N 0 1 378.270 3.315 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1Cc1cn2ccc(Br)cc2n1 ZINC000263480335 566187042 /nfs/dbraw/zinc/18/70/42/566187042.db2.gz GEDYMRIQKSEADY-CQDKDKBSSA-N 0 1 378.270 3.315 10 0 GGAEMN COC(=O)c1ccc(C[N@@H+]2[C@@H]3CCCC[C@@H]3C[C@H]2C(=O)[O-])c(Br)c1 ZINC000263534638 566188657 /nfs/dbraw/zinc/18/86/57/566188657.db2.gz YMZZANZDMXZTON-LYRGGWFBSA-N 0 1 396.281 3.453 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CC(N[C@H]2CCc3c2ccc(F)c3Br)C1 ZINC000263526929 566188869 /nfs/dbraw/zinc/18/88/69/566188869.db2.gz ULBKERHCADJIJV-NWHVRFAMSA-N 0 1 385.277 3.103 10 0 GGAEMN C[C@H](CS(C)(=O)=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000367163562 566188850 /nfs/dbraw/zinc/18/88/50/566188850.db2.gz KOZGWQZBXDWCIQ-GYISXVGNSA-N 0 1 384.973 3.277 10 0 GGAEMN Cc1cc2c(Br)ccnc2cc1N1CCC([N@@H+](C)CC(=O)[O-])CC1 ZINC000263541364 566190025 /nfs/dbraw/zinc/19/00/25/566190025.db2.gz DAKWTYULNKPSFE-UHFFFAOYSA-N 0 1 392.297 3.291 10 0 GGAEMN C[C@](CO)(NCc1cc(-c2cccnc2)n[nH]1)c1ccc(Br)cc1 ZINC000367228465 566191981 /nfs/dbraw/zinc/19/19/81/566191981.db2.gz AXVAYNPCWCAJED-GOSISDBHSA-N 0 1 387.281 3.232 10 0 GGAEMN Fc1ccc(CN2CC[C@@]3(C2)CCCOC3)c(I)c1 ZINC000418047265 566193156 /nfs/dbraw/zinc/19/31/56/566193156.db2.gz SAJXMRJYKOXZKI-OAHLLOKOSA-N 0 1 375.225 3.433 10 0 GGAEMN Fc1ccc(CN2CC[C@]3(C2)CCCOC3)c(I)c1 ZINC000418047262 566193383 /nfs/dbraw/zinc/19/33/83/566193383.db2.gz SAJXMRJYKOXZKI-HNNXBMFYSA-N 0 1 375.225 3.433 10 0 GGAEMN COc1cc(NC(=O)[C@H]2CCCc3[nH]ncc32)cc(OC)c1Br ZINC000182265556 566194041 /nfs/dbraw/zinc/19/40/41/566194041.db2.gz FLDZIXRVFRPRDF-JTQLQIEISA-N 0 1 380.242 3.248 10 0 GGAEMN COc1cc(NC(=O)[C@@H]2CCCc3[nH]ncc32)cc(OC)c1Br ZINC000182265538 566194296 /nfs/dbraw/zinc/19/42/96/566194296.db2.gz FLDZIXRVFRPRDF-SNVBAGLBSA-N 0 1 380.242 3.248 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000290934788 566197007 /nfs/dbraw/zinc/19/70/07/566197007.db2.gz LEVYFVOUFOAWMS-LLVKDONJSA-N 0 1 394.660 3.263 10 0 GGAEMN O=C(N[C@@H]1CSc2ccc(Br)cc21)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000418103349 566197147 /nfs/dbraw/zinc/19/71/47/566197147.db2.gz SOMDSZLMNNABIO-MBNYWOFBSA-N 0 1 382.327 3.132 10 0 GGAEMN COCCN1CCCN(C(=O)c2csc(-c3ccccc3Cl)n2)CC1 ZINC000263915437 566200090 /nfs/dbraw/zinc/20/00/90/566200090.db2.gz XIOBNVRJGJSRBY-UHFFFAOYSA-N 0 1 379.913 3.258 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)C1(c2cc(F)cc(Br)c2)CC1 ZINC000367607802 566209243 /nfs/dbraw/zinc/20/92/43/566209243.db2.gz PIEFWMCYGOHYBN-ZDUSSCGKSA-N 0 1 378.245 3.017 10 0 GGAEMN C[C@@H](NCC(=O)NCc1ccc2c(c1)OCO2)c1cccc(Br)c1 ZINC000182571806 566213111 /nfs/dbraw/zinc/21/31/11/566213111.db2.gz YMEHTZDGRICYOE-GFCCVEGCSA-N 0 1 391.265 3.145 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1cccc(Br)c1 ZINC000182569035 566213166 /nfs/dbraw/zinc/21/31/66/566213166.db2.gz GWJUJLZYLAFGKL-RRQGHBQHSA-N 0 1 381.314 3.270 10 0 GGAEMN C[C@H](NCC(=O)N1CC(=O)Nc2ccccc21)c1cccc(Br)c1 ZINC000182580801 566213650 /nfs/dbraw/zinc/21/36/50/566213650.db2.gz FLMOEZGUIZJXGY-LBPRGKRZSA-N 0 1 388.265 3.085 10 0 GGAEMN C[C@@H](NCC(=O)NC(=O)Nc1ccccc1)c1cccc(Br)c1 ZINC000182580955 566213965 /nfs/dbraw/zinc/21/39/65/566213965.db2.gz SRNKJOWDXRJEKZ-GFCCVEGCSA-N 0 1 376.254 3.448 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](Cc2ccncc2)C1 ZINC000367818406 566217481 /nfs/dbraw/zinc/21/74/81/566217481.db2.gz HQMZSJFJELQBFT-CYBMUJFWSA-N 0 1 385.265 3.425 10 0 GGAEMN O=S(=O)(CCN1CCCC[C@@H]1c1nnc[nH]1)c1cc(Cl)ccc1Cl ZINC000182679208 566218984 /nfs/dbraw/zinc/21/89/84/566218984.db2.gz FOAQLGKSWDCWCF-CYBMUJFWSA-N 0 1 389.308 3.112 10 0 GGAEMN CCOC(=O)Cc1csc(NC(=O)CN[C@@H](C)c2cccc(Cl)c2)n1 ZINC000182674778 566219096 /nfs/dbraw/zinc/21/90/96/566219096.db2.gz XIFDPUAHMYICNO-NSHDSACASA-N 0 1 381.885 3.191 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)CCc2cc(F)ccc2Br)[nH]n1 ZINC000182734768 566221966 /nfs/dbraw/zinc/22/19/66/566221966.db2.gz JVFASADMOVBHDM-UHFFFAOYSA-N 0 1 392.232 3.283 10 0 GGAEMN O=C(NC[C@H]1CCCN(Cc2ncc(C(F)(F)F)s2)C1)C(F)(F)F ZINC000291509022 566223284 /nfs/dbraw/zinc/22/32/84/566223284.db2.gz IEKHNGHDFKVRDT-MRVPVSSYSA-N 0 1 375.338 3.052 10 0 GGAEMN CN(Cc1ccc(Br)c(F)c1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000367912096 566223472 /nfs/dbraw/zinc/22/34/72/566223472.db2.gz RKZANZDLZBTFBE-NSHDSACASA-N 0 1 381.249 3.010 10 0 GGAEMN CCOc1ccc(Br)cc1NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000367975427 566225356 /nfs/dbraw/zinc/22/53/56/566225356.db2.gz YHDCNIGHCMAFAM-LLVKDONJSA-N 0 1 379.258 3.250 10 0 GGAEMN COCCN1CCCN(c2nc(C(F)(F)F)c(Br)s2)CC1 ZINC000418843792 566225413 /nfs/dbraw/zinc/22/54/13/566225413.db2.gz SODKTAOZPGDMNC-UHFFFAOYSA-N 0 1 388.253 3.083 10 0 GGAEMN CC[C@@H](O)CN1CCN(CCSc2ccnc3cc(Cl)ccc32)CC1 ZINC000182813984 566226072 /nfs/dbraw/zinc/22/60/72/566226072.db2.gz WNCHPNKGYZNBCL-MRXNPFEDSA-N 0 1 379.957 3.369 10 0 GGAEMN CN1CC[C@H](NCc2ncc(C3OCCO3)s2)[C@@H]1c1ccc(Cl)cc1 ZINC000368028739 566228001 /nfs/dbraw/zinc/22/80/01/566228001.db2.gz FXFGRBMOOSFMLY-YOEHRIQHSA-N 0 1 379.913 3.377 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@H](NCc2ccnc(Cl)c2Cl)C1 ZINC000291642104 566228755 /nfs/dbraw/zinc/22/87/55/566228755.db2.gz TVPZQCONTRQXCW-AWEZNQCLSA-N 0 1 380.275 3.158 10 0 GGAEMN Cc1n[nH]c(C(=O)NCC2(c3cccc(Br)c3)CCOCC2)c1C ZINC000265174311 566232164 /nfs/dbraw/zinc/23/21/64/566232164.db2.gz DOSJVCIQVOBORK-UHFFFAOYSA-N 0 1 392.297 3.267 10 0 GGAEMN C[C@H]1CN(Cc2csc(Cc3ccc(Cl)cc3)n2)[C@@H](C)CN1CCO ZINC000419324661 566232332 /nfs/dbraw/zinc/23/23/32/566232332.db2.gz KEHNXUQLYFXQOA-GJZGRUSLSA-N 0 1 379.957 3.274 10 0 GGAEMN C[C@@H]1CN(CCO)[C@@H](C)CN1Cc1csc(Cc2ccc(Cl)cc2)n1 ZINC000419324663 566232651 /nfs/dbraw/zinc/23/26/51/566232651.db2.gz KEHNXUQLYFXQOA-LSDHHAIUSA-N 0 1 379.957 3.274 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000182962273 566232872 /nfs/dbraw/zinc/23/28/72/566232872.db2.gz YQOYRVQWXLDOLZ-CQSZACIVSA-N 0 1 392.297 3.350 10 0 GGAEMN COCCOc1cccc(CNC(=O)CN[C@H](C)c2ccc(Cl)s2)c1 ZINC000182986370 566233151 /nfs/dbraw/zinc/23/31/51/566233151.db2.gz QAWIKSHTRKNEBJ-CYBMUJFWSA-N 0 1 382.913 3.394 10 0 GGAEMN Cc1n[nH]c(C(=O)NC[C@H]2CCN(c3ccc(Br)cc3)C2)c1C ZINC000265246992 566233733 /nfs/dbraw/zinc/23/37/33/566233733.db2.gz RJKZCIVLRUGLQX-CYBMUJFWSA-N 0 1 377.286 3.045 10 0 GGAEMN COCCOc1ccc(CNC(=O)CN[C@@H](C)c2ccc(Cl)s2)cc1 ZINC000183005680 566234159 /nfs/dbraw/zinc/23/41/59/566234159.db2.gz BHFOCZYAXIBYBO-ZDUSSCGKSA-N 0 1 382.913 3.394 10 0 GGAEMN CC[C@@H](NCc1csc(Br)c1)c1cccc(S(N)(=O)=O)c1 ZINC000183031539 566235626 /nfs/dbraw/zinc/23/56/26/566235626.db2.gz JLHVYWSRTPUHGN-CYBMUJFWSA-N 0 1 389.340 3.399 10 0 GGAEMN O=C(Nc1ccc(I)cc1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000183059970 566236444 /nfs/dbraw/zinc/23/64/44/566236444.db2.gz JWKNTBIHCYVMRQ-GFCCVEGCSA-N 0 1 397.220 3.168 10 0 GGAEMN COc1cc(NC(=O)N2CCCC[C@H]2c2nnc[nH]2)ccc1Br ZINC000183085636 566237048 /nfs/dbraw/zinc/23/70/48/566237048.db2.gz YCXGEWYSBILGMU-LBPRGKRZSA-N 0 1 380.246 3.335 10 0 GGAEMN Cc1csc(C2(NCCCOc3ccc(S(C)(=O)=O)cc3)CCC2)n1 ZINC000265489375 566237844 /nfs/dbraw/zinc/23/78/44/566237844.db2.gz MVSOLRALBRQKJN-UHFFFAOYSA-N 0 1 380.535 3.293 10 0 GGAEMN O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505073 566240356 /nfs/dbraw/zinc/24/03/56/566240356.db2.gz UHHRCSIOCVUENL-BXUZGUMPSA-N 0 1 378.270 3.081 10 0 GGAEMN O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505074 566240720 /nfs/dbraw/zinc/24/07/20/566240720.db2.gz UHHRCSIOCVUENL-FZMZJTMJSA-N 0 1 378.270 3.081 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)c2cc3c(cccc3Br)[nH]2)n[nH]1 ZINC000183291356 566242935 /nfs/dbraw/zinc/24/29/35/566242935.db2.gz MOXSQJLLEPHSHD-UHFFFAOYSA-N 0 1 377.198 3.083 10 0 GGAEMN Cc1nc([C@H]2CCCOC2)sc1C(=O)NC[C@@H](c1ccsc1)N(C)C ZINC000368639178 566243068 /nfs/dbraw/zinc/24/30/68/566243068.db2.gz SNQVCYDXZLMKBQ-ZFWWWQNUSA-N 0 1 379.551 3.440 10 0 GGAEMN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@H](c1ccsc1)N(C)C ZINC000368639177 566243093 /nfs/dbraw/zinc/24/30/93/566243093.db2.gz SNQVCYDXZLMKBQ-UKRRQHHQSA-N 0 1 379.551 3.440 10 0 GGAEMN O=S(=O)(Nc1cccc2c1OCC[C@H]2O)c1ccc(Br)cc1 ZINC000368651715 566243751 /nfs/dbraw/zinc/24/37/51/566243751.db2.gz HNMFLUSCPNETQU-CQSZACIVSA-N 0 1 384.251 3.066 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCC2(CCOCC2)C1 ZINC000266217947 566247065 /nfs/dbraw/zinc/24/70/65/566247065.db2.gz QEDMYTIGICEXKT-UHFFFAOYSA-N 0 1 378.270 3.358 10 0 GGAEMN Cn1nnc2ccc(C(=O)Nc3cc(Cl)cc(Br)c3O)cc21 ZINC000183526988 566248506 /nfs/dbraw/zinc/24/85/06/566248506.db2.gz PTHWXHJQOJHOQQ-UHFFFAOYSA-N 0 1 381.617 3.342 10 0 GGAEMN O=C(N[C@@H](c1nn[nH]n1)c1ccc(Cl)c(F)c1)c1cc2[nH]ccc2s1 ZINC000369090629 566249799 /nfs/dbraw/zinc/24/97/99/566249799.db2.gz FVGOFALODGDAAB-CYBMUJFWSA-N 0 1 376.804 3.054 10 0 GGAEMN CNC(=O)C[C@H](NCc1cc2c(c(Br)c1)OCO2)c1ccccc1 ZINC000481815599 566253894 /nfs/dbraw/zinc/25/38/94/566253894.db2.gz OWENMEJLVLOITK-HNNXBMFYSA-N 0 1 391.265 3.145 10 0 GGAEMN CC(=O)c1ccc(NS(=O)(=O)c2c(C)cc(Br)cc2C)nc1 ZINC000534794631 566254682 /nfs/dbraw/zinc/25/46/82/566254682.db2.gz HUWMSBDVLPARHA-UHFFFAOYSA-N 0 1 383.267 3.464 10 0 GGAEMN COc1ccc(OCCNC(=O)c2n[nH]c3ccc(Br)cc32)cc1 ZINC000599348306 566254642 /nfs/dbraw/zinc/25/46/42/566254642.db2.gz RQEQBZNMLAFTFE-UHFFFAOYSA-N 0 1 390.237 3.143 10 0 GGAEMN O=C(c1ccc2cncn2c1)N1CCN(Cc2ccc(Br)cc2)CC1 ZINC000555854573 566255284 /nfs/dbraw/zinc/25/52/84/566255284.db2.gz ZXCLVQGXHBDEJD-UHFFFAOYSA-N 0 1 399.292 3.055 10 0 GGAEMN O=C(CNCc1cnc(-c2ccc(Br)cc2)s1)NCC(F)F ZINC000481826893 566255331 /nfs/dbraw/zinc/25/53/31/566255331.db2.gz WOHKCHXTVJPXBT-UHFFFAOYSA-N 0 1 390.253 3.044 10 0 GGAEMN CN(C)C(=O)c1ccc(NS(=O)(=O)Cc2ccc(Cl)cc2Cl)nc1 ZINC000481841241 566255670 /nfs/dbraw/zinc/25/56/70/566255670.db2.gz FGKZSDIEYLFACN-UHFFFAOYSA-N 0 1 388.276 3.032 10 0 GGAEMN CN(C)C(=O)c1ccc(NS(=O)(=O)Cc2cc(Cl)cc(Cl)c2)nc1 ZINC000481837248 566256247 /nfs/dbraw/zinc/25/62/47/566256247.db2.gz FBACNJLOBBIAEF-UHFFFAOYSA-N 0 1 388.276 3.032 10 0 GGAEMN O=C(c1csc(C(F)(F)F)c1)N1CCC(CCN2CCOCC2)CC1 ZINC000624916317 566256849 /nfs/dbraw/zinc/25/68/49/566256849.db2.gz NRKVCLQHGMQSMA-UHFFFAOYSA-N 0 1 376.444 3.341 10 0 GGAEMN C[C@@H](CN1CCC(C)(c2cccc(Br)c2)CC1)CS(C)(=O)=O ZINC000509052198 566257026 /nfs/dbraw/zinc/25/70/26/566257026.db2.gz CUNMHBSSRAIUEN-AWEZNQCLSA-N 0 1 388.371 3.483 10 0 GGAEMN COC(=O)c1cc(F)cc(S(=O)(=O)NCC(C)(C)CC(F)(F)F)c1F ZINC000599362820 566257567 /nfs/dbraw/zinc/25/75/67/566257567.db2.gz RYXQIBJYODOGKJ-UHFFFAOYSA-N 0 1 389.342 3.008 10 0 GGAEMN O=C(c1cc2[nH]cnc2cc1F)N1CCC(n2cc(Br)cn2)CC1 ZINC000575175859 566257651 /nfs/dbraw/zinc/25/76/51/566257651.db2.gz WTZGNROKRHKKAQ-UHFFFAOYSA-N 0 1 392.232 3.138 10 0 GGAEMN CN1CCN(c2ccc(Br)cc2NC(=O)[C@H]2C[C@@H]2C(F)F)CC1 ZINC000509059596 566259848 /nfs/dbraw/zinc/25/98/48/566259848.db2.gz CHQVVWQTRPQTFL-RYUDHWBXSA-N 0 1 388.256 3.041 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3ccc(Cl)c(Br)c3)cc21 ZINC000534859642 566260517 /nfs/dbraw/zinc/26/05/17/566260517.db2.gz DWJOYOARMIDSCJ-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN COc1cc(Br)c(CNCC2(O)CCC(F)(F)CC2)cc1O ZINC000668722845 566260967 /nfs/dbraw/zinc/26/09/67/566260967.db2.gz GYGBEMIFPBNBKC-UHFFFAOYSA-N 0 1 380.229 3.193 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)[C@@H]1CCCN1CC(F)(F)F ZINC000462183242 566260865 /nfs/dbraw/zinc/26/08/65/566260865.db2.gz BOZNJHRIUYHCNR-NSHDSACASA-N 0 1 391.191 3.291 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN(Cc2cc(Br)cc3c2OCC3)C1 ZINC000668733259 566261000 /nfs/dbraw/zinc/26/10/00/566261000.db2.gz BINWBDAYBNAVPB-AWEZNQCLSA-N 0 1 381.314 3.121 10 0 GGAEMN COc1c(C)cc(C)cc1S(=O)(=O)Nc1ccc2c(c1)NC(=O)CS2 ZINC000509102600 566262935 /nfs/dbraw/zinc/26/29/35/566262935.db2.gz HIONZCPEHIZZNG-UHFFFAOYSA-N 0 1 378.475 3.157 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1cccnc1)c1ccc(Cl)cc1 ZINC000555947737 566263322 /nfs/dbraw/zinc/26/33/22/566263322.db2.gz YRCKXKJQJLGDSQ-UHFFFAOYSA-N 0 1 381.929 3.413 10 0 GGAEMN Cc1c(Cl)cc(F)c(NC(=O)c2ccc(S(=O)(=O)N(C)C)o2)c1F ZINC000534928330 566263368 /nfs/dbraw/zinc/26/33/68/566263368.db2.gz JCKAIJGMDVVXEA-UHFFFAOYSA-N 0 1 378.784 3.022 10 0 GGAEMN CCC(F)(F)C(C)(C)CNS(=O)(=O)c1cc(F)cc(C(=O)OC)c1F ZINC000599445843 566265711 /nfs/dbraw/zinc/26/57/11/566265711.db2.gz RTDYNKSMALUORJ-UHFFFAOYSA-N 0 1 385.379 3.101 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1occ2c1CCC2 ZINC000509166311 566269950 /nfs/dbraw/zinc/26/99/50/566269950.db2.gz LCMANQQZAUDQQF-UHFFFAOYSA-N 0 1 387.237 3.246 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1occ2c1CCC2 ZINC000509166311 566269954 /nfs/dbraw/zinc/26/99/54/566269954.db2.gz LCMANQQZAUDQQF-UHFFFAOYSA-N 0 1 387.237 3.246 10 0 GGAEMN Fc1c(Br)ccc(CN2CCN(C[C@@H]3CCCO3)CC2)c1F ZINC000625045491 566270448 /nfs/dbraw/zinc/27/04/48/566270448.db2.gz LLWGYJWGWBTCGN-ZDUSSCGKSA-N 0 1 375.257 3.024 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1)c1cccc(Br)c1 ZINC000462272674 566271913 /nfs/dbraw/zinc/27/19/13/566271913.db2.gz PFWZNMCFIRDQTF-SECBINFHSA-N 0 1 387.237 3.167 10 0 GGAEMN COc1c(C)cc(C)cc1S(=O)(=O)N(CCN(C)C)Cc1cccs1 ZINC000509189278 566272611 /nfs/dbraw/zinc/27/26/11/566272611.db2.gz CGNUIPNWKVMOTI-UHFFFAOYSA-N 0 1 382.551 3.126 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccc(Br)c(F)c1 ZINC000462280060 566273490 /nfs/dbraw/zinc/27/34/90/566273490.db2.gz MHIWLCSFOWAQCD-VXGBXAGGSA-N 0 1 393.322 3.129 10 0 GGAEMN C[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ncc(Br)cn1 ZINC000556204100 566274624 /nfs/dbraw/zinc/27/46/24/566274624.db2.gz BVVNTDIEZDKWGK-LBPRGKRZSA-N 0 1 383.334 3.317 10 0 GGAEMN COc1c(Br)cccc1CN1CCC[C@@H](C(=O)N2CCCC2)C1 ZINC000482000406 566275697 /nfs/dbraw/zinc/27/56/97/566275697.db2.gz OVNWMIFEZJUTEC-OAHLLOKOSA-N 0 1 381.314 3.292 10 0 GGAEMN CCC[C@@H](OCC)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000625116494 566277178 /nfs/dbraw/zinc/27/71/78/566277178.db2.gz VKEOLTCZXVEIGV-CYBMUJFWSA-N 0 1 381.274 3.056 10 0 GGAEMN CCC[C@@H](OCC)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000625116494 566277183 /nfs/dbraw/zinc/27/71/83/566277183.db2.gz VKEOLTCZXVEIGV-CYBMUJFWSA-N 0 1 381.274 3.056 10 0 GGAEMN Fc1ccc([C@@H](NCCCCn2cc(Br)cn2)c2cn[nH]n2)cc1 ZINC000556243813 566278474 /nfs/dbraw/zinc/27/84/74/566278474.db2.gz NFRCAOCDYCNSNL-MRXNPFEDSA-N 0 1 393.264 3.062 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2cc(F)cc(F)c2)[C@@H]1c1cccs1 ZINC000462318761 566281172 /nfs/dbraw/zinc/28/11/72/566281172.db2.gz WXCHCYQNDDMIFW-YVEFUNNKSA-N 0 1 386.489 3.388 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2cc(F)cc(F)c2)[C@@H]1c1cccs1 ZINC000462318760 566281841 /nfs/dbraw/zinc/28/18/41/566281841.db2.gz WXCHCYQNDDMIFW-SJKOYZFVSA-N 0 1 386.489 3.388 10 0 GGAEMN NC(=O)c1cccc(S(=O)(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)c1 ZINC000509245094 566281963 /nfs/dbraw/zinc/28/19/63/566281963.db2.gz CCIGJQHKLKDHDI-UHFFFAOYSA-N 0 1 393.877 3.363 10 0 GGAEMN Cc1nn(C)c(C)c1CCNCc1cn(-c2ccc(Cl)cc2Cl)nn1 ZINC000535186078 566284541 /nfs/dbraw/zinc/28/45/41/566284541.db2.gz QRMKSXHQERZDHC-UHFFFAOYSA-N 0 1 379.295 3.257 10 0 GGAEMN Cc1nc2c(n1[C@H]1CCN(C(=O)c3ncsc3Br)C1)CCCC2 ZINC000575832523 566290828 /nfs/dbraw/zinc/29/08/28/566290828.db2.gz GDKAFVBGWVWSHD-NSHDSACASA-N 0 1 395.326 3.377 10 0 GGAEMN C[C@@H]1CCC[N@@H+](CCNS(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000556376601 566292188 /nfs/dbraw/zinc/29/21/88/566292188.db2.gz GHMFHHZFUJWWNK-LLVKDONJSA-N 0 1 395.750 3.113 10 0 GGAEMN CO[C@@H]1CCCC[C@@H]1C(=O)Nc1nc(-c2ccccc2Br)n[nH]1 ZINC000648517806 566292139 /nfs/dbraw/zinc/29/21/39/566292139.db2.gz ZINFRZQEECUNFF-WCQYABFASA-N 0 1 379.258 3.378 10 0 GGAEMN C[C@@H](NC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ncc(Br)cn1 ZINC000575851661 566292328 /nfs/dbraw/zinc/29/23/28/566292328.db2.gz HNZJJLVJAQXYDE-ZIAGYGMSSA-N 0 1 389.297 3.052 10 0 GGAEMN CCCOc1ccc(Br)cc1C[NH+]1CCC(c2n[nH]c(=O)[n-]2)CC1 ZINC000575901338 566295519 /nfs/dbraw/zinc/29/55/19/566295519.db2.gz HPYDRSOSUCGRDT-UHFFFAOYSA-N 0 1 395.301 3.441 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)CCN1C ZINC000420674958 566296211 /nfs/dbraw/zinc/29/62/11/566296211.db2.gz NYXXLSUPLHZLDC-CMPLNLGQSA-N 0 1 382.860 3.045 10 0 GGAEMN CC1(C)CN(C(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCN1 ZINC000669386896 566297059 /nfs/dbraw/zinc/29/70/59/566297059.db2.gz BFSWIGCTDSUOQU-NXEZZACHSA-N 0 1 375.357 3.289 10 0 GGAEMN COc1cc(OC)cc(S(=O)(=O)Nc2ccc(C(F)(F)F)nc2C)c1 ZINC000509397656 566300272 /nfs/dbraw/zinc/30/02/72/566300272.db2.gz WEONCORTJPZMQI-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)CCCOc2cccc(Cl)c2Cl)CC1 ZINC000535427727 566305497 /nfs/dbraw/zinc/30/54/97/566305497.db2.gz LOMVBMKCOLMHMB-AWEZNQCLSA-N 0 1 389.323 3.068 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)CCCOc2cccc(Cl)c2Cl)CC1 ZINC000535427728 566305775 /nfs/dbraw/zinc/30/57/75/566305775.db2.gz LOMVBMKCOLMHMB-CQSZACIVSA-N 0 1 389.323 3.068 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)cc1Cl)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000445710497 566306803 /nfs/dbraw/zinc/30/68/03/566306803.db2.gz WPRAQFOTNDWMTI-HNNXBMFYSA-N 0 1 397.287 3.321 10 0 GGAEMN CN(CCNC(=O)Cc1cscc1Br)Cc1ccc(F)cc1 ZINC000556510244 566308485 /nfs/dbraw/zinc/30/84/85/566308485.db2.gz DAZXWYCWUVWOSA-UHFFFAOYSA-N 0 1 385.302 3.440 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@H]1CCc2cc(Br)ccc2NC1=O ZINC000625332359 566309000 /nfs/dbraw/zinc/30/90/00/566309000.db2.gz IROTYQLVLUKYRM-LSDHHAIUSA-N 0 1 395.322 3.396 10 0 GGAEMN O=S(=O)(CCN[C@@H](c1cccnc1)C1CC1)c1ccc(Br)cc1 ZINC000445820918 566313485 /nfs/dbraw/zinc/31/34/85/566313485.db2.gz VJIHJLQJEVERCA-QGZVFWFLSA-N 0 1 395.322 3.359 10 0 GGAEMN CN1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)Cc2ccccc21 ZINC000600118032 566316283 /nfs/dbraw/zinc/31/62/83/566316283.db2.gz GIXPZRDBSJTTOS-UHFFFAOYSA-N 0 1 385.265 3.418 10 0 GGAEMN C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc2c(cncc2Br)s1 ZINC000648822079 566318951 /nfs/dbraw/zinc/31/89/51/566318951.db2.gz KERWTSHPTDVVBG-ZANVPECISA-N 0 1 380.311 3.271 10 0 GGAEMN Cc1ccc2nc(CNC(=O)NCc3ccc(O)c(Br)c3)[nH]c2c1 ZINC000482585931 566320079 /nfs/dbraw/zinc/32/00/79/566320079.db2.gz VATXBEANIOIEAE-UHFFFAOYSA-N 0 1 389.253 3.339 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)NCc2ccc(-c3csc(C)n3)s2)n[nH]1 ZINC000535701147 566321000 /nfs/dbraw/zinc/32/10/00/566321000.db2.gz PDRGTYPTOJCEFQ-SECBINFHSA-N 0 1 376.511 3.421 10 0 GGAEMN O=C(Nc1ccccc1-n1cncn1)c1cc(Br)cc2nc[nH]c21 ZINC000669694876 566322491 /nfs/dbraw/zinc/32/24/91/566322491.db2.gz FZPPXZNLGXATOF-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)c3ccc(Cl)c(NS(C)(=O)=O)c3)ccc12 ZINC000535818448 566330814 /nfs/dbraw/zinc/33/08/14/566330814.db2.gz PEKZMBMYTWRVOE-UHFFFAOYSA-N 0 1 378.841 3.149 10 0 GGAEMN O=S1(=O)CCCN1[C@H]1CCCN(Cc2ccc(Cl)c3ccccc23)C1 ZINC000420957577 566331345 /nfs/dbraw/zinc/33/13/45/566331345.db2.gz CVUJDOZOYXHIPW-INIZCTEOSA-N 0 1 378.925 3.493 10 0 GGAEMN OCC[C@H]1CCCN(Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000421033646 566335341 /nfs/dbraw/zinc/33/53/41/566335341.db2.gz GGIZEAYIKPPNGG-ZDUSSCGKSA-N 0 1 380.286 3.484 10 0 GGAEMN O=C(NCc1ccsc1Br)Nc1cnn(-c2ccncc2)c1 ZINC000669956508 566339341 /nfs/dbraw/zinc/33/93/41/566339341.db2.gz QUGOKGJXWJTHOL-UHFFFAOYSA-N 0 1 378.255 3.413 10 0 GGAEMN Clc1ccc(-n2cc(CNCCCOC[C@@H]3CCOC3)nn2)c(Cl)c1 ZINC000535942164 566339588 /nfs/dbraw/zinc/33/95/88/566339588.db2.gz HGQLFSLIMHXAHM-ZDUSSCGKSA-N 0 1 385.295 3.107 10 0 GGAEMN C[C@@H]1CN(C)C[C@H](C)N1C(=O)COc1ccc(Br)cc1Cl ZINC000535928017 566340698 /nfs/dbraw/zinc/34/06/98/566340698.db2.gz GFRQDKRIJCKSCZ-PHIMTYICSA-N 0 1 375.694 3.032 10 0 GGAEMN C[C@H]1CN(C)C[C@H](C)N1C(=O)COc1ccc(Br)cc1Cl ZINC000535928019 566340712 /nfs/dbraw/zinc/34/07/12/566340712.db2.gz GFRQDKRIJCKSCZ-QWRGUYRKSA-N 0 1 375.694 3.032 10 0 GGAEMN COC(=O)C[C@@H](C)CC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600472276 566340846 /nfs/dbraw/zinc/34/08/46/566340846.db2.gz NQQRFMIBQLXSCT-XHDPSFHLSA-N 0 1 375.296 3.302 10 0 GGAEMN O=C(NC[C@@H](CO)C1CCCCC1)c1n[nH]c2ccc(Br)cc21 ZINC000509823475 566340917 /nfs/dbraw/zinc/34/09/17/566340917.db2.gz IFRPNBDWYUQUQM-LBPRGKRZSA-N 0 1 380.286 3.244 10 0 GGAEMN O=C(NC[C@H](CO)C1CCCCC1)c1n[nH]c2ccc(Br)cc21 ZINC000509823474 566341254 /nfs/dbraw/zinc/34/12/54/566341254.db2.gz IFRPNBDWYUQUQM-GFCCVEGCSA-N 0 1 380.286 3.244 10 0 GGAEMN C[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1cncc(Br)c1 ZINC000576410414 566343163 /nfs/dbraw/zinc/34/31/63/566343163.db2.gz JYNUALHBXWSTHB-GFCCVEGCSA-N 0 1 395.276 3.066 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)CN1CCC(C)CC1 ZINC000482946097 566343844 /nfs/dbraw/zinc/34/38/44/566343844.db2.gz JHADEFKQNGIVLM-UHFFFAOYSA-N 0 1 389.359 3.218 10 0 GGAEMN C[N@@H+]1C[C@@H](CNC(=O)c2ccc(Br)c([O-])c2)[C@H](c2ccccc2)C1 ZINC000649103082 566344738 /nfs/dbraw/zinc/34/47/38/566344738.db2.gz WTNYZBYEPNFCHB-CVEARBPZSA-N 0 1 389.293 3.230 10 0 GGAEMN C[N@H+]1C[C@@H](CNC(=O)c2ccc(Br)c([O-])c2)[C@H](c2ccccc2)C1 ZINC000649103082 566344749 /nfs/dbraw/zinc/34/47/49/566344749.db2.gz WTNYZBYEPNFCHB-CVEARBPZSA-N 0 1 389.293 3.230 10 0 GGAEMN C[C@]1(CNC(=O)c2cc(Br)cc3nc[nH]c32)CCO[C@H]1C1CC1 ZINC000556918780 566344895 /nfs/dbraw/zinc/34/48/95/566344895.db2.gz LJDGTYOLBJIBIH-DOTOQJQBSA-N 0 1 378.270 3.260 10 0 GGAEMN C[C@H](NC(=O)c1cc(Oc2cccc(Br)c2)ccn1)c1nnc[nH]1 ZINC000482969419 566346348 /nfs/dbraw/zinc/34/63/48/566346348.db2.gz BQAIVTKIAFBOSP-JTQLQIEISA-N 0 1 388.225 3.246 10 0 GGAEMN CC(C)(C)OC(=O)C(C)(C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000600596877 566349438 /nfs/dbraw/zinc/34/94/38/566349438.db2.gz CRKRDCSBSPKFOX-UHFFFAOYSA-N 0 1 382.258 3.176 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN1CC[C@](F)(CO)C1 ZINC000670111266 566349765 /nfs/dbraw/zinc/34/97/65/566349765.db2.gz JUTWWULOPPLILP-QGZVFWFLSA-N 0 1 387.293 3.191 10 0 GGAEMN CCCOc1ccc(Br)cc1CN[C@@H]1CC(=O)N([C@@H]2C[C@H]2C)C1 ZINC000462743972 566349931 /nfs/dbraw/zinc/34/99/31/566349931.db2.gz FQAOWVBKPIGNIH-DAXOMENPSA-N 0 1 381.314 3.337 10 0 GGAEMN CCCCN(C(=O)c1csc(=NC2CC2)[nH]1)[C@@H]1CCc2ncsc2C1 ZINC000649162807 566349946 /nfs/dbraw/zinc/34/99/46/566349946.db2.gz ZXVWOBYXBVBCPV-CYBMUJFWSA-N 0 1 376.551 3.396 10 0 GGAEMN COC(=O)[C@H](N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1)c1cccnc1 ZINC000600615485 566350411 /nfs/dbraw/zinc/35/04/11/566350411.db2.gz WFIRMLDHKZKNTJ-IAGOWNOFSA-N 0 1 382.291 3.495 10 0 GGAEMN COC(=O)[C@@H](N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1)c1cccnc1 ZINC000600615488 566351067 /nfs/dbraw/zinc/35/10/67/566351067.db2.gz WFIRMLDHKZKNTJ-SJORKVTESA-N 0 1 382.291 3.495 10 0 GGAEMN CCN1CCN(CC(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)CC1 ZINC000462766485 566351430 /nfs/dbraw/zinc/35/14/30/566351430.db2.gz LIHWNLGUXJWZKQ-UHFFFAOYSA-N 0 1 384.351 3.337 10 0 GGAEMN CCCN(CCCS(=O)(=O)NC)[C@H](C)c1ccccc1Br ZINC000600627498 566352400 /nfs/dbraw/zinc/35/24/00/566352400.db2.gz RVIMKNSZMIHUCV-CYBMUJFWSA-N 0 1 377.348 3.161 10 0 GGAEMN CCCN(CCCS(=O)(=O)NC)[C@@H](C)c1ccccc1Br ZINC000600627499 566352744 /nfs/dbraw/zinc/35/27/44/566352744.db2.gz RVIMKNSZMIHUCV-ZDUSSCGKSA-N 0 1 377.348 3.161 10 0 GGAEMN C[C@H](CN1CC[C@@H](Sc2ccc(Br)cc2)C1)CS(C)(=O)=O ZINC000625703373 566352949 /nfs/dbraw/zinc/35/29/49/566352949.db2.gz FXGOKCMRRSMNLX-IUODEOHRSA-N 0 1 392.384 3.296 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@H]1[C@H](O)C(F)(F)F ZINC000600652149 566354445 /nfs/dbraw/zinc/35/44/45/566354445.db2.gz YUSZJEQNBVJIQV-WFBYXXMGSA-N 0 1 388.213 3.121 10 0 GGAEMN CCn1cc(S(=O)(=O)Nc2ccc(Cl)c(C(=O)OC)c2Cl)nc1C ZINC000600662475 566356379 /nfs/dbraw/zinc/35/63/79/566356379.db2.gz MBDVTYZMDNZQMW-UHFFFAOYSA-N 0 1 392.264 3.106 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)CCc2cccc(Cl)c2)[C@H]1c1ccccc1 ZINC000510021038 566357599 /nfs/dbraw/zinc/35/75/99/566357599.db2.gz PRJCGARHEDZFJC-RTBURBONSA-N 0 1 378.925 3.247 10 0 GGAEMN O=C(COc1ccc(Cl)c(Cl)c1)N1CCC[C@@H](N2CCOCC2)CC1 ZINC000670393250 566359270 /nfs/dbraw/zinc/35/92/70/566359270.db2.gz SWPBMNGIDOBCHK-CQSZACIVSA-N 0 1 387.307 3.086 10 0 GGAEMN COc1cc(CNCc2c3c(nn2C)CCCC3)cc(Br)c1O ZINC000462854263 566360221 /nfs/dbraw/zinc/36/02/21/566360221.db2.gz MCHDYHFCADKVBE-UHFFFAOYSA-N 0 1 380.286 3.065 10 0 GGAEMN O=C(NC[C@H]1CN2CCN1CCC2)c1sc2cc(Cl)ccc2c1Cl ZINC000670446770 566362839 /nfs/dbraw/zinc/36/28/39/566362839.db2.gz KQNPIRDRQBYNFC-LBPRGKRZSA-N 0 1 384.332 3.328 10 0 GGAEMN CC1(C)CN(CCOc2cc(F)cc(Br)c2)C[C@]2(CCOC2)O1 ZINC000483184401 566363134 /nfs/dbraw/zinc/36/31/34/566363134.db2.gz LJHXIBWJVAVUOR-KRWDZBQOSA-N 0 1 388.277 3.237 10 0 GGAEMN Cc1ccc2nc(CNC[C@@H](O)COc3c(Cl)cccc3Cl)cn2c1 ZINC000576627678 566363804 /nfs/dbraw/zinc/36/38/04/566363804.db2.gz AYSPZAQWOCJUCJ-CQSZACIVSA-N 0 1 380.275 3.479 10 0 GGAEMN CC[C@H]1CN(CCOc2cc(F)cc(Br)c2)C[C@@]2(CCOC2)O1 ZINC000483200883 566364137 /nfs/dbraw/zinc/36/41/37/566364137.db2.gz QRSCVPKQLBGORL-DOTOQJQBSA-N 0 1 388.277 3.237 10 0 GGAEMN COC(=O)c1cc(CN[C@H]2CCOc3c(Br)cccc32)n(C)c1C ZINC000462904352 566366676 /nfs/dbraw/zinc/36/66/76/566366676.db2.gz VTXOEGKLQANJRZ-INIZCTEOSA-N 0 1 393.281 3.496 10 0 GGAEMN COC(=O)c1cc(CNCc2ccc(Br)cc2OC)n(C)c1C ZINC000462913487 566366794 /nfs/dbraw/zinc/36/67/94/566366794.db2.gz NWJAHMUXCRCPIU-UHFFFAOYSA-N 0 1 381.270 3.181 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1ccn(C2CCOCC2)n1 ZINC000625902384 566368825 /nfs/dbraw/zinc/36/88/25/566368825.db2.gz ZBSDWMOJERMYRW-UHFFFAOYSA-N 0 1 390.241 3.126 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1cccs1 ZINC000649493350 566369606 /nfs/dbraw/zinc/36/96/06/566369606.db2.gz JFHTWBHEJNSSPV-LLVKDONJSA-N 0 1 379.423 3.427 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2ccc(F)cc2Cl)[C@@H]1O ZINC000576686386 566369644 /nfs/dbraw/zinc/36/96/44/566369644.db2.gz ALAHNDZXCUJXQI-OCCSQVGLSA-N 0 1 391.873 3.092 10 0 GGAEMN C[C@H](NC(=O)c1c(F)ccc(C(F)(F)F)c1Br)c1nnc[nH]1 ZINC000625938260 566370391 /nfs/dbraw/zinc/37/03/91/566370391.db2.gz ANTOPQBIPAMVLT-YFKPBYRVSA-N 0 1 381.127 3.216 10 0 GGAEMN Cc1nc(C)c([C@@H](C)N(C)Cc2ccc(S(=O)(=O)NC3CC3)cc2)s1 ZINC000649522195 566371722 /nfs/dbraw/zinc/37/17/22/566371722.db2.gz NRXWAHKMVALPLE-CYBMUJFWSA-N 0 1 379.551 3.394 10 0 GGAEMN CN(C)C[C@@H](NCC(=O)N(C)CC(F)(F)F)c1ccc(Cl)c(Cl)c1 ZINC000625983308 566371973 /nfs/dbraw/zinc/37/19/73/566371973.db2.gz LELOPKZDYLKJHM-CYBMUJFWSA-N 0 1 386.245 3.206 10 0 GGAEMN O=c1ccc([C@@H]2OCC[C@H]2NCc2ncc(Br)cc2Cl)c[nH]1 ZINC000625991636 566373185 /nfs/dbraw/zinc/37/31/85/566373185.db2.gz BKYUHQBCKCMFLA-DOMZBBRYSA-N 0 1 384.661 3.218 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@H](O)COc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000625995800 566373818 /nfs/dbraw/zinc/37/38/18/566373818.db2.gz WAHOXKZZPZAVBB-MEDUHNTESA-N 0 1 384.263 3.066 10 0 GGAEMN Cc1cc(Br)ccc1[C@@H]1CCCN1CCCS(=O)(=O)N(C)C ZINC000626009222 566374487 /nfs/dbraw/zinc/37/44/87/566374487.db2.gz BKZPWRHSGSETBH-INIZCTEOSA-N 0 1 389.359 3.176 10 0 GGAEMN Cc1cc(Br)ccc1[C@H]1CCCN1C[C@H](O)COC1CCOCC1 ZINC000626009252 566374938 /nfs/dbraw/zinc/37/49/38/566374938.db2.gz CBSFCJVVQXSOFZ-QFBILLFUSA-N 0 1 398.341 3.451 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@@H](O)COc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000625995798 566375020 /nfs/dbraw/zinc/37/50/20/566375020.db2.gz WAHOXKZZPZAVBB-BDJLRTHQSA-N 0 1 384.263 3.066 10 0 GGAEMN CCC[C@H](NC(=O)Cc1ccc(SCC)cc1Br)c1nn[nH]n1 ZINC000626024916 566375899 /nfs/dbraw/zinc/37/58/99/566375899.db2.gz ZYOSSWREEPKTGW-ZDUSSCGKSA-N 0 1 398.330 3.274 10 0 GGAEMN COC[C@H](C)OC[C@H](O)CN1CCC[C@H]1c1ccc(Br)cc1C ZINC000626010038 566376018 /nfs/dbraw/zinc/37/60/18/566376018.db2.gz CLNQOVOETNTDED-LESCRADOSA-N 0 1 386.330 3.307 10 0 GGAEMN OC[C@]12CCC[C@H]1CN(Cc1cc3c(cc1Br)OCCCO3)C2 ZINC000626014738 566376410 /nfs/dbraw/zinc/37/64/10/566376410.db2.gz SFLRZWNEODUUSC-KBXCAEBGSA-N 0 1 382.298 3.205 10 0 GGAEMN OC[C@]12CCC[C@H]1CN(Cc1nnc(-c3ccccc3Br)o1)C2 ZINC000626011238 566376661 /nfs/dbraw/zinc/37/66/61/566376661.db2.gz BNWZZSNXNXVCIK-YVEFUNNKSA-N 0 1 378.270 3.094 10 0 GGAEMN C[C@H](C(=O)Nc1ncccn1)N1C[C@@H](c2ccc(Br)cc2)C[C@H]1C ZINC000626040949 566377708 /nfs/dbraw/zinc/37/77/08/566377708.db2.gz OMHOUAFAETVKPQ-NFAWXSAZSA-N 0 1 389.297 3.444 10 0 GGAEMN C[C@H]1C[C@H](c2ccc(Br)cc2)CN1CC1(CS(C)(=O)=O)CC1 ZINC000626040868 566377757 /nfs/dbraw/zinc/37/77/57/566377757.db2.gz NFHMPPGHHMRWMG-ZFWWWQNUSA-N 0 1 386.355 3.452 10 0 GGAEMN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1Cc1coc(S(N)(=O)=O)c1 ZINC000626040722 566377983 /nfs/dbraw/zinc/37/79/83/566377983.db2.gz KVBIABPSQQTYGG-BXUZGUMPSA-N 0 1 399.310 3.068 10 0 GGAEMN COC[C@H](NS(=O)(=O)c1c(Cl)cccc1Br)c1ccco1 ZINC000510356789 566378266 /nfs/dbraw/zinc/37/82/66/566378266.db2.gz VAZKZXRKCKBKEJ-NSHDSACASA-N 0 1 394.674 3.362 10 0 GGAEMN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1CC1(CS(C)(=O)=O)CC1 ZINC000626040866 566378242 /nfs/dbraw/zinc/37/82/42/566378242.db2.gz NFHMPPGHHMRWMG-HIFRSBDPSA-N 0 1 386.355 3.452 10 0 GGAEMN C[C@@H]1C[C@@H](c2ccc(Br)cc2)CN1CC1(CS(C)(=O)=O)CC1 ZINC000626040867 566378709 /nfs/dbraw/zinc/37/87/09/566378709.db2.gz NFHMPPGHHMRWMG-UKRRQHHQSA-N 0 1 386.355 3.452 10 0 GGAEMN Cc1cc(NC(=O)CN2C[C@@H](c3ccc(Br)cc3)C[C@H]2C)n(C)n1 ZINC000626039887 566378835 /nfs/dbraw/zinc/37/88/35/566378835.db2.gz RGWMKINTFLPHOD-HIFRSBDPSA-N 0 1 391.313 3.308 10 0 GGAEMN C[C@@H]1C[C@H](c2ccc(Br)cc2)CN1CC(=O)NCc1cccnc1 ZINC000626041091 566379009 /nfs/dbraw/zinc/37/90/09/566379009.db2.gz QNEYNGDUROGBCV-PBHICJAKSA-N 0 1 388.309 3.338 10 0 GGAEMN CNC(=O)C[C@H](NCc1ccc(I)cc1)c1ccccc1 ZINC000483403856 566380769 /nfs/dbraw/zinc/38/07/69/566380769.db2.gz OEFSFOHWJPCKIC-INIZCTEOSA-N 0 1 394.256 3.258 10 0 GGAEMN CCCC[N@H+]1CCCC[C@@H]1CNS(=O)(=O)c1cccnc1C(F)(F)F ZINC000576847006 566382355 /nfs/dbraw/zinc/38/23/55/566382355.db2.gz PMPPQQGBRQHZBT-CYBMUJFWSA-N 0 1 379.448 3.033 10 0 GGAEMN CC[C@H]1CCCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000463113586 566384675 /nfs/dbraw/zinc/38/46/75/566384675.db2.gz ZGRVLBVHSXIYAP-JTQLQIEISA-N 0 1 383.233 3.430 10 0 GGAEMN Cc1ccc(CNC(=O)c2n[nH]c3ccc(I)cc32)s1 ZINC000463127786 566385755 /nfs/dbraw/zinc/38/57/55/566385755.db2.gz DGNWJIYNGAMKGP-UHFFFAOYSA-N 0 1 397.241 3.467 10 0 GGAEMN CC(C)Cn1ncc(NS(=O)(=O)c2cccc3nsnc32)c1C(C)C ZINC000536573197 566385170 /nfs/dbraw/zinc/38/51/70/566385170.db2.gz UKEAMQCHVUZCGW-UHFFFAOYSA-N 0 1 379.511 3.468 10 0 GGAEMN Cc1occc1CN(C)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463163564 566387840 /nfs/dbraw/zinc/38/78/40/566387840.db2.gz MMBCSPAIIILURQ-UHFFFAOYSA-N 0 1 395.200 3.341 10 0 GGAEMN O=C([C@H]1CCCN(Cc2cc3c(cc2Br)OCO3)C1)N1CCCC1 ZINC000601073611 566388386 /nfs/dbraw/zinc/38/83/86/566388386.db2.gz KQZRDKKDCLFXQY-ZDUSSCGKSA-N 0 1 395.297 3.012 10 0 GGAEMN Cc1cc(NC(=O)CN2CC[C@H](C)C2)n(-c2cccc(Br)c2)n1 ZINC000576888736 566388364 /nfs/dbraw/zinc/38/83/64/566388364.db2.gz WCBKKXMXTKBEMO-LBPRGKRZSA-N 0 1 377.286 3.224 10 0 GGAEMN CN(Cc1ccoc1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463191322 566389198 /nfs/dbraw/zinc/38/91/98/566389198.db2.gz OMXFTJNVTHQZJV-UHFFFAOYSA-N 0 1 381.173 3.033 10 0 GGAEMN CCN(C#N)CCSc1nc(-c2ccc(OC)c(Br)c2)n[nH]1 ZINC000601082168 566390705 /nfs/dbraw/zinc/39/07/05/566390705.db2.gz YTTPKXYYPHWAHF-UHFFFAOYSA-N 0 1 382.287 3.138 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1C[C@H](c2ccccc2)[C@@](F)(CO)C1 ZINC000576938870 566391152 /nfs/dbraw/zinc/39/11/52/566391152.db2.gz JRBCJZOXIAARKO-KDOFPFPSSA-N 0 1 394.240 3.095 10 0 GGAEMN Cc1nc(S(=O)(=O)NCc2ccc3ccccc3n2)sc1Br ZINC000536682073 566391916 /nfs/dbraw/zinc/39/19/16/566391916.db2.gz SDUOAADRQOBTEK-UHFFFAOYSA-N 0 1 398.307 3.241 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000557532327 566394147 /nfs/dbraw/zinc/39/41/47/566394147.db2.gz XTGOQJQFVCQUIB-UHFFFAOYSA-N 0 1 378.460 3.346 10 0 GGAEMN CN(Cc1ccccc1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463247837 566394322 /nfs/dbraw/zinc/39/43/22/566394322.db2.gz XVZPNGXHIWSJRP-UHFFFAOYSA-N 0 1 391.212 3.440 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)[C@H]2CCOc3ccc(Br)cc32)c1 ZINC000649807980 566394466 /nfs/dbraw/zinc/39/44/66/566394466.db2.gz MLIJYBFURPYAEO-AWEZNQCLSA-N 0 1 390.281 3.411 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1cc(Br)ccc1OC(F)F ZINC000576997928 566396819 /nfs/dbraw/zinc/39/68/19/566396819.db2.gz AHNZSKDPLVIWMR-OCCSQVGLSA-N 0 1 396.272 3.298 10 0 GGAEMN O=S(=O)(c1cc(C(F)(F)F)ccc1O)N1CCO[C@@H](c2ccsc2)C1 ZINC000649845645 566397616 /nfs/dbraw/zinc/39/76/16/566397616.db2.gz UHZQQVHDWFHUCA-CYBMUJFWSA-N 0 1 393.408 3.235 10 0 GGAEMN Cn1c(=O)ccc2ccc(NS(=O)(=O)c3ccccc3Br)cc21 ZINC000447263580 566397899 /nfs/dbraw/zinc/39/78/99/566397899.db2.gz JCZCTBPUHVJHOA-UHFFFAOYSA-N 0 1 393.262 3.102 10 0 GGAEMN CN(CC1=Nc2ccccc2S(=O)(=O)N1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000577034986 566399571 /nfs/dbraw/zinc/39/95/71/566399571.db2.gz VLGLXUATFYTPFW-YPMHNXCESA-N 0 1 375.416 3.061 10 0 GGAEMN CC(C)Cn1ccnc1CNCCC(=O)Nc1ccc(Br)cc1 ZINC000577055803 566401493 /nfs/dbraw/zinc/40/14/93/566401493.db2.gz ZRAOZXGINVZQJW-UHFFFAOYSA-N 0 1 379.302 3.420 10 0 GGAEMN CN(C)S(=O)(=O)CCCN1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000463360638 566402398 /nfs/dbraw/zinc/40/23/98/566402398.db2.gz WLDHTOOKVWBIJI-UHFFFAOYSA-N 0 1 379.353 3.454 10 0 GGAEMN CN(CCCN(C)S(=O)(=O)c1ccc2ncsc2c1)Cc1ccco1 ZINC000510677708 566404342 /nfs/dbraw/zinc/40/43/42/566404342.db2.gz CRIFRSJZZCATEX-UHFFFAOYSA-N 0 1 379.507 3.032 10 0 GGAEMN CC[C@@H](CN1CCCC1)NS(=O)(=O)c1cccc(Br)c1Cl ZINC000671176113 566404386 /nfs/dbraw/zinc/40/43/86/566404386.db2.gz CVKRGXVAPYVHAT-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN C[C@@H](NC[C@@H](O)CS(=O)(=O)c1cccs1)c1ccc(Cl)c(F)c1 ZINC000536828746 566405643 /nfs/dbraw/zinc/40/56/43/566405643.db2.gz WDBRHMUOUFTNGT-ZYHUDNBSSA-N 0 1 377.890 3.026 10 0 GGAEMN C[C@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Cl)cc(Cl)c1 ZINC000536866476 566406550 /nfs/dbraw/zinc/40/65/50/566406550.db2.gz RYEPYCUTUAFIMM-LRDDRELGSA-N 0 1 395.352 3.133 10 0 GGAEMN CC1=CCN(CCNC(=O)N(C)CCc2cccc(Br)c2)CC1 ZINC000463405194 566406747 /nfs/dbraw/zinc/40/67/47/566406747.db2.gz OXAMMVGWCOZIHA-UHFFFAOYSA-N 0 1 380.330 3.285 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@@H]2CCCOc3cc(Br)ccc32)CC1=O ZINC000536868684 566407441 /nfs/dbraw/zinc/40/74/41/566407441.db2.gz HIEOMCFBDCNCOY-CUBALJKWSA-N 0 1 379.298 3.262 10 0 GGAEMN C[C@@H](NCCS(=O)(=O)NC[C@@H]1CCCCO1)c1cc(Cl)cc(Cl)c1 ZINC000536866478 566407540 /nfs/dbraw/zinc/40/75/40/566407540.db2.gz RYEPYCUTUAFIMM-WBMJQRKESA-N 0 1 395.352 3.133 10 0 GGAEMN Cn1cc([C@H](NCc2nc3ccc(Br)cc3[nH]2)C(F)(F)F)cn1 ZINC000447376344 566407719 /nfs/dbraw/zinc/40/77/19/566407719.db2.gz UBQFZAUUSHICCE-ZDUSSCGKSA-N 0 1 388.191 3.452 10 0 GGAEMN COc1ccc(CNC(=O)CN(C)CCc2cccc(Br)c2)cc1 ZINC000463415267 566408728 /nfs/dbraw/zinc/40/87/28/566408728.db2.gz QKDCRWNESQLNCR-UHFFFAOYSA-N 0 1 391.309 3.248 10 0 GGAEMN CN(CCc1cccc(Br)c1)CC(=O)N1CCO[C@@H]2CCCC[C@@H]21 ZINC000463413093 566409486 /nfs/dbraw/zinc/40/94/86/566409486.db2.gz JPDIPYIPINSUPA-ZWKOTPCHSA-N 0 1 395.341 3.093 10 0 GGAEMN COC(=O)c1cc(NC(=O)c2cn[nH]c2C(C)C)cc(Br)c1F ZINC000601534322 566411097 /nfs/dbraw/zinc/41/10/97/566411097.db2.gz BFPCSDBLJGZWPF-UHFFFAOYSA-N 0 1 384.205 3.474 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1CC(=O)Nc1ccc(Br)c(C)c1 ZINC000671248940 566413215 /nfs/dbraw/zinc/41/32/15/566413215.db2.gz DQFDFPGTPYRECG-OAHLLOKOSA-N 0 1 396.329 3.077 10 0 GGAEMN O=C1[C@@H](N2CC[C@]3(C2)CCCOC3)CCN1c1cccc(Br)c1 ZINC000671254949 566413360 /nfs/dbraw/zinc/41/33/60/566413360.db2.gz PLQJDFNYNLHTNK-WMZOPIPTSA-N 0 1 379.298 3.057 10 0 GGAEMN CC1=CCN(CCNC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC1 ZINC000626460375 566413640 /nfs/dbraw/zinc/41/36/40/566413640.db2.gz FFSBNTNKXDJYHX-BPQIPLTHSA-N 0 1 375.310 3.103 10 0 GGAEMN C[C@H]1CN(C)C[C@H](C)N1C(=O)c1cc(Br)cc(Br)c1 ZINC000536973003 566415227 /nfs/dbraw/zinc/41/52/27/566415227.db2.gz DSRDMUQRXSBHPZ-UWVGGRQHSA-N 0 1 390.119 3.376 10 0 GGAEMN Brc1ccc(CN2CC[C@]3(C2)CCCOC3)c(N2CCOCC2)c1 ZINC000671312914 566416461 /nfs/dbraw/zinc/41/64/61/566416461.db2.gz ZPFXSBGSYSWWOE-IBGZPJMESA-N 0 1 395.341 3.288 10 0 GGAEMN COC(=O)COc1ccc(S(=O)(=O)Nc2csc3ccccc23)cc1 ZINC000484173193 566419143 /nfs/dbraw/zinc/41/91/43/566419143.db2.gz NGBYSIWFZRSNBO-UHFFFAOYSA-N 0 1 377.443 3.254 10 0 GGAEMN O=C(CC(F)(F)F)NC[C@H]1CCCN(CCOc2ccccc2Cl)C1 ZINC000510905452 566419327 /nfs/dbraw/zinc/41/93/27/566419327.db2.gz PXOCRXAUUIYYDN-CYBMUJFWSA-N 0 1 378.822 3.499 10 0 GGAEMN CCS(=O)(=O)c1cccc(S(=O)(=O)Nc2csc3ccccc23)c1 ZINC000484236020 566420095 /nfs/dbraw/zinc/42/00/95/566420095.db2.gz UKRABLKXJXOMAO-UHFFFAOYSA-N 0 1 381.500 3.496 10 0 GGAEMN O[C@H](CN(CCn1ccnc1)Cc1ccc(Br)o1)CC(F)(F)F ZINC000510952744 566423283 /nfs/dbraw/zinc/42/32/83/566423283.db2.gz PYPYJWMUFWNOSH-NSHDSACASA-N 0 1 396.207 3.054 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)c1csc(=NC3CC3)[nH]1)CC2 ZINC000537172406 566425846 /nfs/dbraw/zinc/42/58/46/566425846.db2.gz VNVCNQVUPHCANV-UHFFFAOYSA-N 0 1 392.322 3.409 10 0 GGAEMN CN(C)CCN(Cc1ccccc1F)S(=O)(=O)c1c(F)cccc1Cl ZINC000463669899 566426704 /nfs/dbraw/zinc/42/67/04/566426704.db2.gz OFGLPDDZMGLAMR-UHFFFAOYSA-N 0 1 388.867 3.371 10 0 GGAEMN Brc1ccc2c(c1)[C@H](NCc1cccc(N3CCOCC3)n1)CC2 ZINC000511012253 566428230 /nfs/dbraw/zinc/42/82/30/566428230.db2.gz OCYSJJLVGNOCCQ-GOSISDBHSA-N 0 1 388.309 3.458 10 0 GGAEMN C[C@@H]1[C@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)[C@@H](C)CN1C ZINC000650150929 566428682 /nfs/dbraw/zinc/42/86/82/566428682.db2.gz BSASVELCFZVWBO-TUAOUCFPSA-N 0 1 392.297 3.256 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N(CC1CC1)CC1CC1 ZINC000463718564 566428860 /nfs/dbraw/zinc/42/88/60/566428860.db2.gz ZFSUENVMMOSUHG-UHFFFAOYSA-N 0 1 395.244 3.430 10 0 GGAEMN CCSc1ccc(Cl)cc1NS(=O)(=O)CC1(OC)CCOCC1 ZINC000650176812 566431649 /nfs/dbraw/zinc/43/16/49/566431649.db2.gz VFIXRHNMLKVUGM-UHFFFAOYSA-N 0 1 379.931 3.389 10 0 GGAEMN C[C@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@H](S(=O)(=O)N(C)C)C1 ZINC000511059520 566432364 /nfs/dbraw/zinc/43/23/64/566432364.db2.gz MWROXYBSUAUXLV-DOMZBBRYSA-N 0 1 380.432 3.002 10 0 GGAEMN COc1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1C)NC(=O)CC2 ZINC000463786806 566432868 /nfs/dbraw/zinc/43/28/68/566432868.db2.gz DMRGORKKHJARJQ-UHFFFAOYSA-N 0 1 380.853 3.343 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1CC[S@](=O)c1cc(Cl)ccc1Cl ZINC000577422358 566434085 /nfs/dbraw/zinc/43/40/85/566434085.db2.gz XQCNPXUXAANQBO-SHACYNPGSA-N 0 1 391.364 3.482 10 0 GGAEMN C[C@H](Oc1ccccc1Br)C(=O)Nc1cnn(-c2ccncc2)c1 ZINC000601978889 566435751 /nfs/dbraw/zinc/43/57/51/566435751.db2.gz STNIMIQMRFCBRH-LBPRGKRZSA-N 0 1 387.237 3.436 10 0 GGAEMN CC(=O)NCCc1ccc(S(=O)(=O)Nc2cc(C(F)F)ccc2F)s1 ZINC000650217654 566439443 /nfs/dbraw/zinc/43/94/43/566439443.db2.gz PNYRUEOFXQSRDJ-UHFFFAOYSA-N 0 1 392.424 3.304 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)N3CC[C@@H](c4nc[nH]n4)C3)coc21 ZINC000577486180 566439619 /nfs/dbraw/zinc/43/96/19/566439619.db2.gz ZSACZECKADMTQU-SNVBAGLBSA-N 0 1 375.226 3.252 10 0 GGAEMN CN(C[C@H]1CCC[N@@H+](CCc2cc(Cl)ccc2Cl)C1)S(C)(=O)=O ZINC000511142553 566441979 /nfs/dbraw/zinc/44/19/79/566441979.db2.gz YXPMXOLFHHFFQE-CYBMUJFWSA-N 0 1 379.353 3.139 10 0 GGAEMN CN(C[C@H]1CCCN(CCc2cc(Cl)ccc2Cl)C1)S(C)(=O)=O ZINC000511142553 566441987 /nfs/dbraw/zinc/44/19/87/566441987.db2.gz YXPMXOLFHHFFQE-CYBMUJFWSA-N 0 1 379.353 3.139 10 0 GGAEMN CSc1ccc(S(=O)(=O)N2CCCC[C@H]2c2n[nH]c(C)n2)cc1Cl ZINC000511151762 566442169 /nfs/dbraw/zinc/44/21/69/566442169.db2.gz PEHGXTVGCPNEJM-ZDUSSCGKSA-N 0 1 386.930 3.404 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1 ZINC000671699844 566443118 /nfs/dbraw/zinc/44/31/18/566443118.db2.gz QRFKGBSHXPOCSK-AWEZNQCLSA-N 0 1 382.291 3.256 10 0 GGAEMN Cc1cc(C(=O)N=c2ncn(C(C)C)[nH]2)nn1-c1ccc(Cl)cc1Cl ZINC000650284261 566445278 /nfs/dbraw/zinc/44/52/78/566445278.db2.gz DBAUDSIYYBJCIO-UHFFFAOYSA-N 0 1 379.251 3.334 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)[N-]c2ccc3[nH+]c(C)cn3c2)cc1OC ZINC000447896429 566445286 /nfs/dbraw/zinc/44/52/86/566445286.db2.gz HPEDUOBDQGYTHV-UHFFFAOYSA-N 0 1 381.841 3.114 10 0 GGAEMN COC(=O)[C@@](C)(NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000602142075 566448960 /nfs/dbraw/zinc/44/89/60/566448960.db2.gz MEMJHHRRLJCRAD-AGKHESDQSA-N 0 1 382.247 3.025 10 0 GGAEMN COc1cccc(N2CCC[C@@H](NCc3c(Br)c(C)nn3C)C2)c1 ZINC000447943234 566449067 /nfs/dbraw/zinc/44/90/67/566449067.db2.gz JNNGNVRKKRVTLF-CQSZACIVSA-N 0 1 393.329 3.258 10 0 GGAEMN OCCCN(Cc1ccccn1)C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000558104660 566450137 /nfs/dbraw/zinc/45/01/37/566450137.db2.gz ABXJTOQJZUZMQW-OAHLLOKOSA-N 0 1 385.291 3.013 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(CN(C)C(=O)c2ccc(Br)s2)n1 ZINC000577609542 566450268 /nfs/dbraw/zinc/45/02/68/566450268.db2.gz BJPDSMWGIVYTNG-SECBINFHSA-N 0 1 387.303 3.212 10 0 GGAEMN C[N@@H+](CCCNC(=O)N=c1nc(-c2ccsc2)[n-]s1)C1CCCCC1 ZINC000448003364 566453367 /nfs/dbraw/zinc/45/33/67/566453367.db2.gz HCZWQOGYERBCRM-UHFFFAOYSA-N 0 1 379.555 3.465 10 0 GGAEMN CCOC(=O)C(CC)(CC)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000558203079 566458266 /nfs/dbraw/zinc/45/82/66/566458266.db2.gz IDUMRXCDNYQMKT-UHFFFAOYSA-N 0 1 382.258 3.177 10 0 GGAEMN CC[C@H](CS(=O)(=O)Nc1ccc(Sc2cccc(OC)c2)cn1)OC ZINC000650490549 566460400 /nfs/dbraw/zinc/46/04/00/566460400.db2.gz YJPLBWYYCZCZOL-CYBMUJFWSA-N 0 1 382.507 3.408 10 0 GGAEMN Brc1cc(CN2CCC[C@@H]([C@@H]3CCOC3)C2)cc2c1OCCO2 ZINC000537698507 566463549 /nfs/dbraw/zinc/46/35/49/566463549.db2.gz VMTIUMAOSKISGW-HUUCEWRRSA-N 0 1 382.298 3.469 10 0 GGAEMN Brc1cc(CN2CCC[C@H]([C@H]3CCOC3)C2)cc2c1OCCO2 ZINC000537698505 566463880 /nfs/dbraw/zinc/46/38/80/566463880.db2.gz VMTIUMAOSKISGW-GJZGRUSLSA-N 0 1 382.298 3.469 10 0 GGAEMN Brc1cc(CN2CCC[C@@H]([C@H]3CCOC3)C2)cc2c1OCCO2 ZINC000537698501 566464064 /nfs/dbraw/zinc/46/40/64/566464064.db2.gz VMTIUMAOSKISGW-CABCVRRESA-N 0 1 382.298 3.469 10 0 GGAEMN C[C@H](CC(F)(F)F)NC(=O)c1n[nH]c2ccc(I)cc21 ZINC000464312622 566464548 /nfs/dbraw/zinc/46/45/48/566464548.db2.gz JRACEQQRQZNEHS-ZCFIWIBFSA-N 0 1 397.138 3.238 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1ccsc1 ZINC000650643202 566468413 /nfs/dbraw/zinc/46/84/13/566468413.db2.gz YHBBKGJEVPDTFF-GFCCVEGCSA-N 0 1 379.423 3.427 10 0 GGAEMN CC(C)(C(=O)N1CCC(c2n[nH]c(=O)o2)CC1)c1cccc(Br)c1 ZINC000558401039 566469161 /nfs/dbraw/zinc/46/91/61/566469161.db2.gz CNWXSSFJYPMTJL-UHFFFAOYSA-N 0 1 394.269 3.222 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ocnc1C1CC1 ZINC000558406917 566469291 /nfs/dbraw/zinc/46/92/91/566469291.db2.gz USKHXOMXLDXMCJ-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ocnc1C1CC1 ZINC000558406917 566469298 /nfs/dbraw/zinc/46/92/98/566469298.db2.gz USKHXOMXLDXMCJ-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN1C/C(C)=C/c1cccc(C(F)(F)F)c1 ZINC000558400564 566469321 /nfs/dbraw/zinc/46/93/21/566469321.db2.gz UJEOUPIEQOZGFI-WQMJKPAKSA-N 0 1 376.444 3.122 10 0 GGAEMN Cc1cc(Br)cn2cc(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)nc12 ZINC000423031779 566469572 /nfs/dbraw/zinc/46/95/72/566469572.db2.gz DOFKYEBHXNCGTF-LBPRGKRZSA-N 0 1 388.313 3.418 10 0 GGAEMN CN(C(=O)CN[C@](C)(CO)c1ccc(Br)cc1)C1CCCCC1 ZINC000511545261 566469975 /nfs/dbraw/zinc/46/99/75/566469975.db2.gz KLKAYYSVBVIRBJ-GOSISDBHSA-N 0 1 383.330 3.037 10 0 GGAEMN Cc1ccc([C@H](CNC(=O)C(=O)c2ccc(Br)cc2)N(C)C)cc1 ZINC000511538095 566470053 /nfs/dbraw/zinc/47/00/53/566470053.db2.gz YKQVSBBAIJQULI-KRWDZBQOSA-N 0 1 389.293 3.359 10 0 GGAEMN C[C@@H]1CO[C@H](C(F)(F)F)CN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000672175257 566470077 /nfs/dbraw/zinc/47/00/77/566470077.db2.gz HKGZWQBHZOEYBH-HQJQHLMTSA-N 0 1 392.175 3.117 10 0 GGAEMN C[C@@](CO)(NCC(=O)NCCC1=CCCCC1)c1ccc(Br)cc1 ZINC000511545876 566470136 /nfs/dbraw/zinc/47/01/36/566470136.db2.gz NPXWHTHLEDIRCF-IBGZPJMESA-N 0 1 395.341 3.253 10 0 GGAEMN C[C@](CO)(NCC(=O)NCCC1=CCCCC1)c1ccc(Br)cc1 ZINC000511545877 566470147 /nfs/dbraw/zinc/47/01/47/566470147.db2.gz NPXWHTHLEDIRCF-LJQANCHMSA-N 0 1 395.341 3.253 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000537785273 566470343 /nfs/dbraw/zinc/47/03/43/566470343.db2.gz WXRNVAYNRZVPIH-GFCCVEGCSA-N 0 1 380.267 3.159 10 0 GGAEMN C[C@@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1cncc(Br)c1 ZINC000558424050 566470474 /nfs/dbraw/zinc/47/04/74/566470474.db2.gz UDOOAXFHPGPESP-KXBFYZLASA-N 0 1 391.309 3.386 10 0 GGAEMN C[C@H]1CO[C@@H](C(F)(F)F)CN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000672175259 566470568 /nfs/dbraw/zinc/47/05/68/566470568.db2.gz HKGZWQBHZOEYBH-WRWORJQWSA-N 0 1 392.175 3.117 10 0 GGAEMN Cc1cccc(NC(=O)CN[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511561104 566471020 /nfs/dbraw/zinc/47/10/20/566471020.db2.gz HWMGMCDMIQMIOD-GOSISDBHSA-N 0 1 377.282 3.193 10 0 GGAEMN C[C@H]1CN(C(=O)N[C@@H]2CCCSc3ccc(Br)cc32)CCN1 ZINC000627179830 566471061 /nfs/dbraw/zinc/47/10/61/566471061.db2.gz NKDFJPMVGPDFED-SMDDNHRTSA-N 0 1 384.343 3.379 10 0 GGAEMN COc1cc2nccc(N3CCO[C@@H](C(=O)C4CC4)C3)c2cc1Br ZINC000577860936 566471146 /nfs/dbraw/zinc/47/11/46/566471146.db2.gz DZKVWOHECYKOMG-QGZVFWFLSA-N 0 1 391.265 3.190 10 0 GGAEMN C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511585648 566473305 /nfs/dbraw/zinc/47/33/05/566473305.db2.gz NVOQXMYDMMKPEU-LJHODMEESA-N 0 1 397.357 3.283 10 0 GGAEMN CC(C)N(C(=O)CN[C@](C)(CO)c1ccc(Br)cc1)C1CCCC1 ZINC000511574852 566473783 /nfs/dbraw/zinc/47/37/83/566473783.db2.gz LJHPFBCFOWOGKI-LJQANCHMSA-N 0 1 397.357 3.426 10 0 GGAEMN Cc1ccc(NC(=O)CN[C@](C)(CO)c2ccc(Br)cc2)cc1F ZINC000511605550 566474960 /nfs/dbraw/zinc/47/49/60/566474960.db2.gz KGVCHPPSYWEDLN-GOSISDBHSA-N 0 1 395.272 3.332 10 0 GGAEMN CCc1cccc(NC(=O)CN[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511607089 566475455 /nfs/dbraw/zinc/47/54/55/566475455.db2.gz RVXUCGGPQYGQJB-LJQANCHMSA-N 0 1 391.309 3.447 10 0 GGAEMN CC[C@H]1CCCCN1C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000511604417 566475467 /nfs/dbraw/zinc/47/54/67/566475467.db2.gz LRGVUPWTIWGGHA-WMZOPIPTSA-N 0 1 383.330 3.037 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)c(C)s1 ZINC000577927883 566476066 /nfs/dbraw/zinc/47/60/66/566476066.db2.gz HPHZOOGRKHATHJ-VXGBXAGGSA-N 0 1 381.523 3.174 10 0 GGAEMN C[C@@H]1CCC[C@H](NC(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)[C@@H]1C ZINC000511609609 566477381 /nfs/dbraw/zinc/47/73/81/566477381.db2.gz IQTQYQMZAHKWRZ-GNSPCKGOSA-N 0 1 397.357 3.187 10 0 GGAEMN CC(C)C[C@@H](C)N(C)C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511628192 566477407 /nfs/dbraw/zinc/47/74/07/566477407.db2.gz XWCWHQSMZQJSNR-RDTXWAMCSA-N 0 1 385.346 3.139 10 0 GGAEMN CN(C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)[C@H]1CN2CCC1CC2 ZINC000537896590 566478577 /nfs/dbraw/zinc/47/85/77/566478577.db2.gz GMOPVQJFYRNVFS-KRWDZBQOSA-N 0 1 379.291 3.345 10 0 GGAEMN CC[C@@H](C(=O)[O-])[N@@H+](C)Cc1cc(Br)cc(Br)c1N ZINC000650805491 566479499 /nfs/dbraw/zinc/47/94/99/566479499.db2.gz BMAIRZFQCCLVSJ-JTQLQIEISA-N 0 1 380.080 3.089 10 0 GGAEMN COCCN1CCN(C(=O)[C@@H](C)c2ccc(Br)s2)C(C)(C)C1 ZINC000650830535 566481055 /nfs/dbraw/zinc/48/10/55/566481055.db2.gz ASEPVNPIRJNLTB-LBPRGKRZSA-N 0 1 389.359 3.183 10 0 GGAEMN COCCN1CCN(C(=O)CCc2cc(Br)cs2)C(C)(C)C1 ZINC000650831422 566481326 /nfs/dbraw/zinc/48/13/26/566481326.db2.gz CLAQXFJYLBGWQX-UHFFFAOYSA-N 0 1 389.359 3.012 10 0 GGAEMN COc1cccc([C@H](CNC(=O)Cc2sccc2Br)N(C)C)c1 ZINC000448603240 566481916 /nfs/dbraw/zinc/48/19/16/566481916.db2.gz DPNUOYJDQYBNHE-HNNXBMFYSA-N 0 1 397.338 3.481 10 0 GGAEMN CN1C[C@H]2CCN(C(=O)c3scc(Br)c3Br)[C@H]2C1 ZINC000627487630 566483470 /nfs/dbraw/zinc/48/34/70/566483470.db2.gz HYHATZGDFUYZGC-APPZFPTMSA-N 0 1 394.132 3.049 10 0 GGAEMN O=C(Cn1ccc(=O)c2ccccc21)Nc1nc2ccc(Br)cc2[nH]1 ZINC000464551195 566483996 /nfs/dbraw/zinc/48/39/96/566483996.db2.gz ILMRZBWOCNUKLR-UHFFFAOYSA-N 0 1 397.232 3.279 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@@H]2CCCOc3ccc(Br)cc32)CC1=O ZINC000537988431 566484399 /nfs/dbraw/zinc/48/43/99/566484399.db2.gz XBIVJEOSNUBJBN-CUBALJKWSA-N 0 1 379.298 3.262 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](N[C@H]2CCCOc3ccc(Br)cc32)CC1=O ZINC000537988434 566484518 /nfs/dbraw/zinc/48/45/18/566484518.db2.gz XBIVJEOSNUBJBN-XTBFLFJDSA-N 0 1 379.298 3.262 10 0 GGAEMN CC(=O)NCc1ccc(C(=O)Nc2nc3ccc(Br)cc3[nH]2)s1 ZINC000464556971 566485702 /nfs/dbraw/zinc/48/57/02/566485702.db2.gz UEKBFOCYEXCSIH-UHFFFAOYSA-N 0 1 393.266 3.275 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cccc(F)c2I)o1 ZINC000538007857 566485844 /nfs/dbraw/zinc/48/58/44/566485844.db2.gz MNEYCSYZEHBMRX-UHFFFAOYSA-N 0 1 381.166 3.133 10 0 GGAEMN O=C(COc1c(Cl)cc(Cl)cc1Cl)NCCCCN1CCOCC1 ZINC000448715087 566489350 /nfs/dbraw/zinc/48/93/50/566489350.db2.gz ROMOOMGXIIOXKY-UHFFFAOYSA-N 0 1 395.714 3.254 10 0 GGAEMN CC1(C)CCC[C@@](O)(CNCc2ncc(I)s2)C1 ZINC000511955094 566500144 /nfs/dbraw/zinc/50/01/44/566500144.db2.gz MLRGJAMLKZEKGZ-ZDUSSCGKSA-N 0 1 380.295 3.169 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000538057665 566490852 /nfs/dbraw/zinc/49/08/52/566490852.db2.gz YETCMKARSWMMPN-ZLENFMNRSA-N 0 1 392.297 3.485 10 0 GGAEMN C[C@H]1CC(C)(C)C[C@@](CO)(NCc2ncc(I)s2)C1 ZINC000512052962 566509056 /nfs/dbraw/zinc/50/90/56/566509056.db2.gz NZEWENKLRAIBBM-HZMBPMFUSA-N 0 1 394.322 3.415 10 0 GGAEMN C[C@](N)(C(=O)NCCC[C@@H]1CCCC[C@H]1O)c1ccc(Br)cc1 ZINC000578130641 566495006 /nfs/dbraw/zinc/49/50/06/566495006.db2.gz VEDICSSZHSRDHW-FDQGKXFDSA-N 0 1 383.330 3.071 10 0 GGAEMN C[C@](N)(C(=O)NCCC[C@H]1CCCC[C@@H]1O)c1ccc(Br)cc1 ZINC000578130644 566495534 /nfs/dbraw/zinc/49/55/34/566495534.db2.gz VEDICSSZHSRDHW-RPVQJOFSSA-N 0 1 383.330 3.071 10 0 GGAEMN CCn1nc(C)c(CNC(=O)c2cc(Br)cc3nc[nH]c32)c1C ZINC000558629607 566495842 /nfs/dbraw/zinc/49/58/42/566495842.db2.gz LWDRXARKFIEJGA-UHFFFAOYSA-N 0 1 376.258 3.089 10 0 GGAEMN Cc1ccc(Oc2ccc(NS(=O)(=O)c3c(Cl)cnn3C)cn2)cc1 ZINC000485396958 566495884 /nfs/dbraw/zinc/49/58/84/566495884.db2.gz PDXCXDFYLMPDNZ-UHFFFAOYSA-N 0 1 378.841 3.370 10 0 GGAEMN O=S(=O)(NCCN[C@H]1CCCOc2cc(Cl)ccc21)c1ccccc1 ZINC000538206004 566498730 /nfs/dbraw/zinc/49/87/30/566498730.db2.gz AFNLNKRGUAWBCU-KRWDZBQOSA-N 0 1 380.897 3.122 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@@H]2CC(=O)N(c3cccc(Br)c3)C2)n1 ZINC000578192447 566500077 /nfs/dbraw/zinc/50/00/77/566500077.db2.gz QNMVGULLNDFZGS-RISCZKNCSA-N 0 1 393.285 3.399 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@H]2CC(=O)N(c3cccc(Br)c3)C2)n1 ZINC000578192446 566500614 /nfs/dbraw/zinc/50/06/14/566500614.db2.gz QNMVGULLNDFZGS-FZMZJTMJSA-N 0 1 393.285 3.399 10 0 GGAEMN Cc1ccc(C2(C(=O)NCc3nnc[nH]3)CCCCC2)c(Br)c1 ZINC000651172882 566500868 /nfs/dbraw/zinc/50/08/68/566500868.db2.gz LQFMXYLVMIMDFP-UHFFFAOYSA-N 0 1 377.286 3.394 10 0 GGAEMN O=C(COc1ccc(F)cc1Br)Nc1cccc(-c2nnc[nH]2)c1 ZINC000511993224 566503143 /nfs/dbraw/zinc/50/31/43/566503143.db2.gz PXHQENRMAWWBOZ-UHFFFAOYSA-N 0 1 391.200 3.391 10 0 GGAEMN Cc1cc(NC(=O)Nc2cc(-c3nccn3C)n[nH]2)cc(C)c1Br ZINC000558769402 566505691 /nfs/dbraw/zinc/50/56/91/566505691.db2.gz FJRBWEZVEBSYNE-UHFFFAOYSA-N 0 1 389.257 3.255 10 0 GGAEMN CCC[C@H](NCCNS(=O)(=O)c1ccc(Cl)cc1C)c1ccccn1 ZINC000578309110 566511256 /nfs/dbraw/zinc/51/12/56/566511256.db2.gz JETSYLWBNRKMDG-INIZCTEOSA-N 0 1 381.929 3.453 10 0 GGAEMN CN(c1nnc([C@H]2CCCS2)n1C)C1CCN(CCC(F)(F)F)CC1 ZINC000424097817 566511359 /nfs/dbraw/zinc/51/13/59/566511359.db2.gz KCZPNIMOYCHBOY-CYBMUJFWSA-N 0 1 377.480 3.236 10 0 GGAEMN CCC[C@@H](NCCNS(=O)(=O)c1ccc(Cl)cc1C)c1ccccn1 ZINC000578309111 566511481 /nfs/dbraw/zinc/51/14/81/566511481.db2.gz JETSYLWBNRKMDG-MRXNPFEDSA-N 0 1 381.929 3.453 10 0 GGAEMN Cc1ccc(-c2n[nH]c(SCc3ccc(S(=O)(=O)N(C)C)s3)n2)cc1 ZINC000424106775 566512958 /nfs/dbraw/zinc/51/29/58/566512958.db2.gz YBAJCXRJJHBEAO-UHFFFAOYSA-N 0 1 394.547 3.384 10 0 GGAEMN COCCN1CC[C@@H](NC(=O)c2ccc3scc(Br)c3c2)C1 ZINC000448932627 566513640 /nfs/dbraw/zinc/51/36/40/566513640.db2.gz KKYZOKNWJKNDBC-GFCCVEGCSA-N 0 1 383.311 3.114 10 0 GGAEMN C[C@@H](CN1CCN(C)CC1)NC(=O)c1ccc2scc(Br)c2c1 ZINC000448930828 566513893 /nfs/dbraw/zinc/51/38/93/566513893.db2.gz SWKWKMQFXLDRJQ-LBPRGKRZSA-N 0 1 396.354 3.030 10 0 GGAEMN Cc1ccc(C2(C(=O)NCCc3nc[nH]n3)CCCCC2)c(Br)c1 ZINC000651389887 566520392 /nfs/dbraw/zinc/52/03/92/566520392.db2.gz HSYDXBBCPYCOSS-UHFFFAOYSA-N 0 1 391.313 3.436 10 0 GGAEMN CCOC(=O)c1sc([C@H](C)NC(=O)c2sccc2CN(C)C)nc1C ZINC000465139990 566520929 /nfs/dbraw/zinc/52/09/29/566520929.db2.gz MIJCJJRBXYJAAE-NSHDSACASA-N 0 1 381.523 3.242 10 0 GGAEMN O=C(NCCCCN1CCOCC1)NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000538612888 566523171 /nfs/dbraw/zinc/52/31/71/566523171.db2.gz JMTTUUMKXSDDJL-UHFFFAOYSA-N 0 1 386.323 3.394 10 0 GGAEMN O=C([C@@H]1CCOc2ccc(Br)cc21)N1CCC(c2cnc[nH]2)CC1 ZINC000651462157 566524707 /nfs/dbraw/zinc/52/47/07/566524707.db2.gz SDUNUKSAYQFGIK-CQSZACIVSA-N 0 1 390.281 3.445 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(Br)cc2OC)[C@@H]1n1cccn1 ZINC000578502965 566528431 /nfs/dbraw/zinc/52/84/31/566528431.db2.gz YMGNTYMEOLSHDI-OIISXLGYSA-N 0 1 380.286 3.163 10 0 GGAEMN CC(C)N1CCN(c2nnc([C@@H]3CCCS3)n2Cc2cccs2)CC1 ZINC000424360212 566529131 /nfs/dbraw/zinc/52/91/31/566529131.db2.gz ROBYURSGKGVYBD-INIZCTEOSA-N 0 1 377.583 3.486 10 0 GGAEMN C[C@H](NCc1cccc(S(=O)(=O)N(C)C)c1)c1ccc2ncsc2c1 ZINC000485822448 566529558 /nfs/dbraw/zinc/52/95/58/566529558.db2.gz MZAGVZQMHCUCAK-ZDUSSCGKSA-N 0 1 375.519 3.397 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)[C@H]1CCOc2ccc(Br)cc21 ZINC000651533099 566530337 /nfs/dbraw/zinc/53/03/37/566530337.db2.gz NASPLSUDNJUZRJ-GXTWGEPZSA-N 0 1 376.254 3.232 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651537128 566530518 /nfs/dbraw/zinc/53/05/18/566530518.db2.gz UMBYJCQUGMOHSL-QMTHXVAHSA-N 0 1 378.270 3.094 10 0 GGAEMN O=C(N[C@H]1CCCc2cn[nH]c21)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651533139 566530595 /nfs/dbraw/zinc/53/05/95/566530595.db2.gz NASPLSUDNJUZRJ-OCCSQVGLSA-N 0 1 376.254 3.232 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(N3CCOCC3)CC2)c(C)c1Br ZINC000628123523 566532203 /nfs/dbraw/zinc/53/22/03/566532203.db2.gz UGRWBHAVOANBAE-UHFFFAOYSA-N 0 1 381.314 3.003 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)cc3)c[nH]2)C[C@H]1C(=O)[O-] ZINC000578532612 566532385 /nfs/dbraw/zinc/53/23/85/566532385.db2.gz WBEGGBKWWLLIQX-BXUZGUMPSA-N 0 1 378.270 3.382 10 0 GGAEMN C[C@@H](CC(=O)N1CCC(N2CCOCC2)CC1)c1ccc(Br)cc1 ZINC000628124618 566532791 /nfs/dbraw/zinc/53/27/91/566532791.db2.gz OADCEADRTBOXBZ-HNNXBMFYSA-N 0 1 395.341 3.266 10 0 GGAEMN C[C@@H](c1ccncc1)N1CCC(NC(=O)c2nscc2Br)CC1 ZINC000651558384 566533626 /nfs/dbraw/zinc/53/36/26/566533626.db2.gz OMVFQTUXLZSUPK-NSHDSACASA-N 0 1 395.326 3.256 10 0 GGAEMN Cc1cc(NC(=O)c2ccc(Br)cc2O)n(C2CCOCC2)n1 ZINC000538764958 566535269 /nfs/dbraw/zinc/53/52/69/566535269.db2.gz KLXFVCORIZYQSC-UHFFFAOYSA-N 0 1 380.242 3.263 10 0 GGAEMN C[C@@]1(CN2CCCN(S(=O)(=O)c3ccc(Cl)s3)CC2)CCCS1 ZINC000628160349 566535514 /nfs/dbraw/zinc/53/55/14/566535514.db2.gz RPCXOAJTPSRCAM-HNNXBMFYSA-N 0 1 395.015 3.384 10 0 GGAEMN CN1Cc2ccccc2[C@@H](Nc2cc(Br)cc(F)c2C(N)=O)C1 ZINC000538764347 566535429 /nfs/dbraw/zinc/53/54/29/566535429.db2.gz BAAMXIJEVLELNH-HNNXBMFYSA-N 0 1 378.245 3.286 10 0 GGAEMN COc1ccc(F)c(CNCCNC(=O)c2ccc(Br)cc2)c1 ZINC000559252648 566536493 /nfs/dbraw/zinc/53/64/93/566536493.db2.gz GLMNBLCWEXIHOX-UHFFFAOYSA-N 0 1 381.245 3.116 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCSC[C@@H]1C1CC1 ZINC000578599124 566537083 /nfs/dbraw/zinc/53/70/83/566537083.db2.gz ILSCKIPQJDFZFL-OAHLLOKOSA-N 0 1 393.306 3.258 10 0 GGAEMN Cn1cc(CNCc2ccc(I)cc2)c(C(F)(F)F)n1 ZINC000449200083 566537832 /nfs/dbraw/zinc/53/78/32/566537832.db2.gz GQOHSRCCFKKRHK-UHFFFAOYSA-N 0 1 395.166 3.333 10 0 GGAEMN COc1cc2c(cc1F)nccc2N(C)CCn1cc(Br)cn1 ZINC000673521348 566540182 /nfs/dbraw/zinc/54/01/82/566540182.db2.gz AWNLTPQBBPTJPR-UHFFFAOYSA-N 0 1 379.233 3.478 10 0 GGAEMN Fc1cc(Br)cc(CNCc2cnc(N3CCOCC3)c(F)c2)c1 ZINC000449250286 566540531 /nfs/dbraw/zinc/54/05/31/566540531.db2.gz NTUJQDBMTHCYHK-UHFFFAOYSA-N 0 1 398.251 3.249 10 0 GGAEMN Cc1csc(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c1Br ZINC000485973491 566545505 /nfs/dbraw/zinc/54/55/05/566545505.db2.gz CKWPGLWVDCWXBS-UHFFFAOYSA-N 0 1 379.239 3.047 10 0 GGAEMN CN(C(=O)c1cc(F)c(Br)c(Cl)c1)[C@H]1CN2CCC1CC2 ZINC000512679113 566549521 /nfs/dbraw/zinc/54/95/21/566549521.db2.gz VGKSILLWWFFIMH-ZDUSSCGKSA-N 0 1 375.669 3.408 10 0 GGAEMN CCOC(=O)c1cc(CN[C@@](C)(CO)c2ccc(Br)cc2)[nH]c1C ZINC000449324755 566550949 /nfs/dbraw/zinc/55/09/49/566550949.db2.gz ZLIXTMRUBBCGCP-SFHVURJKSA-N 0 1 395.297 3.260 10 0 GGAEMN CSCC[C@H](N[C@@H]1CCc2c1ccc(F)c2Br)C(=O)N(C)C ZINC000449329315 566550999 /nfs/dbraw/zinc/55/09/99/566550999.db2.gz NHTYIFMWQNDAAM-KGLIPLIRSA-N 0 1 389.334 3.375 10 0 GGAEMN Nc1nc(-n2cccn2)cc(N2CCC[C@H]2c2ccc(Br)cc2)n1 ZINC000538978990 566551214 /nfs/dbraw/zinc/55/12/14/566551214.db2.gz OVJANLVLXXQFND-AWEZNQCLSA-N 0 1 385.269 3.179 10 0 GGAEMN CNS(=O)(=O)Cc1ccc(CN[C@H]2CCc3ccc(F)c(Cl)c32)cc1 ZINC000651685213 566551484 /nfs/dbraw/zinc/55/14/84/566551484.db2.gz NWDIEOYUSZNEFD-INIZCTEOSA-N 0 1 382.888 3.305 10 0 GGAEMN O=C(c1ccc(Br)c(OC(F)(F)F)c1)N1CCN2CCC1CC2 ZINC000512704468 566551735 /nfs/dbraw/zinc/55/17/35/566551735.db2.gz OLMIPMSTTOAPEC-UHFFFAOYSA-N 0 1 393.203 3.268 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2cc(F)ccc2Br)c2ccccc21 ZINC000449362214 566552644 /nfs/dbraw/zinc/55/26/44/566552644.db2.gz ZVZHYAJZGDHZRR-LBPRGKRZSA-N 0 1 384.270 3.249 10 0 GGAEMN CCCOc1ccc(Br)cc1CN(C)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449362257 566552740 /nfs/dbraw/zinc/55/27/40/566552740.db2.gz KQMXMVJFIUJDQB-AEFFLSMTSA-N 0 1 383.330 3.143 10 0 GGAEMN Cc1n[nH]c(C(F)(F)F)c1C(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000673731754 566554588 /nfs/dbraw/zinc/55/45/88/566554588.db2.gz NJBARVSKRLALOR-UHFFFAOYSA-N 0 1 392.834 3.410 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651725742 566556315 /nfs/dbraw/zinc/55/63/15/566556315.db2.gz NOXSVWQXFFTSFU-LLVKDONJSA-N 0 1 377.242 3.340 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651725742 566556317 /nfs/dbraw/zinc/55/63/17/566556317.db2.gz NOXSVWQXFFTSFU-LLVKDONJSA-N 0 1 377.242 3.340 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1C[C@@H]2CCC[C@]2(CO)C1 ZINC000628460982 566557657 /nfs/dbraw/zinc/55/76/57/566557657.db2.gz DGQPDQFBSQIUFO-QFBILLFUSA-N 0 1 398.341 3.459 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN(Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000628496494 566561705 /nfs/dbraw/zinc/56/17/05/566561705.db2.gz RUTGWYSNJQOYLG-ZDUSSCGKSA-N 0 1 399.969 3.225 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)c1ccc2cncn2c1 ZINC000559618302 566561712 /nfs/dbraw/zinc/56/17/12/566561712.db2.gz TVEYAVOLXLROOI-UHFFFAOYSA-N 0 1 390.237 3.374 10 0 GGAEMN O=C(NCCc1ccc(Br)cc1)Nc1cnn(-c2ccncc2)c1 ZINC000673863880 566561729 /nfs/dbraw/zinc/56/17/29/566561729.db2.gz YCGPENSAAGFCLA-UHFFFAOYSA-N 0 1 386.253 3.394 10 0 GGAEMN O=C(NCCc1ccc(Br)s1)Nc1cnn(-c2ccncc2)c1 ZINC000673859477 566561789 /nfs/dbraw/zinc/56/17/89/566561789.db2.gz OHCILUJJNRJTFW-UHFFFAOYSA-N 0 1 392.282 3.456 10 0 GGAEMN O=C(NCc1ccc(Br)s1)Nc1cnn(-c2ccncc2)c1 ZINC000673861905 566562249 /nfs/dbraw/zinc/56/22/49/566562249.db2.gz CRSUXVGSPAXVAP-UHFFFAOYSA-N 0 1 378.255 3.413 10 0 GGAEMN CCCOc1c(Cl)cc(CN[C@H](C)C2(S(C)(=O)=O)CC2)cc1OC ZINC000512852337 566563009 /nfs/dbraw/zinc/56/30/09/566563009.db2.gz UNZMJWOQPVFTBY-GFCCVEGCSA-N 0 1 375.918 3.193 10 0 GGAEMN O=C1[C@H](NCc2ccc(Cl)c(C(F)(F)F)c2)CCN1C1CCOCC1 ZINC000673886218 566563871 /nfs/dbraw/zinc/56/38/71/566563871.db2.gz TYOUCWXUZIXGPB-OAHLLOKOSA-N 0 1 376.806 3.228 10 0 GGAEMN COCCOc1cccc(CN[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000512858325 566564156 /nfs/dbraw/zinc/56/41/56/566564156.db2.gz WHPCODCFEPQFCU-IBGZPJMESA-N 0 1 394.309 3.472 10 0 GGAEMN C[C@@H](NCC1=Cc2cc(Cl)cc(Cl)c2OC1)C1(S(C)(=O)=O)CC1 ZINC000512874903 566566029 /nfs/dbraw/zinc/56/60/29/566566029.db2.gz VYHVOMPBKWIFTK-SNVBAGLBSA-N 0 1 376.305 3.325 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1cccnc1Sc1ccc(Br)cc1 ZINC000673951627 566568630 /nfs/dbraw/zinc/56/86/30/566568630.db2.gz PFVTWBAUJVRVOP-UHFFFAOYSA-N 0 1 390.266 3.043 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1ccc(Oc2ccc(Br)cc2)c(F)c1 ZINC000673951851 566569641 /nfs/dbraw/zinc/56/96/41/566569641.db2.gz ZOVFSHHOEYTUOG-UHFFFAOYSA-N 0 1 391.200 3.429 10 0 GGAEMN COc1ccc([C@H](C)[C@H](C)NCc2nn(C)cc2Br)cc1OC ZINC000449484756 566569690 /nfs/dbraw/zinc/56/96/90/566569690.db2.gz NMMSIOMIHVUYPS-NEPJUHHUSA-N 0 1 382.302 3.482 10 0 GGAEMN CC[C@@H](Cc1ccc(OC)c(OC)c1)NCc1nn(C)cc1Br ZINC000449487044 566569729 /nfs/dbraw/zinc/56/97/29/566569729.db2.gz WMVVEFOTQAHQFX-ZDUSSCGKSA-N 0 1 382.302 3.311 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC[C@H]2CC[C@@H](C1)S2 ZINC000628653094 566570751 /nfs/dbraw/zinc/57/07/51/566570751.db2.gz KWBWFFZSZISLJS-NEPJUHHUSA-N 0 1 393.306 3.401 10 0 GGAEMN OC1(C2CCN(Cc3cnn(-c4ccc(Br)cc4)c3)CC2)CC1 ZINC000651878307 566571419 /nfs/dbraw/zinc/57/14/19/566571419.db2.gz GCRXDTAUSJAWAN-UHFFFAOYSA-N 0 1 376.298 3.372 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@@H]2C[C@H]3C[C@H]3C2)cc1 ZINC000578999440 566571757 /nfs/dbraw/zinc/57/17/57/566571757.db2.gz CPAFJRCHZCHCHP-AGGWBTHJSA-N 0 1 376.503 3.386 10 0 GGAEMN CCS(=O)(=O)C[C@H](C)NC[C@@H](c1c(F)cccc1Cl)N1CCCC1 ZINC000539306641 566572396 /nfs/dbraw/zinc/57/23/96/566572396.db2.gz AOJCQHRVXROMRW-BBRMVZONSA-N 0 1 376.925 3.029 10 0 GGAEMN CCN1C[C@@H](NCc2cnc(-c3ccc(Br)cc3)s2)CC1=O ZINC000449524052 566572878 /nfs/dbraw/zinc/57/28/78/566572878.db2.gz ZNGVUDAWGLACES-ZDUSSCGKSA-N 0 1 380.311 3.283 10 0 GGAEMN CCC[C@@H](C)[C@H](CO)NCc1ncc(Br)cc1Br ZINC000651893940 566572866 /nfs/dbraw/zinc/57/28/66/566572866.db2.gz LUMSEASQTGWXCA-RNCFNFMXSA-N 0 1 380.124 3.493 10 0 GGAEMN Cc1cc(CCNCc2c(F)ccc(I)c2F)on1 ZINC000512997199 566573078 /nfs/dbraw/zinc/57/30/78/566573078.db2.gz ONZKBBAPAXUNNC-UHFFFAOYSA-N 0 1 378.160 3.198 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc(Cl)ccc1Br ZINC000513021678 566574302 /nfs/dbraw/zinc/57/43/02/566574302.db2.gz IBPHEJKHPYXCGT-CYBMUJFWSA-N 0 1 395.750 3.006 10 0 GGAEMN CCCCOc1ncccc1CN[C@@H](C)Cn1cc(Br)ccc1=O ZINC000559896031 566575262 /nfs/dbraw/zinc/57/52/62/566575262.db2.gz WDCXQBLHGCMBRF-AWEZNQCLSA-N 0 1 394.313 3.363 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)N[C@H]1COc2ccc(Cl)cc21 ZINC000559920644 566576586 /nfs/dbraw/zinc/57/65/86/566576586.db2.gz DOFCEBGQFZFGNV-HZMBPMFUSA-N 0 1 383.673 3.376 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1COc2ccc(Cl)cc21 ZINC000559920645 566576713 /nfs/dbraw/zinc/57/67/13/566576713.db2.gz DOFCEBGQFZFGNV-IINYFYTJSA-N 0 1 383.673 3.376 10 0 GGAEMN C[C@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1ccc(Br)cn1 ZINC000579066954 566576911 /nfs/dbraw/zinc/57/69/11/566576911.db2.gz RZVWHPBFXRMPMH-OLZOCXBDSA-N 0 1 387.281 3.293 10 0 GGAEMN C[C@H](Cn1ncc2ccccc2c1=O)N[C@H](C)c1ccc(Br)cn1 ZINC000579066953 566577211 /nfs/dbraw/zinc/57/72/11/566577211.db2.gz RZVWHPBFXRMPMH-CHWSQXEVSA-N 0 1 387.281 3.293 10 0 GGAEMN Cc1nc(NS(=O)(=O)Cc2ccc(Cl)cc2Cl)n(-c2ccccc2)n1 ZINC000559949897 566577558 /nfs/dbraw/zinc/57/75/58/566577558.db2.gz RJQYOAJSFZESJB-UHFFFAOYSA-N 0 1 397.287 3.246 10 0 GGAEMN CCc1ccnc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000539371003 566577639 /nfs/dbraw/zinc/57/76/39/566577639.db2.gz ZVMJKKFNUVUKTP-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN CCc1ccnc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000539371003 566577646 /nfs/dbraw/zinc/57/76/46/566577646.db2.gz ZVMJKKFNUVUKTP-UHFFFAOYSA-N 0 1 386.253 3.122 10 0 GGAEMN Cc1nc([C@@H]2CCN(c3ccc(Br)c(C(F)(F)F)n3)C2)n[nH]1 ZINC000579086910 566578360 /nfs/dbraw/zinc/57/83/60/566578360.db2.gz RZHUBQREXAMEJO-MRVPVSSYSA-N 0 1 376.180 3.283 10 0 GGAEMN Cc1nnc([C@@H]2CCN(c3ccc(Br)c(C(F)(F)F)n3)C2)[nH]1 ZINC000579086910 566578364 /nfs/dbraw/zinc/57/83/64/566578364.db2.gz RZHUBQREXAMEJO-MRVPVSSYSA-N 0 1 376.180 3.283 10 0 GGAEMN COc1ccc(CN[C@H]2COc3ccc(F)cc3C2)c(Br)c1O ZINC000674216971 566579346 /nfs/dbraw/zinc/57/93/46/566579346.db2.gz ZQMDNOKYZMYIGQ-CYBMUJFWSA-N 0 1 382.229 3.396 10 0 GGAEMN COC(=O)C[C@@](C)(NCc1ccc(OC)nc1)c1ccc(Br)cc1 ZINC000513134214 566582575 /nfs/dbraw/zinc/58/25/75/566582575.db2.gz VAORTDAVJACENE-GOSISDBHSA-N 0 1 393.281 3.421 10 0 GGAEMN CC[C@@H]1CN(CC)CCN1C(=O)Cc1noc2ccc(Br)cc21 ZINC000424871547 566583079 /nfs/dbraw/zinc/58/30/79/566583079.db2.gz MMNUPONNVBPCMO-CYBMUJFWSA-N 0 1 380.286 3.076 10 0 GGAEMN O[C@H](COC[C@H]1CCCO1)CN1CCc2sccc2[C@H]1c1cccs1 ZINC000674276913 566583911 /nfs/dbraw/zinc/58/39/11/566583911.db2.gz NCGJDGRFJALOFT-KHYOSLBOSA-N 0 1 379.547 3.314 10 0 GGAEMN CC1(C)C(=O)N[C@@H]1C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000579137426 566584036 /nfs/dbraw/zinc/58/40/36/566584036.db2.gz BSEVUCZIGNEBQV-MRXNPFEDSA-N 0 1 391.313 3.062 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC(F)(c3ccccn3)CC2)c1Br ZINC000652025924 566584355 /nfs/dbraw/zinc/58/43/55/566584355.db2.gz KKVUUGQNBOOJHW-UHFFFAOYSA-N 0 1 381.249 3.231 10 0 GGAEMN O=S(=O)(Nc1cnc(CC2CC2)nc1)c1ccc(Br)cc1F ZINC000560010251 566584533 /nfs/dbraw/zinc/58/45/33/566584533.db2.gz LFZXTOXIPHSSGI-UHFFFAOYSA-N 0 1 386.246 3.132 10 0 GGAEMN CCN(CC)Cc1ccc(C(=O)NCc2cc(Br)cnc2OC)o1 ZINC000628794263 566586664 /nfs/dbraw/zinc/58/66/64/566586664.db2.gz GGWDHFSLYUZLIF-UHFFFAOYSA-N 0 1 396.285 3.218 10 0 GGAEMN Cc1nc(CC(=O)N[C@H]2CCCSc3ccc(Br)cc32)n[nH]1 ZINC000628828465 566589812 /nfs/dbraw/zinc/58/98/12/566589812.db2.gz ANBXUQVUOJOHGV-LBPRGKRZSA-N 0 1 381.299 3.162 10 0 GGAEMN C[C@@H](CN1CCCCC1)NS(=O)(=O)c1cccc(Br)c1Cl ZINC000560039441 566589876 /nfs/dbraw/zinc/58/98/76/566589876.db2.gz WSDASCMYHPABSG-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN O=C(CCc1nc[nH]n1)N[C@@H]1CCCSc2ccc(Br)cc21 ZINC000628828924 566591210 /nfs/dbraw/zinc/59/12/10/566591210.db2.gz FZQWJCLXNLYZJM-GFCCVEGCSA-N 0 1 381.299 3.243 10 0 GGAEMN O[C@H](COc1cc(Br)ccc1F)CN1CCc2ccccc2C1 ZINC000539633402 566592940 /nfs/dbraw/zinc/59/29/40/566592940.db2.gz SMRAWWGJYGQJJP-INIZCTEOSA-N 0 1 380.257 3.386 10 0 GGAEMN O[C@@H](COc1cc(Br)ccc1F)CN1CCc2ccccc2C1 ZINC000539633404 566593615 /nfs/dbraw/zinc/59/36/15/566593615.db2.gz SMRAWWGJYGQJJP-MRXNPFEDSA-N 0 1 380.257 3.386 10 0 GGAEMN CCS(=O)(=O)c1ccc(CNCc2ccccc2-c2ccnn2C)s1 ZINC000513337344 566595558 /nfs/dbraw/zinc/59/55/58/566595558.db2.gz GVEODRYNNJPQSV-UHFFFAOYSA-N 0 1 375.519 3.232 10 0 GGAEMN CCCS(=O)(=O)NC[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000605162763 566598755 /nfs/dbraw/zinc/59/87/55/566598755.db2.gz NNVCZMCAOGFAJB-ZBFHGGJFSA-N 0 1 378.460 3.418 10 0 GGAEMN C[C@@H](C(=O)Nc1nc2c(s1)CN(C(C)(C)C)CC2)N(C)CC(F)(F)F ZINC000425035295 566599240 /nfs/dbraw/zinc/59/92/40/566599240.db2.gz HNFJGOKMQCPUIH-JTQLQIEISA-N 0 1 378.464 3.121 10 0 GGAEMN O[C@@]1(CCN[C@H](c2ccc(Br)o2)c2ccc(F)cc2)CCOC1 ZINC000652262081 566599690 /nfs/dbraw/zinc/59/96/90/566599690.db2.gz PBXHKSVGRLQQPX-IRXDYDNUSA-N 0 1 384.245 3.402 10 0 GGAEMN Cc1nn(C)c(C)c1CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968853 566600151 /nfs/dbraw/zinc/60/01/51/566600151.db2.gz SUPCISXMDBZBKU-KRWDZBQOSA-N 0 1 383.323 3.305 10 0 GGAEMN CN(C)C[C@H](NC(=O)CCOC[C@H]1CCCO1)c1ccc(Cl)c(Cl)c1 ZINC000628968367 566600205 /nfs/dbraw/zinc/60/02/05/566600205.db2.gz HEGMZWONYWEQHC-PBHICJAKSA-N 0 1 389.323 3.298 10 0 GGAEMN C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968878 566600419 /nfs/dbraw/zinc/60/04/19/566600419.db2.gz UXDDTUGOKUNDJF-JDFRZJQESA-N 0 1 389.323 3.296 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CSc1nncs1)c1ccc(Cl)c(Cl)c1 ZINC000628968700 566600513 /nfs/dbraw/zinc/60/05/13/566600513.db2.gz MQNIIOGRLWDHGS-GFCCVEGCSA-N 0 1 391.349 3.356 10 0 GGAEMN CC(C)CC(=O)NCCC(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968494 566600646 /nfs/dbraw/zinc/60/06/46/566600646.db2.gz GSNSCLZVKQDCKN-INIZCTEOSA-N 0 1 388.339 3.265 10 0 GGAEMN COc1cc(CCC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)on1 ZINC000628969553 566600795 /nfs/dbraw/zinc/60/07/95/566600795.db2.gz SAKZGWCOMREZLP-OAHLLOKOSA-N 0 1 386.279 3.342 10 0 GGAEMN COc1cc(CC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)ccn1 ZINC000628969533 566600859 /nfs/dbraw/zinc/60/08/59/566600859.db2.gz UKNWAKHTGPVTSK-MRXNPFEDSA-N 0 1 382.291 3.359 10 0 GGAEMN CN(C)C[C@H](NC(=O)CC[C@]1(C)CCC(=O)N1)c1ccc(Cl)c(Cl)c1 ZINC000628968306 566600888 /nfs/dbraw/zinc/60/08/88/566600888.db2.gz DCQAQUQXBHJWLU-MAUKXSAKSA-N 0 1 386.323 3.161 10 0 GGAEMN CN(C)C[C@@H](NC(=O)COc1ccccc1O)c1ccc(Cl)c(Cl)c1 ZINC000628968090 566600926 /nfs/dbraw/zinc/60/09/26/566600926.db2.gz DDCVCQAWDIPZEB-OAHLLOKOSA-N 0 1 383.275 3.497 10 0 GGAEMN C[C@@H](Cc1cnn(C)c1)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968044 566601079 /nfs/dbraw/zinc/60/10/79/566601079.db2.gz AHGUSGUOTDNNDD-SJCJKPOMSA-N 0 1 383.323 3.325 10 0 GGAEMN COc1cc(CCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)on1 ZINC000628969552 566601171 /nfs/dbraw/zinc/60/11/71/566601171.db2.gz SAKZGWCOMREZLP-HNNXBMFYSA-N 0 1 386.279 3.342 10 0 GGAEMN COC[C@H]1CCCN(Cc2cn(-c3ccccc3Br)nn2)CC1 ZINC000449773606 566601219 /nfs/dbraw/zinc/60/12/19/566601219.db2.gz IUMCZVUOEXIBHC-AWEZNQCLSA-N 0 1 379.302 3.278 10 0 GGAEMN CC(C)(C)N1CCc2nc(NC(=O)c3csc(S(C)(=O)=O)c3)sc2C1 ZINC000425091260 566602762 /nfs/dbraw/zinc/60/27/62/566602762.db2.gz YJWOBPWBJKKULY-UHFFFAOYSA-N 0 1 399.563 3.017 10 0 GGAEMN COc1cc(Br)ccc1CNC[C@H]1CS(=O)(=O)c2ccccc21 ZINC000560140013 566603104 /nfs/dbraw/zinc/60/31/04/566603104.db2.gz DXNBSZLAJCCSFE-ZDUSSCGKSA-N 0 1 396.306 3.118 10 0 GGAEMN COc1ccc(OC)c(CN2CCC(n3cc(Br)cn3)CC2)c1 ZINC000539828738 566604626 /nfs/dbraw/zinc/60/46/26/566604626.db2.gz GSKGMIXWUAWQNC-UHFFFAOYSA-N 0 1 380.286 3.500 10 0 GGAEMN COCCN1CCCN(C(=O)c2c(Cl)cc(F)cc2Br)CC1 ZINC000449804928 566604823 /nfs/dbraw/zinc/60/48/23/566604823.db2.gz NRQXTPOVOHDIHO-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN O=C(CCCCc1ccc(Br)cc1)NC1(c2nn[nH]n2)CCCC1 ZINC000605381635 566605615 /nfs/dbraw/zinc/60/56/15/566605615.db2.gz IAGRETXHCKZWNA-UHFFFAOYSA-N 0 1 392.301 3.261 10 0 GGAEMN O=C(NCc1c[nH]nn1)[C@H](Oc1ccccc1Br)c1ccccc1 ZINC000674755521 566606068 /nfs/dbraw/zinc/60/60/68/566606068.db2.gz SMTXFNFULDDGPA-MRXNPFEDSA-N 0 1 387.237 3.004 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1cc(OC)c(OC)cc1Br ZINC000560185329 566606460 /nfs/dbraw/zinc/60/64/60/566606460.db2.gz XBXASWNZCKBSFQ-CQSZACIVSA-N 0 1 399.329 3.347 10 0 GGAEMN O=C(NCc1c[nH]nn1)[C@@H](Oc1ccc(Br)cc1)c1ccccc1 ZINC000674754696 566606776 /nfs/dbraw/zinc/60/67/76/566606776.db2.gz CAANLXVZBXIQBJ-INIZCTEOSA-N 0 1 387.237 3.004 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(F)cc3Br)[nH]c2c1 ZINC000466913011 566607583 /nfs/dbraw/zinc/60/75/83/566607583.db2.gz DUSGHNOEWOMLKP-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN CN(C)c1cc(Br)cc(C(=O)N2CCC(c3cnc[nH]3)CC2)c1 ZINC000560219156 566607600 /nfs/dbraw/zinc/60/76/00/566607600.db2.gz QMXOBVRVSKZEGF-UHFFFAOYSA-N 0 1 377.286 3.258 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(F)c(Br)c3)[nH]c2c1 ZINC000466927394 566609009 /nfs/dbraw/zinc/60/90/09/566609009.db2.gz YXLWUQXSWXBOMS-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN CN(C)C[C@@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1Br ZINC000425170744 566609385 /nfs/dbraw/zinc/60/93/85/566609385.db2.gz SYQIPYOXHFOSAJ-AWEZNQCLSA-N 0 1 397.338 3.317 10 0 GGAEMN O=C([O-])CC[C@@H]1CCC[N@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000652496167 566615124 /nfs/dbraw/zinc/61/51/24/566615124.db2.gz MEVLGGMVHLGZGX-QWHCGFSZSA-N 0 1 376.280 3.310 10 0 GGAEMN Cc1nnc(SCC(=O)NC2(c3ccccc3Br)CCC2)[nH]1 ZINC000652515848 566615727 /nfs/dbraw/zinc/61/57/27/566615727.db2.gz ONSXKRMBPLQUHC-UHFFFAOYSA-N 0 1 381.299 3.163 10 0 GGAEMN Cc1n[nH]c(SCC(=O)NC2(c3ccccc3Br)CCC2)n1 ZINC000652515848 566615736 /nfs/dbraw/zinc/61/57/36/566615736.db2.gz ONSXKRMBPLQUHC-UHFFFAOYSA-N 0 1 381.299 3.163 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](CCC[C@@H]2CCOC2)C[C@H]1c1ccc(Br)cc1 ZINC000652506455 566615906 /nfs/dbraw/zinc/61/59/06/566615906.db2.gz SZZRYNLGYOVMAB-XOKHGSTOSA-N 0 1 382.298 3.366 10 0 GGAEMN COc1cc2nccc(N3CCN(C(=O)C(C)C)CC3)c2cc1Br ZINC000425207394 566616028 /nfs/dbraw/zinc/61/60/28/566616028.db2.gz ZTIUOOCFWRFEBX-UHFFFAOYSA-N 0 1 392.297 3.311 10 0 GGAEMN COc1cc2nccc(N(C)CC(=O)NC(C)(C)C)c2cc1Br ZINC000425200285 566616059 /nfs/dbraw/zinc/61/60/59/566616059.db2.gz KKSQIZYXYAGOOV-UHFFFAOYSA-N 0 1 380.286 3.357 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000629101098 566616396 /nfs/dbraw/zinc/61/63/96/566616396.db2.gz WAHFITUBQMRWAZ-MNOVXSKESA-N 0 1 381.420 3.050 10 0 GGAEMN COc1cc2nccc(NCCc3c(C)nn(C)c3C)c2cc1Br ZINC000425212186 566617129 /nfs/dbraw/zinc/61/71/29/566617129.db2.gz YXIHMSQATCWPQI-UHFFFAOYSA-N 0 1 389.297 3.433 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)N[C@H]1CCc2nc[nH]c2C1 ZINC000560344738 566617235 /nfs/dbraw/zinc/61/72/35/566617235.db2.gz GWNYQFLVKLYYOB-LBPRGKRZSA-N 0 1 398.301 3.218 10 0 GGAEMN Cc1cccnc1CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000579557041 566619429 /nfs/dbraw/zinc/61/94/29/566619429.db2.gz LUJQDVYWDFAVTI-INIZCTEOSA-N 0 1 395.322 3.203 10 0 GGAEMN C[C@H](NC(=O)c1ccc(Nc2ccncc2)cc1)c1ncc(Br)cn1 ZINC000486747126 566619421 /nfs/dbraw/zinc/61/94/21/566619421.db2.gz LAWUIPVCGAVYJQ-LBPRGKRZSA-N 0 1 398.264 3.291 10 0 GGAEMN Cc1sc2ncn(CCC(=O)Nc3cccc(Cl)c3O)c(=O)c2c1C ZINC000605888057 566620475 /nfs/dbraw/zinc/62/04/75/566620475.db2.gz HJXZSWVTBYTMNE-UHFFFAOYSA-N 0 1 377.853 3.463 10 0 GGAEMN COc1cc2nccc(NCC[C@@H](O)C(F)(F)F)c2cc1Br ZINC000425231832 566620461 /nfs/dbraw/zinc/62/04/61/566620461.db2.gz TUALVDGLLFHZIZ-CYBMUJFWSA-N 0 1 379.176 3.153 10 0 GGAEMN COc1cc2nccc(N3CCO[C@]4(CCOC4)C3)c2cc1Br ZINC000425240572 566621772 /nfs/dbraw/zinc/62/17/72/566621772.db2.gz LZFMCCVWTKITRK-QGZVFWFLSA-N 0 1 379.254 3.002 10 0 GGAEMN CNC(=O)[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)C(C)C ZINC000486793259 566622168 /nfs/dbraw/zinc/62/21/68/566622168.db2.gz YLVDGMLSHNZFDQ-AWEZNQCLSA-N 0 1 382.327 3.433 10 0 GGAEMN Cc1nc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)c(Br)s1 ZINC000579603388 566624565 /nfs/dbraw/zinc/62/45/65/566624565.db2.gz TWVHDHLJLADBNI-GXTWGEPZSA-N 0 1 380.311 3.389 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000579657983 566627987 /nfs/dbraw/zinc/62/79/87/566627987.db2.gz RPUKVLHPCBLJIP-JQWIXIFHSA-N 0 1 393.285 3.099 10 0 GGAEMN Cc1nnc(SCC(=O)N2C[C@@H](c3ccc(Br)cc3)C[C@H]2C)[nH]1 ZINC000629247257 566628085 /nfs/dbraw/zinc/62/80/85/566628085.db2.gz OYHGJPWCPAQFQL-MFKMUULPSA-N 0 1 395.326 3.372 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2C[C@@H](c3ccc(Br)cc3)C[C@H]2C)n1 ZINC000629247257 566628092 /nfs/dbraw/zinc/62/80/92/566628092.db2.gz OYHGJPWCPAQFQL-MFKMUULPSA-N 0 1 395.326 3.372 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCc3c(F)cc(Br)cc3C2)[nH]1 ZINC000675237165 566631142 /nfs/dbraw/zinc/63/11/42/566631142.db2.gz CVIURACCKPMGPQ-UHFFFAOYSA-N 0 1 399.289 3.082 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCc2c(F)cc(Br)cc2C1 ZINC000675237215 566631398 /nfs/dbraw/zinc/63/13/98/566631398.db2.gz CZIMYWSFNNCJDN-CYBMUJFWSA-N 0 1 378.245 3.316 10 0 GGAEMN CS(=O)(=O)N1CC[C@@H](CN2CCC[C@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000513883003 566632208 /nfs/dbraw/zinc/63/22/08/566632208.db2.gz UPKHKPDTHGAUMQ-LRDDRELGSA-N 0 1 377.337 3.412 10 0 GGAEMN CS(=O)(=O)N1CC[C@H](CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000513883004 566632525 /nfs/dbraw/zinc/63/25/25/566632525.db2.gz UPKHKPDTHGAUMQ-MLGOLLRUSA-N 0 1 377.337 3.412 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1ccccc1Sc1nccn1C)C1CC1 ZINC000629287887 566635054 /nfs/dbraw/zinc/63/50/54/566635054.db2.gz BELFLNAVCJKPCE-OAHLLOKOSA-N 0 1 381.523 3.128 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1ccccc1OCc1cscn1)C1CC1 ZINC000629288365 566635373 /nfs/dbraw/zinc/63/53/73/566635373.db2.gz HHJHXIQTBBCSMN-KRWDZBQOSA-N 0 1 382.507 3.279 10 0 GGAEMN C[C@@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C2(CCC2)CO1 ZINC000652881060 566635858 /nfs/dbraw/zinc/63/58/58/566635858.db2.gz OJGYJYUWMMQQHU-LLVKDONJSA-N 0 1 391.265 3.074 10 0 GGAEMN CN(C(=O)c1cccc(Br)c1O)[C@@H]1CCN(c2ccccc2)C1=O ZINC000606533307 566636229 /nfs/dbraw/zinc/63/62/29/566636229.db2.gz UBCVAGDLUYLQQZ-OAHLLOKOSA-N 0 1 389.249 3.032 10 0 GGAEMN CC1CCN([C@@H](CNS(=O)(=O)c2ccccc2N)c2cccs2)CC1 ZINC000467256969 566636857 /nfs/dbraw/zinc/63/68/57/566636857.db2.gz YXENRRXHGAUDDF-INIZCTEOSA-N 0 1 379.551 3.082 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1cc(Br)c(C)cc1OC)C1CC1 ZINC000629293996 566637036 /nfs/dbraw/zinc/63/70/36/566637036.db2.gz SGOCCDAFTKNNOY-HNNXBMFYSA-N 0 1 392.315 3.323 10 0 GGAEMN CO[C@H](Cc1ccc(F)cc1)CS(=O)(=O)Nc1cc(F)c(F)c(F)c1 ZINC000629289737 566637046 /nfs/dbraw/zinc/63/70/46/566637046.db2.gz OENIIQFSTIVGFA-CYBMUJFWSA-N 0 1 377.359 3.242 10 0 GGAEMN CCO[C@@H](CS(=O)(=O)Nc1cc(F)c(Br)c(F)c1)C1CC1 ZINC000629292126 566637568 /nfs/dbraw/zinc/63/75/68/566637568.db2.gz ZVJKBOFMSIMSJF-LBPRGKRZSA-N 0 1 384.242 3.284 10 0 GGAEMN CC(C)[C@@H]1CN(C)CCN1C(=O)N[C@H](C)Cc1ccc(Br)cc1 ZINC000606645187 566637924 /nfs/dbraw/zinc/63/79/24/566637924.db2.gz XORADGBFYLTKCV-PBHICJAKSA-N 0 1 382.346 3.362 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N=c2[n-]nc(C3CC3)s2)[C@H]1c1cccs1 ZINC000579784706 566638884 /nfs/dbraw/zinc/63/88/84/566638884.db2.gz PPRKHYZPRALVRY-OCCSQVGLSA-N 0 1 377.539 3.104 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCC(=O)Nc1ccc(Br)cc1 ZINC000467296866 566638914 /nfs/dbraw/zinc/63/89/14/566638914.db2.gz BGJAKFDDTOYOBO-PVUWLOKVSA-N 0 1 395.297 3.051 10 0 GGAEMN COc1ccc(Cl)c2c1CCC[C@H]2N(C)C(=O)CSc1nnc(C)[nH]1 ZINC000652939334 566638883 /nfs/dbraw/zinc/63/88/83/566638883.db2.gz MPEQTUCHXUKJKK-CYBMUJFWSA-N 0 1 380.901 3.403 10 0 GGAEMN COc1ccc(Cl)c2c1CCC[C@H]2N(C)C(=O)CSc1nc(C)n[nH]1 ZINC000652939334 566638887 /nfs/dbraw/zinc/63/88/87/566638887.db2.gz MPEQTUCHXUKJKK-CYBMUJFWSA-N 0 1 380.901 3.403 10 0 GGAEMN COc1ccc(Cl)c2c1CCC[C@@H]2N(C)C(=O)CSc1nnc(C)[nH]1 ZINC000652939335 566639274 /nfs/dbraw/zinc/63/92/74/566639274.db2.gz MPEQTUCHXUKJKK-ZDUSSCGKSA-N 0 1 380.901 3.403 10 0 GGAEMN COc1ccc(Cl)c2c1CCC[C@@H]2N(C)C(=O)CSc1nc(C)n[nH]1 ZINC000652939335 566639276 /nfs/dbraw/zinc/63/92/76/566639276.db2.gz MPEQTUCHXUKJKK-ZDUSSCGKSA-N 0 1 380.901 3.403 10 0 GGAEMN Cc1c([C@@H](C)N[C@H](C)C2(S(C)(=O)=O)CC2)cnn1-c1cccc(Cl)c1 ZINC000560582200 566640392 /nfs/dbraw/zinc/64/03/92/566640392.db2.gz YGLIQONBXYQRRZ-TZMCWYRMSA-N 0 1 381.929 3.450 10 0 GGAEMN CCC(CC)CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000606698480 566641068 /nfs/dbraw/zinc/64/10/68/566641068.db2.gz GPHJXMBETYPVPY-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN CCC(CC)CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000606698480 566641075 /nfs/dbraw/zinc/64/10/75/566641075.db2.gz GPHJXMBETYPVPY-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN C[C@H]1[C@@H](Cc2ccccc2)CCN1Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000425426628 566641353 /nfs/dbraw/zinc/64/13/53/566641353.db2.gz SNAAELAMGHLVOB-DOTOQJQBSA-N 0 1 378.563 3.452 10 0 GGAEMN C[C@H](NCc1ccc(S(=O)(=O)N(C)C)s1)c1ccc2ncsc2c1 ZINC000425436715 566643635 /nfs/dbraw/zinc/64/36/35/566643635.db2.gz XDAKQTDPQNOURD-NSHDSACASA-N 0 1 381.548 3.459 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC[C@]2(CC2(F)F)C1 ZINC000653003761 566644208 /nfs/dbraw/zinc/64/42/08/566644208.db2.gz DHGLESHTOCCYLU-HNNXBMFYSA-N 0 1 383.192 3.162 10 0 GGAEMN CN(C)S(=O)(=O)c1ccc(CNC(C)(C)COCc2ccccc2)s1 ZINC000425450614 566644690 /nfs/dbraw/zinc/64/46/90/566644690.db2.gz YRXZKIVDJVVFLZ-UHFFFAOYSA-N 0 1 382.551 3.083 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)[C@H]1CCOc2ccc(Br)cc21 ZINC000653018317 566646359 /nfs/dbraw/zinc/64/63/59/566646359.db2.gz YKRFGIJBQZLSIB-AWEZNQCLSA-N 0 1 378.270 3.096 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccc(C(F)(F)F)cn1)c1ccc(F)cc1 ZINC000629350463 566649888 /nfs/dbraw/zinc/64/98/88/566649888.db2.gz PSCDBBUMOJLOBI-ZDUSSCGKSA-N 0 1 378.347 3.369 10 0 GGAEMN Cn1c(C[N@@H+]2CC[C@H](C(=O)[O-])[C@H]3CCC[C@H]32)nc2ccc(Br)cc21 ZINC000629377131 566652088 /nfs/dbraw/zinc/65/20/88/566652088.db2.gz LJHCRJHOWVNQPK-VNHYZAJKSA-N 0 1 392.297 3.411 10 0 GGAEMN Cn1c(C[N@H+]2CC[C@H](C(=O)[O-])[C@H]3CCC[C@H]32)nc2ccc(Br)cc21 ZINC000629377131 566652099 /nfs/dbraw/zinc/65/20/99/566652099.db2.gz LJHCRJHOWVNQPK-VNHYZAJKSA-N 0 1 392.297 3.411 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)[C@@H]2CCC[C@@H]21 ZINC000629372741 566652292 /nfs/dbraw/zinc/65/22/92/566652292.db2.gz GSINYRHNFMCHGX-DSJMHWKBSA-N 0 1 388.291 3.308 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCO3)[C@H]2CCC[C@H]21 ZINC000629373087 566652382 /nfs/dbraw/zinc/65/23/82/566652382.db2.gz JXJFQNFRJXKPMX-SCRDCRAPSA-N 0 1 382.254 3.253 10 0 GGAEMN CCc1ccc([C@@H]2CNCCN2C(=O)c2nscc2Br)cc1 ZINC000653137298 566652655 /nfs/dbraw/zinc/65/26/55/566652655.db2.gz SZECQOHDADNMOV-AWEZNQCLSA-N 0 1 380.311 3.255 10 0 GGAEMN O=C(c1nscc1Br)N1CCNC[C@@H]1c1cccc(Cl)c1 ZINC000653137400 566653059 /nfs/dbraw/zinc/65/30/59/566653059.db2.gz ZGRCOTGXQGTTGC-GFCCVEGCSA-N 0 1 386.702 3.346 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@@H]2CCC[C@@H]21 ZINC000629377212 566653163 /nfs/dbraw/zinc/65/31/63/566653163.db2.gz MBDIDLXGSPRCOE-LALPHHSUSA-N 0 1 378.270 3.401 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@@H]2CCC[C@@H]21 ZINC000629377212 566653166 /nfs/dbraw/zinc/65/31/66/566653166.db2.gz MBDIDLXGSPRCOE-LALPHHSUSA-N 0 1 378.270 3.401 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@H]2CCC[C@@H]21 ZINC000629377208 566653256 /nfs/dbraw/zinc/65/32/56/566653256.db2.gz MBDIDLXGSPRCOE-JMSVASOKSA-N 0 1 378.270 3.401 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)[C@H]2CCC[C@@H]21 ZINC000629377208 566653257 /nfs/dbraw/zinc/65/32/57/566653257.db2.gz MBDIDLXGSPRCOE-JMSVASOKSA-N 0 1 378.270 3.401 10 0 GGAEMN OCCC1(NCc2csc(COc3ccc(Cl)cc3)n2)CCOCC1 ZINC000675553082 566653615 /nfs/dbraw/zinc/65/36/15/566653615.db2.gz BXFIPGCZQSEHHB-UHFFFAOYSA-N 0 1 382.913 3.397 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(C)ccc2Br)CC1 ZINC000629418790 566654338 /nfs/dbraw/zinc/65/43/38/566654338.db2.gz UZIKZUATDBWTTE-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2oc(Br)cc2C)CC1 ZINC000629416564 566654641 /nfs/dbraw/zinc/65/46/41/566654641.db2.gz DRTOKVWAUSCRCC-UHFFFAOYSA-N 0 1 385.302 3.068 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(Br)cs2)CC1 ZINC000629417168 566654875 /nfs/dbraw/zinc/65/48/75/566654875.db2.gz CSINKZOGAVKIPV-UHFFFAOYSA-N 0 1 387.343 3.228 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(F)cc2Br)CC1 ZINC000629419868 566654895 /nfs/dbraw/zinc/65/48/95/566654895.db2.gz IGXBJPQCZPBUDW-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(Br)cc2)CC1 ZINC000629420943 566655248 /nfs/dbraw/zinc/65/52/48/566655248.db2.gz PKBFQWJWRYEYPM-UHFFFAOYSA-N 0 1 381.314 3.166 10 0 GGAEMN Cc1cc2c(o1)c(C(=O)NCCCCN1CCOCC1)ccc2Br ZINC000467673584 566657709 /nfs/dbraw/zinc/65/77/09/566657709.db2.gz MBOVYASAUIMQMR-UHFFFAOYSA-N 0 1 395.297 3.346 10 0 GGAEMN CCOC(=O)c1csc(NCCOc2ncc(C(F)(F)F)cc2Cl)n1 ZINC000450345827 566660602 /nfs/dbraw/zinc/66/06/02/566660602.db2.gz BSPZDLJNTKFMMF-UHFFFAOYSA-N 0 1 395.790 3.300 10 0 GGAEMN O=C(NCc1ccn(Cc2ccccc2)n1)c1cccc(Br)c1O ZINC000560821709 566661597 /nfs/dbraw/zinc/66/15/97/566661597.db2.gz ODZTZMCTOXJYLY-UHFFFAOYSA-N 0 1 386.249 3.330 10 0 GGAEMN COc1cc(Br)c(NS(=O)(=O)c2ccc(C)o2)cc1OC ZINC000514746209 566667452 /nfs/dbraw/zinc/66/74/52/566667452.db2.gz TZTBHZGCGJBWNY-UHFFFAOYSA-N 0 1 376.228 3.169 10 0 GGAEMN COc1ccnc(N2CCN(C(=O)c3cc4cc(Cl)sc4[nH]3)CC2)c1 ZINC000580140251 566667717 /nfs/dbraw/zinc/66/77/17/566667717.db2.gz DTXNHZCFHDXUQQ-UHFFFAOYSA-N 0 1 376.869 3.249 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000629586710 566669483 /nfs/dbraw/zinc/66/94/83/566669483.db2.gz CIPGDAZSCMYKET-SNVBAGLBSA-N 0 1 398.212 3.275 10 0 GGAEMN Cc1ccc2nc(CNC(=O)C(=O)Nc3cc(Cl)ccc3Cl)[nH]c2c1 ZINC000467810834 566669530 /nfs/dbraw/zinc/66/95/30/566669530.db2.gz XKJKYZMNAOHFND-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CCOc2cccc(Br)c2C1 ZINC000653479977 566670019 /nfs/dbraw/zinc/67/00/19/566670019.db2.gz LGVDXCHUPZMDDZ-UHFFFAOYSA-N 0 1 393.285 3.017 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1cccs1 ZINC000653481083 566670039 /nfs/dbraw/zinc/67/00/39/566670039.db2.gz ZKNWIWRVTKKNKL-BZPMIXESSA-N 0 1 379.448 3.150 10 0 GGAEMN CC(C)[C@@H](C)N(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000607416068 566671237 /nfs/dbraw/zinc/67/12/37/566671237.db2.gz UDPRYNAZHCPGCL-LLVKDONJSA-N 0 1 380.290 3.420 10 0 GGAEMN CC(C)[C@@H](C)N(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000607416068 566671238 /nfs/dbraw/zinc/67/12/38/566671238.db2.gz UDPRYNAZHCPGCL-LLVKDONJSA-N 0 1 380.290 3.420 10 0 GGAEMN CC(C)[C@H](C)N(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000607416074 566671526 /nfs/dbraw/zinc/67/15/26/566671526.db2.gz UDPRYNAZHCPGCL-NSHDSACASA-N 0 1 380.290 3.420 10 0 GGAEMN CC(C)[C@H](C)N(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000607416074 566671531 /nfs/dbraw/zinc/67/15/31/566671531.db2.gz UDPRYNAZHCPGCL-NSHDSACASA-N 0 1 380.290 3.420 10 0 GGAEMN C[C@@H]1C[C@@H](C)N(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000607415063 566671582 /nfs/dbraw/zinc/67/15/82/566671582.db2.gz ADMBYAVONXEMQS-GHMZBOCLSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1C[C@@H](C)N(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000607415063 566671590 /nfs/dbraw/zinc/67/15/90/566671590.db2.gz ADMBYAVONXEMQS-GHMZBOCLSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1C[C@H](C)N(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000607415071 566671885 /nfs/dbraw/zinc/67/18/85/566671885.db2.gz ADMBYAVONXEMQS-MNOVXSKESA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H]1C[C@H](C)N(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000607415071 566671891 /nfs/dbraw/zinc/67/18/91/566671891.db2.gz ADMBYAVONXEMQS-MNOVXSKESA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@H]1CN(c2ncc(Br)cc2C(F)(F)F)CCN1CC(C)(C)O ZINC000450473746 566674723 /nfs/dbraw/zinc/67/47/23/566674723.db2.gz NYEQHXJOPXNFDJ-JTQLQIEISA-N 0 1 396.251 3.144 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 ZINC000561091173 566675275 /nfs/dbraw/zinc/67/52/75/566675275.db2.gz GVJUYKXOKRQCEY-STQMWFEESA-N 0 1 380.432 3.126 10 0 GGAEMN CCc1[nH]ncc1C(=O)Nc1ccc(CCn2cc(Br)cn2)cc1 ZINC000607679128 566677400 /nfs/dbraw/zinc/67/74/00/566677400.db2.gz HXNUSSMLRLIGON-UHFFFAOYSA-N 0 1 388.269 3.426 10 0 GGAEMN CN(CCn1cc(Br)cn1)Cc1cnc(-c2ccncc2)s1 ZINC000580259721 566677629 /nfs/dbraw/zinc/67/76/29/566677629.db2.gz UHCMZSZCENWBGS-UHFFFAOYSA-N 0 1 378.299 3.296 10 0 GGAEMN CCO[C@H]1C[C@H](NC(=O)c2n[nH]c3ccc(Br)cc32)C12CCC2 ZINC000607683071 566677712 /nfs/dbraw/zinc/67/77/12/566677712.db2.gz RMADLZRTVVZENZ-KBPBESRZSA-N 0 1 378.270 3.403 10 0 GGAEMN C[C@H]1CN(Cc2cccc(NCc3c(Br)cnn3C)c2)C[C@H](C)O1 ZINC000487553232 566679493 /nfs/dbraw/zinc/67/94/93/566679493.db2.gz PUIJMIOUZNWZPO-KBPBESRZSA-N 0 1 393.329 3.404 10 0 GGAEMN C[C@@H]1CN(Cc2cccc(NCc3c(Br)cnn3C)c2)C[C@H](C)O1 ZINC000487553233 566679989 /nfs/dbraw/zinc/67/99/89/566679989.db2.gz PUIJMIOUZNWZPO-OKILXGFUSA-N 0 1 393.329 3.404 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC[C@@H](C)Oc2cccc(Br)c2)n[nH]1 ZINC000487546036 566680140 /nfs/dbraw/zinc/68/01/40/566680140.db2.gz ZTZJYOVKYYNOBR-DGCLKSJQSA-N 0 1 395.301 3.178 10 0 GGAEMN Cn1ncc(Br)c1CN[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 ZINC000487555902 566680230 /nfs/dbraw/zinc/68/02/30/566680230.db2.gz HIJUUUJXQICYLH-GDBMZVCRSA-N 0 1 383.721 3.371 10 0 GGAEMN Cc1cc(Br)c(C(=O)NC2(c3nn[nH]n3)CCCC2)cc1Cl ZINC000561172909 566681016 /nfs/dbraw/zinc/68/10/16/566681016.db2.gz AQMYGLRHHOVXJR-UHFFFAOYSA-N 0 1 384.665 3.123 10 0 GGAEMN O=C(c1csc(=NC2CC2)[nH]1)N1CCc2cc(F)cc(Br)c2C1 ZINC000629741085 566681064 /nfs/dbraw/zinc/68/10/64/566681064.db2.gz QQUAIIALCSPQBF-UHFFFAOYSA-N 0 1 396.285 3.239 10 0 GGAEMN C[C@@H](Oc1cccc(Br)c1)C(=O)Nc1cnn(-c2ccncc2)c1 ZINC000607820685 566682004 /nfs/dbraw/zinc/68/20/04/566682004.db2.gz DNIZQOLGVWLKMI-GFCCVEGCSA-N 0 1 387.237 3.436 10 0 GGAEMN C[C@H](Oc1cccc(Br)c1)C(=O)Nc1cnn(-c2ccncc2)c1 ZINC000607820686 566682166 /nfs/dbraw/zinc/68/21/66/566682166.db2.gz DNIZQOLGVWLKMI-LBPRGKRZSA-N 0 1 387.237 3.436 10 0 GGAEMN C[C@H](CC(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccc(Br)cc1 ZINC000676252020 566682666 /nfs/dbraw/zinc/68/26/66/566682666.db2.gz WAURRCIVBIJHTE-JLSDUUJJSA-N 0 1 395.341 3.000 10 0 GGAEMN Cc1nnc(SCC(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)[nH]1 ZINC000468181392 566687607 /nfs/dbraw/zinc/68/76/07/566687607.db2.gz ACIBLHVFCFDDTJ-UHFFFAOYSA-N 0 1 380.779 3.438 10 0 GGAEMN Cc1n[nH]c(SCC(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)n1 ZINC000468181392 566687612 /nfs/dbraw/zinc/68/76/12/566687612.db2.gz ACIBLHVFCFDDTJ-UHFFFAOYSA-N 0 1 380.779 3.438 10 0 GGAEMN O=C(Cc1cc(Br)ccc1F)Nc1cnn(-c2ccncc2)c1 ZINC000676369731 566687941 /nfs/dbraw/zinc/68/79/41/566687941.db2.gz DUVKWTYGLLPZSX-UHFFFAOYSA-N 0 1 375.201 3.350 10 0 GGAEMN O=C(N[C@H]1CCCc2sc(Cl)cc21)N1CCN(C[C@@H]2CCOC2)CC1 ZINC000426057956 566688594 /nfs/dbraw/zinc/68/85/94/566688594.db2.gz KODCVHOAJMPMNN-ZFWWWQNUSA-N 0 1 383.945 3.143 10 0 GGAEMN CC1CCN(CC(=O)NCc2cc3cccnc3cc2Br)CC1 ZINC000676395545 566688811 /nfs/dbraw/zinc/68/88/11/566688811.db2.gz AKEJGODNJQUNHJ-UHFFFAOYSA-N 0 1 376.298 3.345 10 0 GGAEMN CC[N@H+]1CCCC[C@H]1C(=O)NCc1cc2cccnc2cc1Br ZINC000676396716 566689285 /nfs/dbraw/zinc/68/92/85/566689285.db2.gz NUYWLXRZAAYZKL-KRWDZBQOSA-N 0 1 376.298 3.488 10 0 GGAEMN CCN1CCCC[C@H]1C(=O)NCc1cc2cccnc2cc1Br ZINC000676396716 566689290 /nfs/dbraw/zinc/68/92/90/566689290.db2.gz NUYWLXRZAAYZKL-KRWDZBQOSA-N 0 1 376.298 3.488 10 0 GGAEMN O=C(NCCNC(=O)c1ccccc1Cl)c1n[nH]c2ccc(Cl)cc21 ZINC000487783507 566690124 /nfs/dbraw/zinc/69/01/24/566690124.db2.gz PTOMEPHTHLGYGW-UHFFFAOYSA-N 0 1 377.231 3.030 10 0 GGAEMN COCC[C@@H](COC)N[C@@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000515096930 566690587 /nfs/dbraw/zinc/69/05/87/566690587.db2.gz ADNSIHKCGALECX-WFASDCNBSA-N 0 1 397.317 3.040 10 0 GGAEMN COCC[C@@H](COC)N[C@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000515096927 566690640 /nfs/dbraw/zinc/69/06/40/566690640.db2.gz ADNSIHKCGALECX-DOMZBBRYSA-N 0 1 397.317 3.040 10 0 GGAEMN COCC[C@H](COC)N[C@@H](C)c1nnn(-c2cccc(Br)c2)c1C ZINC000515096929 566690745 /nfs/dbraw/zinc/69/07/45/566690745.db2.gz ADNSIHKCGALECX-SWLSCSKDSA-N 0 1 397.317 3.040 10 0 GGAEMN Cc1c(Br)ccc(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c1F ZINC000468226169 566690876 /nfs/dbraw/zinc/69/08/76/566690876.db2.gz ZLDQTTVDBMPDTL-VXGBXAGGSA-N 0 1 387.293 3.126 10 0 GGAEMN CCN1CCN(c2nnc(-c3ccc(Br)cc3Cl)n2C)CC1 ZINC000515094353 566691238 /nfs/dbraw/zinc/69/12/38/566691238.db2.gz KFYVUQZNUVLXLX-UHFFFAOYSA-N 0 1 384.709 3.040 10 0 GGAEMN CCN(Cc1ccccc1)C(=O)CN[C@H](CO)c1ccc(Br)cc1 ZINC000541052883 566691383 /nfs/dbraw/zinc/69/13/83/566691383.db2.gz CKDVOYPFYGFFTE-GOSISDBHSA-N 0 1 391.309 3.121 10 0 GGAEMN COC(=O)c1ccc(CN2CCCC[C@H]2c2n[nH]c(C)n2)c(Br)c1 ZINC000450616493 566691661 /nfs/dbraw/zinc/69/16/61/566691661.db2.gz QCHYVSJBTIXGSL-HNNXBMFYSA-N 0 1 393.285 3.389 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)C1 ZINC000676420642 566692999 /nfs/dbraw/zinc/69/29/99/566692999.db2.gz MXSGMIPLCOANLN-NWDGAFQWSA-N 0 1 376.448 3.145 10 0 GGAEMN CN(CC(=O)Nc1nc(-c2ccc(Cl)cc2)n[nH]1)c1ccc(Cl)cn1 ZINC000676446042 566695590 /nfs/dbraw/zinc/69/55/90/566695590.db2.gz JWJMZZXHCYNZAS-UHFFFAOYSA-N 0 1 377.235 3.248 10 0 GGAEMN Cc1cc(NS(=O)(=O)c2cccc(Cl)c2Cl)ccc1OCCO ZINC000541128753 566697125 /nfs/dbraw/zinc/69/71/25/566697125.db2.gz ZHQNUCITYCNHOU-UHFFFAOYSA-N 0 1 376.261 3.474 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1cccc(Br)c1)C(C)C ZINC000580485870 566697734 /nfs/dbraw/zinc/69/77/34/566697734.db2.gz DCZGEDFIEUYADX-UHFFFAOYSA-N 0 1 391.375 3.331 10 0 GGAEMN COCCN(C(C)=O)c1nc(CN[C@@H](C)C2CCC(F)(F)CC2)cs1 ZINC000653870441 566699569 /nfs/dbraw/zinc/69/95/69/566699569.db2.gz SRPJDNKUKSOOQX-LBPRGKRZSA-N 0 1 375.485 3.446 10 0 GGAEMN C[C@@H](NCC(=O)N1CCN(Cc2cccs2)CC1)c1cccc(Cl)c1 ZINC000487962339 566699730 /nfs/dbraw/zinc/69/97/30/566699730.db2.gz YLDVDIWNOQNSLZ-OAHLLOKOSA-N 0 1 377.941 3.397 10 0 GGAEMN CN(C)c1ncc(CNC2(c3ccc(Br)cc3)CCOCC2)cn1 ZINC000608060273 566699894 /nfs/dbraw/zinc/69/98/94/566699894.db2.gz SNRWZDPNPRSEFB-UHFFFAOYSA-N 0 1 391.313 3.101 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCCN(c3ccccc3F)CC2)c1Br ZINC000561401535 566700790 /nfs/dbraw/zinc/70/07/90/566700790.db2.gz CFKNARKRAYMASF-UHFFFAOYSA-N 0 1 395.276 3.226 10 0 GGAEMN CC[C@@H](NS(=O)(=O)CCN(CC)CC)c1cc(F)cc(Br)c1 ZINC000515256169 566701214 /nfs/dbraw/zinc/70/12/14/566701214.db2.gz VYYRJDHKCXOYGP-OAHLLOKOSA-N 0 1 395.338 3.301 10 0 GGAEMN CC(=O)Nc1cc(S(=O)(=O)Nc2ccc(C(C)=O)c(Cl)c2)ccc1O ZINC000541165957 566701678 /nfs/dbraw/zinc/70/16/78/566701678.db2.gz WZVDNPSWXUZBKO-UHFFFAOYSA-N 0 1 382.825 3.007 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2cccc(Cl)c2F)c(Cl)c1 ZINC000515262830 566702272 /nfs/dbraw/zinc/70/22/72/566702272.db2.gz YUKDYRULCULOCE-UHFFFAOYSA-N 0 1 379.196 3.115 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccnc(C2CC2)c1 ZINC000541213552 566705037 /nfs/dbraw/zinc/70/50/37/566705037.db2.gz MVHGOFZKQGINRL-UHFFFAOYSA-N 0 1 398.264 3.437 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccnc(C2CC2)c1 ZINC000541213552 566705040 /nfs/dbraw/zinc/70/50/40/566705040.db2.gz MVHGOFZKQGINRL-UHFFFAOYSA-N 0 1 398.264 3.437 10 0 GGAEMN Cn1cnc2cc(CN(CCO)Cc3cc(Br)cs3)ccc21 ZINC000426377403 566707034 /nfs/dbraw/zinc/70/70/34/566707034.db2.gz NHPMLYMXKWUJKK-UHFFFAOYSA-N 0 1 380.311 3.392 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)N[C@H]2CCCc3sc(Cl)cc32)C1 ZINC000488150734 566708410 /nfs/dbraw/zinc/70/84/10/566708410.db2.gz NTDKDIANELRQRS-ZFWWWQNUSA-N 0 1 385.961 3.435 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)N[C@@H]2CCCc3sc(Cl)cc32)C1 ZINC000488150733 566709539 /nfs/dbraw/zinc/70/95/39/566709539.db2.gz NTDKDIANELRQRS-UKRRQHHQSA-N 0 1 385.961 3.435 10 0 GGAEMN COCCN(Cc1ccc(OC(F)F)c(Br)c1)[C@@H]1CCOC1 ZINC000426508956 566716191 /nfs/dbraw/zinc/71/61/91/566716191.db2.gz QWFYUHUZRBMEFM-GFCCVEGCSA-N 0 1 380.229 3.288 10 0 GGAEMN C[N@@H+]1CC[C@@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@@H]1c1ccccc1 ZINC000561538275 566716706 /nfs/dbraw/zinc/71/67/06/566716706.db2.gz KOPHVOFFLFZHLR-ZBFHGGJFSA-N 0 1 386.851 3.342 10 0 GGAEMN C[N@H+]1CC[C@@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@@H]1c1ccccc1 ZINC000561538275 566716710 /nfs/dbraw/zinc/71/67/10/566716710.db2.gz KOPHVOFFLFZHLR-ZBFHGGJFSA-N 0 1 386.851 3.342 10 0 GGAEMN C[N@@H+]1CC[C@@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@H]1c1ccccc1 ZINC000561538268 566716863 /nfs/dbraw/zinc/71/68/63/566716863.db2.gz KOPHVOFFLFZHLR-GDBMZVCRSA-N 0 1 386.851 3.342 10 0 GGAEMN C[N@H+]1CC[C@@H]([N-]S(=O)(=O)c2c(Cl)ccc(F)c2F)[C@H]1c1ccccc1 ZINC000561538268 566716868 /nfs/dbraw/zinc/71/68/68/566716868.db2.gz KOPHVOFFLFZHLR-GDBMZVCRSA-N 0 1 386.851 3.342 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2ccc(F)c(Cl)c2)C1 ZINC000468650370 566718440 /nfs/dbraw/zinc/71/84/40/566718440.db2.gz UGMNLYFWXAIGGJ-HNNXBMFYSA-N 0 1 388.936 3.185 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2ccc(F)cc2Cl)c(Cl)c1 ZINC000515567050 566720633 /nfs/dbraw/zinc/72/06/33/566720633.db2.gz VQASVEPJXQGIPB-UHFFFAOYSA-N 0 1 379.196 3.115 10 0 GGAEMN CN(C)CCN(Cc1ccc(Br)cc1)C(=O)C1CCC(=O)CC1 ZINC000468705120 566721538 /nfs/dbraw/zinc/72/15/38/566721538.db2.gz BNQQNAMFQUNCFI-UHFFFAOYSA-N 0 1 381.314 3.099 10 0 GGAEMN COCC[C@H](Cc1ccco1)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000541439321 566724515 /nfs/dbraw/zinc/72/45/15/566724515.db2.gz OUJGBHOJYDVIFE-GFCCVEGCSA-N 0 1 392.253 3.296 10 0 GGAEMN C[C@@H]1CN(C(=O)c2[nH]nc3ccc(Br)cc32)C[C@H](C(F)(F)F)O1 ZINC000608605716 566725029 /nfs/dbraw/zinc/72/50/29/566725029.db2.gz UJDVSMXRAZWNLR-RDDDGLTNSA-N 0 1 392.175 3.117 10 0 GGAEMN CC[C@H]1CN(C(=O)NCCc2cccc(Cl)c2Cl)CCN1C[C@H](C)O ZINC000541496314 566729106 /nfs/dbraw/zinc/72/91/06/566729106.db2.gz QXMFENAESRCAOA-ZFWWWQNUSA-N 0 1 388.339 3.023 10 0 GGAEMN CC[C@H](NS(=O)(=O)c1cc(Cl)ccc1O[C@H](C)COC)C(F)(F)F ZINC000468786410 566730013 /nfs/dbraw/zinc/73/00/13/566730013.db2.gz CBDCWKZXPJWWOW-RNCFNFMXSA-N 0 1 389.823 3.373 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)NCc2ccc(Br)cc2OC)C[C@@H]1C ZINC000488495749 566730280 /nfs/dbraw/zinc/73/02/80/566730280.db2.gz JCUIOIOZWKKPCN-QWHCGFSZSA-N 0 1 384.318 3.082 10 0 GGAEMN O=C([O-])[C@H]([NH2+]Cc1ccc(-c2ccc(Br)cc2)o1)[C@H]1CCCO1 ZINC000630470110 566734105 /nfs/dbraw/zinc/73/41/05/566734105.db2.gz RWVWXERHYKXNAU-HZPDHXFCSA-N 0 1 380.238 3.431 10 0 GGAEMN CN(C)c1ncc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)s1 ZINC000677245354 566734501 /nfs/dbraw/zinc/73/45/01/566734501.db2.gz GWIPTKHNFRJBTC-HOCLYGCPSA-N 0 1 382.892 3.063 10 0 GGAEMN C[C@H]([NH2+]Cc1cc2c(c(Br)c1)OCO2)c1nc(C(=O)[O-])cs1 ZINC000630465342 566735421 /nfs/dbraw/zinc/73/54/21/566735421.db2.gz SPHAYEQIBCFEBU-ZETCQYMHSA-N 0 1 385.239 3.183 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(C[C@H](O)COc3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000677269331 566735886 /nfs/dbraw/zinc/73/58/86/566735886.db2.gz MSQKTLRQQURDCN-GGNLRSJOSA-N 0 1 390.307 3.001 10 0 GGAEMN COc1ccccc1SC[C@H](C)CNC(=O)CCSc1nnc(C)[nH]1 ZINC000468847438 566737485 /nfs/dbraw/zinc/73/74/85/566737485.db2.gz GRDZXADNSBUCEQ-GFCCVEGCSA-N 0 1 380.539 3.149 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NC2(Cc3ccccc3Br)CC2)cn1 ZINC000561766282 566737472 /nfs/dbraw/zinc/73/74/72/566737472.db2.gz VQLLODJTZUADOF-UHFFFAOYSA-N 0 1 388.309 3.411 10 0 GGAEMN COCCSc1ccc([C@H](C)NC(=O)CCSc2nnc(C)[nH]2)cc1 ZINC000468869836 566738377 /nfs/dbraw/zinc/73/83/77/566738377.db2.gz HUKRUWSWHCBFGE-LBPRGKRZSA-N 0 1 380.539 3.211 10 0 GGAEMN C[C@](CO)(NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1cccc(O)c1 ZINC000451029853 566738958 /nfs/dbraw/zinc/73/89/58/566738958.db2.gz HXVPQHAYANHMCA-MZNJEOGPSA-N 0 1 388.316 3.304 10 0 GGAEMN CSCCCCNc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1 ZINC000426908312 566739518 /nfs/dbraw/zinc/73/95/18/566739518.db2.gz XGNOERJMIZKQIF-UHFFFAOYSA-N 0 1 387.477 3.138 10 0 GGAEMN Cc1ccc(C(=O)Nc2c(C(N)=O)[nH]nc2C(C)C)c(C)c1Br ZINC000654563183 566740871 /nfs/dbraw/zinc/74/08/71/566740871.db2.gz WTLKUAAODDFBKV-UHFFFAOYSA-N 0 1 379.258 3.264 10 0 GGAEMN COCC[N@H+]1CC[C@H](NC(=O)c2oc3c(cc(Br)cc3C)c2C)C1 ZINC000426995040 566741297 /nfs/dbraw/zinc/74/12/97/566741297.db2.gz MDMZMQSKJQHQRE-AWEZNQCLSA-N 0 1 395.297 3.263 10 0 GGAEMN COCCN1CC[C@H](NC(=O)c2oc3c(cc(Br)cc3C)c2C)C1 ZINC000426995040 566741306 /nfs/dbraw/zinc/74/13/06/566741306.db2.gz MDMZMQSKJQHQRE-AWEZNQCLSA-N 0 1 395.297 3.263 10 0 GGAEMN CCN1CCC[C@H](NC(=O)CCC(=O)c2cc(Br)ccc2OC)C1 ZINC000515976470 566741460 /nfs/dbraw/zinc/74/14/60/566741460.db2.gz BNAOHJCYFUQPCX-AWEZNQCLSA-N 0 1 397.313 3.021 10 0 GGAEMN CN(C)[C@@H](CNC(=O)c1c(F)cncc1Br)c1cccc(F)c1 ZINC000630577423 566742832 /nfs/dbraw/zinc/74/28/32/566742832.db2.gz ZYCRXQROHPHIKR-AWEZNQCLSA-N 0 1 384.224 3.155 10 0 GGAEMN CN(C)C[C@H]1CCCN1S(=O)(=O)c1cc(Cl)ccc1OCC1CCC1 ZINC000468925847 566743995 /nfs/dbraw/zinc/74/39/95/566743995.db2.gz IBBHUJZFXXFULK-MRXNPFEDSA-N 0 1 386.945 3.234 10 0 GGAEMN COc1ccc(C(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)cc1Br ZINC000541747872 566744307 /nfs/dbraw/zinc/74/43/07/566744307.db2.gz OXNKOZARSXCMKB-OAHLLOKOSA-N 0 1 387.237 3.095 10 0 GGAEMN CN(C)[C@@H](CNC(=O)c1c(F)cncc1Br)c1ccc(F)cc1 ZINC000630783742 566751419 /nfs/dbraw/zinc/75/14/19/566751419.db2.gz NWMGHSHPDRAGHC-AWEZNQCLSA-N 0 1 384.224 3.155 10 0 GGAEMN CC(C)c1nc([C@H](C)NS(=O)(=O)Cc2ccc(Cl)cc2Cl)n[nH]1 ZINC000541862819 566755929 /nfs/dbraw/zinc/75/59/29/566755929.db2.gz APCLDWAMWSQFBD-VIFPVBQESA-N 0 1 377.297 3.416 10 0 GGAEMN CN(CCc1nnnn1-c1ccccc1)Cc1csc(Br)c1 ZINC000516307954 566756084 /nfs/dbraw/zinc/75/60/84/566756084.db2.gz VNTSMDUBWSAGHC-UHFFFAOYSA-N 0 1 378.299 3.161 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1ccc(I)cc1 ZINC000581204814 566757492 /nfs/dbraw/zinc/75/74/92/566757492.db2.gz BMNPZLYUNZCJCG-HNNXBMFYSA-N 0 1 386.277 3.172 10 0 GGAEMN CCN1CCN(CC(=O)N2CCC(c3c(Cl)cccc3Cl)CC2)CC1 ZINC000581224172 566758392 /nfs/dbraw/zinc/75/83/92/566758392.db2.gz ZTKGLGNDXVNGOZ-UHFFFAOYSA-N 0 1 384.351 3.337 10 0 GGAEMN CO[C@H](C(=O)N1CCC(c2cnc[nH]2)CC1)c1ccccc1Br ZINC000654873168 566759387 /nfs/dbraw/zinc/75/93/87/566759387.db2.gz APXWQPLTPHGEOX-INIZCTEOSA-N 0 1 378.270 3.266 10 0 GGAEMN O=S(=O)(C[C@H]1CCCC1(F)F)NC[C@@H]1CCCN(Cc2cccs2)C1 ZINC000451136534 566764146 /nfs/dbraw/zinc/76/41/46/566764146.db2.gz QOTQSIUXFSBYTL-LSDHHAIUSA-N 0 1 392.537 3.315 10 0 GGAEMN O=S(=O)(C[C@@H]1CCCC1(F)F)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000451136531 566764311 /nfs/dbraw/zinc/76/43/11/566764311.db2.gz QOTQSIUXFSBYTL-CABCVRRESA-N 0 1 392.537 3.315 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1oc2ccccc2c1Br ZINC000630932396 566764977 /nfs/dbraw/zinc/76/49/77/566764977.db2.gz JJUBCAGKVDLRAC-LBPRGKRZSA-N 0 1 381.270 3.036 10 0 GGAEMN COC[C@H](NS(=O)(=O)c1cc(C(F)(F)F)ccc1O)c1ccccc1 ZINC000451161040 566767613 /nfs/dbraw/zinc/76/76/13/566767613.db2.gz JAFUCJQSFPEFIM-ZDUSSCGKSA-N 0 1 375.368 3.077 10 0 GGAEMN Cc1nc2sccn2c(=O)c1CCN1CCc2c(Cl)cc(F)cc2C1 ZINC000451161289 566767673 /nfs/dbraw/zinc/76/76/73/566767673.db2.gz JOBKCCJCYSHSKK-UHFFFAOYSA-N 0 1 377.872 3.458 10 0 GGAEMN O=C(Nc1ccccc1CN1CCC(O)CC1)c1ncsc1Br ZINC000654970844 566768275 /nfs/dbraw/zinc/76/82/75/566768275.db2.gz UIKPPPIUMXWRGW-UHFFFAOYSA-N 0 1 396.310 3.115 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(S[C@@H]2CCN(C3CCC3)C2=O)n1 ZINC000631003443 566768775 /nfs/dbraw/zinc/76/87/75/566768775.db2.gz KNFDGMCBESCLLT-CQSZACIVSA-N 0 1 378.885 3.379 10 0 GGAEMN O=C(CNS(=O)(=O)c1c(F)cccc1F)Nc1csc2ccccc12 ZINC000562188457 566768907 /nfs/dbraw/zinc/76/89/07/566768907.db2.gz USZMMGLJHJPLAR-UHFFFAOYSA-N 0 1 382.413 3.097 10 0 GGAEMN Brc1ccc(-c2n[nH]c(SC[C@H]3CCc4ncnn43)n2)cc1 ZINC000631005382 566770192 /nfs/dbraw/zinc/77/01/92/566770192.db2.gz QKFKZZGCHMPPFH-LLVKDONJSA-N 0 1 377.271 3.105 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3ccc(Br)cn3)cccc21 ZINC000469199987 566770775 /nfs/dbraw/zinc/77/07/75/566770775.db2.gz LDACKEXRBDMMGD-HNNXBMFYSA-N 0 1 376.254 3.482 10 0 GGAEMN Brc1ccn2cc(CN[C@H](c3nnc[nH]3)c3ccccc3)nc2c1 ZINC000562212339 566771041 /nfs/dbraw/zinc/77/10/41/566771041.db2.gz OATRNKOBYWREDC-INIZCTEOSA-N 0 1 383.253 3.094 10 0 GGAEMN COC(=O)c1c(C)c(NS(=O)(=O)c2cc(OC)ccc2Cl)ccc1F ZINC000562232950 566771879 /nfs/dbraw/zinc/77/18/79/566771879.db2.gz DDXBXOUPWKXYGR-UHFFFAOYSA-N 0 1 387.816 3.384 10 0 GGAEMN Cc1noc(CN2CC[C@@H](Cc3cccc(I)c3)C2)n1 ZINC000451185009 566773630 /nfs/dbraw/zinc/77/36/30/566773630.db2.gz BVWTZLYPJMDRLF-ZDUSSCGKSA-N 0 1 383.233 3.047 10 0 GGAEMN C[C@H](c1nncn1C)N1CC[C@H](Cc2cccc(I)c2)C1 ZINC000451186149 566773698 /nfs/dbraw/zinc/77/36/98/566773698.db2.gz DMHXUTCBTOCTKG-TZMCWYRMSA-N 0 1 396.276 3.045 10 0 GGAEMN CC(C)n1ncnc1CNC[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000631049050 566773752 /nfs/dbraw/zinc/77/37/52/566773752.db2.gz RPFXKTASLVGRNP-CQSZACIVSA-N 0 1 378.318 3.238 10 0 GGAEMN Clc1ccc(OCCCNCc2cn(C[C@H]3CCOC3)nn2)c(Cl)c1 ZINC000631055583 566773860 /nfs/dbraw/zinc/77/38/60/566773860.db2.gz CWAJSXINKXBFDT-CYBMUJFWSA-N 0 1 385.295 3.180 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)N=c2nc(-c3ccsc3)[n-]s2)n[nH]1 ZINC000516620875 566773725 /nfs/dbraw/zinc/77/37/25/566773725.db2.gz PSUAQMFUMHBEJX-RKDXNWHRSA-N 0 1 377.499 3.203 10 0 GGAEMN Cc1ccnc(CN2CC[C@H](Cc3cccc(I)c3)C2)n1 ZINC000451190750 566773798 /nfs/dbraw/zinc/77/37/98/566773798.db2.gz LXYQVYMFOFBXHX-OAHLLOKOSA-N 0 1 393.272 3.454 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)N=c2nc(-c3ccsc3)[n-]s2)n[nH]1 ZINC000516620873 566774285 /nfs/dbraw/zinc/77/42/85/566774285.db2.gz PSUAQMFUMHBEJX-DTWKUNHWSA-N 0 1 377.499 3.203 10 0 GGAEMN O=C(CNC1(c2cccc(Br)c2)CCC1)N1CCOC[C@@H]1C1CC1 ZINC000678008695 566775486 /nfs/dbraw/zinc/77/54/86/566775486.db2.gz VTEVHSKDERWPCY-QGZVFWFLSA-N 0 1 393.325 3.055 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)c2[nH]nc3ccc(Br)cc32)n[nH]1 ZINC000489220818 566776073 /nfs/dbraw/zinc/77/60/73/566776073.db2.gz PYJJTICAQKPUCV-IUCAKERBSA-N 0 1 391.273 3.448 10 0 GGAEMN Cc1ccoc1C(=O)NCCCNCc1ncc(Br)cc1Cl ZINC000631077407 566776296 /nfs/dbraw/zinc/77/62/96/566776296.db2.gz ULKNXVJKKCGGOU-UHFFFAOYSA-N 0 1 386.677 3.309 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NC(=O)C(=O)c2ccc(Br)cc2)n[nH]1 ZINC000489262997 566777062 /nfs/dbraw/zinc/77/70/62/566777062.db2.gz VTIVFKNSWIMGEG-ZJUUUORDSA-N 0 1 379.258 3.141 10 0 GGAEMN COc1ccc(Br)c(S(=O)(=O)Nc2ccnc(SC)c2)c1 ZINC000678033720 566777002 /nfs/dbraw/zinc/77/70/02/566777002.db2.gz UKEDUGMNXMRQFE-UHFFFAOYSA-N 0 1 389.296 3.375 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@@H](Cc1ccccc1)C(N)=O ZINC000469284143 566778017 /nfs/dbraw/zinc/77/80/17/566778017.db2.gz UCUQXVBRWRENDM-LRDDRELGSA-N 0 1 377.282 3.205 10 0 GGAEMN COCCc1ncc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000631103541 566780852 /nfs/dbraw/zinc/78/08/52/566780852.db2.gz IVFNNPVDDOOBAE-YJBOKZPZSA-N 0 1 379.913 3.047 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)CC2CC(F)(F)C2)[C@H]1c1cccs1 ZINC000451243503 566781297 /nfs/dbraw/zinc/78/12/97/566781297.db2.gz PLDSDHWYJKDIHR-HIFRSBDPSA-N 0 1 378.510 3.096 10 0 GGAEMN C[C@H]1CCC[C@@H]1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000542187092 566781526 /nfs/dbraw/zinc/78/15/26/566781526.db2.gz YTOQYPJCAAUOCT-WCQYABFASA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@H]1CCC[C@@H]1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000542187092 566781533 /nfs/dbraw/zinc/78/15/33/566781533.db2.gz YTOQYPJCAAUOCT-WCQYABFASA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@H]1CCC[C@H]1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000542187090 566781693 /nfs/dbraw/zinc/78/16/93/566781693.db2.gz YTOQYPJCAAUOCT-AAEUAGOBSA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@H]1CCC[C@H]1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000542187090 566781699 /nfs/dbraw/zinc/78/16/99/566781699.db2.gz YTOQYPJCAAUOCT-AAEUAGOBSA-N 0 1 392.301 3.470 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N(C)Cc3cc(C(C)(C)C)[nH]n3)cc2s1 ZINC000562335268 566782204 /nfs/dbraw/zinc/78/22/04/566782204.db2.gz DWTVPUQUKXIRRP-UHFFFAOYSA-N 0 1 378.523 3.446 10 0 GGAEMN Cn1cc(CNC[C@H](O)COc2c(Cl)cccc2Cl)c(C(F)(F)F)n1 ZINC000516761694 566782395 /nfs/dbraw/zinc/78/23/95/566782395.db2.gz LFIMUGNREVPACQ-JTQLQIEISA-N 0 1 398.212 3.275 10 0 GGAEMN Clc1cc(Br)cnc1CNC1CCN(c2cccnn2)CC1 ZINC000631120861 566782429 /nfs/dbraw/zinc/78/24/29/566782429.db2.gz DYHHAFLTGINIAX-UHFFFAOYSA-N 0 1 382.693 3.046 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)NCc1ccn(C2CCCC2)n1 ZINC000562359383 566782636 /nfs/dbraw/zinc/78/26/36/566782636.db2.gz PGSCHKIPURZEHO-ZDUSSCGKSA-N 0 1 379.302 3.101 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@H]2[C@@H]3CCC[C@@H]32)cc1 ZINC000562355711 566782779 /nfs/dbraw/zinc/78/27/79/566782779.db2.gz YAHVXXZXRWLMOX-FOLVSLTJSA-N 0 1 376.503 3.386 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@H](Cc1ccc(F)cc1)C(N)=O ZINC000469337808 566783208 /nfs/dbraw/zinc/78/32/08/566783208.db2.gz MSTCNOFQKQRWNA-BDJLRTHQSA-N 0 1 395.272 3.344 10 0 GGAEMN C[C@](CO)(NCc1ccnn1CC1CCC1)c1ccc(Br)cc1 ZINC000631133873 566783953 /nfs/dbraw/zinc/78/39/53/566783953.db2.gz LOYDLFHOXBAKDF-GOSISDBHSA-N 0 1 378.314 3.443 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C1(CO)CC=CC1 ZINC000655180594 566784295 /nfs/dbraw/zinc/78/42/95/566784295.db2.gz PHKZTCQQRVWYII-MRXNPFEDSA-N 0 1 392.297 3.409 10 0 GGAEMN CN1CCC[C@H](NCc2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc21 ZINC000631154350 566784903 /nfs/dbraw/zinc/78/49/03/566784903.db2.gz WCPQUJZZQIQNHT-INIZCTEOSA-N 0 1 379.913 3.048 10 0 GGAEMN Clc1cc(Br)ccc1CCNCc1cn(C[C@@H]2CCOC2)nn1 ZINC000631145124 566785856 /nfs/dbraw/zinc/78/58/56/566785856.db2.gz CNAFSDUFOFBDEO-LBPRGKRZSA-N 0 1 399.720 3.063 10 0 GGAEMN COc1cc(Br)ccc1OC[C@H](O)CN1CCc2ccccc2C1 ZINC000489418128 566786369 /nfs/dbraw/zinc/78/63/69/566786369.db2.gz IDKJDZSFLOLUGR-QGZVFWFLSA-N 0 1 392.293 3.256 10 0 GGAEMN COc1cc(Br)ccc1OC[C@@H](O)CN1CCc2ccccc2C1 ZINC000489418127 566786603 /nfs/dbraw/zinc/78/66/03/566786603.db2.gz IDKJDZSFLOLUGR-KRWDZBQOSA-N 0 1 392.293 3.256 10 0 GGAEMN O=C(N[C@H](C1CC1)[C@@H]1CCCCO1)c1cc(Br)cc2nc[nH]c21 ZINC000655221117 566786537 /nfs/dbraw/zinc/78/65/37/566786537.db2.gz DPOBXWXORRPYHG-LSDHHAIUSA-N 0 1 378.270 3.403 10 0 GGAEMN Cc1c2cc(Br)cc(C)c2oc1C(=O)N1CCc2[nH]nnc2C1 ZINC000469408069 566787378 /nfs/dbraw/zinc/78/73/78/566787378.db2.gz NIQBLJQVYZKNLH-UHFFFAOYSA-N 0 1 375.226 3.129 10 0 GGAEMN O=C(N[C@H](C1CC1)[C@@H]1CCCCO1)c1n[nH]c2ccc(Br)cc21 ZINC000655222838 566787457 /nfs/dbraw/zinc/78/74/57/566787457.db2.gz MNQSOFJIVPPXIB-LSDHHAIUSA-N 0 1 378.270 3.403 10 0 GGAEMN CCN1CCN(CC(=O)Nc2cc(Br)cc(C(C)(C)C)c2O)CC1 ZINC000655204883 566787589 /nfs/dbraw/zinc/78/75/89/566787589.db2.gz RTPHIJIBXCHWES-UHFFFAOYSA-N 0 1 398.345 3.028 10 0 GGAEMN CN1CCC[C@H]1C(=O)NCCOc1ccc(Br)cc1C(F)(F)F ZINC000489454703 566788269 /nfs/dbraw/zinc/78/82/69/566788269.db2.gz FRODPLKCRQWCFT-LBPRGKRZSA-N 0 1 395.219 3.057 10 0 GGAEMN CN1CCC[C@@H]1C(=O)NCCOc1ccc(Br)cc1C(F)(F)F ZINC000489454702 566789035 /nfs/dbraw/zinc/78/90/35/566789035.db2.gz FRODPLKCRQWCFT-GFCCVEGCSA-N 0 1 395.219 3.057 10 0 GGAEMN CS(=O)(=O)Nc1cccc(CN[C@@H](CCO)c2ccc(Cl)c(F)c2)c1 ZINC000631191549 566789350 /nfs/dbraw/zinc/78/93/50/566789350.db2.gz QVIGEKXQFWSHGU-KRWDZBQOSA-N 0 1 386.876 3.064 10 0 GGAEMN Clc1ccc(Br)cc1CNCc1n[nH]c(C2CCOCC2)n1 ZINC000631212772 566790614 /nfs/dbraw/zinc/79/06/14/566790614.db2.gz GJSOBKSAPALRTN-UHFFFAOYSA-N 0 1 385.693 3.404 10 0 GGAEMN CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)C(C)(C)c1c[nH]cn1 ZINC000469445192 566791662 /nfs/dbraw/zinc/79/16/62/566791662.db2.gz YCUGVZRJLKKMSF-UHFFFAOYSA-N 0 1 383.279 3.481 10 0 GGAEMN O=C(c1csc(-c2ccc(Cl)c(Cl)c2)n1)N1CCN2C[C@H](O)C[C@H]2C1 ZINC000655298595 566792173 /nfs/dbraw/zinc/79/21/73/566792173.db2.gz QTSBHNPVCGHSBH-NWDGAFQWSA-N 0 1 398.315 3.008 10 0 GGAEMN O=C(NCc1nc2ccc(Br)cc2o1)[C@@H]1CCCc2[nH]ncc21 ZINC000516923063 566793658 /nfs/dbraw/zinc/79/36/58/566793658.db2.gz BGOMQIINKQNVJB-SNVBAGLBSA-N 0 1 375.226 3.050 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOc2cccc(Br)c2C1 ZINC000655319168 566794038 /nfs/dbraw/zinc/79/40/38/566794038.db2.gz AYCRCKNKWQHPJV-NSHDSACASA-N 0 1 376.254 3.013 10 0 GGAEMN O=C(N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1cccc(Br)c1O ZINC000655337840 566794751 /nfs/dbraw/zinc/79/47/51/566794751.db2.gz WGDSWWUTMCBTNN-KWQFWETISA-N 0 1 382.176 3.385 10 0 GGAEMN CC(F)(F)CCCNS(=O)(=O)c1cc(Br)c(F)cc1F ZINC000451610938 566850183 /nfs/dbraw/zinc/85/01/83/566850183.db2.gz VEZJTIJKAJTURR-UHFFFAOYSA-N 0 1 378.185 3.441 10 0 GGAEMN O=C(N[C@H](C[C@H]1CCCO1)C(F)(F)F)c1cccc(Br)c1O ZINC000655337842 566795262 /nfs/dbraw/zinc/79/52/62/566795262.db2.gz WGDSWWUTMCBTNN-LDYMZIIASA-N 0 1 382.176 3.385 10 0 GGAEMN CN(CCOc1ccc(Br)cc1)Cc1cc(-c2cnn(C)c2)no1 ZINC000469519757 566797215 /nfs/dbraw/zinc/79/72/15/566797215.db2.gz YHNGXPKTVNHNGJ-UHFFFAOYSA-N 0 1 391.269 3.348 10 0 GGAEMN Brc1cc(CN[C@@H]2CCCn3nccc32)cc2c1OCCCO2 ZINC000631302067 566798707 /nfs/dbraw/zinc/79/87/07/566798707.db2.gz VAWJZWJIPJMBMB-CQSZACIVSA-N 0 1 378.270 3.432 10 0 GGAEMN CCN(CC)Cc1ccc(C(=O)N[C@@H](CO)c2cccc(Br)c2)o1 ZINC000678402473 566798928 /nfs/dbraw/zinc/79/89/28/566798928.db2.gz XTECDLVVSMCZNI-INIZCTEOSA-N 0 1 395.297 3.347 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)[C@H]1CCCc2[nH]ncc21 ZINC000427801170 566799631 /nfs/dbraw/zinc/79/96/31/566799631.db2.gz IMMQDIMBRBUXHZ-LBPRGKRZSA-N 0 1 398.326 3.329 10 0 GGAEMN Cc1nc(S(=O)(=O)NCC(C)(C)[C@H]2CCCCO2)sc1Br ZINC000678488575 566801761 /nfs/dbraw/zinc/80/17/61/566801761.db2.gz TUPOXHITULRLNJ-SNVBAGLBSA-N 0 1 397.360 3.088 10 0 GGAEMN Brc1cnc2c(c1)nccc2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631459582 566805505 /nfs/dbraw/zinc/80/55/05/566805505.db2.gz FOGZCOMXCFBHKF-UHFFFAOYSA-N 0 1 389.257 3.017 10 0 GGAEMN C[C@@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1ccc(Br)c(F)c1 ZINC000678595290 566805841 /nfs/dbraw/zinc/80/58/41/566805841.db2.gz UQRLIVLAFODZCD-BZNIZROVSA-N 0 1 385.277 3.019 10 0 GGAEMN Cc1ccc([C@@H](N)C(=O)N2CCOc3cccc(Br)c3C2)cc1 ZINC000655504892 566806358 /nfs/dbraw/zinc/80/63/58/566806358.db2.gz WDCGHDURHVJBGW-QGZVFWFLSA-N 0 1 375.266 3.179 10 0 GGAEMN Cc1ccc([C@H](N)C(=O)N2CCOc3cccc(Br)c3C2)cc1 ZINC000655504891 566806892 /nfs/dbraw/zinc/80/68/92/566806892.db2.gz WDCGHDURHVJBGW-KRWDZBQOSA-N 0 1 375.266 3.179 10 0 GGAEMN Cc1c([C@H](C)NCC2(CCO)CC2)nnn1-c1cccc(Br)c1 ZINC000427977443 566807873 /nfs/dbraw/zinc/80/78/73/566807873.db2.gz YJMBDHFDTXXORC-LBPRGKRZSA-N 0 1 379.302 3.151 10 0 GGAEMN COCCN1CCCN(CC/C=C\c2ccc(Br)cc2)CC1=O ZINC000469689065 566807897 /nfs/dbraw/zinc/80/78/97/566807897.db2.gz DSCUNCLMZLOBSB-DJWKRKHSSA-N 0 1 381.314 3.033 10 0 GGAEMN Cc1c([C@@H](C)NCC2(CCO)CC2)nnn1-c1cccc(Br)c1 ZINC000427977442 566808253 /nfs/dbraw/zinc/80/82/53/566808253.db2.gz YJMBDHFDTXXORC-GFCCVEGCSA-N 0 1 379.302 3.151 10 0 GGAEMN Cc1csc(-c2ccc(S(=O)(=O)N(C)[C@H]3CCN(C)[C@@H](C)C3)cc2)n1 ZINC000655523364 566808673 /nfs/dbraw/zinc/80/86/73/566808673.db2.gz HMQPAWFQOXSWCJ-HOCLYGCPSA-N 0 1 379.551 3.222 10 0 GGAEMN CC[C@@H](NCC(=O)Nc1ccccc1Br)c1c(C)nn(C)c1C ZINC000542530540 566810277 /nfs/dbraw/zinc/81/02/77/566810277.db2.gz DYXVZCQBJLNZFQ-CQSZACIVSA-N 0 1 379.302 3.479 10 0 GGAEMN O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)Nc1nc2ccc(F)cc2[nH]1 ZINC000428033424 566811835 /nfs/dbraw/zinc/81/18/35/566811835.db2.gz MOXORJJZVHRTRW-UHFFFAOYSA-N 0 1 381.194 3.377 10 0 GGAEMN O=C(c1ccc2scc(Br)c2c1)N1CCC[C@H](c2nn[nH]n2)C1 ZINC000562690976 566813260 /nfs/dbraw/zinc/81/32/60/566813260.db2.gz IQMOHEIZPWAPDH-JTQLQIEISA-N 0 1 392.282 3.197 10 0 GGAEMN C[C@H](NCc1n[nH]c(C2CCOCC2)n1)c1cc(Br)ccc1F ZINC000631694392 566816324 /nfs/dbraw/zinc/81/63/24/566816324.db2.gz AQSMMDMFVLPTQT-JTQLQIEISA-N 0 1 383.265 3.451 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1ccc(F)c(Br)c1 ZINC000542673963 566816770 /nfs/dbraw/zinc/81/67/70/566816770.db2.gz NSEMHQKWJJMGLO-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 ZINC000610231249 566817482 /nfs/dbraw/zinc/81/74/82/566817482.db2.gz HEQVJKYZZWVSPS-OLZOCXBDSA-N 0 1 392.253 3.400 10 0 GGAEMN Cc1ccccc1-c1noc(=O)n1Cc1nc2ccc(Br)cc2[nH]1 ZINC000542711060 566818085 /nfs/dbraw/zinc/81/80/85/566818085.db2.gz YGWNPHRNDAUNMQ-UHFFFAOYSA-N 0 1 385.221 3.499 10 0 GGAEMN Fc1ccc(Br)c2c1CC[C@@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631695153 566818164 /nfs/dbraw/zinc/81/81/64/566818164.db2.gz ZBIWXBQTSRJCIU-AWEZNQCLSA-N 0 1 395.276 3.377 10 0 GGAEMN Cc1cc(OC[C@@H](O)CN2CC[C@@](O)(C(F)F)C2)c(C(C)C)cc1Cl ZINC000451440421 566818727 /nfs/dbraw/zinc/81/87/27/566818727.db2.gz PTIQFYSHBKHQGI-UGSOOPFHSA-N 0 1 377.859 3.213 10 0 GGAEMN C[C@@H](Cc1ccc(Br)cc1F)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631695973 566818996 /nfs/dbraw/zinc/81/89/96/566818996.db2.gz LBDVBCCPGKSWOZ-NSHDSACASA-N 0 1 397.292 3.321 10 0 GGAEMN Cc1cc(OC[C@H](O)CN2CC[C@](O)(C(F)F)C2)c(C(C)C)cc1Cl ZINC000451440419 566819056 /nfs/dbraw/zinc/81/90/56/566819056.db2.gz PTIQFYSHBKHQGI-FZKQIMNGSA-N 0 1 377.859 3.213 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1F)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631695972 566819170 /nfs/dbraw/zinc/81/91/70/566819170.db2.gz LBDVBCCPGKSWOZ-LLVKDONJSA-N 0 1 397.292 3.321 10 0 GGAEMN C[C@@H]1[C@H](C(F)(F)F)CCN1S(=O)(=O)c1cc(C(F)(F)F)ccc1O ZINC000451512730 566830159 /nfs/dbraw/zinc/83/01/59/566830159.db2.gz XXTFOJBUSGKQET-VXNVDRBHSA-N 0 1 377.306 3.372 10 0 GGAEMN O=S(=O)(N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1cc(F)cc(Cl)c1 ZINC000655662603 566830664 /nfs/dbraw/zinc/83/06/64/566830664.db2.gz UAFFUGXIENNROD-CMPLNLGQSA-N 0 1 375.771 3.257 10 0 GGAEMN COc1cccc2c1OCC[C@H]2NS(=O)(=O)c1onc(C2CC2)c1Cl ZINC000631878754 566831158 /nfs/dbraw/zinc/83/11/58/566831158.db2.gz ZJMWHKHKKQLVIT-LLVKDONJSA-N 0 1 384.841 3.016 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)N[C@H]1CCCN2CCCC[C@H]12 ZINC000655669133 566834192 /nfs/dbraw/zinc/83/41/92/566834192.db2.gz XLYLAFZQFWADEK-NWDGAFQWSA-N 0 1 383.366 3.491 10 0 GGAEMN CN(CC(=O)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1)[C@H]1CCSC1 ZINC000490182791 566834701 /nfs/dbraw/zinc/83/47/01/566834701.db2.gz RKKSQORXZSHEKP-BBRMVZONSA-N 0 1 378.929 3.317 10 0 GGAEMN C[C@H](C(=O)Nc1cc(I)ccc1O)N1[C@H](C)CC[C@H]1C ZINC000610490761 566837101 /nfs/dbraw/zinc/83/71/01/566837101.db2.gz IEDWKVHYDSWELO-GMTAPVOTSA-N 0 1 388.249 3.197 10 0 GGAEMN COc1ccccc1[C@H](CO)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000542912277 566837533 /nfs/dbraw/zinc/83/75/33/566837533.db2.gz ISSOXZGCZRSWJT-LRDDRELGSA-N 0 1 386.275 3.065 10 0 GGAEMN COc1ccccc1[C@H](CO)NC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000542912279 566837697 /nfs/dbraw/zinc/83/76/97/566837697.db2.gz ISSOXZGCZRSWJT-WBMJQRKESA-N 0 1 386.275 3.065 10 0 GGAEMN CCCN1CCC[C@H]1C(=O)Nc1cc(Br)c(F)c(C(=O)OC)c1 ZINC000469999928 566837804 /nfs/dbraw/zinc/83/78/04/566837804.db2.gz NLIYVHKNBRDXEY-ZDUSSCGKSA-N 0 1 387.249 3.188 10 0 GGAEMN COc1ccccc1[C@@H](CO)NC[C@H](O)COc1c(Cl)cccc1Cl ZINC000542912276 566837886 /nfs/dbraw/zinc/83/78/86/566837886.db2.gz ISSOXZGCZRSWJT-BLLLJJGKSA-N 0 1 386.275 3.065 10 0 GGAEMN O=C(NCCOc1ccccc1F)c1n[nH]c2ccc(Br)cc21 ZINC000517662298 566839668 /nfs/dbraw/zinc/83/96/68/566839668.db2.gz QHUZZIUOMAPYAL-UHFFFAOYSA-N 0 1 378.201 3.273 10 0 GGAEMN O=C(NCCn1cnc2ccccc21)c1n[nH]c2ccc(Br)cc21 ZINC000517669084 566839708 /nfs/dbraw/zinc/83/97/08/566839708.db2.gz UMXCUNQKDMEUQT-UHFFFAOYSA-N 0 1 384.237 3.105 10 0 GGAEMN O=C(CCNCc1cc2n(n1)CCCC2)Nc1ccc(Br)cc1 ZINC000655724886 566839764 /nfs/dbraw/zinc/83/97/64/566839764.db2.gz JIVKBOJUDWSSDC-UHFFFAOYSA-N 0 1 377.286 3.100 10 0 GGAEMN Brc1ccccc1N1CC[C@H](NCc2cc3n(n2)CCCC3)C1 ZINC000655738488 566840749 /nfs/dbraw/zinc/84/07/49/566840749.db2.gz VUSZXJBBJDBLOF-AWEZNQCLSA-N 0 1 375.314 3.350 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@@H]2CCC2(F)F)[C@@H]1c1cccs1 ZINC000632027624 566841403 /nfs/dbraw/zinc/84/14/03/566841403.db2.gz IZXQJWORZQEVIF-VNHYZAJKSA-N 0 1 378.510 3.096 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@@H]2C[C@H]2C2CC2)cc1 ZINC000582218043 566842692 /nfs/dbraw/zinc/84/26/92/566842692.db2.gz FLXVPDIKMMVRIB-LSDHHAIUSA-N 0 1 376.503 3.386 10 0 GGAEMN COc1ccc2c(c1)OCC[C@H]2NS(=O)(=O)c1onc(C2CC2)c1Cl ZINC000632031334 566842975 /nfs/dbraw/zinc/84/29/75/566842975.db2.gz IQVSYXFTWLDXTF-GFCCVEGCSA-N 0 1 384.841 3.016 10 0 GGAEMN C[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)CCN1C ZINC000632030407 566843051 /nfs/dbraw/zinc/84/30/51/566843051.db2.gz RLUSNHAEPVNNTJ-PWSUYJOCSA-N 0 1 386.386 3.102 10 0 GGAEMN COc1ccc2c(c1)OCC[C@@H]2NS(=O)(=O)c1onc(C2CC2)c1Cl ZINC000632031335 566843588 /nfs/dbraw/zinc/84/35/88/566843588.db2.gz IQVSYXFTWLDXTF-LBPRGKRZSA-N 0 1 384.841 3.016 10 0 GGAEMN C[C@H](c1ccccc1)[C@H](CO)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000679277844 566844981 /nfs/dbraw/zinc/84/49/81/566844981.db2.gz XPMNQZMMRRTAAK-BZNIZROVSA-N 0 1 388.265 3.220 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cccc(Br)c3F)[nH]c2c1 ZINC000543069582 566848323 /nfs/dbraw/zinc/84/83/23/566848323.db2.gz NYBKKDZFJWOCBB-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN C[C@H](N[C@@H]1CCCN(Cc2nccn2C)C1=O)c1ccc(Br)s1 ZINC000543085527 566850220 /nfs/dbraw/zinc/85/02/20/566850220.db2.gz QUNYBWMZNDRZQV-NWDGAFQWSA-N 0 1 397.342 3.086 10 0 GGAEMN Fc1ccc2c(c1Br)CC[C@@H]2[NH2+]Cc1nnc([C@@H]2CCCO2)[n-]1 ZINC000655795822 566850231 /nfs/dbraw/zinc/85/02/31/566850231.db2.gz CRKQCHNZEZYBHJ-STQMWFEESA-N 0 1 381.249 3.335 10 0 GGAEMN CC[C@@H](CNC(=O)[C@@H](C)CN1CCOCC1)Cc1cccc(Br)c1 ZINC000543111781 566851951 /nfs/dbraw/zinc/85/19/51/566851951.db2.gz IATVENKCOUFFRH-JKSUJKDBSA-N 0 1 397.357 3.102 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@H]1F ZINC000679380317 566852963 /nfs/dbraw/zinc/85/29/63/566852963.db2.gz GMLFGBLGMCPYSS-ZWNOBZJWSA-N 0 1 396.264 3.124 10 0 GGAEMN C[C@@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@H]1F ZINC000679380317 566852972 /nfs/dbraw/zinc/85/29/72/566852972.db2.gz GMLFGBLGMCPYSS-ZWNOBZJWSA-N 0 1 396.264 3.124 10 0 GGAEMN CC[C@@H](NCc1cn(-c2ccccc2Br)nn1)[C@H]1CCCCO1 ZINC000655856318 566854018 /nfs/dbraw/zinc/85/40/18/566854018.db2.gz MQUGHLFWSYSARU-NVXWUHKLSA-N 0 1 379.302 3.467 10 0 GGAEMN NC(=O)N[C@H]1CCN(Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000470174898 566854684 /nfs/dbraw/zinc/85/46/84/566854684.db2.gz NQLDTHZNFNVASR-HNNXBMFYSA-N 0 1 390.281 3.484 10 0 GGAEMN CCOc1cc(C[N@H+]2CC[C@H](C)[C@H](C(=O)[O-])C2)cc(Br)c1OC ZINC000563131495 566858170 /nfs/dbraw/zinc/85/81/70/566858170.db2.gz LAKQKRHNHLXWCH-WCQYABFASA-N 0 1 386.286 3.399 10 0 GGAEMN O[C@H](COC[C@@H]1CCCO1)CN1CCC[C@@H]1c1ccc(Br)s1 ZINC000543176823 566860080 /nfs/dbraw/zinc/86/00/80/566860080.db2.gz MIXSCPBMMBXNPN-MELADBBJSA-N 0 1 390.343 3.204 10 0 GGAEMN COC(=O)c1ccc(CNC[C@@H]2COc3ccccc3O2)c(Br)c1 ZINC000582435671 566861670 /nfs/dbraw/zinc/86/16/70/566861670.db2.gz ATJVHAAQKNGPPE-CQSZACIVSA-N 0 1 392.249 3.165 10 0 GGAEMN CCC(C)(C)CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000428619863 566862717 /nfs/dbraw/zinc/86/27/17/566862717.db2.gz ORSIMVOMVFPFMQ-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN CCC(C)(C)CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000428619863 566862720 /nfs/dbraw/zinc/86/27/20/566862720.db2.gz ORSIMVOMVFPFMQ-UHFFFAOYSA-N 0 1 380.290 3.470 10 0 GGAEMN CN(C)c1ccc(NS(=O)(=O)c2cccc(Br)c2Cl)cn1 ZINC000582458771 566863542 /nfs/dbraw/zinc/86/35/42/566863542.db2.gz BMERCMDZLOVNIO-UHFFFAOYSA-N 0 1 390.690 3.364 10 0 GGAEMN COc1ccc2c(c1)[C@@H](NS(=O)(=O)c1onc(C3CC3)c1Cl)CCO2 ZINC000632224831 566863539 /nfs/dbraw/zinc/86/35/39/566863539.db2.gz QFEACJQFPXTBBF-LBPRGKRZSA-N 0 1 384.841 3.016 10 0 GGAEMN O=C(N[C@@H]1CCC(F)(F)C1)c1n[nH]c2ccc(I)cc21 ZINC000610790710 566864092 /nfs/dbraw/zinc/86/40/92/566864092.db2.gz CPQOJEMARFHLSS-MRVPVSSYSA-N 0 1 391.159 3.085 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1cccc(OC(F)(F)F)c1 ZINC000518089253 566865708 /nfs/dbraw/zinc/86/57/08/566865708.db2.gz FHLZPISFLRXQQV-BETUJISGSA-N 0 1 380.432 3.126 10 0 GGAEMN CC[C@H](NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)[C@H](O)C(F)F ZINC000451709354 566867436 /nfs/dbraw/zinc/86/74/36/566867436.db2.gz KLMQGBWPULDPPM-IUCAKERBSA-N 0 1 382.643 3.330 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1cccc(Br)c1OC(F)F ZINC000563261174 566869064 /nfs/dbraw/zinc/86/90/64/566869064.db2.gz KYACYVBVWCEEQX-AAEUAGOBSA-N 0 1 396.272 3.298 10 0 GGAEMN Brc1ccccc1-n1cc(CN2CCC[C@H]([C@H]3CCOC3)C2)nn1 ZINC000582518115 566870906 /nfs/dbraw/zinc/87/09/06/566870906.db2.gz ILQATHSFCREFQX-GJZGRUSLSA-N 0 1 391.313 3.278 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289662 566872706 /nfs/dbraw/zinc/87/27/06/566872706.db2.gz OCRKUDPRDJWHAO-MNOVXSKESA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cccc(Br)c2OC(F)F)C1 ZINC000563289662 566872716 /nfs/dbraw/zinc/87/27/16/566872716.db2.gz OCRKUDPRDJWHAO-MNOVXSKESA-N 0 1 394.212 3.115 10 0 GGAEMN O=S(=O)(NC1(CF)CCOCC1)c1c(Cl)cccc1C(F)(F)F ZINC000451740697 566872847 /nfs/dbraw/zinc/87/28/47/566872847.db2.gz YXNRZDUZOJKJCC-UHFFFAOYSA-N 0 1 375.771 3.156 10 0 GGAEMN O=C(NC[C@@H](O)CCc1ccccc1)c1n[nH]c2ccc(Br)cc21 ZINC000543385699 566874995 /nfs/dbraw/zinc/87/49/95/566874995.db2.gz JHGPYDVFSSESQC-AWEZNQCLSA-N 0 1 388.265 3.049 10 0 GGAEMN COC[C@@H]1CN(CCCC(=O)Nc2c(C)cc(Br)cc2C)CCO1 ZINC000679819367 566875013 /nfs/dbraw/zinc/87/50/13/566875013.db2.gz NSLLCQGRMUJIIO-INIZCTEOSA-N 0 1 399.329 3.132 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN(C)Cc1nnc[nH]1 ZINC000679818706 566875066 /nfs/dbraw/zinc/87/50/66/566875066.db2.gz HEKGSXCLFHJPRA-UHFFFAOYSA-N 0 1 380.290 3.035 10 0 GGAEMN Fc1ccc([C@H](NCCOc2ccc(Br)cc2)c2c[nH]nn2)cc1 ZINC000563319183 566875348 /nfs/dbraw/zinc/87/53/48/566875348.db2.gz ZDRYGZIZMSARFO-KRWDZBQOSA-N 0 1 391.244 3.464 10 0 GGAEMN COC(=O)c1cc(CN2CCC(n3cc(Br)cn3)CC2)c(C)o1 ZINC000518316411 566878027 /nfs/dbraw/zinc/87/80/27/566878027.db2.gz KUTONUUBJMASSG-UHFFFAOYSA-N 0 1 382.258 3.171 10 0 GGAEMN CCOC(=O)CCC1CCN(CC(=O)Nc2ccc(Br)cc2)CC1 ZINC000610997592 566878730 /nfs/dbraw/zinc/87/87/30/566878730.db2.gz YRWBCAXVPIBHTN-UHFFFAOYSA-N 0 1 397.313 3.443 10 0 GGAEMN CCOC(=O)CCC1CCN(CC(=O)N(C)Cc2ccc(Cl)s2)CC1 ZINC000610996917 566879147 /nfs/dbraw/zinc/87/91/47/566879147.db2.gz NVDWCZRHNDFOSC-UHFFFAOYSA-N 0 1 386.945 3.415 10 0 GGAEMN CSc1ccc([C@H](C)NC[C@H]2CS(=O)(=O)c3ccccc3O2)cc1F ZINC000582605523 566879298 /nfs/dbraw/zinc/87/92/98/566879298.db2.gz CSEPBFWULOWEBE-JSGCOSHPSA-N 0 1 381.494 3.433 10 0 GGAEMN O=S1(=O)CCCC[C@@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000543427590 566879978 /nfs/dbraw/zinc/87/99/78/566879978.db2.gz PKBOOEPQPHGAMD-UKRRQHHQSA-N 0 1 388.327 3.220 10 0 GGAEMN Cc1nc(-c2ccc(Br)cc2)c(NC(=O)CN2CC[C@@H](C)C2)n1C ZINC000563385013 566880286 /nfs/dbraw/zinc/88/02/86/566880286.db2.gz JLQBFKABLWEQEC-GFCCVEGCSA-N 0 1 391.313 3.438 10 0 GGAEMN Cc1c(Br)cccc1CS(=O)(=O)Nc1cc(C(F)(F)F)[nH]n1 ZINC000656184393 566880946 /nfs/dbraw/zinc/88/09/46/566880946.db2.gz RCGBWXKEGPIZKU-UHFFFAOYSA-N 0 1 398.204 3.441 10 0 GGAEMN O=C(NCCN1CCc2ccccc2C1)c1[nH]nc2ccc(Br)cc21 ZINC000518389596 566881008 /nfs/dbraw/zinc/88/10/08/566881008.db2.gz WLMRIIBMJHYWNC-UHFFFAOYSA-N 0 1 399.292 3.114 10 0 GGAEMN Cc1cnc([C@H](C)[N@@H+]2C[C@@H](c3ccc(Br)cc3)[C@H](C(=O)[O-])C2)cn1 ZINC000518385981 566881485 /nfs/dbraw/zinc/88/14/85/566881485.db2.gz APFMSEQTHSWBCI-VBNZEHGJSA-N 0 1 390.281 3.409 10 0 GGAEMN CS(=O)(=O)CC[C@H]1CCCCN1CCCc1nc(-c2cccs2)no1 ZINC000428837248 566881882 /nfs/dbraw/zinc/88/18/82/566881882.db2.gz GXBMUAKABZPUJU-CQSZACIVSA-N 0 1 383.539 3.020 10 0 GGAEMN Cc1cc(Br)ccc1SCC(=O)N(C)[C@@H]1CN2CCC1CC2 ZINC000518431736 566882648 /nfs/dbraw/zinc/88/26/48/566882648.db2.gz IUQOGVGTHFHNKX-OAHLLOKOSA-N 0 1 383.355 3.402 10 0 GGAEMN CN(C(=O)CSCc1cc(-c2cccs2)on1)[C@H]1CN2CCC1CC2 ZINC000518431817 566882916 /nfs/dbraw/zinc/88/29/16/566882916.db2.gz DUFRELSJJMNORM-HNNXBMFYSA-N 0 1 377.535 3.189 10 0 GGAEMN CC(C)[C@@H]1C[C@H](CNS(=O)(=O)c2cc(C(F)(F)F)ccc2O)CCO1 ZINC000451817407 566887657 /nfs/dbraw/zinc/88/76/57/566887657.db2.gz LQRVRALFJWOQST-RISCZKNCSA-N 0 1 381.416 3.141 10 0 GGAEMN Brc1ccc(-c2ccc(CN3CCN4CCOC[C@H]4C3)o2)cc1 ZINC000543621121 566892569 /nfs/dbraw/zinc/89/25/69/566892569.db2.gz FSYIAAHZDBCZOY-MRXNPFEDSA-N 0 1 377.282 3.226 10 0 GGAEMN Cc1cc(-c2nnn(Cc3nc4ccc(Br)cc4[nH]3)n2)ccc1F ZINC000543640470 566896038 /nfs/dbraw/zinc/89/60/38/566896038.db2.gz HKEJRALVNJMTHJ-UHFFFAOYSA-N 0 1 387.216 3.475 10 0 GGAEMN O[C@@H]1C[C@H]2CN(Cc3nc(-c4cc(Cl)ccc4Cl)cs3)CCN2C1 ZINC000656273260 566896828 /nfs/dbraw/zinc/89/68/28/566896828.db2.gz AJNWSPQTNSPLFI-QWHCGFSZSA-N 0 1 384.332 3.368 10 0 GGAEMN Clc1cnc(NCCNCc2cnnn2Cc2ccccc2)c(Cl)c1 ZINC000491234580 566899469 /nfs/dbraw/zinc/89/94/69/566899469.db2.gz HHHMBOAEHKTHSU-UHFFFAOYSA-N 0 1 377.279 3.230 10 0 GGAEMN O=C(N[C@@H]1COc2cc(F)cc(F)c21)c1n[nH]c2ccc(Br)cc21 ZINC000680307559 566900033 /nfs/dbraw/zinc/90/00/33/566900033.db2.gz NEZSKANFOGFEJH-GFCCVEGCSA-N 0 1 394.175 3.467 10 0 GGAEMN Brc1cccc(-c2n[nH]c(-c3noc(CCOCC4CC4)n3)n2)c1 ZINC000582860623 566900599 /nfs/dbraw/zinc/90/05/99/566900599.db2.gz HLAAFMVOFHWEAW-UHFFFAOYSA-N 0 1 390.241 3.253 10 0 GGAEMN O[C@@H]([C@@H]1CCN(CCOc2cc(F)cc(Br)c2)C1)C(F)(F)F ZINC000451886866 566901479 /nfs/dbraw/zinc/90/14/79/566901479.db2.gz JFJMNKIJVPJRQQ-RNCFNFMXSA-N 0 1 386.183 3.212 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCOCC12CCCC2 ZINC000518750276 566903017 /nfs/dbraw/zinc/90/30/17/566903017.db2.gz RFBMJLGOMFEJNL-UHFFFAOYSA-N 0 1 391.265 3.076 10 0 GGAEMN O[C@@H]([C@@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)C(F)(F)F ZINC000451896903 566903085 /nfs/dbraw/zinc/90/30/85/566903085.db2.gz VHJNXOLTWOQMNQ-WBMJQRKESA-N 0 1 379.806 3.289 10 0 GGAEMN C[C@](N)(C(=O)NC[C@H]1CC12CCSCC2)c1ccc(Br)cc1 ZINC000582903636 566904076 /nfs/dbraw/zinc/90/40/76/566904076.db2.gz LKTCSYNBXRCFLK-CZUORRHYSA-N 0 1 383.355 3.273 10 0 GGAEMN CC(C)(C)CC(C)(C)N1CCN(Cc2csc(CS(C)(=O)=O)n2)CC1 ZINC000451903851 566904133 /nfs/dbraw/zinc/90/41/33/566904133.db2.gz QXYDLGMXFQZZPU-UHFFFAOYSA-N 0 1 387.615 3.020 10 0 GGAEMN C[C@@H](NC(=O)CN1CCC[C@]2(CCOC2)C1)c1ccc(Br)cc1 ZINC000451907580 566904521 /nfs/dbraw/zinc/90/45/21/566904521.db2.gz XIDZPEXOSMVDJI-KDOFPFPSSA-N 0 1 381.314 3.129 10 0 GGAEMN C[C@@H](NC(=O)CN1CCC[C@@]2(CCOC2)C1)c1ccc(Br)cc1 ZINC000451907582 566905101 /nfs/dbraw/zinc/90/51/01/566905101.db2.gz XIDZPEXOSMVDJI-RDTXWAMCSA-N 0 1 381.314 3.129 10 0 GGAEMN OC[C@H](NCCOCCOc1ccccc1)c1ccc(Br)c(F)c1 ZINC000429046847 566906482 /nfs/dbraw/zinc/90/64/82/566906482.db2.gz XVNYPYLFWXQLCL-SFHVURJKSA-N 0 1 398.272 3.307 10 0 GGAEMN Cc1ccccc1S(=O)(=O)Nc1cc(I)ccc1O ZINC000611291077 566907361 /nfs/dbraw/zinc/90/73/61/566907361.db2.gz QMXHECVSZZAUND-UHFFFAOYSA-N 0 1 389.214 3.106 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2cccc(Br)c2Cl)CCN1C ZINC000563676571 566908052 /nfs/dbraw/zinc/90/80/52/566908052.db2.gz IQXGRQFSQSFXBP-WDEREUQCSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@]1(c2cccc(Br)c2)C[C@H]1C(=O)NC1(c2nnc[nH]2)CCC1 ZINC000632709297 566908502 /nfs/dbraw/zinc/90/85/02/566908502.db2.gz OJUJGXDSXYXGJG-XJKSGUPXSA-N 0 1 375.270 3.040 10 0 GGAEMN C[C@H](NCC(=O)N1CCC[C@@H](C(F)(F)F)C1)[C@H]1OCCc2sccc21 ZINC000429120726 566909166 /nfs/dbraw/zinc/90/91/66/566909166.db2.gz IHSMDALHSSHIRX-HWWQOWPSSA-N 0 1 376.444 3.141 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccc2c(c1)CCCO2 ZINC000611304934 566909251 /nfs/dbraw/zinc/90/92/51/566909251.db2.gz ZERXUOVGLNVGAF-UHFFFAOYSA-N 0 1 381.837 3.252 10 0 GGAEMN Cn1cc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)c(C(F)(F)F)n1 ZINC000563710589 566909335 /nfs/dbraw/zinc/90/93/35/566909335.db2.gz ZYYJUGRGZDTXCD-LLVKDONJSA-N 0 1 398.212 3.275 10 0 GGAEMN C[N@@H+]1CC[C@H](N=c2[n-]nc(-c3ccon3)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000583042776 566917247 /nfs/dbraw/zinc/91/72/47/566917247.db2.gz ZZEMGYHMVULUCS-JSGCOSHPSA-N 0 1 379.848 3.265 10 0 GGAEMN C[N@H+]1CC[C@H](N=c2[n-]nc(-c3ccon3)s2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000583042776 566917254 /nfs/dbraw/zinc/91/72/54/566917254.db2.gz ZZEMGYHMVULUCS-JSGCOSHPSA-N 0 1 379.848 3.265 10 0 GGAEMN C[C@@H](C(=O)[O-])[C@H]([NH2+]Cc1cn(C2CCC2)nn1)c1ccc(Br)cc1 ZINC000656567584 566917507 /nfs/dbraw/zinc/91/75/07/566917507.db2.gz VXUYJBFTDYXKQE-BZNIZROVSA-N 0 1 393.285 3.317 10 0 GGAEMN CN(Cc1nnc[nH]1)C(=O)Nc1ccc(C(F)(F)F)c(Br)c1 ZINC000563799655 566917743 /nfs/dbraw/zinc/91/77/43/566917743.db2.gz ZDAMCJDAJANWQC-UHFFFAOYSA-N 0 1 378.152 3.250 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCC(Cc2nccs2)CC1)c1ccsc1 ZINC000632856295 566919182 /nfs/dbraw/zinc/91/91/82/566919182.db2.gz HPZPIHMCCQSSQG-INIZCTEOSA-N 0 1 378.567 3.472 10 0 GGAEMN Cc1cc(NS(=O)(=O)c2cc(Cl)ccc2Cl)ccc1OCCO ZINC000543911581 566921269 /nfs/dbraw/zinc/92/12/69/566921269.db2.gz SEDANJGGCJFBRA-UHFFFAOYSA-N 0 1 376.261 3.474 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000563842292 566923308 /nfs/dbraw/zinc/92/33/08/566923308.db2.gz OZNRUMUSIWPODW-INIZCTEOSA-N 0 1 395.352 3.038 10 0 GGAEMN COc1cc(Br)cc(S(=O)(=O)Nc2ccnc(SC)c2)c1 ZINC000680625040 566923735 /nfs/dbraw/zinc/92/37/35/566923735.db2.gz LOJAKOJWSUSBQK-UHFFFAOYSA-N 0 1 389.296 3.375 10 0 GGAEMN COC(=O)c1cc(F)ccc1S(=O)(=O)Nc1ccc(C(C)=O)c(Cl)c1 ZINC000543950826 566924719 /nfs/dbraw/zinc/92/47/19/566924719.db2.gz DMHRSMBRZKLAQR-UHFFFAOYSA-N 0 1 385.800 3.269 10 0 GGAEMN Fc1ccc2c(c1)C[C@@H](NCc1cn3ccc(Br)cc3n1)CO2 ZINC000519236308 566927845 /nfs/dbraw/zinc/92/78/45/566927845.db2.gz STZRXVDCBVDXHM-CQSZACIVSA-N 0 1 376.229 3.329 10 0 GGAEMN CCCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C(F)F)nc2)cc1 ZINC000656633832 566928372 /nfs/dbraw/zinc/92/83/72/566928372.db2.gz ILFITAAWCWIPLV-UHFFFAOYSA-N 0 1 390.433 3.004 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(CS(C)(=O)=O)cc2)c(Cl)cc1F ZINC000471133412 566931320 /nfs/dbraw/zinc/93/13/20/566931320.db2.gz LIUOIAHJEHHFDW-UHFFFAOYSA-N 0 1 391.873 3.133 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1ccc(OC(F)F)cc1OC(F)F)C1CC1 ZINC000563957988 566931521 /nfs/dbraw/zinc/93/15/21/566931521.db2.gz WXIBFRLXYXZNSG-GFCCVEGCSA-N 0 1 387.351 3.056 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1ccc(Cl)cc1Br ZINC000544030279 566931760 /nfs/dbraw/zinc/93/17/60/566931760.db2.gz CHIFTAPYPNMZTK-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN C[C@@H]1[C@H](NC(=O)c2c(F)cncc2Br)CCN1Cc1ccccc1 ZINC000633096838 566933602 /nfs/dbraw/zinc/93/36/02/566933602.db2.gz MDNIENXSFOXQAP-MLGOLLRUSA-N 0 1 392.272 3.376 10 0 GGAEMN COC(=O)Cc1ccc(S(=O)(=O)Nc2sc(C)nc2CC(C)C)cc1 ZINC000583253929 566933999 /nfs/dbraw/zinc/93/39/99/566933999.db2.gz DMLHIHHJRHUECX-UHFFFAOYSA-N 0 1 382.507 3.166 10 0 GGAEMN C[C@H]1[C@@H](NC(=O)c2c(F)cncc2Br)CCN1Cc1ccccc1 ZINC000633096835 566934161 /nfs/dbraw/zinc/93/41/61/566934161.db2.gz MDNIENXSFOXQAP-LRDDRELGSA-N 0 1 392.272 3.376 10 0 GGAEMN NC(=O)[C@@H](NC[C@@H]1C[C@H](c2ccccc2)CO1)c1cccc(Br)c1 ZINC000656685381 566934433 /nfs/dbraw/zinc/93/44/33/566934433.db2.gz PFRVWAFCGBGYBQ-SZMVWBNQSA-N 0 1 389.293 3.138 10 0 GGAEMN O=C(Nc1nc2ccc(F)cc2[nH]1)[C@@H]1Cc2cc(Br)ccc2O1 ZINC000471166134 566934885 /nfs/dbraw/zinc/93/48/85/566934885.db2.gz UUERVQIVRPEFBO-AWEZNQCLSA-N 0 1 376.185 3.407 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CNc2cc(Cl)c(F)c(Cl)c2)C1 ZINC000492763545 566937491 /nfs/dbraw/zinc/93/74/91/566937491.db2.gz ABFZZVULODLNGK-ZDUSSCGKSA-N 0 1 392.302 3.017 10 0 GGAEMN COc1c(O)cccc1CN[C@H]1CCO[C@@H]1c1cncc(Br)c1 ZINC000492708174 566938146 /nfs/dbraw/zinc/93/81/46/566938146.db2.gz HGSHPGZDUXEBRY-GOEBONIOSA-N 0 1 379.254 3.178 10 0 GGAEMN COCc1cncc(C(=O)Nc2nc(-c3ccccc3Br)n[nH]2)c1 ZINC000680885124 566939971 /nfs/dbraw/zinc/93/99/71/566939971.db2.gz HSHHRUODVJFDHJ-UHFFFAOYSA-N 0 1 388.225 3.028 10 0 GGAEMN O=S(=O)(NCC(F)(F)C(F)F)c1cc(Cl)cc(Br)c1 ZINC000656733127 566941060 /nfs/dbraw/zinc/94/10/60/566941060.db2.gz FKZIPZNYMXRJBG-UHFFFAOYSA-N 0 1 384.576 3.281 10 0 GGAEMN CN(C)c1ncc(CN(C)Cc2ccc(Br)c3cccnc23)cn1 ZINC000544119033 566941395 /nfs/dbraw/zinc/94/13/95/566941395.db2.gz NTJKMJXSSZFTLJ-UHFFFAOYSA-N 0 1 386.297 3.485 10 0 GGAEMN COc1cc(OC)c(NC(=O)NCCN2CC=C(C)CC2)cc1Br ZINC000429633085 566942522 /nfs/dbraw/zinc/94/25/22/566942522.db2.gz HGQBFQOZWDDQAK-UHFFFAOYSA-N 0 1 398.301 3.240 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)NCc1cc(Br)ccn1)C2 ZINC000452144744 566943431 /nfs/dbraw/zinc/94/34/31/566943431.db2.gz GUZQIYBLYUOBPB-NSHDSACASA-N 0 1 377.286 3.112 10 0 GGAEMN Nc1nc(-n2cccn2)cc(N2CCC[C@@H]2c2ccc(Br)s2)n1 ZINC000544141917 566944149 /nfs/dbraw/zinc/94/41/49/566944149.db2.gz LGIZMRIICGOLHD-SNVBAGLBSA-N 0 1 391.298 3.240 10 0 GGAEMN CSC[C@H](O)CN1CCC[C@H]1c1ccccc1I ZINC000493163266 566945294 /nfs/dbraw/zinc/94/52/94/566945294.db2.gz XNGPSSLKWIQNTG-RISCZKNCSA-N 0 1 377.291 3.152 10 0 GGAEMN CSC[C@@H](O)CN1CCC[C@H]1c1ccccc1I ZINC000493163262 566945868 /nfs/dbraw/zinc/94/58/68/566945868.db2.gz XNGPSSLKWIQNTG-FZMZJTMJSA-N 0 1 377.291 3.152 10 0 GGAEMN Cc1ccc(CN(CCN(C)C)S(=O)(=O)c2cc(C)c(F)cc2Cl)o1 ZINC000471311127 566947494 /nfs/dbraw/zinc/94/74/94/566947494.db2.gz JIZDAPLVRIHHTJ-UHFFFAOYSA-N 0 1 388.892 3.441 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)NCc1cc2cccnc2cc1Br ZINC000681089441 566950086 /nfs/dbraw/zinc/95/00/86/566950086.db2.gz IMEBBTCVKVGCAW-UHFFFAOYSA-N 0 1 388.269 3.145 10 0 GGAEMN COCc1ccccc1CS(=O)(=O)Nc1csc(-c2ccccn2)n1 ZINC000564145619 566950114 /nfs/dbraw/zinc/95/01/14/566950114.db2.gz ZRSIHVCQEUFPRK-UHFFFAOYSA-N 0 1 375.475 3.293 10 0 GGAEMN CC(C)(C)n1cc(Br)c(C(=O)N2CCC(c3cnc[nH]3)CC2)n1 ZINC000612063964 566951590 /nfs/dbraw/zinc/95/15/90/566951590.db2.gz OIFPPYGHNAMPNX-UHFFFAOYSA-N 0 1 380.290 3.144 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC(C)(C)c1ccc(OC(F)(F)F)cc1 ZINC000519670438 566956054 /nfs/dbraw/zinc/95/60/54/566956054.db2.gz FXDNBOJIPCMAGG-UHFFFAOYSA-N 0 1 382.448 3.082 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000656860714 566957699 /nfs/dbraw/zinc/95/76/99/566957699.db2.gz MCLKCUCLHXLCHZ-AWEZNQCLSA-N 0 1 378.460 3.159 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000656860715 566957837 /nfs/dbraw/zinc/95/78/37/566957837.db2.gz MCLKCUCLHXLCHZ-CQSZACIVSA-N 0 1 378.460 3.159 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000656861799 566958130 /nfs/dbraw/zinc/95/81/30/566958130.db2.gz AZFDUNCPWNEUEV-QWHCGFSZSA-N 0 1 384.489 3.393 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000656873780 566963179 /nfs/dbraw/zinc/96/31/79/566963179.db2.gz MZERRBOUMYBLTM-GOEBONIOSA-N 0 1 378.460 3.159 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOCC2(CCCC2)C1 ZINC000681281632 566963937 /nfs/dbraw/zinc/96/39/37/566963937.db2.gz WEPTUIXLFYOHMO-UHFFFAOYSA-N 0 1 378.270 3.358 10 0 GGAEMN COc1ccc(Br)c(CN2CCC[C@H](c3ccnc(N)n3)C2)c1 ZINC000564304055 566964136 /nfs/dbraw/zinc/96/41/36/566964136.db2.gz QCYHOQOVEXQCEQ-LBPRGKRZSA-N 0 1 377.286 3.040 10 0 GGAEMN O=S(=O)(N[C@@H](c1nnc[nH]1)c1ccccc1)c1ccc(Cl)cc1Cl ZINC000429895809 566964762 /nfs/dbraw/zinc/96/47/62/566964762.db2.gz NNMNQEWHGFLASG-CQSZACIVSA-N 0 1 383.260 3.179 10 0 GGAEMN COc1cc(Br)c(CN[C@H]2COc3ccc(F)cc3C2)cc1O ZINC000564329574 566965265 /nfs/dbraw/zinc/96/52/65/566965265.db2.gz AWGQEJPIOARHIE-CYBMUJFWSA-N 0 1 382.229 3.396 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000656887677 566966292 /nfs/dbraw/zinc/96/62/92/566966292.db2.gz XOYNTPUTPRKEOO-CYBMUJFWSA-N 0 1 384.439 3.108 10 0 GGAEMN O=C(c1cc(F)ccc1Br)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633525245 566968305 /nfs/dbraw/zinc/96/83/05/566968305.db2.gz XNDLLMWRTLZJHB-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN O=C(c1cc(F)cc(Br)c1)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633525723 566968372 /nfs/dbraw/zinc/96/83/72/566968372.db2.gz HASSHADXWFPNIL-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN Cc1cc(Br)cc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)c1 ZINC000633527521 566968421 /nfs/dbraw/zinc/96/84/21/566968421.db2.gz WBSGFXAPAXVIJG-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@H]1CCCN1Cc1ccccc1 ZINC000656904661 566970140 /nfs/dbraw/zinc/97/01/40/566970140.db2.gz KSFCJWUTFLDCBI-GDBMZVCRSA-N 0 1 378.460 3.159 10 0 GGAEMN Cc1cc(C(=O)N2CC[C@H](Cc3cccc(I)c3)C2)n[nH]1 ZINC000452373997 566971040 /nfs/dbraw/zinc/97/10/40/566971040.db2.gz WZJMNOOMPUXTSB-CYBMUJFWSA-N 0 1 395.244 3.028 10 0 GGAEMN Cc1c2cc(Br)ccc2oc1C(=O)NC[C@H]1CCCCN1CCO ZINC000452375288 566971323 /nfs/dbraw/zinc/97/13/23/566971323.db2.gz MFCLACIGWHOIGI-CQSZACIVSA-N 0 1 395.297 3.080 10 0 GGAEMN Cc1cc(Br)cc2cc(C(=O)NC[C@@H]3CCCCN3CCO)oc21 ZINC000452377293 566971872 /nfs/dbraw/zinc/97/18/72/566971872.db2.gz MKCDPDREBFDBOC-HNNXBMFYSA-N 0 1 395.297 3.080 10 0 GGAEMN CCC[C@H](C)[C@H](CO)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000519829697 566971959 /nfs/dbraw/zinc/97/19/59/566971959.db2.gz QFXSGAXFXVMXRR-RBZYPMLTSA-N 0 1 383.341 3.089 10 0 GGAEMN CCC[C@H](C)[C@@H](CO)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000519829696 566971991 /nfs/dbraw/zinc/97/19/91/566971991.db2.gz QFXSGAXFXVMXRR-PKFCDNJMSA-N 0 1 383.341 3.089 10 0 GGAEMN O=C(CSc1cc(Cl)ccc1Cl)NC[C@@H]1CCCCN1CCO ZINC000452389254 566972653 /nfs/dbraw/zinc/97/26/53/566972653.db2.gz LUJGPRKNLDICQQ-ZDUSSCGKSA-N 0 1 377.337 3.049 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@H](C(F)(F)F)O1 ZINC000681405283 566973960 /nfs/dbraw/zinc/97/39/60/566973960.db2.gz WRWAFDHBUCFTCZ-PELKAZGASA-N 0 1 378.192 3.477 10 0 GGAEMN COC[C@@H](Cc1ccccc1)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000471720318 566973821 /nfs/dbraw/zinc/97/38/21/566973821.db2.gz IINJRLODYVPDJD-CQSZACIVSA-N 0 1 388.265 3.313 10 0 GGAEMN CC(C)(C)CC(=O)N1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000681400627 566974103 /nfs/dbraw/zinc/97/41/03/566974103.db2.gz HKDQGSVJXHUJQU-UHFFFAOYSA-N 0 1 393.329 3.406 10 0 GGAEMN COc1c(NS(=O)(=O)c2cccc(Cl)c2C)cc(Cl)cc1C(N)=O ZINC000583698998 566974953 /nfs/dbraw/zinc/97/49/53/566974953.db2.gz YAZIBBMUVIMPAW-UHFFFAOYSA-N 0 1 389.260 3.210 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N1CC[C@H](N(C)Cc2ccccc2)C1 ZINC000656921278 566975362 /nfs/dbraw/zinc/97/53/62/566975362.db2.gz MALFMWMAMCWIJT-ZBFHGGJFSA-N 0 1 378.460 3.111 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000656933407 566978397 /nfs/dbraw/zinc/97/83/97/566978397.db2.gz OFYUZVUGDIPSAC-YCPHGPKFSA-N 0 1 378.460 3.157 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000656933405 566978484 /nfs/dbraw/zinc/97/84/84/566978484.db2.gz OFYUZVUGDIPSAC-IIAWOOMASA-N 0 1 378.460 3.157 10 0 GGAEMN O=C(CCc1c[nH]nn1)N[C@H]1CCCSc2ccc(Br)cc21 ZINC000633681081 566979266 /nfs/dbraw/zinc/97/92/66/566979266.db2.gz KSWCUSUMVATBMF-ZDUSSCGKSA-N 0 1 381.299 3.243 10 0 GGAEMN O=C(CCc1cnn[nH]1)N[C@H]1CCCSc2ccc(Br)cc21 ZINC000633681081 566979274 /nfs/dbraw/zinc/97/92/74/566979274.db2.gz KSWCUSUMVATBMF-ZDUSSCGKSA-N 0 1 381.299 3.243 10 0 GGAEMN Cc1nc(CCNC(=O)c2c[nH]c3ccc(Br)cc3c2=O)cs1 ZINC000519980098 566980896 /nfs/dbraw/zinc/98/08/96/566980896.db2.gz CYKWVAHQNSJJPP-UHFFFAOYSA-N 0 1 392.278 3.028 10 0 GGAEMN C[N@H+]1CC[C@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@@H]1c1ccccc1 ZINC000656945204 566981721 /nfs/dbraw/zinc/98/17/21/566981721.db2.gz LZARZFVAMAAMFU-ROUUACIJSA-N 0 1 382.888 3.344 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2cc(F)ccc2Cl)[C@@H]1c1ccccc1 ZINC000656945204 566981728 /nfs/dbraw/zinc/98/17/28/566981728.db2.gz LZARZFVAMAAMFU-ROUUACIJSA-N 0 1 382.888 3.344 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC(C)(C)CN(C)Cc1ccccc1 ZINC000656944584 566981960 /nfs/dbraw/zinc/98/19/60/566981960.db2.gz VWAPFYGSRYVSCA-AWEZNQCLSA-N 0 1 380.476 3.405 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cc(F)c(C)cc2F)c(C(F)(F)F)n1 ZINC000681548020 566982522 /nfs/dbraw/zinc/98/25/22/566982522.db2.gz BCSAJNHXDLSNLS-UHFFFAOYSA-N 0 1 382.310 3.496 10 0 GGAEMN COCc1cnc(CNCCc2cn3cc(Br)cc(C)c3n2)s1 ZINC000544710697 566985019 /nfs/dbraw/zinc/98/50/19/566985019.db2.gz LEMIPEQZKRZVBW-UHFFFAOYSA-N 0 1 395.326 3.340 10 0 GGAEMN CN(C)c1ccncc1C(=O)N(C)CC(=O)Nc1c(Cl)cccc1Cl ZINC000544708518 566985722 /nfs/dbraw/zinc/98/57/22/566985722.db2.gz TZVFUIKIYJYALS-UHFFFAOYSA-N 0 1 381.263 3.165 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCc3cc(C)cc(Br)c3C2)[nH]1 ZINC000633733241 566986404 /nfs/dbraw/zinc/98/64/04/566986404.db2.gz XOLWABOFECQQDV-UHFFFAOYSA-N 0 1 395.326 3.251 10 0 GGAEMN CC1(CCNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000471986868 566992131 /nfs/dbraw/zinc/99/21/31/566992131.db2.gz UBJAFRKOUUFVPO-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN CC1(CCNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000471986868 566992136 /nfs/dbraw/zinc/99/21/36/566992136.db2.gz UBJAFRKOUUFVPO-UHFFFAOYSA-N 0 1 378.274 3.224 10 0 GGAEMN CN(Cc1ccc(F)cc1Br)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000583904969 566994402 /nfs/dbraw/zinc/99/44/02/566994402.db2.gz XFSFTFCYIICTCJ-LBPRGKRZSA-N 0 1 381.249 3.010 10 0 GGAEMN C[C@H](COCC(F)(F)F)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000520339257 566997825 /nfs/dbraw/zinc/99/78/25/566997825.db2.gz KXRYFUDRQYIAEL-SSDOTTSWSA-N 0 1 380.164 3.023 10 0 GGAEMN COc1ccc(Br)cc1C1(NS(=O)(=O)c2ccccc2O)CC1 ZINC000657019266 566999705 /nfs/dbraw/zinc/99/97/05/566999705.db2.gz YFMVVAQQIFMDCB-UHFFFAOYSA-N 0 1 398.278 3.131 10 0 GGAEMN CCc1ncc(CNC[C@H](O)COc2ccc(Cl)cc2Br)o1 ZINC000583989869 567001508 /nfs/dbraw/zinc/00/15/08/567001508.db2.gz UCVDLEQBHUUKBU-NSHDSACASA-N 0 1 389.677 3.182 10 0 GGAEMN COC(=O)CC1(NCc2ccc(I)cc2Cl)CC1 ZINC000583997300 567002951 /nfs/dbraw/zinc/00/29/51/567002951.db2.gz CIZXKOPHFZRIJC-UHFFFAOYSA-N 0 1 379.625 3.130 10 0 GGAEMN C[C@@H]1C[C@@]2(CCO1)CN(CCOc1ccc(Br)cc1)C[C@H](C)O2 ZINC000430271530 567004205 /nfs/dbraw/zinc/00/42/05/567004205.db2.gz VJVGGEZPGQXNNS-VKJFTORMSA-N 0 1 384.314 3.486 10 0 GGAEMN CC(=O)NCc1ccc(C(=O)Nc2nc(-c3ccc(Cl)cc3)n[nH]2)s1 ZINC000520440892 567004811 /nfs/dbraw/zinc/00/48/11/567004811.db2.gz VPQZYSONCFSTAA-UHFFFAOYSA-N 0 1 375.841 3.075 10 0 GGAEMN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)cn1 ZINC000564779550 567007711 /nfs/dbraw/zinc/00/77/11/567007711.db2.gz VKQBXUSIOKBYDP-GUYCJALGSA-N 0 1 376.298 3.194 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@@H]2C[C@H]2c2ccc(Br)c(F)c2)CC1 ZINC000472197961 567008364 /nfs/dbraw/zinc/00/83/64/567008364.db2.gz VFBOKCIMQUIOAS-WMLDXEAASA-N 0 1 396.304 3.395 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1cc(Br)ccc1Cl ZINC000634007275 567010089 /nfs/dbraw/zinc/01/00/89/567010089.db2.gz MUNVNBPSDGVQSU-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN O=C(NCc1n[nH]c(C2CCOCC2)n1)c1ccc(Br)c(Cl)c1 ZINC000634010946 567010662 /nfs/dbraw/zinc/01/06/62/567010662.db2.gz YUXSWYQZOFKHDK-UHFFFAOYSA-N 0 1 399.676 3.045 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)N[C@@H](C)c1ccc(Br)cc1 ZINC000494644543 567013120 /nfs/dbraw/zinc/01/31/20/567013120.db2.gz CGOZBANWQCMJML-SWLSCSKDSA-N 0 1 397.338 3.319 10 0 GGAEMN Cc1ccc(Cl)c(OC[C@@H](O)CNCc2cn3cc(Cl)ccc3n2)c1 ZINC000564843820 567013389 /nfs/dbraw/zinc/01/33/89/567013389.db2.gz FIAWKLNBLXVUBZ-HNNXBMFYSA-N 0 1 380.275 3.479 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCCS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000494643407 567013823 /nfs/dbraw/zinc/01/38/23/567013823.db2.gz QLLWOXXFQYJSML-ZDUSSCGKSA-N 0 1 394.345 3.460 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000494653733 567014642 /nfs/dbraw/zinc/01/46/42/567014642.db2.gz ZREAFLZPFJZCFH-RISCZKNCSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000494653730 567015005 /nfs/dbraw/zinc/01/50/05/567015005.db2.gz ZREAFLZPFJZCFH-FZMZJTMJSA-N 0 1 383.311 3.469 10 0 GGAEMN C[C@H](O)C[C@H]1CCCCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000584130041 567015901 /nfs/dbraw/zinc/01/59/01/567015901.db2.gz DYKNXCPHBDPMQV-WCQYABFASA-N 0 1 380.286 3.481 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)c2c(F)c(F)c(Br)c(F)c2F)n[nH]1 ZINC000613125130 567015871 /nfs/dbraw/zinc/01/58/71/567015871.db2.gz YDBHZNXIABSDPG-SCSAIBSYSA-N 0 1 395.154 3.177 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)c2cc(Br)cc(N3CCCC3)c2)n[nH]1 ZINC000613124765 567016470 /nfs/dbraw/zinc/01/64/70/567016470.db2.gz SWDCKGSXAYIQGV-LLVKDONJSA-N 0 1 392.301 3.221 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)Nc1ccc(Br)c(C)c1 ZINC000494672939 567017179 /nfs/dbraw/zinc/01/71/79/567017179.db2.gz OBZITOUZYFRXAG-AWEZNQCLSA-N 0 1 383.311 3.389 10 0 GGAEMN C[C@H](NCC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)c1cn[nH]c1 ZINC000494706133 567017252 /nfs/dbraw/zinc/01/72/52/567017252.db2.gz DCWLOPQMZCAXTJ-QMMMGPOBSA-N 0 1 391.191 3.480 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)Nc1ccc(Br)cc1F ZINC000494686845 567017584 /nfs/dbraw/zinc/01/75/84/567017584.db2.gz SSIJFJMRBGCHCA-ZDUSSCGKSA-N 0 1 387.274 3.220 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCc2sccc2[C@@H]1c1cccs1 ZINC000584201551 567020334 /nfs/dbraw/zinc/02/03/34/567020334.db2.gz ZAGXJXXHTSZEHT-QGZVFWFLSA-N 0 1 384.592 3.429 10 0 GGAEMN C[C@](N)(C(=O)N[C@@H]1C[C@]1(F)c1ccccc1)c1ccc(Br)cc1 ZINC000564941711 567022970 /nfs/dbraw/zinc/02/29/70/567022970.db2.gz BPXRPDUDTVMFIG-NXHRZFHOSA-N 0 1 377.257 3.377 10 0 GGAEMN COc1ccccc1S(=O)(=O)CCCNC1(c2nc(C)cs2)CCC1 ZINC000494787432 567024236 /nfs/dbraw/zinc/02/42/36/567024236.db2.gz JEEHTQNHCTVOLR-UHFFFAOYSA-N 0 1 380.535 3.293 10 0 GGAEMN COCCOc1c(Cl)cc(NC(=O)[C@@H]2CCc3[nH]cnc3C2)cc1Cl ZINC000613246008 567024254 /nfs/dbraw/zinc/02/42/54/567024254.db2.gz DLAAWFIATKPWCF-SNVBAGLBSA-N 0 1 384.263 3.485 10 0 GGAEMN C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ncnc2cccc(I)c21 ZINC000545164834 567024409 /nfs/dbraw/zinc/02/44/09/567024409.db2.gz YSIGKAIFLOHPOP-IINYFYTJSA-N 0 1 394.260 3.129 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613245289 567024694 /nfs/dbraw/zinc/02/46/94/567024694.db2.gz FUOYYGSHDPLFGO-BNLOLNQZSA-N 0 1 392.297 3.170 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(Cc2csc(NC(=O)c3cccs3)n2)n1 ZINC000520811473 567025799 /nfs/dbraw/zinc/02/57/99/567025799.db2.gz KBTGBTCRKCQJTG-LLVKDONJSA-N 0 1 377.495 3.477 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2cc(Br)cc(F)c2C1 ZINC000613257971 567026004 /nfs/dbraw/zinc/02/60/04/567026004.db2.gz LJZFTKNEBQZRMO-NSHDSACASA-N 0 1 378.245 3.001 10 0 GGAEMN CC1=CCN(CCNC(=O)N(C)Cc2ccc(Br)c(F)c2)CC1 ZINC000494827214 567026726 /nfs/dbraw/zinc/02/67/26/567026726.db2.gz SNAOSVCKTLGVAP-UHFFFAOYSA-N 0 1 384.293 3.382 10 0 GGAEMN CC(C)OC(=O)[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(C)C ZINC000452866634 567026824 /nfs/dbraw/zinc/02/68/24/567026824.db2.gz AAARLUWAVQQGDJ-ZDUSSCGKSA-N 0 1 382.258 3.031 10 0 GGAEMN Cc1cccc(CN2CC[C@H](NC(=O)c3c(F)cncc3Br)C2)c1 ZINC000634274915 567027616 /nfs/dbraw/zinc/02/76/16/567027616.db2.gz KMPYRXPHXBEUEP-AWEZNQCLSA-N 0 1 392.272 3.296 10 0 GGAEMN Cc1cccc(CN2CC[C@@H](NC(=O)c3c(F)cncc3Br)C2)c1 ZINC000634274916 567027993 /nfs/dbraw/zinc/02/79/93/567027993.db2.gz KMPYRXPHXBEUEP-CQSZACIVSA-N 0 1 392.272 3.296 10 0 GGAEMN O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)[C@H]1CCc2[nH]cnc2C1 ZINC000613306265 567028970 /nfs/dbraw/zinc/02/89/70/567028970.db2.gz YNBBMDGVERBNEN-RYUDHWBXSA-N 0 1 379.291 3.217 10 0 GGAEMN C[C@H](NCc1ccsc1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430724489 567030630 /nfs/dbraw/zinc/03/06/30/567030630.db2.gz RDTAXWOODZKGCD-VIFPVBQESA-N 0 1 375.313 3.009 10 0 GGAEMN C[C@H](CC(F)(F)F)N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430742968 567033097 /nfs/dbraw/zinc/03/30/97/567033097.db2.gz QKIBWWDAMREDJL-HTQZYQBOSA-N 0 1 389.237 3.088 10 0 GGAEMN O[C@@H](CCNCc1c(Br)cncc1Br)C(F)(F)F ZINC000584323527 567033438 /nfs/dbraw/zinc/03/34/38/567033438.db2.gz SKVUKGDCGVKVFG-VIFPVBQESA-N 0 1 392.013 3.010 10 0 GGAEMN O=S(=O)(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cnc2n1CCC2 ZINC000682151846 567034830 /nfs/dbraw/zinc/03/48/30/567034830.db2.gz PLORRFHGJMFSJY-UHFFFAOYSA-N 0 1 381.326 3.284 10 0 GGAEMN O[C@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H](c2ccncn2)C1 ZINC000613380588 567035201 /nfs/dbraw/zinc/03/52/01/567035201.db2.gz JTRXGTWCMCMSGA-HIFRSBDPSA-N 0 1 382.291 3.403 10 0 GGAEMN O[C@@H](COc1ccc(Cl)c(Cl)c1)CN1CCC[C@@H](c2ccncn2)C1 ZINC000613380940 567035459 /nfs/dbraw/zinc/03/54/59/567035459.db2.gz RCAVZCNJBPMQFQ-ZIAGYGMSSA-N 0 1 382.291 3.403 10 0 GGAEMN CCN(CCNC(=O)NCc1cc(Cl)ccc1OC)CCC(F)(F)F ZINC000494968238 567036397 /nfs/dbraw/zinc/03/63/97/567036397.db2.gz BYLWMAXJDNMGAC-UHFFFAOYSA-N 0 1 381.826 3.422 10 0 GGAEMN C[C@H]1CCCN1S(=O)(=O)Nc1cc(-c2ccc(Br)s2)n[nH]1 ZINC000545314185 567037870 /nfs/dbraw/zinc/03/78/70/567037870.db2.gz OYRMPGNHCBFZGS-QMMMGPOBSA-N 0 1 391.316 3.042 10 0 GGAEMN Cc1cc(I)cc(NC(=O)[C@@H]2CCCc3[nH]ncc32)c1 ZINC000565103520 567038712 /nfs/dbraw/zinc/03/87/12/567038712.db2.gz KRDQISBXCYQSIP-GFCCVEGCSA-N 0 1 381.217 3.381 10 0 GGAEMN Cc1cc(I)cc(NC(=O)[C@H]2CCCc3[nH]ncc32)c1 ZINC000565103528 567038849 /nfs/dbraw/zinc/03/88/49/567038849.db2.gz KRDQISBXCYQSIP-LBPRGKRZSA-N 0 1 381.217 3.381 10 0 GGAEMN NC(=O)[C@@H](NCC1([C@@H]2CCCCO2)CCC1)c1cccc(Br)c1 ZINC000634580162 567040413 /nfs/dbraw/zinc/04/04/13/567040413.db2.gz ZZKGWVDAJNVPLS-HOTGVXAUSA-N 0 1 381.314 3.305 10 0 GGAEMN NC(=O)[C@@H](NCC1([C@H]2CCCCO2)CCC1)c1cccc(Br)c1 ZINC000634580161 567040480 /nfs/dbraw/zinc/04/04/80/567040480.db2.gz ZZKGWVDAJNVPLS-CVEARBPZSA-N 0 1 381.314 3.305 10 0 GGAEMN CCN(CC)CCN(C(=O)C1CCC(=O)CC1)c1ccc(Br)cn1 ZINC000584414489 567042437 /nfs/dbraw/zinc/04/24/37/567042437.db2.gz VRSDJTOCBGKNEJ-UHFFFAOYSA-N 0 1 396.329 3.278 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SC[C@H](O)C[C@@](C)(O)C2CC2)n1 ZINC000634638997 567042640 /nfs/dbraw/zinc/04/26/40/567042640.db2.gz ZWRIYZFDGAOBLN-SJKOYZFVSA-N 0 1 383.901 3.138 10 0 GGAEMN O[C@@]1(CSc2nnc(C(F)(F)F)s2)CCN(Cc2ccccc2)C1 ZINC000634648500 567044016 /nfs/dbraw/zinc/04/40/16/567044016.db2.gz SFOXTJGGGHTRCW-AWEZNQCLSA-N 0 1 375.441 3.286 10 0 GGAEMN Cc1nn(C)c(NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)c1C ZINC000634655864 567044973 /nfs/dbraw/zinc/04/49/73/567044973.db2.gz LTNRYYHQEPIRRD-UHFFFAOYSA-N 0 1 383.342 3.492 10 0 GGAEMN Cc1ccnc(NS(=O)(=O)c2cnn(C3CCCC3)c2)c1Br ZINC000634658933 567046152 /nfs/dbraw/zinc/04/61/52/567046152.db2.gz IJLVKOSJRAGGAA-UHFFFAOYSA-N 0 1 385.287 3.265 10 0 GGAEMN Brc1cccc(N2CC[C@@H](CNCc3cn(C4CCC4)nn3)C2)c1 ZINC000657329473 567046340 /nfs/dbraw/zinc/04/63/40/567046340.db2.gz MDPYFFVRQGOECR-AWEZNQCLSA-N 0 1 390.329 3.382 10 0 GGAEMN Brc1ccc(N2CC[C@H](CNCc3cn(C4CCC4)nn3)C2)cc1 ZINC000657325397 567046387 /nfs/dbraw/zinc/04/63/87/567046387.db2.gz DUVYZJUFOGSXMK-CQSZACIVSA-N 0 1 390.329 3.382 10 0 GGAEMN CCC(CC)[C@@H](CNCc1c(F)cncc1Br)N1CCOCC1 ZINC000657305518 567047731 /nfs/dbraw/zinc/04/77/31/567047731.db2.gz ZODXHUBWMJOQTA-QGZVFWFLSA-N 0 1 388.325 3.210 10 0 GGAEMN Brc1ccc(N2CC[C@@H](NCc3cn(C4CCC4)nn3)C2)cc1 ZINC000657354985 567048897 /nfs/dbraw/zinc/04/88/97/567048897.db2.gz XYRFKJMUYHIVJI-CQSZACIVSA-N 0 1 376.302 3.134 10 0 GGAEMN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cncc(Br)c1 ZINC000565243729 567050012 /nfs/dbraw/zinc/05/00/12/567050012.db2.gz OOIXNSWQWRJHSQ-DYVFJYSZSA-N 0 1 376.298 3.194 10 0 GGAEMN O=S1(=O)CC(CCN[C@H](c2ccco2)c2ccc(Br)cc2)C1 ZINC000682500120 567051680 /nfs/dbraw/zinc/05/16/80/567051680.db2.gz WSGHJMMZPMAPFB-INIZCTEOSA-N 0 1 384.295 3.156 10 0 GGAEMN O=C(CCCNCc1c(F)cncc1Br)N1Cc2ccccc2C1 ZINC000657357252 567051790 /nfs/dbraw/zinc/05/17/90/567051790.db2.gz UKWWDSNWQALYIF-UHFFFAOYSA-N 0 1 392.272 3.395 10 0 GGAEMN Cn1c(CCNCc2c(F)cncc2Br)nc2c1cccc2F ZINC000657365770 567052216 /nfs/dbraw/zinc/05/22/16/567052216.db2.gz GKXRCVWAIHNIOP-UHFFFAOYSA-N 0 1 381.224 3.341 10 0 GGAEMN Cc1ccc(Br)cc1NC(=O)CCNCc1cc2n(n1)CCC2 ZINC000657360719 567052585 /nfs/dbraw/zinc/05/25/85/567052585.db2.gz QDAVELUGAQZMFE-UHFFFAOYSA-N 0 1 377.286 3.019 10 0 GGAEMN Clc1ccccc1-c1n[n-]c(=N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)s1 ZINC000545472269 567053831 /nfs/dbraw/zinc/05/38/31/567053831.db2.gz OQCYBQLXFPNJEJ-CVEARBPZSA-N 0 1 378.929 3.336 10 0 GGAEMN Clc1ccccc1-c1n[n-]c(=N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)s1 ZINC000545472271 567054027 /nfs/dbraw/zinc/05/40/27/567054027.db2.gz OQCYBQLXFPNJEJ-HZPDHXFCSA-N 0 1 378.929 3.336 10 0 GGAEMN Brc1ccc(-c2nc(CNCc3ccnn3CC3CC3)n[nH]2)cc1 ZINC000657389957 567054319 /nfs/dbraw/zinc/05/43/19/567054319.db2.gz PRZHKQGXLBYNAY-UHFFFAOYSA-N 0 1 387.285 3.131 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNCc3ccnn3CC3CC3)n2)cc1 ZINC000657389957 567054326 /nfs/dbraw/zinc/05/43/26/567054326.db2.gz PRZHKQGXLBYNAY-UHFFFAOYSA-N 0 1 387.285 3.131 10 0 GGAEMN OC[C@@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Br)c1 ZINC000657398709 567054557 /nfs/dbraw/zinc/05/45/57/567054557.db2.gz FOJUKCNUQSMHQM-RBUKOAKNSA-N 0 1 392.293 3.440 10 0 GGAEMN O=C1[C@@H](NCc2cnn3c2CCC3)CCCN1c1ccc(Cl)cc1Cl ZINC000657446874 567057149 /nfs/dbraw/zinc/05/71/49/567057149.db2.gz HQAIAKKKGBGHSV-HNNXBMFYSA-N 0 1 379.291 3.421 10 0 GGAEMN OC[C@@]1(CNCc2c(F)cncc2Br)C[C@@H]1c1ccc(F)cc1 ZINC000657449204 567057910 /nfs/dbraw/zinc/05/79/10/567057910.db2.gz QZWBETNMJMKCRR-PBHICJAKSA-N 0 1 383.236 3.378 10 0 GGAEMN Brc1cccc(N2CC[C@@H](NCc3cn(C4CCC4)nn3)C2)c1 ZINC000657451243 567059268 /nfs/dbraw/zinc/05/92/68/567059268.db2.gz LRXOKCQNNVZISQ-CQSZACIVSA-N 0 1 376.302 3.134 10 0 GGAEMN CN(C)C(=O)CCN1CCN(CCSc2cc(Cl)ccc2Cl)CC1 ZINC000473044671 567062484 /nfs/dbraw/zinc/06/24/84/567062484.db2.gz GYRPPHLHDULXTP-UHFFFAOYSA-N 0 1 390.380 3.181 10 0 GGAEMN CCn1c(-c2ccccc2Br)nnc1N1CCN(C2CC2)CC1 ZINC000584708498 567063110 /nfs/dbraw/zinc/06/31/10/567063110.db2.gz QUKGZGHWXXDSDI-UHFFFAOYSA-N 0 1 376.302 3.012 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC(C)(C)c1ccc(Br)c(C)c1 ZINC000521519050 567064086 /nfs/dbraw/zinc/06/40/86/567064086.db2.gz CFFSXMZVVRFRTI-UHFFFAOYSA-N 0 1 391.375 3.254 10 0 GGAEMN CCn1cc(S(=O)(=O)Nc2ncc(C3CCC3)cc2Br)nc1C ZINC000521545007 567065850 /nfs/dbraw/zinc/06/58/50/567065850.db2.gz ZFSHDFDCUOKPRF-UHFFFAOYSA-N 0 1 399.314 3.437 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613864980 567067346 /nfs/dbraw/zinc/06/73/46/567067346.db2.gz BQRNMMXUBJJNEU-QWRGUYRKSA-N 0 1 378.270 3.163 10 0 GGAEMN C[C@H](NC(=O)c1sccc1CN(C)C)C1CCN(CC(F)(F)F)CC1 ZINC000473194756 567067853 /nfs/dbraw/zinc/06/78/53/567067853.db2.gz UFRNNOFDIUXUOO-LBPRGKRZSA-N 0 1 377.476 3.202 10 0 GGAEMN O=C(N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1)[C@H]1CCc2[nH]cnc2C1 ZINC000613903256 567070364 /nfs/dbraw/zinc/07/03/64/567070364.db2.gz YUAFNURHMPFDKD-WCQYABFASA-N 0 1 379.291 3.217 10 0 GGAEMN C[C@H](Oc1ccccc1)c1noc(CNS(=O)(=O)c2ccc(Cl)s2)n1 ZINC000545724389 567071190 /nfs/dbraw/zinc/07/11/90/567071190.db2.gz OMXJRDVTGALIKZ-JTQLQIEISA-N 0 1 399.881 3.403 10 0 GGAEMN CC[C@H](CNS(C)(=O)=O)N[C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000453272579 567071398 /nfs/dbraw/zinc/07/13/98/567071398.db2.gz BAEDRLUNUQOEDN-GXFFZTMASA-N 0 1 389.315 3.174 10 0 GGAEMN COC[C@H](NCc1cn(-c2ccc(Cl)cc2Cl)nn1)C1CCOCC1 ZINC000657564774 567071445 /nfs/dbraw/zinc/07/14/45/567071445.db2.gz AEJVWLNWNXMCIE-INIZCTEOSA-N 0 1 385.295 3.105 10 0 GGAEMN CN(C)C[C@@H](Cc1ccccc1)NS(=O)(=O)Cc1cc(Cl)ccc1F ZINC000431294097 567072296 /nfs/dbraw/zinc/07/22/96/567072296.db2.gz YGWWZJSDEUGALN-QGZVFWFLSA-N 0 1 384.904 3.071 10 0 GGAEMN COc1ccc(CN[C@H]2Cc3ccccc3N(C)C2=O)cc1Br ZINC000657573562 567072557 /nfs/dbraw/zinc/07/25/57/567072557.db2.gz DYHJSPMKLQQMAK-HNNXBMFYSA-N 0 1 375.266 3.135 10 0 GGAEMN Cc1ccc2nc(CN3C(=O)N[C@H](c4ccc(Br)cc4)C3=O)[nH]c2c1 ZINC000431305987 567073430 /nfs/dbraw/zinc/07/34/30/567073430.db2.gz OOYNYMMTMSTNKI-MRXNPFEDSA-N 0 1 399.248 3.427 10 0 GGAEMN CCN(CCNC(=O)c1cncc(Br)c1C)CCC(F)(F)F ZINC000613974778 567073951 /nfs/dbraw/zinc/07/39/51/567073951.db2.gz PYKDCOKVLLIOTQ-UHFFFAOYSA-N 0 1 382.224 3.157 10 0 GGAEMN O=C(Nc1ccc2c(=O)cc[nH]c2c1)c1cc(Br)cc2nc[nH]c21 ZINC000565512302 567074683 /nfs/dbraw/zinc/07/46/83/567074683.db2.gz PKZVKDIMWIVAFT-UHFFFAOYSA-N 0 1 383.205 3.419 10 0 GGAEMN C[C@@H]1CC[C@@H](NCc2ccc(OC(F)F)c(Br)c2)CS1(=O)=O ZINC000657638733 567078602 /nfs/dbraw/zinc/07/86/02/567078602.db2.gz OQYGYZSHLISSFE-MWLCHTKSSA-N 0 1 398.269 3.106 10 0 GGAEMN C[C@H]1CC[C@H](NCc2ccc(OC(F)F)c(Br)c2)CS1(=O)=O ZINC000657638738 567078640 /nfs/dbraw/zinc/07/86/40/567078640.db2.gz OQYGYZSHLISSFE-ONGXEEELSA-N 0 1 398.269 3.106 10 0 GGAEMN C[C@H]1CC[C@@H](NCc2ccc(OC(F)F)c(Br)c2)CS1(=O)=O ZINC000657638729 567078830 /nfs/dbraw/zinc/07/88/30/567078830.db2.gz OQYGYZSHLISSFE-GXSJLCMTSA-N 0 1 398.269 3.106 10 0 GGAEMN CSc1cc(Br)ccc1CN[C@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657639181 567078967 /nfs/dbraw/zinc/07/89/67/567078967.db2.gz QQQGTDONIXSNSJ-MFKMUULPSA-N 0 1 378.357 3.226 10 0 GGAEMN Cc1ccc(C(=O)N2CCCN(C[C@H]3CCCO3)CC2)c(C)c1Br ZINC000682886504 567079400 /nfs/dbraw/zinc/07/94/00/567079400.db2.gz HGSAISDUDKJKQC-MRXNPFEDSA-N 0 1 395.341 3.393 10 0 GGAEMN Cc1ccc(C(=O)N2CCCN(C[C@@H]3CCCO3)CC2)c(C)c1Br ZINC000682886503 567079499 /nfs/dbraw/zinc/07/94/99/567079499.db2.gz HGSAISDUDKJKQC-INIZCTEOSA-N 0 1 395.341 3.393 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCCCN1C[C@@H](C)O[C@@H](C)C1 ZINC000496735317 567080336 /nfs/dbraw/zinc/08/03/36/567080336.db2.gz FNXGVIOMCYRFGA-MJBXVCDLSA-N 0 1 389.323 3.376 10 0 GGAEMN Cc1ccc(C(=O)NC[C@H](C(C)C)N2CCN(C)CC2)c(C)c1Br ZINC000682899827 567080977 /nfs/dbraw/zinc/08/09/77/567080977.db2.gz OHXJLOXOYLRHJD-QGZVFWFLSA-N 0 1 396.373 3.068 10 0 GGAEMN CC1=CC[N@@H+](CCNC(=O)N2CCc3c(Br)ccc(F)c3C2)CC1 ZINC000545858094 567081160 /nfs/dbraw/zinc/08/11/60/567081160.db2.gz GMJLBWWHKSAFJB-UHFFFAOYSA-N 0 1 396.304 3.308 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCc3c(Br)ccc(F)c3C2)CC1 ZINC000545858094 567081166 /nfs/dbraw/zinc/08/11/66/567081166.db2.gz GMJLBWWHKSAFJB-UHFFFAOYSA-N 0 1 396.304 3.308 10 0 GGAEMN CN(CCCc1nc(-c2cccs2)no1)CC(=O)NCc1cccs1 ZINC000496968365 567083157 /nfs/dbraw/zinc/08/31/57/567083157.db2.gz RCMQJCUGOVANGQ-UHFFFAOYSA-N 0 1 376.507 3.040 10 0 GGAEMN COC(=O)c1csc(NS(=O)(=O)c2c(C)n(C)c3ccccc32)c1C ZINC000585733178 567083510 /nfs/dbraw/zinc/08/35/10/567083510.db2.gz ZIHIEAJFIWPOOC-UHFFFAOYSA-N 0 1 378.475 3.444 10 0 GGAEMN Cc1ccc(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c(C)c1Br ZINC000682926641 567084465 /nfs/dbraw/zinc/08/44/65/567084465.db2.gz FTZYPLQSFDQEOS-UHFFFAOYSA-N 0 1 387.237 3.293 10 0 GGAEMN COCCOc1ncccc1NS(=O)(=O)c1ccc(Cl)c(F)c1Cl ZINC000473482857 567085268 /nfs/dbraw/zinc/08/52/68/567085268.db2.gz ZFQUPWQFEHVBLC-UHFFFAOYSA-N 0 1 395.239 3.354 10 0 GGAEMN CC(C)Oc1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cn1 ZINC000521922721 567085834 /nfs/dbraw/zinc/08/58/34/567085834.db2.gz NZBNZJCXMRLVME-UHFFFAOYSA-N 0 1 389.253 3.438 10 0 GGAEMN Ic1cnc(Sc2nc(-c3ccccc3)n[nH]2)nc1 ZINC000545915144 567086632 /nfs/dbraw/zinc/08/66/32/567086632.db2.gz SLUHQZAKCUQVEA-UHFFFAOYSA-N 0 1 381.202 3.018 10 0 GGAEMN C[C@H](c1ccccc1Br)N(C)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000521947943 567087779 /nfs/dbraw/zinc/08/77/79/567087779.db2.gz OHFFWKUKOZFUAG-NEPJUHHUSA-N 0 1 377.286 3.432 10 0 GGAEMN OC[C@@]1(NCc2ccc(Br)o2)CCCN(Cc2ccccc2)C1 ZINC000682943368 567088093 /nfs/dbraw/zinc/08/80/93/567088093.db2.gz UWMCBXAFQGLPTH-GOSISDBHSA-N 0 1 379.298 3.159 10 0 GGAEMN CSc1ccc(Cl)c(NC(=O)C(=O)N2CCC(c3cnc[nH]3)CC2)c1 ZINC000657721064 567089463 /nfs/dbraw/zinc/08/94/63/567089463.db2.gz KUJUWHOEDBEMCR-UHFFFAOYSA-N 0 1 378.885 3.130 10 0 GGAEMN C[C@]1(CNC(=O)c2n[nH]c3ccc(Br)cc32)CCO[C@H]1C1CC1 ZINC000545953760 567092124 /nfs/dbraw/zinc/09/21/24/567092124.db2.gz SEDAZAKEGQNGHU-DOTOQJQBSA-N 0 1 378.270 3.260 10 0 GGAEMN Cc1cc(Br)c(CNC[C@@H]2CS(=O)(=O)c3ccccc32)s1 ZINC000453571527 567092406 /nfs/dbraw/zinc/09/24/06/567092406.db2.gz DMXCNBQUXMIKEM-LLVKDONJSA-N 0 1 386.336 3.480 10 0 GGAEMN CCS(=O)(=O)C1(CNCc2ccc(OC(F)F)c(Br)c2)CC1 ZINC000657758397 567092751 /nfs/dbraw/zinc/09/27/51/567092751.db2.gz BLAYICYJAYSSOW-UHFFFAOYSA-N 0 1 398.269 3.107 10 0 GGAEMN CCCOc1ccc(Br)cc1CNCC1(S(=O)(=O)CC)CC1 ZINC000657757644 567093416 /nfs/dbraw/zinc/09/34/16/567093416.db2.gz NCBJRZOFASCQGL-UHFFFAOYSA-N 0 1 390.343 3.295 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H]1CCN(c2cccc(Br)c2)C1=O ZINC000431580930 567094659 /nfs/dbraw/zinc/09/46/59/567094659.db2.gz YEHOBCMQDMBMSG-GFCCVEGCSA-N 0 1 397.298 3.054 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc(Br)ccc1OC(F)F ZINC000565779239 567097464 /nfs/dbraw/zinc/09/74/64/567097464.db2.gz TYSPPPIZYWAYPT-VIFPVBQESA-N 0 1 386.196 3.061 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@@H]1CCc2[nH]cnc2C1 ZINC000614254510 567097757 /nfs/dbraw/zinc/09/77/57/567097757.db2.gz UDZNVNIPUFXCQP-JRPNMDOOSA-N 0 1 378.245 3.089 10 0 GGAEMN O=C(CN1CC[C@H](c2ccc(Cl)cc2)C1)NC(=O)NCc1cccs1 ZINC000522068756 567098070 /nfs/dbraw/zinc/09/80/70/567098070.db2.gz FFTKBVGLVPYFBR-AWEZNQCLSA-N 0 1 377.897 3.217 10 0 GGAEMN Cc1cc(C(=O)N2CCN(Cc3ccc(Br)c(C)c3)[C@H](C)C2)n[nH]1 ZINC000453617278 567098748 /nfs/dbraw/zinc/09/87/48/567098748.db2.gz RJIJLAKEQGQLHI-CQSZACIVSA-N 0 1 391.313 3.136 10 0 GGAEMN O=C(CN1CC[C@@H](c2ccc(Cl)cc2)C1)NC(=O)NCc1cccs1 ZINC000522068757 567098841 /nfs/dbraw/zinc/09/88/41/567098841.db2.gz FFTKBVGLVPYFBR-CQSZACIVSA-N 0 1 377.897 3.217 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)[C@@H](C)C1 ZINC000497479571 567099977 /nfs/dbraw/zinc/09/99/77/567099977.db2.gz QIIUPLHHBREGNV-MKBNYLNASA-N 0 1 386.323 3.077 10 0 GGAEMN Cc1cc(Br)cc2c(C(=O)NCCCCN3CCOCC3)coc21 ZINC000473751076 567100167 /nfs/dbraw/zinc/10/01/67/567100167.db2.gz MIEPGRBQAIJFFC-UHFFFAOYSA-N 0 1 395.297 3.346 10 0 GGAEMN C[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1cncc(Br)c1 ZINC000657862481 567100717 /nfs/dbraw/zinc/10/07/17/567100717.db2.gz DRMZRHIIZMETRN-LBPRGKRZSA-N 0 1 383.311 3.240 10 0 GGAEMN COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)N[C@H]1CCCN(C)C1 ZINC000586853204 567101090 /nfs/dbraw/zinc/10/10/90/567101090.db2.gz UEPMHZYPXUUCFQ-HOCLYGCPSA-N 0 1 396.329 3.398 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)s[n-]1 ZINC000473827415 567105344 /nfs/dbraw/zinc/10/53/44/567105344.db2.gz HUJPUPYGHVBRMJ-AAEUAGOBSA-N 0 1 379.555 3.239 10 0 GGAEMN Cc1cc(S(=O)(=O)NCCN[C@@H](C)c2cc3cnccc3o2)c(C)s1 ZINC000657930297 567106935 /nfs/dbraw/zinc/10/69/35/567106935.db2.gz MSKWUADBEWDYNY-LBPRGKRZSA-N 0 1 379.507 3.135 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)C[C@@H](C)c2ccc(Br)cc2)C1 ZINC000431785163 567107770 /nfs/dbraw/zinc/10/77/70/567107770.db2.gz MVNWLVMITZQIDD-CRAIPNDOSA-N 0 1 397.357 3.416 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635763583 567110793 /nfs/dbraw/zinc/11/07/93/567110793.db2.gz BGUBOCRJWCBRDM-HLRQMNNKSA-N 0 1 378.270 3.168 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@H](N3CCOCC3)CC2)c(C)c1Br ZINC000614436468 567112470 /nfs/dbraw/zinc/11/24/70/567112470.db2.gz WRFYJEVBFWBISK-INIZCTEOSA-N 0 1 395.341 3.393 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)C(C)(C)c2cccc(Br)c2)C[C@H](C)O1 ZINC000588081081 567112573 /nfs/dbraw/zinc/11/25/73/567112573.db2.gz JOXQXJGKUAFTJC-GASCZTMLSA-N 0 1 397.357 3.342 10 0 GGAEMN O=C(c1c(Cl)cc(F)cc1Cl)N1CCC[C@H](N2CCOCC2)CC1 ZINC000614435317 567112685 /nfs/dbraw/zinc/11/26/85/567112685.db2.gz CWLGCNIVLMQNQM-ZDUSSCGKSA-N 0 1 375.271 3.459 10 0 GGAEMN Cc1nc([C@@H](C)NC(=O)CSCc2ccc(Br)cc2F)n[nH]1 ZINC000588073581 567112851 /nfs/dbraw/zinc/11/28/51/567112851.db2.gz XCVBPDZQYORKHX-MRVPVSSYSA-N 0 1 387.278 3.125 10 0 GGAEMN O=C(CCOc1cccc(Cl)c1Cl)N1CCC(c2n[nH]c(=O)o2)CC1 ZINC000614472575 567113639 /nfs/dbraw/zinc/11/36/39/567113639.db2.gz ADPYLGYNOLSFBS-UHFFFAOYSA-N 0 1 386.235 3.257 10 0 GGAEMN CN(C)[C@@H](CNC(=O)Cc1ccc(Br)cc1O)c1ccsc1 ZINC000431881437 567114299 /nfs/dbraw/zinc/11/42/99/567114299.db2.gz GMAIMFXIXIQNGZ-AWEZNQCLSA-N 0 1 383.311 3.178 10 0 GGAEMN COC(=O)c1cncc(S(=O)(=O)Nc2ccc(OC(C)C)c(Cl)c2)c1 ZINC000565987988 567115875 /nfs/dbraw/zinc/11/58/75/567115875.db2.gz DSUCDUAFXWLCBD-UHFFFAOYSA-N 0 1 384.841 3.110 10 0 GGAEMN O=C(NC[C@H]1CN2CCN1CCC2)c1sc2cccc(Cl)c2c1Cl ZINC000614511375 567118102 /nfs/dbraw/zinc/11/81/02/567118102.db2.gz IBPBRDGBJAWUGS-NSHDSACASA-N 0 1 384.332 3.328 10 0 GGAEMN CO[C@H](CCNS(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(F)(F)F ZINC000473955263 567118747 /nfs/dbraw/zinc/11/87/47/567118747.db2.gz BPYNJPGBOZMTNT-MRVPVSSYSA-N 0 1 384.178 3.378 10 0 GGAEMN O=C1NCC[C@@H]1N[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 ZINC000658056815 567118874 /nfs/dbraw/zinc/11/88/74/567118874.db2.gz ZPEBDQKZDDCNJS-JSGCOSHPSA-N 0 1 392.322 3.428 10 0 GGAEMN C[C@@H]1C[C@H](NC2CCN(Cc3ccccc3Br)CC2)c2ncnn21 ZINC000658100271 567122119 /nfs/dbraw/zinc/12/21/19/567122119.db2.gz GPXBQUVYWLNWRZ-DYVFJYSZSA-N 0 1 390.329 3.301 10 0 GGAEMN CC[C@@H](COCC1CC1)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658092602 567122528 /nfs/dbraw/zinc/12/25/28/567122528.db2.gz QSLKXPPDFHTRKP-JQWIXIFHSA-N 0 1 395.352 3.497 10 0 GGAEMN C[C@@H]1CCN(Cc2ccccc2)CCN1S(=O)(=O)CCc1cccs1 ZINC000683463853 567125916 /nfs/dbraw/zinc/12/59/16/567125916.db2.gz IOLGBBWZYATADW-QGZVFWFLSA-N 0 1 378.563 3.217 10 0 GGAEMN COCc1nc(CN[C@@H](c2ccc(Br)o2)c2ccc(F)cc2)n[nH]1 ZINC000658156579 567126782 /nfs/dbraw/zinc/12/67/82/567126782.db2.gz JYQTXGOGMQOFRR-MRXNPFEDSA-N 0 1 395.232 3.325 10 0 GGAEMN COCc1nc(CN[C@@H](c2ccc(OC)cc2Br)C(C)C)n[nH]1 ZINC000658155948 567126848 /nfs/dbraw/zinc/12/68/48/567126848.db2.gz FQIMIBPEBMXVIQ-MRXNPFEDSA-N 0 1 383.290 3.209 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)NCc1cccc(OC2CC2)c1F ZINC000658172116 567127777 /nfs/dbraw/zinc/12/77/77/567127777.db2.gz QCPAODULUPWWMN-GFCCVEGCSA-N 0 1 395.272 3.469 10 0 GGAEMN CCS(=O)(=O)C[C@@H](C)N[C@H]1CSCc2ccc(Br)cc21 ZINC000658186148 567127981 /nfs/dbraw/zinc/12/79/81/567127981.db2.gz BTHFNHNAHZAPQX-YGRLFVJLSA-N 0 1 378.357 3.150 10 0 GGAEMN CN(C)C[C@@H](Cc1ccccc1)NS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000614634171 567128003 /nfs/dbraw/zinc/12/80/03/567128003.db2.gz YEQHYUHYHLXWOV-OAHLLOKOSA-N 0 1 387.332 3.445 10 0 GGAEMN C[C@@H]1CCC[C@@H](CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)O1 ZINC000658216139 567129438 /nfs/dbraw/zinc/12/94/38/567129438.db2.gz PLZUWCVJOQSHRX-OSAQELSMSA-N 0 1 388.327 3.215 10 0 GGAEMN C[C@@H]1CCC[C@H](CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)O1 ZINC000658216140 567130019 /nfs/dbraw/zinc/13/00/19/567130019.db2.gz PLZUWCVJOQSHRX-UXIGCNINSA-N 0 1 388.327 3.215 10 0 GGAEMN Cc1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C)n1C ZINC000588654176 567131328 /nfs/dbraw/zinc/13/13/28/567131328.db2.gz RJHSMMYKEOHDLB-UHFFFAOYSA-N 0 1 388.269 3.120 10 0 GGAEMN Cc1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)n1C ZINC000588654176 567131334 /nfs/dbraw/zinc/13/13/34/567131334.db2.gz RJHSMMYKEOHDLB-UHFFFAOYSA-N 0 1 388.269 3.120 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@@H](C)c2ccc(OC)c(Br)c2)CC1 ZINC000658301946 567133396 /nfs/dbraw/zinc/13/33/96/567133396.db2.gz NKDQWXNUZOIYQJ-NSHDSACASA-N 0 1 376.316 3.076 10 0 GGAEMN Cc1ccc(O)c(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000588704137 567134024 /nfs/dbraw/zinc/13/40/24/567134024.db2.gz JTHFLWSGUKGKFY-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN Cc1ccc(O)c(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000588704137 567134031 /nfs/dbraw/zinc/13/40/31/567134031.db2.gz JTHFLWSGUKGKFY-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@@H](C)c2cnn(-c3cccc(Cl)c3)c2C)CC1 ZINC000658300207 567134244 /nfs/dbraw/zinc/13/42/44/567134244.db2.gz SRUDJXCNFJFTFX-ZDUSSCGKSA-N 0 1 381.929 3.452 10 0 GGAEMN C[C@H](NC(=O)[C@](C)(N)c1ccc(Br)cc1)[C@H]1COc2ccccc21 ZINC000566190880 567134966 /nfs/dbraw/zinc/13/49/66/567134966.db2.gz KYYHVHINBMCXMZ-JOKNJTHLSA-N 0 1 389.293 3.304 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(F)c(Br)c3)[nH]c21 ZINC000497951242 567135909 /nfs/dbraw/zinc/13/59/09/567135909.db2.gz OSANJDJOFVDWSG-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN COc1ccc([C@@H](C)NCCN2C[C@@H]3CCCCN3C2=O)c(Br)c1 ZINC000658307742 567136392 /nfs/dbraw/zinc/13/63/92/567136392.db2.gz WBTOBHNHHLYQJO-KGLIPLIRSA-N 0 1 396.329 3.398 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2ccc(Br)c(F)c2)[nH]n1 ZINC000432226787 567139687 /nfs/dbraw/zinc/13/96/87/567139687.db2.gz PVOLVMOSEDWAGV-UHFFFAOYSA-N 0 1 393.260 3.085 10 0 GGAEMN COc1ccc(Br)c(OC[C@@H](O)CN2CCc3ccccc3C2)c1 ZINC000432255765 567140927 /nfs/dbraw/zinc/14/09/27/567140927.db2.gz QSWLFZPRMWZSNB-INIZCTEOSA-N 0 1 392.293 3.256 10 0 GGAEMN O=C([O-])[C@@H]1C[N@H+](Cc2nc(-c3cccc(Cl)c3)no2)C[C@H]1C(F)(F)F ZINC000497996411 567141049 /nfs/dbraw/zinc/14/10/49/567141049.db2.gz NAFHDUNNTYHSKV-GHMZBOCLSA-N 0 1 375.734 3.085 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](Cc2nc(-c3cccc(Cl)c3)no2)C[C@H]1C(F)(F)F ZINC000497996411 567141057 /nfs/dbraw/zinc/14/10/57/567141057.db2.gz NAFHDUNNTYHSKV-GHMZBOCLSA-N 0 1 375.734 3.085 10 0 GGAEMN Cc1ccc([C@@H](N)C(=O)Nc2ccc(CN(C)C)c(Br)c2)cc1 ZINC000566250542 567142605 /nfs/dbraw/zinc/14/26/05/567142605.db2.gz BCCOOPBTBHFOIE-QGZVFWFLSA-N 0 1 376.298 3.458 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC2(CCC2)C1 ZINC000566273043 567145685 /nfs/dbraw/zinc/14/56/85/567145685.db2.gz SRKLMUNRAVKXBQ-UHFFFAOYSA-N 0 1 375.270 3.431 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC2(CCC2)C1 ZINC000566273043 567145690 /nfs/dbraw/zinc/14/56/90/567145690.db2.gz SRKLMUNRAVKXBQ-UHFFFAOYSA-N 0 1 375.270 3.431 10 0 GGAEMN O=S(=O)(NCCc1cccc(C(F)(F)F)n1)c1c(F)cc(F)cc1F ZINC000432286119 567145677 /nfs/dbraw/zinc/14/56/77/567145677.db2.gz QDCRPHNRLYFELJ-UHFFFAOYSA-N 0 1 384.301 3.039 10 0 GGAEMN COc1cc(Br)c(Cl)cc1C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000566282940 567145871 /nfs/dbraw/zinc/14/58/71/567145871.db2.gz JLCIGLAISKXMMZ-MRVPVSSYSA-N 0 1 384.661 3.122 10 0 GGAEMN C[C@H]1CN(CC(C)(C)O)CCN1C(=O)CCOc1cccc(Cl)c1Cl ZINC000474205716 567146258 /nfs/dbraw/zinc/14/62/58/567146258.db2.gz ZNODHQRMQYYTLL-ZDUSSCGKSA-N 0 1 389.323 3.066 10 0 GGAEMN C[C@@H]1CN(CC(C)(C)O)CCN1C(=O)CCOc1cccc(Cl)c1Cl ZINC000474205715 567146302 /nfs/dbraw/zinc/14/63/02/567146302.db2.gz ZNODHQRMQYYTLL-CYBMUJFWSA-N 0 1 389.323 3.066 10 0 GGAEMN NC(=O)c1csc(NCc2ccc(Br)cc2C(F)(F)F)n1 ZINC000432330030 567149775 /nfs/dbraw/zinc/14/97/75/567149775.db2.gz WWEOLLRPOVHDOB-UHFFFAOYSA-N 0 1 380.189 3.057 10 0 GGAEMN CN(Cc1c(F)ccc(I)c1F)[C@H]1CC[N@H+](C2CC2)C1 ZINC000474264487 567151895 /nfs/dbraw/zinc/15/18/95/567151895.db2.gz HVZPKECDIPACJB-NSHDSACASA-N 0 1 392.231 3.238 10 0 GGAEMN OC[C@@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000474264961 567152921 /nfs/dbraw/zinc/15/29/21/567152921.db2.gz GZSUAOLLXOZGLI-RDTXWAMCSA-N 0 1 382.287 3.325 10 0 GGAEMN OC[C@@H]1c2ccccc2CCN1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000474264961 567152926 /nfs/dbraw/zinc/15/29/26/567152926.db2.gz GZSUAOLLXOZGLI-RDTXWAMCSA-N 0 1 382.287 3.325 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1cccc(F)c1Br ZINC000498208371 567157620 /nfs/dbraw/zinc/15/76/20/567157620.db2.gz QZRXUNMHILLMLZ-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN COc1cc2c(cc1C(=O)Nc1nc3ccc(Br)cc3[nH]1)OCO2 ZINC000546775414 567158320 /nfs/dbraw/zinc/15/83/20/567158320.db2.gz GQSZACKGCZJNDR-UHFFFAOYSA-N 0 1 390.193 3.315 10 0 GGAEMN C[C@@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)[C@@H](C)[C@H](C)O1 ZINC000474330804 567159570 /nfs/dbraw/zinc/15/95/70/567159570.db2.gz LBCPSCIEQZPCTH-WOPDTQHZSA-N 0 1 378.270 3.477 10 0 GGAEMN Cc1cccc([C@H]2C(=O)NCCN2Cc2nc3ccc(Br)cc3[nH]2)c1 ZINC000566486987 567161507 /nfs/dbraw/zinc/16/15/07/567161507.db2.gz MDZUNAWLRWQUOE-SFHVURJKSA-N 0 1 399.292 3.307 10 0 GGAEMN Cc1ccc(Cl)c(S(=O)(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c1 ZINC000432481018 567162851 /nfs/dbraw/zinc/16/28/51/567162851.db2.gz VEPIMIHOBJRUIT-UHFFFAOYSA-N 0 1 382.869 3.335 10 0 GGAEMN O=C([O-])c1ccc(C[N@H+]2C[C@@H](c3ccsc3)[C@H](CO)C2)c(Br)c1 ZINC000566510504 567163061 /nfs/dbraw/zinc/16/30/61/567163061.db2.gz SXGDICONNYSENO-GJZGRUSLSA-N 0 1 396.306 3.417 10 0 GGAEMN O=C(N[C@@H]1CCCN(c2ccccc2)C1=O)c1cccc(Br)c1O ZINC000523702284 567166961 /nfs/dbraw/zinc/16/69/61/567166961.db2.gz QSUBACSFUKILSV-OAHLLOKOSA-N 0 1 389.249 3.080 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1C[C@H](OC)C[C@H]1CC(=O)[O-] ZINC000566566416 567167745 /nfs/dbraw/zinc/16/77/45/567167745.db2.gz IKWGZXCEUVCBLD-LSDHHAIUSA-N 0 1 386.286 3.302 10 0 GGAEMN O=S(=O)(N[C@@]1(C(F)(F)F)CCc2ccccc21)c1cncc(Cl)c1 ZINC000546878910 567168699 /nfs/dbraw/zinc/16/86/99/567168699.db2.gz OLHGQIRKQMCZQY-AWEZNQCLSA-N 0 1 376.787 3.417 10 0 GGAEMN O=C(CNC(=O)c1cc2c(s1)CCCC2)Nc1cc(F)cc(Cl)c1O ZINC000474440286 567171789 /nfs/dbraw/zinc/17/17/89/567171789.db2.gz XWTJVXHJGOGBNR-UHFFFAOYSA-N 0 1 382.844 3.494 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)c3ccc(I)c(O)c3)ccc12 ZINC000546922318 567172109 /nfs/dbraw/zinc/17/21/09/567172109.db2.gz NHSGCCXHTUNTOD-UHFFFAOYSA-N 0 1 393.184 3.434 10 0 GGAEMN Cc1c(Br)ccc(C(=O)N2CCCN(C[C@H]3CCCO3)CC2)c1F ZINC000684045909 567173724 /nfs/dbraw/zinc/17/37/24/567173724.db2.gz ARISBTVUYSIVJG-CQSZACIVSA-N 0 1 399.304 3.224 10 0 GGAEMN C[N@H+]1CCC[C@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277542 567175338 /nfs/dbraw/zinc/17/53/38/567175338.db2.gz WLSULDHXXSAZRS-DACLVMHWSA-N 0 1 383.319 3.419 10 0 GGAEMN CSc1cc(Br)ccc1C(=O)N1CCOC[C@@H]1[C@H]1CCC[N@H+]1C ZINC000615274785 567175508 /nfs/dbraw/zinc/17/55/08/567175508.db2.gz KEHXJHFNWOCKJG-HUUCEWRRSA-N 0 1 399.354 3.106 10 0 GGAEMN Cc1cc(Br)cc(C(=O)N2CCOC[C@@H]2[C@@H]2CCC[N@@H+]2C)c1C ZINC000615274489 567175871 /nfs/dbraw/zinc/17/58/71/567175871.db2.gz JICPGWHTPPAYFF-DLBZAZTESA-N 0 1 381.314 3.001 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3cccc(I)c3)[nH]c21 ZINC000498420857 567176310 /nfs/dbraw/zinc/17/63/10/567176310.db2.gz QKGFQZSPMTYZKE-UHFFFAOYSA-N 0 1 391.212 3.406 10 0 GGAEMN CCC[C@@H](NC(=O)c1coc2c1cc(Br)cc2C)c1nn[nH]n1 ZINC000474497418 567176383 /nfs/dbraw/zinc/17/63/83/567176383.db2.gz UJLQHWCNUXBICB-GFCCVEGCSA-N 0 1 378.230 3.288 10 0 GGAEMN COC(=O)[C@](C)(NC(=O)c1cccc(Br)c1O)c1ccc(F)cc1 ZINC000566655518 567176652 /nfs/dbraw/zinc/17/66/52/567176652.db2.gz OYORZWHPGNRMRR-QGZVFWFLSA-N 0 1 396.212 3.112 10 0 GGAEMN Cc1c(CN(C)CCC(=O)Nc2ccc(Br)cc2F)cnn1C ZINC000684107567 567179399 /nfs/dbraw/zinc/17/93/99/567179399.db2.gz MPOVXXPBHKDJOY-UHFFFAOYSA-N 0 1 383.265 3.091 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)C[C@H]1C(=O)[O-] ZINC000566679507 567179365 /nfs/dbraw/zinc/17/93/65/567179365.db2.gz WHSLHPRGQHWTSM-DGCLKSJQSA-N 0 1 384.270 3.153 10 0 GGAEMN OCCC1(CNCc2c(F)ccc(I)c2F)CCC1 ZINC000474797092 567200630 /nfs/dbraw/zinc/20/06/30/567200630.db2.gz XSCXAVUVEQQAGP-UHFFFAOYSA-N 0 1 381.204 3.212 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC[C@@H](Nc3cccc(Br)c3)C2)C1 ZINC000684135013 567183448 /nfs/dbraw/zinc/18/34/48/567183448.db2.gz NDYMKVCBBIURAH-DLBZAZTESA-N 0 1 395.345 3.129 10 0 GGAEMN C[C@H](NC[C@@H](O)COc1ccccc1Br)c1cn2ccccc2n1 ZINC000566746833 567184929 /nfs/dbraw/zinc/18/49/29/567184929.db2.gz AXKOAELMGLXIRK-UONOGXRCSA-N 0 1 390.281 3.187 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C[C@@H]1C ZINC000498567225 567185931 /nfs/dbraw/zinc/18/59/31/567185931.db2.gz MSCVLSJJTBSYIQ-RYUDHWBXSA-N 0 1 392.297 3.258 10 0 GGAEMN Cc1cc(C[C@H](C)N2C(=O)N[C@](C)(c3ccc(Cl)c(Cl)c3)C2=O)n[nH]1 ZINC000566774412 567188060 /nfs/dbraw/zinc/18/80/60/567188060.db2.gz DYCMTFHNNGLBRJ-DYZYQPBXSA-N 0 1 381.263 3.423 10 0 GGAEMN Cc1cc(C[C@H](C)N2C(=O)N[C@@](C)(c3ccc(Cl)c(Cl)c3)C2=O)n[nH]1 ZINC000566774411 567188537 /nfs/dbraw/zinc/18/85/37/567188537.db2.gz DYCMTFHNNGLBRJ-BTDLBPIBSA-N 0 1 381.263 3.423 10 0 GGAEMN COC(=O)c1cccc(Br)c1CN1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000432776549 567190049 /nfs/dbraw/zinc/19/00/49/567190049.db2.gz PBVPFOJLGLHQAR-ZIAGYGMSSA-N 0 1 382.298 3.484 10 0 GGAEMN Cn1cc(Br)c(CN2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)n1 ZINC000432784355 567190725 /nfs/dbraw/zinc/19/07/25/567190725.db2.gz NZTVEAKDMHCAAI-OAHLLOKOSA-N 0 1 387.285 3.305 10 0 GGAEMN Cn1cc(Br)c(CN2CCC[C@@H]2c2nc(-c3ccccc3)n[nH]2)n1 ZINC000432784355 567190729 /nfs/dbraw/zinc/19/07/29/567190729.db2.gz NZTVEAKDMHCAAI-OAHLLOKOSA-N 0 1 387.285 3.305 10 0 GGAEMN COC(=O)c1cccc(Br)c1CN1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000432776547 567190941 /nfs/dbraw/zinc/19/09/41/567190941.db2.gz PBVPFOJLGLHQAR-KGLIPLIRSA-N 0 1 382.298 3.484 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)Nc1ncc(Cc2cccc(Br)c2)s1 ZINC000659250164 567193473 /nfs/dbraw/zinc/19/34/73/567193473.db2.gz OSUAIIQWLONURD-AWEZNQCLSA-N 0 1 398.326 3.187 10 0 GGAEMN CC(C)(NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(F)F ZINC000684269029 567194333 /nfs/dbraw/zinc/19/43/33/567194333.db2.gz WILGDEJVGLZERA-UHFFFAOYSA-N 0 1 388.216 3.077 10 0 GGAEMN CC(C)(NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(F)F ZINC000684269029 567194343 /nfs/dbraw/zinc/19/43/43/567194343.db2.gz WILGDEJVGLZERA-UHFFFAOYSA-N 0 1 388.216 3.077 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)Nc1nc(-c2cc(Br)cs2)cs1 ZINC000659269368 567195652 /nfs/dbraw/zinc/19/56/52/567195652.db2.gz OZMBYIWUGLQVCG-VIFPVBQESA-N 0 1 390.328 3.325 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 ZINC000659256960 567196042 /nfs/dbraw/zinc/19/60/42/567196042.db2.gz POJLSYOUJSLAGG-KBPBESRZSA-N 0 1 387.343 3.197 10 0 GGAEMN COc1cc(Br)c(NC(=O)NCCN2CC=C(C)CC2)cc1OC ZINC000547283814 567196622 /nfs/dbraw/zinc/19/66/22/567196622.db2.gz QPVFPGTZSHKXRC-UHFFFAOYSA-N 0 1 398.301 3.240 10 0 GGAEMN CC1(CN2CCN(CC(=O)Nc3ccc(Br)cc3)CC2)CCC1 ZINC000432837238 567197045 /nfs/dbraw/zinc/19/70/45/567197045.db2.gz ZGJQPOKMCBDLPQ-UHFFFAOYSA-N 0 1 380.330 3.195 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC/C=C\c2ccc(Br)cc2)n[nH]1 ZINC000454707888 567198212 /nfs/dbraw/zinc/19/82/12/567198212.db2.gz MAACFLWSWJWBRZ-MVZIDQBPSA-N 0 1 377.286 3.424 10 0 GGAEMN C[C@@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(Br)cn1 ZINC000566890389 567199787 /nfs/dbraw/zinc/19/97/87/567199787.db2.gz YHYFUFLLHXEJKB-GFCCVEGCSA-N 0 1 383.311 3.240 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC(Oc2ccncc2)C1 ZINC000589987332 567202201 /nfs/dbraw/zinc/20/22/01/567202201.db2.gz DZPMPDSPPPQWQJ-UHFFFAOYSA-N 0 1 399.248 3.138 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)c(C)c1 ZINC000524630296 567206810 /nfs/dbraw/zinc/20/68/10/567206810.db2.gz IQYVYYNSYANHJU-UHFFFAOYSA-N 0 1 382.869 3.302 10 0 GGAEMN CCC(=O)N1CSC[C@@H]1C(=O)N(C)[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000615816701 567207051 /nfs/dbraw/zinc/20/70/51/567207051.db2.gz OSEXRLFQNHNIBI-QMTHXVAHSA-N 0 1 380.901 3.047 10 0 GGAEMN Cc1ccc(O[C@@H](C)C(=O)N(C)[C@@H]2CN3CCC2CC3)c(Br)c1 ZINC000524694390 567209145 /nfs/dbraw/zinc/20/91/45/567209145.db2.gz MPZONJAKYVXJME-XJKSGUPXSA-N 0 1 381.314 3.077 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1csc(-c2ccccc2Cl)n1 ZINC000590115985 567209899 /nfs/dbraw/zinc/20/98/99/567209899.db2.gz NPUMYRPYTCELAU-ZDUSSCGKSA-N 0 1 379.913 3.304 10 0 GGAEMN CN(C)[C@@H](CNC(=O)[C@H]1CCCN1c1nccs1)c1ccc(Cl)cc1 ZINC000547474554 567213517 /nfs/dbraw/zinc/21/35/17/567213517.db2.gz BAHFYDFWNMFEKP-CVEARBPZSA-N 0 1 378.929 3.184 10 0 GGAEMN CCn1nccc1CCN1CCN(Cc2ccc(Br)cc2)CC1 ZINC000567064262 567213708 /nfs/dbraw/zinc/21/37/08/567213708.db2.gz IZHTTXAQBPFLDV-UHFFFAOYSA-N 0 1 377.330 3.026 10 0 GGAEMN CN(C)[C@H](CNC(=O)[C@H]1CCCN1c1nccs1)c1ccc(Cl)cc1 ZINC000547474556 567213949 /nfs/dbraw/zinc/21/39/49/567213949.db2.gz BAHFYDFWNMFEKP-HZPDHXFCSA-N 0 1 378.929 3.184 10 0 GGAEMN O=C(c1cc(I)ccc1F)N1CCC(c2cnc[nH]2)CC1 ZINC000474965888 567215701 /nfs/dbraw/zinc/21/57/01/567215701.db2.gz KIEAWAFZHNFKRJ-UHFFFAOYSA-N 0 1 399.207 3.173 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN(C)C[C@@H](O)Cc1ccccc1 ZINC000433038075 567217634 /nfs/dbraw/zinc/21/76/34/567217634.db2.gz FJTRKBOJOXTPCK-KRWDZBQOSA-N 0 1 392.293 3.271 10 0 GGAEMN CC[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C[C@]2(CCOC2)O1 ZINC000684626374 567221875 /nfs/dbraw/zinc/22/18/75/567221875.db2.gz XRWBOQPXSNWDMV-LBTNJELSSA-N 0 1 390.307 3.003 10 0 GGAEMN CC1(C)CN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C[C@@]2(CCOC2)O1 ZINC000684627202 567224053 /nfs/dbraw/zinc/22/40/53/567224053.db2.gz RDDZLDKQNAKJLV-RDTXWAMCSA-N 0 1 390.307 3.003 10 0 GGAEMN O=C([O-])[C@@]12C[N@@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C[C@@H]1CCCC2 ZINC000659798597 567226166 /nfs/dbraw/zinc/22/61/66/567226166.db2.gz KAIBLLCPMWKMMH-LXIYXOSZSA-N 0 1 388.291 3.310 10 0 GGAEMN C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)[N@H+]1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000659797858 567226573 /nfs/dbraw/zinc/22/65/73/567226573.db2.gz VDAYNPAMNZFRRR-XQHKEYJVSA-N 0 1 376.280 3.307 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCC[C@H]1c1ccc(Br)cn1 ZINC000616197335 567230969 /nfs/dbraw/zinc/23/09/69/567230969.db2.gz QMMMSYBNJSBSNT-ZBEGNZNMSA-N 0 1 375.270 3.036 10 0 GGAEMN CC[C@@H](C)N1CCN(C(=O)Nc2ccc(Br)c(C(=O)OC)c2)CC1 ZINC000455074945 567231665 /nfs/dbraw/zinc/23/16/65/567231665.db2.gz JXTQNCFTEPGTSW-GFCCVEGCSA-N 0 1 398.301 3.184 10 0 GGAEMN Cc1cc(N2CCC[C@@H](NCc3c(F)cccc3Br)C2)n(C)n1 ZINC000475214490 567233163 /nfs/dbraw/zinc/23/31/63/567233163.db2.gz ZJHJHTQTIQABGC-CYBMUJFWSA-N 0 1 381.293 3.389 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2cccc(C)c2Cl)c(Cl)c1 ZINC000590592289 567234222 /nfs/dbraw/zinc/23/42/22/567234222.db2.gz FVXVNEYYHUOUEY-UHFFFAOYSA-N 0 1 375.233 3.284 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cc3n[nH]cc3c(C)c2)cc1Cl ZINC000499273855 567234604 /nfs/dbraw/zinc/23/46/04/567234604.db2.gz PMKLFJITCSJQEO-UHFFFAOYSA-N 0 1 379.825 3.112 10 0 GGAEMN CCOc1c(Br)cc(C[N@H+]2CC[C@@H](C)[C@@H](C(=O)[O-])C2)cc1OC ZINC000567385951 567241135 /nfs/dbraw/zinc/24/11/35/567241135.db2.gz YEPDAGFOZACJJX-YPMHNXCESA-N 0 1 386.286 3.399 10 0 GGAEMN CC1(C)CCc2sc(NC(=O)C(C[C@@H]3COCCO3)C(F)(F)F)nc21 ZINC000616372767 567241126 /nfs/dbraw/zinc/24/11/26/567241126.db2.gz WHAOCIJKLQBIKL-ZJUUUORDSA-N 0 1 378.416 3.289 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cccc(Br)c2OC)[C@@H]1n1cccn1 ZINC000567372129 567241572 /nfs/dbraw/zinc/24/15/72/567241572.db2.gz XFCPTPYNAZOOCG-XHSDSOJGSA-N 0 1 380.286 3.163 10 0 GGAEMN Cc1cc(C)c(NC(=O)NC[C@@H]2CCCC[N@H+]2CCO)cc1Br ZINC000455196125 567245155 /nfs/dbraw/zinc/24/51/55/567245155.db2.gz QCCRNMFRUXUZCZ-AWEZNQCLSA-N 0 1 384.318 3.034 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)[C@H]2CCc3[nH]cnc3C2)CC1 ZINC000616456493 567247533 /nfs/dbraw/zinc/24/75/33/567247533.db2.gz BLYMSGIITLDIMJ-NSHDSACASA-N 0 1 390.281 3.091 10 0 GGAEMN CCC[C@@H]1CN(C(=O)Cc2ccc(Br)s2)CCN1CCOC ZINC000499441258 567248676 /nfs/dbraw/zinc/24/86/76/567248676.db2.gz IBMBVXYLEFLCKA-CYBMUJFWSA-N 0 1 389.359 3.012 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cnc(C)nc2C2CC2)cc1Br ZINC000685007853 567253764 /nfs/dbraw/zinc/25/37/64/567253764.db2.gz UKQGVMUAKQCRRF-UHFFFAOYSA-N 0 1 398.282 3.234 10 0 GGAEMN C[C@@](CO)(NC(=O)c1[nH]nc2c1CCCCC2)c1ccc(Br)cc1 ZINC000616829052 567257996 /nfs/dbraw/zinc/25/79/96/567257996.db2.gz IQBOOFOCCBNMIX-SFHVURJKSA-N 0 1 392.297 3.079 10 0 GGAEMN CC(=O)Nc1cc(F)c(S(=O)(=O)NCC(F)(F)C(C)(C)C)cc1Cl ZINC000660107067 567260917 /nfs/dbraw/zinc/26/09/17/567260917.db2.gz HTOZHAOFYBXFIN-UHFFFAOYSA-N 0 1 386.823 3.397 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)Nc1ccccc1SCCC(N)=O ZINC000591044914 567261029 /nfs/dbraw/zinc/26/10/29/567261029.db2.gz ZMODEQBRFZLJRL-UHFFFAOYSA-N 0 1 384.910 3.417 10 0 GGAEMN NC(=O)[C@@H](NC[C@H]1CC[C@H](c2ccccc2)O1)c1cccc(Br)c1 ZINC000685192705 567261405 /nfs/dbraw/zinc/26/14/05/567261405.db2.gz FRGILTZMRKULDX-KURKYZTESA-N 0 1 389.293 3.485 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(Br)c1)N1CCC[C@@H](n2ccnc2)C1 ZINC000591081508 567262870 /nfs/dbraw/zinc/26/28/70/567262870.db2.gz DKGWYNGNAIVOMM-CZUORRHYSA-N 0 1 377.286 3.310 10 0 GGAEMN CC1(C)CN(CC2=Cc3cc(Br)ccc3OC2)C[C@@]2(CCOC2)O1 ZINC000475630148 567264003 /nfs/dbraw/zinc/26/40/03/567264003.db2.gz ZTTAJIMWQVWSNQ-LJQANCHMSA-N 0 1 394.309 3.495 10 0 GGAEMN C[C@@H]1C[C@@H]1CNS(=O)(=O)c1scc(Br)c1Br ZINC000433639832 567264859 /nfs/dbraw/zinc/26/48/59/567264859.db2.gz OICYXYCRQTUFGR-PHDIDXHHSA-N 0 1 389.134 3.207 10 0 GGAEMN COc1cc(Cl)ccc1[C@@H](C)NC[C@@H]1CS(=O)(=O)c2ccccc2O1 ZINC000567733540 567272470 /nfs/dbraw/zinc/27/24/70/567272470.db2.gz IQEAHAHRIMBHLB-TZMCWYRMSA-N 0 1 381.881 3.234 10 0 GGAEMN COc1c(Br)c(C)sc1C(=O)NC[C@H]1CCN1C(C)(C)C ZINC000617013084 567274851 /nfs/dbraw/zinc/27/48/51/567274851.db2.gz MYBFEKXIQRFCFG-SNVBAGLBSA-N 0 1 375.332 3.430 10 0 GGAEMN CC(C)(C)N1CC[C@H]1CNC(=O)C1(c2cccc(Br)c2)CC(=O)C1 ZINC000617009220 567275758 /nfs/dbraw/zinc/27/57/58/567275758.db2.gz UVMVIJFLGVGCAQ-HNNXBMFYSA-N 0 1 393.325 3.039 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc3c(C)n[nH]c3c2)c(Br)c1 ZINC000475793785 567276713 /nfs/dbraw/zinc/27/67/13/567276713.db2.gz NZKAZMGTUUPPHP-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc3c(C)[nH]nc3c2)c(Br)c1 ZINC000475793785 567276729 /nfs/dbraw/zinc/27/67/29/567276729.db2.gz NZKAZMGTUUPPHP-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN C[C@H](CNS(=O)(=O)c1ccc2ncsc2c1)N(C)Cc1ccccc1 ZINC000475794400 567277516 /nfs/dbraw/zinc/27/75/16/567277516.db2.gz ZYZPORZAFLOQLM-CQSZACIVSA-N 0 1 375.519 3.095 10 0 GGAEMN COC(=O)c1cc(NC(=O)NCCN2CC=C(C)CC2)ccc1Br ZINC000548081306 567278039 /nfs/dbraw/zinc/27/80/39/567278039.db2.gz MCQPMWXWRRNXKZ-UHFFFAOYSA-N 0 1 396.285 3.009 10 0 GGAEMN CC(C)[C@@H](NCc1coc(S(N)(=O)=O)c1)c1cccc(C(F)(F)F)c1 ZINC000660192483 567278690 /nfs/dbraw/zinc/27/86/90/567278690.db2.gz SSKNUYPUNFAJBI-OAHLLOKOSA-N 0 1 376.400 3.433 10 0 GGAEMN CCc1nc([C@H](C)N[C@@H](C)c2cc3c(cc2Br)OCCO3)n[nH]1 ZINC000660189149 567278977 /nfs/dbraw/zinc/27/89/77/567278977.db2.gz XZGUODJJYTWVQM-UWVGGRQHSA-N 0 1 381.274 3.313 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)Nc2ccc(Br)c(C(=O)OC)c2)C[C@@H]1C ZINC000548081792 567279170 /nfs/dbraw/zinc/27/91/70/567279170.db2.gz LKUAASMFRJCTKA-NWDGAFQWSA-N 0 1 398.301 3.182 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCc3cc(Br)cc(F)c3C2)CC1 ZINC000525983228 567280060 /nfs/dbraw/zinc/28/00/60/567280060.db2.gz QAXKLOGYVKBEMS-UHFFFAOYSA-N 0 1 396.304 3.308 10 0 GGAEMN CC(C)(CNS(=O)(=O)c1ncccc1Br)CC(F)(F)F ZINC000660201069 567280268 /nfs/dbraw/zinc/28/02/68/567280268.db2.gz UHKZADUIUZVCIP-UHFFFAOYSA-N 0 1 375.210 3.101 10 0 GGAEMN CC(C)[C@H](NCc1coc(S(N)(=O)=O)c1)c1ccc(C(F)(F)F)cc1 ZINC000660201806 567280800 /nfs/dbraw/zinc/28/08/00/567280800.db2.gz ZXUKMTBEQYFGMJ-HNNXBMFYSA-N 0 1 376.400 3.433 10 0 GGAEMN COCC[C@@H]1CCCCN(C(=O)[C@](C)(N)c2ccc(Br)cc2)C1 ZINC000567825121 567281082 /nfs/dbraw/zinc/28/10/82/567281082.db2.gz WOHGWINUSTYPIT-KBXCAEBGSA-N 0 1 383.330 3.288 10 0 GGAEMN COCC[C@H]1CCCCN(C(=O)[C@@](C)(N)c2ccc(Br)cc2)C1 ZINC000567825122 567281814 /nfs/dbraw/zinc/28/18/14/567281814.db2.gz WOHGWINUSTYPIT-KDOFPFPSSA-N 0 1 383.330 3.288 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1 ZINC000685589147 567283595 /nfs/dbraw/zinc/28/35/95/567283595.db2.gz YTIONUUEZFFWQE-AWEZNQCLSA-N 0 1 381.567 3.441 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC1(c2ccc(Br)cc2)CCC1 ZINC000685590012 567284216 /nfs/dbraw/zinc/28/42/16/567284216.db2.gz RGEBWBOJQJMNPS-UHFFFAOYSA-N 0 1 389.359 3.090 10 0 GGAEMN O=C(NCCOc1ccccc1F)c1cc(Br)cc2nc[nH]c21 ZINC000499910802 567284221 /nfs/dbraw/zinc/28/42/21/567284221.db2.gz YABRFEGVMPHMRJ-UHFFFAOYSA-N 0 1 378.201 3.273 10 0 GGAEMN COc1ccc([C@H](C)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)c(Cl)c1 ZINC000567857555 567285036 /nfs/dbraw/zinc/28/50/36/567285036.db2.gz IOLXIQUWAKPEFI-GXTWGEPZSA-N 0 1 381.881 3.234 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@]1(c1ccccc1)C(F)(F)F ZINC000685597072 567285472 /nfs/dbraw/zinc/28/54/72/567285472.db2.gz DEGGTFYKUXENLR-MRXNPFEDSA-N 0 1 378.460 3.212 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@H](O)CC12CCC2)c1ccc(Br)cc1 ZINC000567885885 567285776 /nfs/dbraw/zinc/28/57/76/567285776.db2.gz APKGIRXPWMYPTK-BBRMVZONSA-N 0 1 381.314 3.006 10 0 GGAEMN CO[C@H](CCNC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C)C(F)(F)F ZINC000526046587 567286096 /nfs/dbraw/zinc/28/60/96/567286096.db2.gz MAKIKYQMRHHPBN-UONOGXRCSA-N 0 1 381.826 3.209 10 0 GGAEMN CO[C@@H](CCNC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C)C(F)(F)F ZINC000526046586 567286365 /nfs/dbraw/zinc/28/63/65/567286365.db2.gz MAKIKYQMRHHPBN-KGLIPLIRSA-N 0 1 381.826 3.209 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@@H](O)CC12CCC2)c1ccc(Br)cc1 ZINC000567885890 567286538 /nfs/dbraw/zinc/28/65/38/567286538.db2.gz APKGIRXPWMYPTK-XJKSGUPXSA-N 0 1 381.314 3.006 10 0 GGAEMN CCN(CCNC(=O)N[C@@H](c1nccs1)C(F)(F)F)CCC(F)(F)F ZINC000455632029 567286679 /nfs/dbraw/zinc/28/66/79/567286679.db2.gz FGBZLKQSVXUVEN-VIFPVBQESA-N 0 1 392.369 3.320 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@H](c2ccsc2)N(C)C)C[C@H](CC(F)(F)F)O1 ZINC000660313411 567286961 /nfs/dbraw/zinc/28/69/61/567286961.db2.gz XTXROTCKBFWPNV-KWCYVHTRSA-N 0 1 379.448 3.102 10 0 GGAEMN CC(C)C[C@H](CO)N(C)C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1 ZINC000475944077 567289079 /nfs/dbraw/zinc/28/90/79/567289079.db2.gz CISRVJXLDPDFSK-CQSZACIVSA-N 0 1 380.286 3.318 10 0 GGAEMN O=C(Cc1cscc1Br)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000499979862 567289405 /nfs/dbraw/zinc/28/94/05/567289405.db2.gz YRXVUAXAXNITRL-UHFFFAOYSA-N 0 1 391.294 3.197 10 0 GGAEMN COC[C@@H](CN1CCC[C@H]1c1nc(-c2ccccc2Br)no1)OC ZINC000660383188 567290334 /nfs/dbraw/zinc/29/03/34/567290334.db2.gz ZVFVFYDMZICMEW-DOMZBBRYSA-N 0 1 396.285 3.297 10 0 GGAEMN COC[C@@H](CN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1)OC ZINC000660383189 567290843 /nfs/dbraw/zinc/29/08/43/567290843.db2.gz ZVFVFYDMZICMEW-IUODEOHRSA-N 0 1 396.285 3.297 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)[C@H]2CCc3cc(Br)ccc32)C[C@@H](C)O1 ZINC000567945149 567291132 /nfs/dbraw/zinc/29/11/32/567291132.db2.gz IMKIEIFWWNNHDA-LBTNJELSSA-N 0 1 395.341 3.094 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)Nc2ccc(Br)cc2C(=O)OC)C[C@H]1C ZINC000500033780 567291430 /nfs/dbraw/zinc/29/14/30/567291430.db2.gz CJDGQBTUYZAKOW-NEPJUHHUSA-N 0 1 398.301 3.182 10 0 GGAEMN NC(=O)[C@H](NCCc1ccc2ccccc2n1)c1ccc(Br)cc1 ZINC000591690866 567292631 /nfs/dbraw/zinc/29/26/31/567292631.db2.gz TYAQQMRYBYSHQX-GOSISDBHSA-N 0 1 384.277 3.356 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N1CC[C@@H]1c1ccc(Br)cc1 ZINC000660402671 567292785 /nfs/dbraw/zinc/29/27/85/567292785.db2.gz JCCMSJGJBKYVGA-QGZVFWFLSA-N 0 1 396.329 3.018 10 0 GGAEMN COCCN(CC[C@H]1Sc2ccccc2NC1=O)Cc1scnc1C ZINC000660428510 567294529 /nfs/dbraw/zinc/29/45/29/567294529.db2.gz DJEZIIVQGCDHSX-MRXNPFEDSA-N 0 1 377.535 3.403 10 0 GGAEMN CC[C@@H](C)[C@H](C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000591769620 567295323 /nfs/dbraw/zinc/29/53/23/567295323.db2.gz BTEVJMUCSFDGRR-MNOVXSKESA-N 0 1 380.290 3.468 10 0 GGAEMN CC[C@@H](C)[C@H](C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000591769620 567295327 /nfs/dbraw/zinc/29/53/27/567295327.db2.gz BTEVJMUCSFDGRR-MNOVXSKESA-N 0 1 380.290 3.468 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(Cc3cc(Br)ccc3F)CC2)n[nH]1 ZINC000660465066 567296868 /nfs/dbraw/zinc/29/68/68/567296868.db2.gz IDLGKWBKKGNSGN-LBPRGKRZSA-N 0 1 396.308 3.148 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)c1[nH]nc2c1CCC2 ZINC000500089942 567297039 /nfs/dbraw/zinc/29/70/39/567297039.db2.gz ITEJHHKHMCXIEB-UHFFFAOYSA-N 0 1 375.475 3.281 10 0 GGAEMN O=C1N[C@@H]2CCCC[C@@H]2C[C@H]1N[C@@H]1CCOc2c(Br)cccc21 ZINC000660481609 567299023 /nfs/dbraw/zinc/29/90/23/567299023.db2.gz SFIXOJMLXGBNFF-RAEVTNRLSA-N 0 1 379.298 3.310 10 0 GGAEMN O=C1N[C@@H]2CCCC[C@@H]2C[C@@H]1N[C@H]1CCOc2c(Br)cccc21 ZINC000660481607 567299411 /nfs/dbraw/zinc/29/94/11/567299411.db2.gz SFIXOJMLXGBNFF-FWYOQMDTSA-N 0 1 379.298 3.310 10 0 GGAEMN Cc1cc2c(o1)c(C(=O)N1CCC[C@@H](c3nn[nH]n3)C1)ccc2Br ZINC000526946966 567299856 /nfs/dbraw/zinc/29/98/56/567299856.db2.gz DFJYTMIACGWMBR-SNVBAGLBSA-N 0 1 390.241 3.037 10 0 GGAEMN CCc1nc([C@@H](C)N(CCNC(C)=O)Cc2ccc(Cl)cc2Cl)n[nH]1 ZINC000660487053 567301580 /nfs/dbraw/zinc/30/15/80/567301580.db2.gz UEHGPRYFCBVJEK-LLVKDONJSA-N 0 1 384.311 3.373 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000568074512 567303240 /nfs/dbraw/zinc/30/32/40/567303240.db2.gz KTHXGFKLXVIIPL-ZIAGYGMSSA-N 0 1 395.253 3.168 10 0 GGAEMN C[C@H]1CCN(C(=O)c2[nH]nc3ccc(I)cc32)C[C@H]1C ZINC000500165656 567304285 /nfs/dbraw/zinc/30/42/85/567304285.db2.gz CTNCQGRTHINSLR-VHSXEESVSA-N 0 1 383.233 3.286 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3cn[nH]c3)C2=O)ccc1Br ZINC000548298575 567305511 /nfs/dbraw/zinc/30/55/11/567305511.db2.gz MSNYZLQTIXPITM-BLLLJJGKSA-N 0 1 377.286 3.327 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@H](C)c3cn[nH]c3)C2=O)ccc1Br ZINC000548298578 567305715 /nfs/dbraw/zinc/30/57/15/567305715.db2.gz MSNYZLQTIXPITM-WBMJQRKESA-N 0 1 377.286 3.327 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)N[C@@H]1CCCN(C)C1 ZINC000617415901 567306277 /nfs/dbraw/zinc/30/62/77/567306277.db2.gz TZJOCPXQDYMIMR-OAHLLOKOSA-N 0 1 391.313 3.076 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 ZINC000617412844 567306429 /nfs/dbraw/zinc/30/64/29/567306429.db2.gz WDIXPYOXAFJTJM-ZDUSSCGKSA-N 0 1 377.897 3.478 10 0 GGAEMN O[C@]1(CN2CCN(c3ccc(C(F)(F)F)cc3Cl)CC2)CCCOC1 ZINC000660545469 567308236 /nfs/dbraw/zinc/30/82/36/567308236.db2.gz UPLKVAHIOHYYFO-INIZCTEOSA-N 0 1 378.822 3.022 10 0 GGAEMN Cc1ccc(CN[C@@H](c2cnn(C)c2)C2(CO)CCC2)cc1Br ZINC000660597437 567310979 /nfs/dbraw/zinc/31/09/79/567310979.db2.gz BISVMCIFYDQPLA-KRWDZBQOSA-N 0 1 378.314 3.485 10 0 GGAEMN Cc1cc(CN[C@@H](c2cnn(C)c2)C2(CO)CCC2)ccc1Br ZINC000660597536 567311074 /nfs/dbraw/zinc/31/10/74/567311074.db2.gz CJWVDCNUTHWQCR-KRWDZBQOSA-N 0 1 378.314 3.485 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@@H](C)N2CCCCCC2)ccc1Br ZINC000548380897 567312057 /nfs/dbraw/zinc/31/20/57/567312057.db2.gz LOBFGUJQBALAIT-GFCCVEGCSA-N 0 1 383.286 3.439 10 0 GGAEMN C[C@@H](NC[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ncc(Br)cn1 ZINC000660624710 567313829 /nfs/dbraw/zinc/31/38/29/567313829.db2.gz GCJZOPGYNLSKTR-CHWSQXEVSA-N 0 1 383.334 3.174 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(Br)cc3F)[nH]c2c1 ZINC000476328381 567314849 /nfs/dbraw/zinc/31/48/49/567314849.db2.gz DFOLHBHBGUWKLD-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2cc(I)c(C)cc2C)n[nH]1 ZINC000476376985 567319030 /nfs/dbraw/zinc/31/90/30/567319030.db2.gz JSSOHBPWPNEGQR-LLVKDONJSA-N 0 1 397.260 3.301 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@@H](c1cccs1)C(C)(C)CO ZINC000568331939 567319902 /nfs/dbraw/zinc/31/99/02/567319902.db2.gz YFXCPUHWDOTINO-HNNXBMFYSA-N 0 1 380.476 3.444 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3cc(Br)cc(F)c3C2)n[nH]1 ZINC000527226247 567322177 /nfs/dbraw/zinc/32/21/77/567322177.db2.gz DEYDFEBRPMXHQW-SNVBAGLBSA-N 0 1 395.276 3.319 10 0 GGAEMN CN(C)C[C@@H]1CCCN1S(=O)(=O)c1ccc2cc(Br)ccc2c1 ZINC000476420523 567323436 /nfs/dbraw/zinc/32/34/36/567323436.db2.gz DZDMIBUOJAYINX-INIZCTEOSA-N 0 1 397.338 3.317 10 0 GGAEMN CCN(C(=O)CSc1nc(C)nc2sc(C)c(C)c21)[C@@H]1CCN(C)C1 ZINC000617560114 567324181 /nfs/dbraw/zinc/32/41/81/567324181.db2.gz HMLVXIRHEYUILY-CQSZACIVSA-N 0 1 378.567 3.261 10 0 GGAEMN Cc1cc(=O)[nH]c(C(C)(C)NCc2nc3ccc(Br)cc3[nH]2)n1 ZINC000660752814 567324703 /nfs/dbraw/zinc/32/47/03/567324703.db2.gz ZSDZETHGHXHTHZ-UHFFFAOYSA-N 0 1 376.258 3.154 10 0 GGAEMN Brc1ccc2nc(CN3CCC[C@@H](n4ccnn4)CC3)[nH]c2c1 ZINC000639816030 567325212 /nfs/dbraw/zinc/32/52/12/567325212.db2.gz BSJWKHQVZMVVKR-CYBMUJFWSA-N 0 1 375.274 3.144 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCc2cc(Br)cc(F)c2C1 ZINC000527277968 567326239 /nfs/dbraw/zinc/32/62/39/567326239.db2.gz GHEWJENHUCDQQG-UHFFFAOYSA-N 0 1 378.245 3.248 10 0 GGAEMN Cc1cc(C)c(C(=O)N2[C@@H](C)CN(C)C[C@@H]2C)cc1I ZINC000476470194 567326169 /nfs/dbraw/zinc/32/61/69/567326169.db2.gz IOFRFCAAERDHAH-STQMWFEESA-N 0 1 386.277 3.073 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1Cc2ccc(C)c(Br)c2C1 ZINC000660819409 567327174 /nfs/dbraw/zinc/32/71/74/567327174.db2.gz NHMZIPOFMCLZKS-UHFFFAOYSA-N 0 1 377.286 3.447 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)Nc2ccc(C(F)(F)F)c(Br)c2)n1 ZINC000527306153 567329102 /nfs/dbraw/zinc/32/91/02/567329102.db2.gz OBBOVGWCHJRWDJ-UHFFFAOYSA-N 0 1 392.179 3.259 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1conc1C1CC1 ZINC000568453963 567330198 /nfs/dbraw/zinc/33/01/98/567330198.db2.gz QMEHBOAXJKAQIW-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1conc1C1CC1 ZINC000568453963 567330203 /nfs/dbraw/zinc/33/02/03/567330203.db2.gz QMEHBOAXJKAQIW-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)NCc1cc(Cl)cc(Cl)c1OC(F)F ZINC000660876192 567331103 /nfs/dbraw/zinc/33/11/03/567331103.db2.gz IGYISBJVQCAIDH-UHFFFAOYSA-N 0 1 382.238 3.298 10 0 GGAEMN CC(C)c1nn(-c2ccc(Br)cc2)cc1CN[C@H]1CCCNC1=O ZINC000568473331 567331520 /nfs/dbraw/zinc/33/15/20/567331520.db2.gz BSXIWQTTWKNUJZ-INIZCTEOSA-N 0 1 391.313 3.126 10 0 GGAEMN COc1cc(NC(=O)[C@@H]2CCc3[nH]c(C(C)C)nc3C2)ncc1Br ZINC000476535262 567333756 /nfs/dbraw/zinc/33/37/56/567333756.db2.gz NGOIUADNNWNGBA-SNVBAGLBSA-N 0 1 393.285 3.443 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCc2nnn(C(C)(C)C)n2)CC1 ZINC000660903033 567334122 /nfs/dbraw/zinc/33/41/22/567334122.db2.gz UHWQTRRPIXXVSV-UHFFFAOYSA-N 0 1 394.317 3.021 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](CCOc2ccc(Cl)cc2Br)C1 ZINC000568521644 567334206 /nfs/dbraw/zinc/33/42/06/567334206.db2.gz JWRYWHRVRCESMF-RYUDHWBXSA-N 0 1 392.677 3.045 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 ZINC000617776350 567334976 /nfs/dbraw/zinc/33/49/76/567334976.db2.gz QOBSJXWXYBAQOP-ZDUSSCGKSA-N 0 1 379.291 3.485 10 0 GGAEMN FC(F)(F)c1cnc(CN2CCC(CCCN3CCOCC3)CC2)s1 ZINC000434981209 567337263 /nfs/dbraw/zinc/33/72/63/567337263.db2.gz FBCJBMWRTFOMOB-UHFFFAOYSA-N 0 1 377.476 3.486 10 0 GGAEMN C[C@@H]1[C@H](NC(=O)c2ncsc2Br)CCN1Cc1ccccc1 ZINC000568550890 567338035 /nfs/dbraw/zinc/33/80/35/567338035.db2.gz MVXVGQMAICUTCE-DGCLKSJQSA-N 0 1 380.311 3.298 10 0 GGAEMN OC[C@@H]1CN(CCOc2cc(F)cc(Br)c2)C[C@H]1C(F)(F)F ZINC000640044482 567339767 /nfs/dbraw/zinc/33/97/67/567339767.db2.gz UGHAGHCQSDFQHX-TVQRCGJNSA-N 0 1 386.183 3.070 10 0 GGAEMN CCCc1c(NS(=O)(=O)c2c[nH]c(=O)s2)cnn1-c1ccccc1C ZINC000568592245 567341700 /nfs/dbraw/zinc/34/17/00/567341700.db2.gz PSKGUZDDHRYCQC-UHFFFAOYSA-N 0 1 378.479 3.096 10 0 GGAEMN COCc1nc(CNC(=O)[C@H](C)Sc2cc(Cl)ccc2Cl)n[nH]1 ZINC000617937946 567345932 /nfs/dbraw/zinc/34/59/32/567345932.db2.gz GXYCVMYRSURGQE-QMMMGPOBSA-N 0 1 375.281 3.055 10 0 GGAEMN COCc1nnc(CNC(=O)[C@H](C)Sc2cc(Cl)ccc2Cl)[nH]1 ZINC000617937946 567345933 /nfs/dbraw/zinc/34/59/33/567345933.db2.gz GXYCVMYRSURGQE-QMMMGPOBSA-N 0 1 375.281 3.055 10 0 GGAEMN C[C@](N)(C(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccccc1 ZINC000527616488 567348937 /nfs/dbraw/zinc/34/89/37/567348937.db2.gz CVKYXISVQWNZEK-GOSISDBHSA-N 0 1 377.257 3.347 10 0 GGAEMN Cc1n[nH]c(C(=O)NCc2cc(Br)ccc2Br)c1C ZINC000476800917 567350356 /nfs/dbraw/zinc/35/03/56/567350356.db2.gz YKHWHZOZFSPYLF-UHFFFAOYSA-N 0 1 387.075 3.482 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cc(F)ccc3Br)[nH]c2c1 ZINC000435228433 567350515 /nfs/dbraw/zinc/35/05/15/567350515.db2.gz ZIOBCBIZMLIGND-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN Cc1ccc([C@@H](N)C(=O)N2CCc3ccc(F)c(Br)c3C2)cc1 ZINC000527617054 567350800 /nfs/dbraw/zinc/35/08/00/567350800.db2.gz BLEOFOWKTNEUMU-QGZVFWFLSA-N 0 1 377.257 3.481 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCOC[C@@H]1CC(F)F)c1ccc(Cl)cc1 ZINC000548815024 567352741 /nfs/dbraw/zinc/35/27/41/567352741.db2.gz JKDPSWNYGWFUFR-LSDHHAIUSA-N 0 1 375.847 3.008 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)NCC1(c2ccc(Br)s2)CCC1 ZINC000661164494 567352829 /nfs/dbraw/zinc/35/28/29/567352829.db2.gz LOQLBFRJXPNNIY-UHFFFAOYSA-N 0 1 386.359 3.135 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCc3ccc(F)c(Br)c3C2)cn1 ZINC000527628386 567353112 /nfs/dbraw/zinc/35/31/12/567353112.db2.gz OEUQZQUQCPETTB-UHFFFAOYSA-N 0 1 392.272 3.243 10 0 GGAEMN O=C(c1ccccc1)N1CCC(NCc2ncc(Br)cc2F)CC1 ZINC000527632529 567353131 /nfs/dbraw/zinc/35/31/31/567353131.db2.gz JEAAJEAUGCCEFX-UHFFFAOYSA-N 0 1 392.272 3.378 10 0 GGAEMN COC[C@H](NCc1nnc(-c2ccccc2Br)o1)C1CCOCC1 ZINC000661161420 567353330 /nfs/dbraw/zinc/35/33/30/567353330.db2.gz VMOVIEMSOUPYIK-HNNXBMFYSA-N 0 1 396.285 3.030 10 0 GGAEMN C[C@@]1(C2CC2)CN(CCC(=O)Nc2ccc(Br)cc2F)CCO1 ZINC000661171541 567353443 /nfs/dbraw/zinc/35/34/43/567353443.db2.gz XGVSWQVMZJALPK-KRWDZBQOSA-N 0 1 385.277 3.418 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)N1CCc2ccc(F)c(Br)c2C1 ZINC000527628653 567353503 /nfs/dbraw/zinc/35/35/03/567353503.db2.gz RMPNLTAAOJGZAJ-UHFFFAOYSA-N 0 1 381.249 3.004 10 0 GGAEMN C[C@H](CN1CCN(c2ccccn2)CC1)NCc1ccsc1Br ZINC000527660601 567356412 /nfs/dbraw/zinc/35/64/12/567356412.db2.gz FVGSCCJQVSULRM-CQSZACIVSA-N 0 1 395.370 3.206 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)N1CC[C@H]1c1ccc(Br)cc1 ZINC000661204300 567357542 /nfs/dbraw/zinc/35/75/42/567357542.db2.gz HTDDZLMFVLHMFC-BBRMVZONSA-N 0 1 375.270 3.186 10 0 GGAEMN COC[C@](C)(CCO)NCc1cc(Br)c(C)cc1Br ZINC000527670619 567357825 /nfs/dbraw/zinc/35/78/25/567357825.db2.gz PADZDVYPAUWQCM-AWEZNQCLSA-N 0 1 395.135 3.397 10 0 GGAEMN CS(=O)(=O)[C@@H]1CCC[C@H](NCc2ccc(Br)c(F)c2F)C1 ZINC000527665940 567357836 /nfs/dbraw/zinc/35/78/36/567357836.db2.gz RWJOTMCAPYGSAT-WDEREUQCSA-N 0 1 382.270 3.173 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@H](CO)NCc2c(F)ccc(Br)c2F)C1 ZINC000661218537 567357858 /nfs/dbraw/zinc/35/78/58/567357858.db2.gz ZQWZCLUFNLDHOW-RWSFTLGLSA-N 0 1 378.257 3.383 10 0 GGAEMN Cc1cc(Br)c(CN[C@H]2CCC(=O)N(C)C2)cc1Br ZINC000527664754 567358726 /nfs/dbraw/zinc/35/87/26/567358726.db2.gz NXOZDOUDENYFDU-NSHDSACASA-N 0 1 390.119 3.230 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@@H]2CCc3c2ccc(F)c3Br)cn1 ZINC000456281310 567358730 /nfs/dbraw/zinc/35/87/30/567358730.db2.gz VKGHJACUHQRUGG-MRXNPFEDSA-N 0 1 392.272 3.462 10 0 GGAEMN Fc1cc(Br)cnc1CNCCc1csc(N2CCCC2)n1 ZINC000527662966 567358801 /nfs/dbraw/zinc/35/88/01/567358801.db2.gz WRRQMVOFSFBZAY-UHFFFAOYSA-N 0 1 385.306 3.372 10 0 GGAEMN COCCN1CCC[C@@H](NC(=O)c2cc(Br)cc3ccccc32)C1 ZINC000592765432 567360446 /nfs/dbraw/zinc/36/04/46/567360446.db2.gz NEGPTTULVSWRHQ-MRXNPFEDSA-N 0 1 391.309 3.443 10 0 GGAEMN COCCN1CC[C@@H](NC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@H]2C)C1 ZINC000435417717 567361269 /nfs/dbraw/zinc/36/12/69/567361269.db2.gz NBZPFGBPPOQRMW-IUODEOHRSA-N 0 1 386.323 3.343 10 0 GGAEMN C[C@H](CCc1ccc(I)cc1)CC(=O)NCc1cnc[nH]1 ZINC000592767509 567362089 /nfs/dbraw/zinc/36/20/89/567362089.db2.gz YIKRIPGXXJUHJR-GFCCVEGCSA-N 0 1 397.260 3.290 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000618195344 567362438 /nfs/dbraw/zinc/36/24/38/567362438.db2.gz DVOPDDJAAPZEKQ-UHFFFAOYSA-N 0 1 393.281 3.255 10 0 GGAEMN C[C@H]1CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC[C@@H]1C ZINC000501077395 567363229 /nfs/dbraw/zinc/36/32/29/567363229.db2.gz URHMDGKZXFXZIP-RYUDHWBXSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@H]1CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC[C@@H]1C ZINC000501077395 567363233 /nfs/dbraw/zinc/36/32/33/567363233.db2.gz URHMDGKZXFXZIP-RYUDHWBXSA-N 0 1 392.301 3.422 10 0 GGAEMN Cc1cc(Br)c(CN[C@@H](C)C[S@](C)=O)cc1Br ZINC000527691736 567363384 /nfs/dbraw/zinc/36/33/84/567363384.db2.gz NNBJKQOWYISIQJ-XYZCENFISA-N 0 1 383.149 3.377 10 0 GGAEMN Cc1cc(Br)c(CN[C@H](C)C[S@@](C)=O)cc1Br ZINC000527691709 567363601 /nfs/dbraw/zinc/36/36/01/567363601.db2.gz NNBJKQOWYISIQJ-VVVCHXIZSA-N 0 1 383.149 3.377 10 0 GGAEMN OC[C@H](CNCc1ncc(Br)cc1F)Cc1ccc(F)c(F)c1 ZINC000527700768 567365068 /nfs/dbraw/zinc/36/50/68/567365068.db2.gz SEDRLNBVFXWCJT-NSHDSACASA-N 0 1 389.215 3.202 10 0 GGAEMN Cc1cc(Br)c(CN[C@]2(CCO)CCOC2)cc1Br ZINC000527701179 567365317 /nfs/dbraw/zinc/36/53/17/567365317.db2.gz SVWHDGWMDFLRKB-CQSZACIVSA-N 0 1 393.119 3.151 10 0 GGAEMN C[C@H](CCNS(=O)(=O)c1ccccc1)NCc1ncc(C(F)(F)F)s1 ZINC000548991236 567366400 /nfs/dbraw/zinc/36/64/00/567366400.db2.gz KNDGDRMVNBJDLC-LLVKDONJSA-N 0 1 393.456 3.009 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2ccc(Br)c(F)c2F)[C@H]1n1cccn1 ZINC000527711871 567366960 /nfs/dbraw/zinc/36/69/60/567366960.db2.gz BOSWBZPLBKQLNZ-WOSRLPQWSA-N 0 1 386.240 3.432 10 0 GGAEMN CO[C@]1(CO)CCCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000661396918 567370528 /nfs/dbraw/zinc/37/05/28/567370528.db2.gz UFLPFVXLGKRSKX-VEVIJQCQSA-N 0 1 389.323 3.032 10 0 GGAEMN CN(C)[C@@H](CNC(=O)NC[C@H]1CSc2ccccc2O1)c1ccsc1 ZINC000568979050 567370831 /nfs/dbraw/zinc/37/08/31/567370831.db2.gz QFHGMJUPUUDFKT-GJZGRUSLSA-N 0 1 377.535 3.203 10 0 GGAEMN COc1cc(CNC[C@H](n2cccn2)C(F)(F)F)cc(Br)c1O ZINC000527744178 567371796 /nfs/dbraw/zinc/37/17/96/567371796.db2.gz OTILHBRZKXPISZ-LBPRGKRZSA-N 0 1 394.191 3.253 10 0 GGAEMN COc1ccc(CNC[C@@]2(C)COc3ccccc3O2)c(Br)c1O ZINC000527739269 567372385 /nfs/dbraw/zinc/37/23/85/567372385.db2.gz VDBPFJSHWTWNHH-SFHVURJKSA-N 0 1 394.265 3.483 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@](C)(N)c2ccccc2)cc1Br ZINC000569004626 567372559 /nfs/dbraw/zinc/37/25/59/567372559.db2.gz IJTNORQWTPZOHG-GOSISDBHSA-N 0 1 376.298 3.323 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)[C@H](CO)c2cccc(Cl)c2Cl)[nH]1 ZINC000618340062 567373441 /nfs/dbraw/zinc/37/34/41/567373441.db2.gz GRVGXHRWMXZYIO-GFCCVEGCSA-N 0 1 389.308 3.094 10 0 GGAEMN CC(C)(CO)[C@H](NCC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1cccs1 ZINC000569054907 567376510 /nfs/dbraw/zinc/37/65/10/567376510.db2.gz RDLASZMPAKSDCC-IUODEOHRSA-N 0 1 378.460 3.198 10 0 GGAEMN O=C(N[C@@H]1CSCc2ccc(Br)cc21)[C@H]1CCc2[nH]cnc2C1 ZINC000618359857 567377527 /nfs/dbraw/zinc/37/75/27/567377527.db2.gz GJWIOVYGISNTTL-MGPLVRAMSA-N 0 1 392.322 3.381 10 0 GGAEMN C[C@H]1c2ccccc2C[C@H]1N[C@@H](C(N)=O)c1ccc(Br)cc1F ZINC000661518870 567379334 /nfs/dbraw/zinc/37/93/34/567379334.db2.gz HJKLQUWNICFBIZ-LZVXQISVSA-N 0 1 377.257 3.433 10 0 GGAEMN C[C@@H](NC(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(Br)cn1 ZINC000527893884 567381927 /nfs/dbraw/zinc/38/19/27/567381927.db2.gz LBLCOTCFAXVTFG-IUODEOHRSA-N 0 1 381.318 3.221 10 0 GGAEMN C[C@H](NC(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(Br)cn1 ZINC000527893886 567382207 /nfs/dbraw/zinc/38/22/07/567382207.db2.gz LBLCOTCFAXVTFG-SWLSCSKDSA-N 0 1 381.318 3.221 10 0 GGAEMN CN(C(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)[C@H]1CN2CCC1CC2 ZINC000435678993 567382814 /nfs/dbraw/zinc/38/28/14/567382814.db2.gz UYIPWEFNMYOBQK-KRWDZBQOSA-N 0 1 379.291 3.345 10 0 GGAEMN O=S1(=O)C[C@@H](CN[C@H]2CCc3cc(F)c(Cl)cc32)Oc2ccccc21 ZINC000527907753 567383290 /nfs/dbraw/zinc/38/32/90/567383290.db2.gz BEGOXGWVBDPEBJ-WBMJQRKESA-N 0 1 381.856 3.291 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)CSCc2ccc(Cl)cc2Cl)[nH][nH]1 ZINC000435716543 567384145 /nfs/dbraw/zinc/38/41/45/567384145.db2.gz GQYVEVHCMQGGPH-UHFFFAOYSA-N 0 1 396.303 3.411 10 0 GGAEMN CC(C)OCc1nc([C@H](C)NCc2nc3ccc(Br)cc3[nH]2)no1 ZINC000569175558 567384218 /nfs/dbraw/zinc/38/42/18/567384218.db2.gz PHYLCTTXVJHFEY-JTQLQIEISA-N 0 1 394.273 3.484 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)c2cc(Br)cc3ccccc32)[nH][nH]1 ZINC000435716087 567384743 /nfs/dbraw/zinc/38/47/43/567384743.db2.gz ZJFKSFDKPAHGNK-UHFFFAOYSA-N 0 1 396.248 3.400 10 0 GGAEMN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@@H]2C[C@H]1C[S@@]2=O ZINC000593099054 567385077 /nfs/dbraw/zinc/38/50/77/567385077.db2.gz HSZDIXJXIZMLQK-XHQUFGICSA-N 0 1 382.957 3.389 10 0 GGAEMN CCn1c(-c2ccccc2Br)nnc1N1CCN(C2CCC2)CC1 ZINC000549363971 567388456 /nfs/dbraw/zinc/38/84/56/567388456.db2.gz YAHIMQCNDVDAKP-UHFFFAOYSA-N 0 1 390.329 3.402 10 0 GGAEMN O=C([O-])[C@H](c1cccc(Br)c1)[N@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000569238444 567389251 /nfs/dbraw/zinc/38/92/51/567389251.db2.gz QHDJNVZJNOQQST-BPUTZDHNSA-N 0 1 396.306 3.344 10 0 GGAEMN O=C([O-])[C@H](c1cccc(Br)c1)[N@@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000569238444 567389254 /nfs/dbraw/zinc/38/92/54/567389254.db2.gz QHDJNVZJNOQQST-BPUTZDHNSA-N 0 1 396.306 3.344 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)CSCc2cc(-c3cccs3)on2)n[nH]1 ZINC000477338519 567389463 /nfs/dbraw/zinc/38/94/63/567389463.db2.gz NKQQEGRXQNQTPM-SNVBAGLBSA-N 0 1 377.495 3.194 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000528004415 567389805 /nfs/dbraw/zinc/38/98/05/567389805.db2.gz GEMNFTUUJNMCEA-LRXDAGSUSA-N 0 1 388.327 3.069 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)NCCc1nc2ccc(F)cc2[nH]1 ZINC000477375507 567390885 /nfs/dbraw/zinc/39/08/85/567390885.db2.gz GJMBKMWETNIBCE-UHFFFAOYSA-N 0 1 392.228 3.072 10 0 GGAEMN O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000501548789 567395973 /nfs/dbraw/zinc/39/59/73/567395973.db2.gz GOEKSJBRQVLAIJ-UHFFFAOYSA-N 0 1 399.248 3.470 10 0 GGAEMN COc1ccc(OC)c(CNC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000501550664 567396608 /nfs/dbraw/zinc/39/66/08/567396608.db2.gz LWJKQEOTXXSPTQ-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN CO[C@@H]1C[C@H](N(C)C(=O)c2[nH]nc3ccc(Br)cc32)C12CCC2 ZINC000456638897 567397061 /nfs/dbraw/zinc/39/70/61/567397061.db2.gz NWGHEALWTNIMCW-UONOGXRCSA-N 0 1 378.270 3.355 10 0 GGAEMN O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1cc(Br)cc2nc[nH]c21 ZINC000501575640 567398054 /nfs/dbraw/zinc/39/80/54/567398054.db2.gz AOIYHLRUIIDUCJ-CYBMUJFWSA-N 0 1 387.237 3.233 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1CC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000456683273 567401660 /nfs/dbraw/zinc/40/16/60/567401660.db2.gz IEJPXFOHDMEHSB-MADCSZMMSA-N 0 1 379.791 3.177 10 0 GGAEMN COc1cc2nccc(N3CC[C@H]4CC[C@@H](C3)[S@@]4=O)c2cc1Br ZINC000528218426 567402367 /nfs/dbraw/zinc/40/23/67/567402367.db2.gz GDBMJBDKAZZNBE-YCDSQXFLSA-N 0 1 395.322 3.496 10 0 GGAEMN O=C(NCc1cc(F)c(Br)cc1F)N[C@@H]1CCCc2cn[nH]c21 ZINC000528254395 567404216 /nfs/dbraw/zinc/40/42/16/567404216.db2.gz QNKYOFWQRDEZAC-CYBMUJFWSA-N 0 1 385.212 3.327 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)NCCN1CC=CCC1 ZINC000477620235 567404972 /nfs/dbraw/zinc/40/49/72/567404972.db2.gz FOOZCNHXEBQRDQ-UHFFFAOYSA-N 0 1 387.318 3.200 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)CN1CCC(c2ccon2)CC1 ZINC000662043864 567406354 /nfs/dbraw/zinc/40/63/54/567406354.db2.gz MSXINUGLWUMKFK-OAHLLOKOSA-N 0 1 381.270 3.056 10 0 GGAEMN C[C@@H](CNC(=O)c1ccc(CN(C)C)nc1)Oc1ccccc1Br ZINC000549738201 567407687 /nfs/dbraw/zinc/40/76/87/567407687.db2.gz NAWJXOJQZGQLLM-ZDUSSCGKSA-N 0 1 392.297 3.103 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NC[C@@H](O)COc2ccccc2Cl)[C@@H]1O ZINC000569485466 567408381 /nfs/dbraw/zinc/40/83/81/567408381.db2.gz IKZCLQUVESIFNI-JGFGOQIWSA-N 0 1 383.897 3.004 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1F)CN1CCc2ccccc2C1 ZINC000549784445 567410902 /nfs/dbraw/zinc/41/09/02/567410902.db2.gz ACHJSYXPYWRWII-MRXNPFEDSA-N 0 1 380.257 3.386 10 0 GGAEMN COC(=O)[C@H](NS(=O)(=O)Cc1ccc(Cl)cc1Cl)c1cccs1 ZINC000501896459 567412182 /nfs/dbraw/zinc/41/21/82/567412182.db2.gz ZTFDITZUPDMELP-CYBMUJFWSA-N 0 1 394.301 3.389 10 0 GGAEMN COc1ccc(CN2CCC[C@@H](C(=O)NC(C)C)C2)c(Br)c1OC ZINC000662112989 567412684 /nfs/dbraw/zinc/41/26/84/567412684.db2.gz HYFVMFMGGQWLGQ-CQSZACIVSA-N 0 1 399.329 3.203 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000662120213 567412699 /nfs/dbraw/zinc/41/26/99/567412699.db2.gz JGMDGKVQWYIXHG-LBPRGKRZSA-N 0 1 379.302 3.062 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN([C@H](C)C(=O)Nc2ccc(Br)cc2)C1 ZINC000662120013 567412833 /nfs/dbraw/zinc/41/28/33/567412833.db2.gz BSEOJYHIWVMAAV-KGLIPLIRSA-N 0 1 396.329 3.013 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOC[C@@H]1c1cccc(Br)c1 ZINC000618772591 567412970 /nfs/dbraw/zinc/41/29/70/567412970.db2.gz KBDCYNHGALUREH-RHSMWYFYSA-N 0 1 390.281 3.192 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOC[C@H]1c1cccc(Br)c1 ZINC000618772594 567413256 /nfs/dbraw/zinc/41/32/56/567413256.db2.gz KBDCYNHGALUREH-YOEHRIQHSA-N 0 1 390.281 3.192 10 0 GGAEMN COc1cc(Br)c(CN2CCC[C@H](C(=O)NC(C)C)C2)cc1OC ZINC000662117458 567413328 /nfs/dbraw/zinc/41/33/28/567413328.db2.gz GHSPYCKPAGLVIS-ZDUSSCGKSA-N 0 1 399.329 3.203 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOC[C@H]1c1cccc(Br)c1 ZINC000618772589 567413471 /nfs/dbraw/zinc/41/34/71/567413471.db2.gz KBDCYNHGALUREH-PBHICJAKSA-N 0 1 390.281 3.192 10 0 GGAEMN Cc1cccc2sc(C(=O)Nc3nn[nH]c3C(=O)NC3CC3)c(Cl)c21 ZINC000662173240 567414699 /nfs/dbraw/zinc/41/46/99/567414699.db2.gz CEIMMWIGMNDBME-UHFFFAOYSA-N 0 1 375.841 3.126 10 0 GGAEMN Cc1nnc(SCC(=O)N2C[C@@H](c3cccc(Cl)c3)OCC2(C)C)[nH]1 ZINC000618783828 567415068 /nfs/dbraw/zinc/41/50/68/567415068.db2.gz NQRXYMZMBWNMPY-AWEZNQCLSA-N 0 1 380.901 3.237 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2C[C@@H](c3cccc(Cl)c3)OCC2(C)C)n1 ZINC000618783828 567415075 /nfs/dbraw/zinc/41/50/75/567415075.db2.gz NQRXYMZMBWNMPY-AWEZNQCLSA-N 0 1 380.901 3.237 10 0 GGAEMN CC(C)c1nocc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000528363248 567415163 /nfs/dbraw/zinc/41/51/63/567415163.db2.gz JJWHCAQYRUEYHU-UHFFFAOYSA-N 0 1 390.241 3.276 10 0 GGAEMN CC(C)c1nocc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000528363248 567415171 /nfs/dbraw/zinc/41/51/71/567415171.db2.gz JJWHCAQYRUEYHU-UHFFFAOYSA-N 0 1 390.241 3.276 10 0 GGAEMN CC[C@H]1C[C@@H](N=c2nc[nH]c3cc(I)sc32)CCO1 ZINC000593480923 567417796 /nfs/dbraw/zinc/41/77/96/567417796.db2.gz ZBWJKYDBXYUPIV-IUCAKERBSA-N 0 1 389.262 3.087 10 0 GGAEMN CC[C@@H]1C[C@@H](N=c2nc[nH]c3cc(I)sc32)CCO1 ZINC000593480922 567417950 /nfs/dbraw/zinc/41/79/50/567417950.db2.gz ZBWJKYDBXYUPIV-DTWKUNHWSA-N 0 1 389.262 3.087 10 0 GGAEMN CN1CCN(c2cccc(C(=O)NCc3ccc(Cl)cc3Cl)n2)CC1 ZINC000502081132 567419421 /nfs/dbraw/zinc/41/94/21/567419421.db2.gz YIEILVWQHPCIKG-UHFFFAOYSA-N 0 1 379.291 3.070 10 0 GGAEMN CC(C)(C)c1nnc2n1CCN(Cc1nc3ccc(Br)cc3[nH]1)C2 ZINC000662238843 567420396 /nfs/dbraw/zinc/42/03/96/567420396.db2.gz YMOWFEDKRBBXPE-UHFFFAOYSA-N 0 1 389.301 3.230 10 0 GGAEMN Cc1nnc(SCC(=O)Nc2ccc(Br)cc2NC(C)C)[nH]1 ZINC000618883170 567420691 /nfs/dbraw/zinc/42/06/91/567420691.db2.gz KZYYPHGOQVUAIQ-UHFFFAOYSA-N 0 1 384.303 3.427 10 0 GGAEMN Cc1n[nH]c(SCC(=O)Nc2ccc(Br)cc2NC(C)C)n1 ZINC000618883170 567420694 /nfs/dbraw/zinc/42/06/94/567420694.db2.gz KZYYPHGOQVUAIQ-UHFFFAOYSA-N 0 1 384.303 3.427 10 0 GGAEMN CC(C)(CNC(=O)c1cc(Br)cc2nc[nH]c21)C1(O)CCCC1 ZINC000456839471 567420915 /nfs/dbraw/zinc/42/09/15/567420915.db2.gz GIBRBQUZSXPLSH-UHFFFAOYSA-N 0 1 380.286 3.387 10 0 GGAEMN Cc1nc([C@@](C)(NS(=O)(=O)c2cc(Cl)sc2Cl)C2CC2)no1 ZINC000569665480 567422280 /nfs/dbraw/zinc/42/22/80/567422280.db2.gz IVCDSGDBXUWNOP-LBPRGKRZSA-N 0 1 382.294 3.350 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)c2scc(Br)c2Br)C1 ZINC000528434796 567423107 /nfs/dbraw/zinc/42/31/07/567423107.db2.gz CCRUCAMAFFSNGZ-MRVPVSSYSA-N 0 1 396.148 3.487 10 0 GGAEMN Cc1nc([C@@](C)(NCc2nc3ccc(Br)cc3[nH]2)C2CC2)no1 ZINC000569704657 567425814 /nfs/dbraw/zinc/42/58/14/567425814.db2.gz PMIXBAONAABLQQ-INIZCTEOSA-N 0 1 376.258 3.432 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)c1conc1C(C)(C)N ZINC000569707936 567425972 /nfs/dbraw/zinc/42/59/72/567425972.db2.gz NDIIGCVJPPWZCT-SECBINFHSA-N 0 1 382.258 3.131 10 0 GGAEMN CC(C)CN1CCN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000618950573 567426037 /nfs/dbraw/zinc/42/60/37/567426037.db2.gz UOLWHSFYBHPRTP-MRXNPFEDSA-N 0 1 396.329 3.256 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ncoc1C1CC1 ZINC000550110175 567427554 /nfs/dbraw/zinc/42/75/54/567427554.db2.gz LEHMLEOKNYUUPL-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ncoc1C1CC1 ZINC000550110175 567427559 /nfs/dbraw/zinc/42/75/59/567427559.db2.gz LEHMLEOKNYUUPL-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN COCC[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1ccco1 ZINC000502348216 567429980 /nfs/dbraw/zinc/42/99/80/567429980.db2.gz YGEQLJYAYYSVGZ-GFCCVEGCSA-N 0 1 378.226 3.426 10 0 GGAEMN C[N@@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2[O-])[C@@H]1c1ccccc1 ZINC000436524735 567431959 /nfs/dbraw/zinc/43/19/59/567431959.db2.gz KJKBJQGNVUORHO-RDJZCZTQSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2[O-])[C@@H]1c1ccccc1 ZINC000436524735 567431961 /nfs/dbraw/zinc/43/19/61/567431961.db2.gz KJKBJQGNVUORHO-RDJZCZTQSA-N 0 1 375.266 3.330 10 0 GGAEMN CCn1cc(S(=O)(=O)N[C@H](c2ccc(Cl)cc2)C(F)(F)F)nc1C ZINC000502418060 567434253 /nfs/dbraw/zinc/43/42/53/567434253.db2.gz IMWUXWOWWPZKLU-CYBMUJFWSA-N 0 1 381.807 3.447 10 0 GGAEMN CO[C@H]1CCCC[C@H]1C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000550209202 567434397 /nfs/dbraw/zinc/43/43/97/567434397.db2.gz GXWZSLRXXIBMSK-OLZOCXBDSA-N 0 1 379.258 3.378 10 0 GGAEMN O=S(=O)(Cc1cccc(C(F)(F)F)c1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000528547803 567436117 /nfs/dbraw/zinc/43/61/17/567436117.db2.gz IXQIYWJPEBZNDS-MRXNPFEDSA-N 0 1 376.444 3.142 10 0 GGAEMN O=S(=O)(Cc1cccc(C(F)(F)F)c1)NC[C@H]1CCN1C1CCCC1 ZINC000528547803 567436122 /nfs/dbraw/zinc/43/61/22/567436122.db2.gz IXQIYWJPEBZNDS-MRXNPFEDSA-N 0 1 376.444 3.142 10 0 GGAEMN COc1ccc(S(=O)(=O)NC[C@H]2CCN2C2CCCC2)c(Cl)c1Cl ZINC000528556459 567437643 /nfs/dbraw/zinc/43/76/43/567437643.db2.gz ZOJRZACNAFEPSC-GFCCVEGCSA-N 0 1 393.336 3.297 10 0 GGAEMN O=S(=O)(Cc1ccccc1C(F)(F)F)NC[C@H]1CCN1C1CCCC1 ZINC000528555094 567437709 /nfs/dbraw/zinc/43/77/09/567437709.db2.gz VQTPSMNEVFRTDT-OAHLLOKOSA-N 0 1 376.444 3.142 10 0 GGAEMN CCN1CC[C@H]2OCCN(C(=O)c3c(C)c(C)sc3Br)[C@H]2C1 ZINC000502499876 567438343 /nfs/dbraw/zinc/43/83/43/567438343.db2.gz SFGBFIVZPADNOP-QWHCGFSZSA-N 0 1 387.343 3.063 10 0 GGAEMN C[C@@H]1[C@H](C(F)(F)F)OCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000619258582 567441623 /nfs/dbraw/zinc/44/16/23/567441623.db2.gz LTNNITXOJVCFES-JMCQJSRRSA-N 0 1 392.175 3.117 10 0 GGAEMN Cc1cc(Br)c([O-])c(NC(=O)c2cc(C3CC[NH2+]CC3)no2)c1 ZINC000662511483 567442769 /nfs/dbraw/zinc/44/27/69/567442769.db2.gz AMSWXXBUKDZTKO-UHFFFAOYSA-N 0 1 380.242 3.170 10 0 GGAEMN OC[C@@H]1CCC2(CCOCC2)CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000528635821 567443494 /nfs/dbraw/zinc/44/34/94/567443494.db2.gz BTHKPJGKFZGUTN-AWEZNQCLSA-N 0 1 394.313 3.079 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H](C)c1n[nH]c(C)n1 ZINC000502588212 567444019 /nfs/dbraw/zinc/44/40/19/567444019.db2.gz LNHLJYCCJJIGAR-DTWKUNHWSA-N 0 1 382.262 3.006 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H](C)c1n[nH]c(C)n1 ZINC000502588213 567444289 /nfs/dbraw/zinc/44/42/89/567444289.db2.gz LNHLJYCCJJIGAR-IUCAKERBSA-N 0 1 382.262 3.006 10 0 GGAEMN NC(=O)[C@@H](NCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1 ZINC000502649892 567444978 /nfs/dbraw/zinc/44/49/78/567444978.db2.gz FUVOSYJHCYRCIB-HNNXBMFYSA-N 0 1 387.199 3.225 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@H](C)Cc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502633863 567445263 /nfs/dbraw/zinc/44/52/63/567445263.db2.gz BHTMJXMMVCOBJZ-JEBQAFNWSA-N 0 1 385.335 3.494 10 0 GGAEMN CCC[C@@H]1CNCCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000662554984 567447572 /nfs/dbraw/zinc/44/75/72/567447572.db2.gz YAFIJNZJLVCAJP-MRXNPFEDSA-N 0 1 380.330 3.263 10 0 GGAEMN C[C@H](c1ncc(Br)cn1)[N@@H+]1C[C@H](C(=O)[O-])[C@@H](c2ccccc2)C1 ZINC000569971020 567448328 /nfs/dbraw/zinc/44/83/28/567448328.db2.gz BLURCTSKECNURZ-DFBGVHRSSA-N 0 1 376.254 3.100 10 0 GGAEMN C[C@H](c1ncc(Br)cn1)[N@H+]1C[C@H](C(=O)[O-])[C@@H](c2ccccc2)C1 ZINC000569971020 567448335 /nfs/dbraw/zinc/44/83/35/567448335.db2.gz BLURCTSKECNURZ-DFBGVHRSSA-N 0 1 376.254 3.100 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)on1 ZINC000662567204 567449362 /nfs/dbraw/zinc/44/93/62/567449362.db2.gz CCWNKLNYTWURAK-CQSZACIVSA-N 0 1 384.263 3.389 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)on1 ZINC000662567199 567449756 /nfs/dbraw/zinc/44/97/56/567449756.db2.gz CCWNKLNYTWURAK-AWEZNQCLSA-N 0 1 384.263 3.389 10 0 GGAEMN CO[C@@H]1CCC[C@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000550471283 567449804 /nfs/dbraw/zinc/44/98/04/567449804.db2.gz HFDIBLOVNRMPMC-GXTWGEPZSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@@H]1CCC[C@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000550471283 567449811 /nfs/dbraw/zinc/44/98/11/567449811.db2.gz HFDIBLOVNRMPMC-GXTWGEPZSA-N 0 1 393.285 3.056 10 0 GGAEMN CC1(N2CCOCC2)CCN(Cc2c(F)ccc(Br)c2F)CC1 ZINC000528727450 567451411 /nfs/dbraw/zinc/45/14/11/567451411.db2.gz QOXKGOKGJIVZJX-UHFFFAOYSA-N 0 1 389.284 3.414 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662642979 567453837 /nfs/dbraw/zinc/45/38/37/567453837.db2.gz HUQSLOUVFMYNSN-LBPRGKRZSA-N 0 1 380.286 3.382 10 0 GGAEMN Cc1n[nH]c(C(=O)NCc2ccc(I)cc2Cl)c1C ZINC000478501458 567463516 /nfs/dbraw/zinc/46/35/16/567463516.db2.gz MRFUOCAITUDHGY-UHFFFAOYSA-N 0 1 389.624 3.215 10 0 GGAEMN C[C@@](N)(C(=O)N1CCC(c2ccon2)CC1)c1ccc(Br)cc1 ZINC000662713289 567457918 /nfs/dbraw/zinc/45/79/18/567457918.db2.gz OPZFNYAKLPAKKT-KRWDZBQOSA-N 0 1 378.270 3.017 10 0 GGAEMN C[C@@](CO)(NC(=O)c1cc(Br)cc2nc[nH]c21)C1CCCCC1 ZINC000502862685 567459410 /nfs/dbraw/zinc/45/94/10/567459410.db2.gz UESHSEHSNCPMHW-KRWDZBQOSA-N 0 1 380.286 3.387 10 0 GGAEMN C[S@@](=O)Cc1ccccc1NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000502865410 567459538 /nfs/dbraw/zinc/45/95/38/567459538.db2.gz YRPUXHKGTVWNJS-HSZRJFAPSA-N 0 1 392.278 3.456 10 0 GGAEMN COc1ccc(CNC[C@@H]2CS(=O)(=O)c3ccccc32)c(Cl)c1OC ZINC000570129837 567460443 /nfs/dbraw/zinc/46/04/43/567460443.db2.gz XNAYUAJXBBDULE-CYBMUJFWSA-N 0 1 381.881 3.018 10 0 GGAEMN O=C(Cc1cscc1Br)NCc1nc(-c2ccc(F)cc2)n[nH]1 ZINC000550750855 567460697 /nfs/dbraw/zinc/46/06/97/567460697.db2.gz PNLPUAJTOWLLRC-UHFFFAOYSA-N 0 1 395.257 3.294 10 0 GGAEMN O=C(Cc1cscc1Br)NCc1n[nH]c(-c2ccc(F)cc2)n1 ZINC000550750855 567460704 /nfs/dbraw/zinc/46/07/04/567460704.db2.gz PNLPUAJTOWLLRC-UHFFFAOYSA-N 0 1 395.257 3.294 10 0 GGAEMN COC(C)(C)CCN(CCNC(C)=O)Cc1ccc(Br)s1 ZINC000503228902 567475154 /nfs/dbraw/zinc/47/51/54/567475154.db2.gz COQLVLYIYJMUIZ-UHFFFAOYSA-N 0 1 377.348 3.264 10 0 GGAEMN CC[N@@H+]1CC[C@@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C[C@@H]1C ZINC000662743909 567461139 /nfs/dbraw/zinc/46/11/39/567461139.db2.gz WZXTUZKPQNZWEZ-WDEREUQCSA-N 0 1 386.359 3.059 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NCCc2cc(Cl)ccc2Br)on1 ZINC000662806656 567462037 /nfs/dbraw/zinc/46/20/37/567462037.db2.gz SYMOLSQNCNHVSR-UHFFFAOYSA-N 0 1 386.677 3.257 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662796034 567462389 /nfs/dbraw/zinc/46/23/89/567462389.db2.gz HHCIIVOHHADVEW-SECBINFHSA-N 0 1 382.258 3.131 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)on1 ZINC000662812664 567463084 /nfs/dbraw/zinc/46/30/84/567463084.db2.gz VTGKAAHBFZPVEN-XYPYZODXSA-N 0 1 396.260 3.446 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662796036 567463160 /nfs/dbraw/zinc/46/31/60/567463160.db2.gz HHCIIVOHHADVEW-VIFPVBQESA-N 0 1 382.258 3.131 10 0 GGAEMN O=C(NCc1nc2cc(F)ccc2[nH]1)c1cc(Br)cc2nc[nH]c21 ZINC000502981283 567463610 /nfs/dbraw/zinc/46/36/10/567463610.db2.gz JZPSLBFGVWGBHD-UHFFFAOYSA-N 0 1 388.200 3.271 10 0 GGAEMN CCO[C@H]1C[C@H](NC(=O)c2cc(Br)cc3nc[nH]c32)C12CCC2 ZINC000502992665 567463688 /nfs/dbraw/zinc/46/36/88/567463688.db2.gz AATXPYWZBYTWAH-KBPBESRZSA-N 0 1 378.270 3.403 10 0 GGAEMN CC(C)Cn1ccnc1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000502997105 567463753 /nfs/dbraw/zinc/46/37/53/567463753.db2.gz DMMCRBHNEHGTHJ-UHFFFAOYSA-N 0 1 376.258 3.108 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)NC1(c2nnc[nH]2)CCC1 ZINC000619543783 567463776 /nfs/dbraw/zinc/46/37/76/567463776.db2.gz HALYVIQGEDOLPZ-UHFFFAOYSA-N 0 1 399.289 3.135 10 0 GGAEMN Cc1nn(C)c(C)c1C[C@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503030317 567465237 /nfs/dbraw/zinc/46/52/37/567465237.db2.gz PCRAQNIYWSPUTM-VIFPVBQESA-N 0 1 390.285 3.037 10 0 GGAEMN Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503030314 567465334 /nfs/dbraw/zinc/46/53/34/567465334.db2.gz PCRAQNIYWSPUTM-SECBINFHSA-N 0 1 390.285 3.037 10 0 GGAEMN COC[C@H](Cc1ccccc1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503012302 567465444 /nfs/dbraw/zinc/46/54/44/567465444.db2.gz DUBJWXOLPLKSDT-AWEZNQCLSA-N 0 1 388.265 3.313 10 0 GGAEMN CC(C)(N)c1cc(C(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)on1 ZINC000662857256 567466103 /nfs/dbraw/zinc/46/61/03/567466103.db2.gz JFJVEASDISNHSV-UHFFFAOYSA-N 0 1 383.279 3.138 10 0 GGAEMN C[N@@H+]1CC[C@@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000550952573 567469825 /nfs/dbraw/zinc/46/98/25/567469825.db2.gz UBPHDYWEKHGSDL-ZIAGYGMSSA-N 0 1 377.901 3.058 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)N=c2[n-]nc(C3CC3)s2)[C@H]1c1ccc(Cl)cc1 ZINC000550952573 567469831 /nfs/dbraw/zinc/46/98/31/567469831.db2.gz UBPHDYWEKHGSDL-ZIAGYGMSSA-N 0 1 377.901 3.058 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@H]1c1cccc(Br)c1 ZINC000570250165 567470441 /nfs/dbraw/zinc/47/04/41/567470441.db2.gz LMAPZIVLSAFRHC-INIZCTEOSA-N 0 1 389.359 3.258 10 0 GGAEMN Cc1ccc([C@@H](N)C(=O)N2CCOc3cc(Br)ccc3C2)cc1 ZINC000662939615 567470577 /nfs/dbraw/zinc/47/05/77/567470577.db2.gz PZNCOIMLHHOBGT-QGZVFWFLSA-N 0 1 375.266 3.179 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000570252035 567470679 /nfs/dbraw/zinc/47/06/79/567470679.db2.gz BZSPMYSKDDCAPP-DAXOMENPSA-N 0 1 392.297 3.481 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000570252038 567470685 /nfs/dbraw/zinc/47/06/85/567470685.db2.gz BZSPMYSKDDCAPP-MAZHCROVSA-N 0 1 392.297 3.481 10 0 GGAEMN CC[C@H](Cc1ccc(Br)cc1)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662927733 567470695 /nfs/dbraw/zinc/47/06/95/567470695.db2.gz HBCHBGYUTZFHDT-CYBMUJFWSA-N 0 1 380.286 3.382 10 0 GGAEMN C[C@@H](CC(F)(F)F)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000457525025 567471864 /nfs/dbraw/zinc/47/18/64/567471864.db2.gz NSAVGCVGASTURG-QMMMGPOBSA-N 0 1 391.191 3.439 10 0 GGAEMN C[C@@H](CC(F)(F)F)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000457525025 567471867 /nfs/dbraw/zinc/47/18/67/567471867.db2.gz NSAVGCVGASTURG-QMMMGPOBSA-N 0 1 391.191 3.439 10 0 GGAEMN COCC1(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCCC1 ZINC000457530723 567472753 /nfs/dbraw/zinc/47/27/53/567472753.db2.gz SIIPQZVSLQCNGW-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN COCC1(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCCC1 ZINC000457530723 567472758 /nfs/dbraw/zinc/47/27/58/567472758.db2.gz SIIPQZVSLQCNGW-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN Cc1c(Br)cccc1NC(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000528959461 567472859 /nfs/dbraw/zinc/47/28/59/567472859.db2.gz CDAXKDZXZWQVPW-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)N1CCC[C@@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000528977743 567474160 /nfs/dbraw/zinc/47/41/60/567474160.db2.gz BTTCBQSIUBEALP-LBTNJELSSA-N 0 1 389.297 3.351 10 0 GGAEMN C[NH+](C)Cc1ccc(NC(=O)[C@H](C(=O)[O-])C2CCCC2)cc1Br ZINC000663047013 567474776 /nfs/dbraw/zinc/47/47/76/567474776.db2.gz YZWZLFHCWBHZRA-OAHLLOKOSA-N 0 1 383.286 3.340 10 0 GGAEMN O=C(NCCN1CCc2ccccc2C1)c1cc(Br)cc2[nH]cnc21 ZINC000503284822 567478438 /nfs/dbraw/zinc/47/84/38/567478438.db2.gz JMYIMBJFROQZPH-UHFFFAOYSA-N 0 1 399.292 3.114 10 0 GGAEMN O=C(NCCOc1ccc(F)c(F)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503343779 567481498 /nfs/dbraw/zinc/48/14/98/567481498.db2.gz LPOSEEPGMWGHID-UHFFFAOYSA-N 0 1 396.191 3.412 10 0 GGAEMN Cc1nc(C)c(CCNC(=O)c2cc(Br)cc3nc[nH]c32)s1 ZINC000503345333 567481866 /nfs/dbraw/zinc/48/18/66/567481866.db2.gz NSEFFGKQHJJYBM-UHFFFAOYSA-N 0 1 379.283 3.371 10 0 GGAEMN O=S(=O)(NC1CCN(C2CC2)CC1)c1cccc(Br)c1Cl ZINC000551167266 567482857 /nfs/dbraw/zinc/48/28/57/567482857.db2.gz BDHMRBHYLDPATP-UHFFFAOYSA-N 0 1 393.734 3.008 10 0 GGAEMN Ic1cnc(CN[C@@H](C2CC2)[C@H]2CCCCO2)s1 ZINC000594509994 567483983 /nfs/dbraw/zinc/48/39/83/567483983.db2.gz MNHXSMJZVAVDIL-MFKMUULPSA-N 0 1 378.279 3.185 10 0 GGAEMN CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCc1cnc[nH]1 ZINC000478828545 567485818 /nfs/dbraw/zinc/48/58/18/567485818.db2.gz QGJHLJNQFMENGP-OAHLLOKOSA-N 0 1 383.279 3.177 10 0 GGAEMN NC(=O)[C@@H](NC1CCC(OC(F)F)CC1)c1ccc(Br)cc1F ZINC000642707709 567486056 /nfs/dbraw/zinc/48/60/56/567486056.db2.gz JALPAMJTVWEVAD-ZPPKWKGLSA-N 0 1 395.219 3.255 10 0 GGAEMN C[C@@H]1COC2(CCCC2)CN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000619927464 567486854 /nfs/dbraw/zinc/48/68/54/567486854.db2.gz SGEQCWNYZORZHK-LLVKDONJSA-N 0 1 378.270 3.499 10 0 GGAEMN O=C(Nc1cnn(Cc2ccncc2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503465061 567487195 /nfs/dbraw/zinc/48/71/95/567487195.db2.gz UWIMWYWPSHKWAB-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2cc(OC)c(Br)cc2Cl)c1 ZINC000663261531 567487442 /nfs/dbraw/zinc/48/74/42/567487442.db2.gz KLMHAQLMFWMRQY-UHFFFAOYSA-N 0 1 394.678 3.128 10 0 GGAEMN O=S(=O)(N[C@H]1CCCc2cn[nH]c21)c1cccc(Br)c1Cl ZINC000551212479 567488611 /nfs/dbraw/zinc/48/86/11/567488611.db2.gz GTADAYOSCBIIII-JTQLQIEISA-N 0 1 390.690 3.182 10 0 GGAEMN COC(=O)CC1(NCc2cn(-c3cccc(Br)c3)nc2C)CC1 ZINC000594607614 567490199 /nfs/dbraw/zinc/49/01/99/567490199.db2.gz YKVKUYFGXQCUJF-UHFFFAOYSA-N 0 1 378.270 3.129 10 0 GGAEMN CC(=O)N1CCc2cc(S(=O)(=O)Nc3cc(Cl)c(Cl)cn3)ccc21 ZINC000437313762 567491217 /nfs/dbraw/zinc/49/12/17/567491217.db2.gz KBCAGJIHGXMCKM-UHFFFAOYSA-N 0 1 386.260 3.098 10 0 GGAEMN COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503516924 567491416 /nfs/dbraw/zinc/49/14/16/567491416.db2.gz CQMZNIXKNZRTFV-PXAZEXFGSA-N 0 1 394.269 3.177 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)c1cc(F)cc3nn[nH]c31)CC2 ZINC000503538499 567492821 /nfs/dbraw/zinc/49/28/21/567492821.db2.gz IVFCCQZCBOUEDC-UHFFFAOYSA-N 0 1 389.228 3.366 10 0 GGAEMN COC(=O)CCN1CCC[C@H](N[C@@H]2CCSc3ccc(Cl)cc32)C1=O ZINC000594661035 567493901 /nfs/dbraw/zinc/49/39/01/567493901.db2.gz KKLYZOMWIAHDRL-CABCVRRESA-N 0 1 382.913 3.021 10 0 GGAEMN CCOC(=O)[C@@H]1CC[C@H](NCc2cn(-c3cccc(Cl)c3Cl)nn2)C1 ZINC000437342631 567494113 /nfs/dbraw/zinc/49/41/13/567494113.db2.gz JJEMJWIQOCJEKF-NEPJUHHUSA-N 0 1 383.279 3.396 10 0 GGAEMN CCOC(=O)[C@@H]1CC[C@H](NCc2c(Br)cc(OC)cc2OC)C1 ZINC000437337735 567494204 /nfs/dbraw/zinc/49/42/04/567494204.db2.gz MYFFJWPEGCHFEN-NEPJUHHUSA-N 0 1 386.286 3.288 10 0 GGAEMN O=C(Nc1ccc(-c2nc[nH]n2)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000503584191 567495057 /nfs/dbraw/zinc/49/50/57/567495057.db2.gz ZRMGJBLUHXMMSI-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN CC(C)c1nc(C[S@](=O)Cc2ncc(Br)cc2Cl)n[nH]1 ZINC000594675040 567495194 /nfs/dbraw/zinc/49/51/94/567495194.db2.gz JRZFVNMRPDHOCF-HXUWFJFHSA-N 0 1 377.695 3.188 10 0 GGAEMN Cc1csc(C2(N[C@H](C)Cn3cc(Br)ccc3=O)CCC2)n1 ZINC000551294252 567495531 /nfs/dbraw/zinc/49/55/31/567495531.db2.gz NWFYTYXNEAEPAD-LLVKDONJSA-N 0 1 382.327 3.433 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc(N(C)C)nc2)c(Cl)c1Cl ZINC000437390293 567495459 /nfs/dbraw/zinc/49/54/59/567495459.db2.gz GDJZUOZJLXHHFY-UHFFFAOYSA-N 0 1 376.265 3.264 10 0 GGAEMN C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)Nc1ccccc1 ZINC000503594203 567496323 /nfs/dbraw/zinc/49/63/23/567496323.db2.gz KLXQHBYJZDRONU-JTQLQIEISA-N 0 1 387.237 3.082 10 0 GGAEMN C[C@@H](CC(=O)OC(C)(C)C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503594340 567497005 /nfs/dbraw/zinc/49/70/05/567497005.db2.gz MJVQPDFISKZJMI-VIFPVBQESA-N 0 1 382.258 3.176 10 0 GGAEMN CC(=O)NCc1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000503638844 567498031 /nfs/dbraw/zinc/49/80/31/567498031.db2.gz CADUDNSEAUROAE-UHFFFAOYSA-N 0 1 387.237 3.214 10 0 GGAEMN O=C(NC[C@H](CCO)c1ccccc1)c1cc(Br)cc2nc[nH]c21 ZINC000503709782 567503288 /nfs/dbraw/zinc/50/32/88/567503288.db2.gz RRIFWEPVLNDHGK-ZDUSSCGKSA-N 0 1 388.265 3.221 10 0 GGAEMN COc1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1CO ZINC000503725869 567503368 /nfs/dbraw/zinc/50/33/68/567503368.db2.gz XVYPFXIRWIWCLF-UHFFFAOYSA-N 0 1 376.210 3.079 10 0 GGAEMN O=C(NC[C@@H](CCO)c1ccccc1)c1cc(Br)cc2nc[nH]c21 ZINC000503709781 567503450 /nfs/dbraw/zinc/50/34/50/567503450.db2.gz RRIFWEPVLNDHGK-CYBMUJFWSA-N 0 1 388.265 3.221 10 0 GGAEMN Cc1[nH]nc(-c2nc(-c3nc(-c4cccc(Br)c4)n[nH]3)no2)c1C ZINC000551431519 567505588 /nfs/dbraw/zinc/50/55/88/567505588.db2.gz MFDQWVQEYVMKST-UHFFFAOYSA-N 0 1 386.213 3.291 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCNC[C@H]1C(C)C ZINC000529326118 567505778 /nfs/dbraw/zinc/50/57/78/567505778.db2.gz XHRPXSBWWGDEII-DOMZBBRYSA-N 0 1 384.318 3.158 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1nc2ccc(Br)cc2n1C ZINC000551428363 567506174 /nfs/dbraw/zinc/50/61/74/567506174.db2.gz RLQHJMJQPOKWCG-AWEZNQCLSA-N 0 1 393.329 3.217 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCNC[C@H]1C(C)C ZINC000529326122 567506341 /nfs/dbraw/zinc/50/63/41/567506341.db2.gz XHRPXSBWWGDEII-WFASDCNBSA-N 0 1 384.318 3.158 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)cc3cccnc32)C1 ZINC000570730030 567508761 /nfs/dbraw/zinc/50/87/61/567508761.db2.gz WRSMKSNBVGMAPZ-CABCVRRESA-N 0 1 379.254 3.061 10 0 GGAEMN C[C@H](CS(C)(=O)=O)N[C@@H]1CCCSc2ccc(Br)cc21 ZINC000663443300 567508938 /nfs/dbraw/zinc/50/89/38/567508938.db2.gz QPWRUHSLCGTLCS-ZWNOBZJWSA-N 0 1 378.357 3.399 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)C2(c3ccccc3Br)CC2)n[nH]1 ZINC000458030169 567514551 /nfs/dbraw/zinc/51/45/51/567514551.db2.gz QELCTMZTZLQAEW-UHFFFAOYSA-N 0 1 377.286 3.213 10 0 GGAEMN CC[C@H](Cc1ccc(Br)cc1)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000620338136 567514500 /nfs/dbraw/zinc/51/45/00/567514500.db2.gz KZAKAKHJNOFEMM-DZGCQCFKSA-N 0 1 376.298 3.415 10 0 GGAEMN CC[C@H](Cc1ccc(Br)cc1)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000620338138 567514646 /nfs/dbraw/zinc/51/46/46/567514646.db2.gz KZAKAKHJNOFEMM-UKRRQHHQSA-N 0 1 376.298 3.415 10 0 GGAEMN COc1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)c(OC)c1 ZINC000503961376 567516203 /nfs/dbraw/zinc/51/62/03/567516203.db2.gz GAKRBAVZROYQRV-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1C ZINC000503972763 567516255 /nfs/dbraw/zinc/51/62/55/567516255.db2.gz AEHGPXIXCHZETG-UHFFFAOYSA-N 0 1 387.237 3.246 10 0 GGAEMN Cc1ncc(C(=O)N2CCc3cc(Br)c(Br)cc3C2)[nH]1 ZINC000620359662 567519094 /nfs/dbraw/zinc/51/90/94/567519094.db2.gz CSYFUGNYXKZROF-UHFFFAOYSA-N 0 1 399.086 3.442 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000663678595 567520896 /nfs/dbraw/zinc/52/08/96/567520896.db2.gz MXKOMEZYTHUSRR-QWRGUYRKSA-N 0 1 375.357 3.099 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C1 ZINC000620415272 567521545 /nfs/dbraw/zinc/52/15/45/567521545.db2.gz MMYVWTXWTTUPCD-NSHDSACASA-N 0 1 380.901 3.168 10 0 GGAEMN CC(C)=CCCNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000479304806 567523272 /nfs/dbraw/zinc/52/32/72/567523272.db2.gz UYBYETBNXXQIJW-UHFFFAOYSA-N 0 1 378.274 3.390 10 0 GGAEMN CC(C)=CCCNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000479304806 567523275 /nfs/dbraw/zinc/52/32/75/567523275.db2.gz UYBYETBNXXQIJW-UHFFFAOYSA-N 0 1 378.274 3.390 10 0 GGAEMN COc1ccc([C@H](C)NC[C@H]2CS(=O)(=O)c3ccccc3O2)cc1Cl ZINC000570964009 567526938 /nfs/dbraw/zinc/52/69/38/567526938.db2.gz BOVJAKGMGJVWLE-JSGCOSHPSA-N 0 1 381.881 3.234 10 0 GGAEMN CO[C@@H](CNCc1cc(Cl)ccc1I)[C@H]1CCOC1 ZINC000594954425 567529179 /nfs/dbraw/zinc/52/91/79/567529179.db2.gz ZSUDIGVYWKKROF-HZMBPMFUSA-N 0 1 395.668 3.086 10 0 GGAEMN Cc1cc(Br)c(CNC2(CC(N)=O)CCC2)cc1Br ZINC000529547805 567529614 /nfs/dbraw/zinc/52/96/14/567529614.db2.gz LMOGVJZIBNQFDE-UHFFFAOYSA-N 0 1 390.119 3.408 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)c1csc(=NC2CC2)[nH]1 ZINC000504326404 567529905 /nfs/dbraw/zinc/52/99/05/567529905.db2.gz WXZQCBOCTXCNID-LBPRGKRZSA-N 0 1 394.294 3.155 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)c1cccc(-c2nnc[nH]2)c1 ZINC000504324001 567530049 /nfs/dbraw/zinc/53/00/49/567530049.db2.gz IIJWWZHWGSIDPU-HNNXBMFYSA-N 0 1 399.248 3.488 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)c1csc(=NC2CC2)[nH]1 ZINC000504326403 567530179 /nfs/dbraw/zinc/53/01/79/567530179.db2.gz WXZQCBOCTXCNID-GFCCVEGCSA-N 0 1 394.294 3.155 10 0 GGAEMN FC1(F)C[C@H]1OCCNCc1cc(Cl)ccc1I ZINC000594972106 567530504 /nfs/dbraw/zinc/53/05/04/567530504.db2.gz YYEOEEABPDQNJO-LLVKDONJSA-N 0 1 387.595 3.458 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1ccc(OC)c(OC)c1Br ZINC000551720785 567531662 /nfs/dbraw/zinc/53/16/62/567531662.db2.gz IVDXPVFBYUNRPC-CQSZACIVSA-N 0 1 399.329 3.347 10 0 GGAEMN CCn1nc(C)c(CNc2nc3ccc(I)cc3[nH]2)c1C ZINC000595001179 567534126 /nfs/dbraw/zinc/53/41/26/567534126.db2.gz RLCLWRWJORTQTF-UHFFFAOYSA-N 0 1 395.248 3.035 10 0 GGAEMN CCc1nc(C2CCN(c3nc(C4CC4)ncc3Br)CC2)n[nH]1 ZINC000663839580 567535373 /nfs/dbraw/zinc/53/53/73/567535373.db2.gz NMTHXBPSFMGWQW-UHFFFAOYSA-N 0 1 377.290 3.181 10 0 GGAEMN CCc1nnc(C2CCN(c3nc(C4CC4)ncc3Br)CC2)[nH]1 ZINC000663839580 567535375 /nfs/dbraw/zinc/53/53/75/567535375.db2.gz NMTHXBPSFMGWQW-UHFFFAOYSA-N 0 1 377.290 3.181 10 0 GGAEMN CN(C(=O)c1ccc2[nH]nnc2c1)[C@H]1CCOc2ccc(Br)cc21 ZINC000438640232 567538665 /nfs/dbraw/zinc/53/86/65/567538665.db2.gz GJNLGTSJNJHSKD-HNNXBMFYSA-N 0 1 387.237 3.316 10 0 GGAEMN CN(CC(=O)N(C)[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CCSC1 ZINC000438636583 567538987 /nfs/dbraw/zinc/53/89/87/567538987.db2.gz LNAAHNDUOOTRLB-DZGCQCFKSA-N 0 1 399.354 3.168 10 0 GGAEMN COc1cc(CN2CC[C@H]3CC[C@@H](C2)[S@@]3=O)ccc1OCC(F)(F)F ZINC000529673439 567539659 /nfs/dbraw/zinc/53/96/59/567539659.db2.gz IWYMRKXEDDXJMI-PJGQNWHFSA-N 0 1 377.428 3.122 10 0 GGAEMN O=C(NCC1CCN(Cc2ccccc2Cl)CC1)N1C[C@@H]2C[C@H]1CS2 ZINC000458330426 567540573 /nfs/dbraw/zinc/54/05/73/567540573.db2.gz CPOHJPFJDAYXBR-IRXDYDNUSA-N 0 1 379.957 3.451 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NC[C@H]1CCN1Cc1ccccc1 ZINC000620773605 567540965 /nfs/dbraw/zinc/54/09/65/567540965.db2.gz VQYSRUVFMKUPCZ-CQSZACIVSA-N 0 1 379.323 3.444 10 0 GGAEMN CN(C)C(=O)c1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1Cl ZINC000479513717 567541226 /nfs/dbraw/zinc/54/12/26/567541226.db2.gz JLHDDVUDSGYKFN-UHFFFAOYSA-N 0 1 395.893 3.452 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2cccc(-c3ncc(C)o3)c2)cs1 ZINC000438753757 567541569 /nfs/dbraw/zinc/54/15/69/567541569.db2.gz IXGGACWKFAJPMA-UHFFFAOYSA-N 0 1 378.431 3.299 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCO[C@H](CC(F)(F)F)C1 ZINC000620782116 567541537 /nfs/dbraw/zinc/54/15/37/567541537.db2.gz ZBRMIQNDYXZPBO-SECBINFHSA-N 0 1 392.175 3.119 10 0 GGAEMN CCOCc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cc1 ZINC000438723080 567541609 /nfs/dbraw/zinc/54/16/09/567541609.db2.gz KDVGDELKSCBVBK-UHFFFAOYSA-N 0 1 383.853 3.449 10 0 GGAEMN C[C@@H](CN(C)C(=O)c1[nH]nc2ccc(Br)cc21)C(=O)OC(C)(C)C ZINC000458367180 567541996 /nfs/dbraw/zinc/54/19/96/567541996.db2.gz UWOSMZXYGYEHEX-JTQLQIEISA-N 0 1 396.285 3.375 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc3ncsc3c2)c(OC)c1OC ZINC000479522223 567542436 /nfs/dbraw/zinc/54/24/36/567542436.db2.gz BGJYEWRILRBKCS-UHFFFAOYSA-N 0 1 380.447 3.123 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cccc(Br)c2O)C[C@H](CC(F)(F)F)O1 ZINC000620801652 567543457 /nfs/dbraw/zinc/54/34/57/567543457.db2.gz QEAYHFVITAANDZ-BDAKNGLRSA-N 0 1 382.176 3.337 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000571184435 567543845 /nfs/dbraw/zinc/54/38/45/567543845.db2.gz ZBPSPJIDGCCRQA-KKBVYLPWSA-N 0 1 396.329 3.061 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000620807827 567544333 /nfs/dbraw/zinc/54/43/33/567544333.db2.gz ANZZTWMTGAJNBG-DYVFJYSZSA-N 0 1 389.323 3.066 10 0 GGAEMN C[C@H]1CCCCN1CCNC(=O)C1(c2cccc(Br)c2)CC(=O)C1 ZINC000438774835 567544962 /nfs/dbraw/zinc/54/49/62/567544962.db2.gz SEJXQGAJEOOWQM-AWEZNQCLSA-N 0 1 393.325 3.040 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000620807829 567545057 /nfs/dbraw/zinc/54/50/57/567545057.db2.gz ANZZTWMTGAJNBG-SUMWQHHRSA-N 0 1 389.323 3.066 10 0 GGAEMN CC[C@@H](NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(F)F ZINC000458416815 567546375 /nfs/dbraw/zinc/54/63/75/567546375.db2.gz FMLZSNXQTYCBRA-SNVBAGLBSA-N 0 1 388.216 3.077 10 0 GGAEMN CC[C@@H](NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(F)F ZINC000458416815 567546382 /nfs/dbraw/zinc/54/63/82/567546382.db2.gz FMLZSNXQTYCBRA-SNVBAGLBSA-N 0 1 388.216 3.077 10 0 GGAEMN CC(C)(C)c1nc(CS(=O)(=O)Cc2csc(Br)c2)n[nH]1 ZINC000571235884 567547491 /nfs/dbraw/zinc/54/74/91/567547491.db2.gz FZVIPEPISDLSKB-UHFFFAOYSA-N 0 1 378.317 3.041 10 0 GGAEMN CC(C)[C@@H]1C[C@H]1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000458442808 567547814 /nfs/dbraw/zinc/54/78/14/567547814.db2.gz ZJGGAZYFXGQSQD-QWHCGFSZSA-N 0 1 378.274 3.078 10 0 GGAEMN CC(C)[C@@H]1C[C@H]1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000458442808 567547820 /nfs/dbraw/zinc/54/78/20/567547820.db2.gz ZJGGAZYFXGQSQD-QWHCGFSZSA-N 0 1 378.274 3.078 10 0 GGAEMN Fc1cc(CNCc2cccc(N3CCOCC3)n2)ccc1Br ZINC000479597532 567547857 /nfs/dbraw/zinc/54/78/57/567547857.db2.gz DCUZWXASPHZZEH-UHFFFAOYSA-N 0 1 380.261 3.110 10 0 GGAEMN CC[C@@H]1C[C@H]1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000458440351 567548173 /nfs/dbraw/zinc/54/81/73/567548173.db2.gz WWQNMQGAAGRBKM-PWSUYJOCSA-N 0 1 378.274 3.080 10 0 GGAEMN CC[C@@H]1C[C@H]1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000458440351 567548180 /nfs/dbraw/zinc/54/81/80/567548180.db2.gz WWQNMQGAAGRBKM-PWSUYJOCSA-N 0 1 378.274 3.080 10 0 GGAEMN O=C(NC/C=C/c1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000571278308 567550026 /nfs/dbraw/zinc/55/00/26/567550026.db2.gz IJGQFOOAHLZZRM-YUKKFKLSSA-N 0 1 375.270 3.042 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCC[C@@H]2c2ccc(Br)cn2)n[nH]1 ZINC000458541302 567552141 /nfs/dbraw/zinc/55/21/41/567552141.db2.gz ANKDFXLKDHASAW-BDJLRTHQSA-N 0 1 392.301 3.353 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCc2cc(F)c(Br)cc2F)cn1 ZINC000529877264 567552448 /nfs/dbraw/zinc/55/24/48/567552448.db2.gz JDPUNFWANIKFFO-UHFFFAOYSA-N 0 1 384.224 3.114 10 0 GGAEMN NS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(Sc3ccccc3)cc2)C1 ZINC000552043461 567552914 /nfs/dbraw/zinc/55/29/14/567552914.db2.gz NWVZIKXTODYHNJ-QGZVFWFLSA-N 0 1 376.547 3.338 10 0 GGAEMN Cc1cc(Br)ccc1CC(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000529910215 567554614 /nfs/dbraw/zinc/55/46/14/567554614.db2.gz AZBJQJNDTZDPOH-UHFFFAOYSA-N 0 1 395.341 3.013 10 0 GGAEMN Cc1cc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c(C)cc1Br ZINC000529911597 567554768 /nfs/dbraw/zinc/55/47/68/567554768.db2.gz VCRKZCKNZICVQJ-UHFFFAOYSA-N 0 1 395.341 3.393 10 0 GGAEMN Cc1c(Br)cccc1C(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000529912841 567554952 /nfs/dbraw/zinc/55/49/52/567554952.db2.gz AZSHLQUQOTUIFI-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN COC(=O)c1oc(S(=O)(=O)N[C@H]2CCCC[C@H]2CC(F)(F)F)cc1C ZINC000595335766 567555125 /nfs/dbraw/zinc/55/51/25/567555125.db2.gz VPYUKTSODMOBSW-QWRGUYRKSA-N 0 1 383.388 3.164 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)c2cc(Br)cc3[nH]cnc32)n[nH]1 ZINC000505079459 567557655 /nfs/dbraw/zinc/55/76/55/567557655.db2.gz FVWSKJZQKHGZGK-RKDXNWHRSA-N 0 1 391.273 3.448 10 0 GGAEMN C[C@@H](CC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000571373063 567557979 /nfs/dbraw/zinc/55/79/79/567557979.db2.gz UVOCVINYVNQVHQ-CMPLNLGQSA-N 0 1 380.261 3.479 10 0 GGAEMN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1Br ZINC000552097185 567559005 /nfs/dbraw/zinc/55/90/05/567559005.db2.gz VTXJCDPFJDAHCQ-AAEUAGOBSA-N 0 1 393.322 3.053 10 0 GGAEMN CO[C@H](CCNC(=O)c1cc(Br)cc2nc[nH]c21)C(F)(F)F ZINC000505114714 567559704 /nfs/dbraw/zinc/55/97/04/567559704.db2.gz RJMJDIWOXGEPPF-SNVBAGLBSA-N 0 1 380.164 3.023 10 0 GGAEMN O=C(NCc1ccc(OC(F)F)cn1)c1cc(Br)cc2nc[nH]c21 ZINC000505117965 567560309 /nfs/dbraw/zinc/56/03/09/567560309.db2.gz RRFUWFYXOMPBOQ-UHFFFAOYSA-N 0 1 397.179 3.252 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2cc(F)ccc2Cl)[C@@H]1O ZINC000571416579 567560953 /nfs/dbraw/zinc/56/09/53/567560953.db2.gz AJOYZSQUNNSTAC-OCCSQVGLSA-N 0 1 391.873 3.092 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1cn(CC2CC2)nn1)c1ccc(Cl)c(Cl)c1 ZINC000530033641 567563536 /nfs/dbraw/zinc/56/35/36/567563536.db2.gz PYIMUAZNTBKQSI-OAHLLOKOSA-N 0 1 382.295 3.028 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@H]1CCCC12OCCO2)c1ccc(Cl)c(Cl)c1 ZINC000530032930 567564228 /nfs/dbraw/zinc/56/42/28/567564228.db2.gz LRDBIWREKZDSOD-CJNGLKHVSA-N 0 1 387.307 3.256 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)NCc1n[nH]c(C(C)C)n1 ZINC000458686310 567564672 /nfs/dbraw/zinc/56/46/72/567564672.db2.gz FYKLRULYVAWNDJ-JTQLQIEISA-N 0 1 396.289 3.260 10 0 GGAEMN CSc1c(C(=O)Nc2cccc(CN3CCSCC3)c2C)cnn1C ZINC000479907915 567567431 /nfs/dbraw/zinc/56/74/31/567567431.db2.gz CUIGQKCGPLXGAM-UHFFFAOYSA-N 0 1 376.551 3.252 10 0 GGAEMN O=S1(=O)CC[C@@H](N(CCCCc2cccc(Cl)c2)C[C@@H]2CCCO2)C1 ZINC000621271101 567570650 /nfs/dbraw/zinc/57/06/50/567570650.db2.gz XCCGOEXYJKGORX-MOPGFXCFSA-N 0 1 385.957 3.331 10 0 GGAEMN COC(=O)C1(N(Cc2nc3ccc(Br)cc3[nH]2)C2CC2)CCC1 ZINC000595540896 567571091 /nfs/dbraw/zinc/57/10/91/567571091.db2.gz AQWMNZJMDQMBRF-UHFFFAOYSA-N 0 1 378.270 3.386 10 0 GGAEMN NC(=O)[C@@H](NC[C@H]1CCN1C1CCCCC1)c1ccc(Br)cc1F ZINC000530128906 567572069 /nfs/dbraw/zinc/57/20/69/567572069.db2.gz DDMJAOFIEYWJKR-PBHICJAKSA-N 0 1 398.320 3.111 10 0 GGAEMN OC[C@@H](NCc1coc(-c2ccc(I)cc2)n1)C1CCC1 ZINC000595618345 567573812 /nfs/dbraw/zinc/57/38/12/567573812.db2.gz XJLUZUDIAKCYIF-OAHLLOKOSA-N 0 1 398.244 3.197 10 0 GGAEMN CC(C)c1cc(Cl)ccc1NS(=O)(=O)c1ccc(S(C)(=O)=O)nc1 ZINC000530147088 567575100 /nfs/dbraw/zinc/57/51/00/567575100.db2.gz ZJSYMQIUDDLSCO-UHFFFAOYSA-N 0 1 388.898 3.063 10 0 GGAEMN CC(C)c1cc(Cl)ccc1NS(=O)(=O)c1cc(C(=O)N(C)C)n(C)c1 ZINC000530146466 567575236 /nfs/dbraw/zinc/57/52/36/567575236.db2.gz KHOXXGIAMQSDEU-UHFFFAOYSA-N 0 1 383.901 3.305 10 0 GGAEMN CCCOc1cncc(NS(=O)(=O)c2ccc(NC(C)=O)c(Cl)c2)c1 ZINC000530156628 567577725 /nfs/dbraw/zinc/57/77/25/567577725.db2.gz BTDHIHULTZRZEF-UHFFFAOYSA-N 0 1 383.857 3.283 10 0 GGAEMN C[C@H](NCC(=O)Nc1nc2c(s1)CCCC2)[C@H]1OCCc2sccc21 ZINC000644785617 567578466 /nfs/dbraw/zinc/57/84/66/567578466.db2.gz FTXLONOYAUBGAR-APPDUMDISA-N 0 1 377.535 3.314 10 0 GGAEMN FC(F)(F)[C@@H](CN[C@H]1CCCOc2ccc(Cl)cc21)N1CCOCC1 ZINC000552338564 567578807 /nfs/dbraw/zinc/57/88/07/567578807.db2.gz HYHSCAWOXKVHAF-GOEBONIOSA-N 0 1 378.822 3.406 10 0 GGAEMN C[C@H](N[C@H]1CCc2c1cc(Br)cc2F)C1(S(C)(=O)=O)CC1 ZINC000552338954 567578835 /nfs/dbraw/zinc/57/88/35/567578835.db2.gz UQEHYDCRKIJAMB-XPTSAGLGSA-N 0 1 376.291 3.131 10 0 GGAEMN C[C@@H](N[C@@H]1CCc2c1cc(Br)cc2F)C1(S(C)(=O)=O)CC1 ZINC000552338955 567579300 /nfs/dbraw/zinc/57/93/00/567579300.db2.gz UQEHYDCRKIJAMB-YMTOWFKASA-N 0 1 376.291 3.131 10 0 GGAEMN O=C([O-])[C@H]1c2ccoc2CC[N@@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000530171155 567579552 /nfs/dbraw/zinc/57/95/52/567579552.db2.gz WITOHVHUQCQSRO-MEDUHNTESA-N 0 1 386.231 3.010 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)C2(c3cc(F)cc(Br)c3)CC2)n[nH]1 ZINC000552389702 567585406 /nfs/dbraw/zinc/58/54/06/567585406.db2.gz QJYSPEGUGXEISI-JTQLQIEISA-N 0 1 380.261 3.399 10 0 GGAEMN O=S1(=O)C[C@@H](CN[C@@H]2CCSc3ccc(F)cc32)Oc2ccccc21 ZINC000571761666 567586971 /nfs/dbraw/zinc/58/69/71/567586971.db2.gz NHEPFLMHIQYFQF-UKRRQHHQSA-N 0 1 379.478 3.187 10 0 GGAEMN Ic1ccc(CN[C@@H](c2nnc[nH]2)c2ccccc2)cc1 ZINC000439441809 567587224 /nfs/dbraw/zinc/58/72/24/567587224.db2.gz RCKRUOUTBGWUIA-OAHLLOKOSA-N 0 1 390.228 3.289 10 0 GGAEMN C[C@H](O)CN1CCN(c2nnc(-c3cc(Cl)cc(Cl)c3)s2)[C@H](C)C1 ZINC000480197955 567587794 /nfs/dbraw/zinc/58/77/94/567587794.db2.gz HSOURFCNVXKOMT-MNOVXSKESA-N 0 1 387.336 3.403 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@H](c3n[nH]c(=O)o3)C2)c(C)c1Br ZINC000644884137 567588088 /nfs/dbraw/zinc/58/80/88/567588088.db2.gz KOBMNQULWHQCIJ-NSHDSACASA-N 0 1 380.242 3.174 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@@H](c2cncc(Br)c2)C2CC2)cn1 ZINC000552423860 567588206 /nfs/dbraw/zinc/58/82/06/567588206.db2.gz YINZNBXOCRSZKU-QGZVFWFLSA-N 0 1 389.297 3.182 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@@H](c3n[nH]c(=O)o3)C2)c(C)c1Br ZINC000644884136 567588557 /nfs/dbraw/zinc/58/85/57/567588557.db2.gz KOBMNQULWHQCIJ-LLVKDONJSA-N 0 1 380.242 3.174 10 0 GGAEMN NC(=O)[C@@H](N[C@H]1CCc2ccccc2C1)c1ccc(Br)cc1F ZINC000439547641 567591453 /nfs/dbraw/zinc/59/14/53/567591453.db2.gz HRFHHNNKUHBHGX-YOEHRIQHSA-N 0 1 377.257 3.262 10 0 GGAEMN NC(=O)[C@H](N[C@H]1CCc2ccccc2C1)c1ccc(Br)cc1F ZINC000439547636 567591723 /nfs/dbraw/zinc/59/17/23/567591723.db2.gz HRFHHNNKUHBHGX-WMLDXEAASA-N 0 1 377.257 3.262 10 0 GGAEMN Cc1nccc(NC(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1Br ZINC000530354407 567595470 /nfs/dbraw/zinc/59/54/70/567595470.db2.gz CXCSHUWXWIKKSM-WBVHZDCISA-N 0 1 389.297 3.141 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000552536801 567595620 /nfs/dbraw/zinc/59/56/20/567595620.db2.gz VDAGJWLFDLFFJA-CYBMUJFWSA-N 0 1 380.311 3.079 10 0 GGAEMN O=C1c2ccccc2C(=O)N1CCN[C@H]1COc2c1ccc(Cl)c2Cl ZINC000552576507 567598163 /nfs/dbraw/zinc/59/81/63/567598163.db2.gz ZDUDGLPNLAZDKQ-AWEZNQCLSA-N 0 1 377.227 3.313 10 0 GGAEMN COC(=O)c1c(F)ccc(NS(=O)(=O)c2c(F)cccc2Cl)c1F ZINC000571935086 567599189 /nfs/dbraw/zinc/59/91/89/567599189.db2.gz JBKLXXZZVOJRMY-UHFFFAOYSA-N 0 1 379.743 3.345 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)N1CC(Oc2cccc(Cl)c2Cl)C1 ZINC000664925858 567600356 /nfs/dbraw/zinc/60/03/56/567600356.db2.gz DOZPNLMNBMCEIA-JTQLQIEISA-N 0 1 381.263 3.047 10 0 GGAEMN C[C@@H](NC(=O)C(C)(C)c1cnc[nH]1)c1cc2c(cc1Br)OCCO2 ZINC000621677827 567603911 /nfs/dbraw/zinc/60/39/11/567603911.db2.gz GSWVRDHEVORXEN-SNVBAGLBSA-N 0 1 394.269 3.098 10 0 GGAEMN O=C(Nc1nnc(SCc2cccs2)s1)[C@@H]1CCc2[nH]cnc2C1 ZINC000621706500 567605844 /nfs/dbraw/zinc/60/58/44/567605844.db2.gz WIMISMXWMHSUOZ-SECBINFHSA-N 0 1 377.520 3.359 10 0 GGAEMN CCN(C)[C@H](C(=O)N[C@@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552729714 567606106 /nfs/dbraw/zinc/60/61/06/567606106.db2.gz FBRRDNXNHNYXJS-WFASDCNBSA-N 0 1 377.286 3.109 10 0 GGAEMN O=C(Nc1cn(Cc2ccccc2)nn1)c1cc(Br)cc2nc[nH]c21 ZINC000506019917 567608357 /nfs/dbraw/zinc/60/83/57/567608357.db2.gz QJCAIVYGZNOSCW-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN CCOC(=O)CC1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000480503593 567608719 /nfs/dbraw/zinc/60/87/19/567608719.db2.gz SZRHCAGJEAMYIQ-UHFFFAOYSA-N 0 1 380.286 3.491 10 0 GGAEMN Fc1cccc2ncnc(NCc3n[nH]c(-c4ccc(Br)cc4)n3)c12 ZINC000480509745 567608956 /nfs/dbraw/zinc/60/89/56/567608956.db2.gz JHPXKDXSKMIOGY-UHFFFAOYSA-N 0 1 399.227 3.351 10 0 GGAEMN Fc1cccc2ncnc(NCc3nc(-c4ccc(Br)cc4)n[nH]3)c12 ZINC000480509745 567608959 /nfs/dbraw/zinc/60/89/59/567608959.db2.gz JHPXKDXSKMIOGY-UHFFFAOYSA-N 0 1 399.227 3.351 10 0 GGAEMN O=C(NCCc1nc2ccccc2o1)c1cc(Br)cc2nc[nH]c21 ZINC000572059873 567609719 /nfs/dbraw/zinc/60/97/19/567609719.db2.gz NPBSEUARXFUTSE-UHFFFAOYSA-N 0 1 385.221 3.439 10 0 GGAEMN OCCCN1CCC[C@H](N[C@H](c2ccc(Br)cc2)C(F)F)C1 ZINC000621762405 567610606 /nfs/dbraw/zinc/61/06/06/567610606.db2.gz BLBMZVXTZCAKAB-LSDHHAIUSA-N 0 1 377.273 3.192 10 0 GGAEMN OCCN1CCCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621763249 567610632 /nfs/dbraw/zinc/61/06/32/567610632.db2.gz UPXBMJRKXSPKDB-CABCVRRESA-N 0 1 377.273 3.192 10 0 GGAEMN Cn1ccc2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc2c1=O ZINC000552810948 567610683 /nfs/dbraw/zinc/61/06/83/567610683.db2.gz AYIRLNYKKKTRFZ-UHFFFAOYSA-N 0 1 397.232 3.430 10 0 GGAEMN OCCCN1CCC[C@H]1CN[C@H](c1ccc(Br)cc1)C(F)F ZINC000621763472 567610704 /nfs/dbraw/zinc/61/07/04/567610704.db2.gz YHVLWFQNTOZLFW-LSDHHAIUSA-N 0 1 377.273 3.192 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1ccc(Br)cc1Br ZINC000665166669 567611650 /nfs/dbraw/zinc/61/16/50/567611650.db2.gz NEKNBKVRNMCOCE-UHFFFAOYSA-N 0 1 391.107 3.237 10 0 GGAEMN [O-]c1c(F)cc(-c2noc(Cn3c[nH+]c4c3CCCC4)n2)cc1Br ZINC000621808527 567612311 /nfs/dbraw/zinc/61/23/11/567612311.db2.gz MKIZGGWZZUHVSQ-UHFFFAOYSA-N 0 1 393.216 3.467 10 0 GGAEMN Cc1ccc(-c2cc(=NC(=O)c3cc(Br)cc4nc[nH]c43)[nH][nH]2)o1 ZINC000572084726 567612734 /nfs/dbraw/zinc/61/27/34/567612734.db2.gz AWEZWRFCRHWPON-UHFFFAOYSA-N 0 1 386.209 3.291 10 0 GGAEMN Cc1ccc(-c2cc(=NC(=O)c3cc(Br)cc4[nH]cnc43)[nH][nH]2)o1 ZINC000572084726 567612738 /nfs/dbraw/zinc/61/27/38/567612738.db2.gz AWEZWRFCRHWPON-UHFFFAOYSA-N 0 1 386.209 3.291 10 0 GGAEMN CCc1ccc(S(=O)(=O)N2C[C@H]3C[N@@H+](Cc4ccccc4)C[C@H]3C2)s1 ZINC000480600217 567614665 /nfs/dbraw/zinc/61/46/65/567614665.db2.gz INCOLQRQINYRKX-CALCHBBNSA-N 0 1 376.547 3.063 10 0 GGAEMN Cc1[nH]ncc1C1CCN(C(=O)C(=O)c2ccc(Br)cc2)CC1 ZINC000572191603 567619641 /nfs/dbraw/zinc/61/96/41/567619641.db2.gz AWYZWQJUACDNJK-UHFFFAOYSA-N 0 1 376.254 3.070 10 0 GGAEMN CCOc1cc(CNCc2cccnc2N(C)C)cc(Br)c1O ZINC000459378984 567619927 /nfs/dbraw/zinc/61/99/27/567619927.db2.gz SBOIXQHTGNVBHX-UHFFFAOYSA-N 0 1 380.286 3.304 10 0 GGAEMN CCOc1cc(CNCC(=O)NC2CCCCC2)cc(Br)c1O ZINC000459397268 567620105 /nfs/dbraw/zinc/62/01/05/567620105.db2.gz GTQTXGXQPVYVBB-UHFFFAOYSA-N 0 1 385.302 3.092 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)C(C)(C)c1cnc[nH]1 ZINC000621942192 567623291 /nfs/dbraw/zinc/62/32/91/567623291.db2.gz NXGKNUOCVCSVQK-IAQYHMDHSA-N 0 1 380.286 3.342 10 0 GGAEMN CCn1c(CNC(=O)C(C)(C)c2cnc[nH]2)nc2cc(Br)ccc21 ZINC000621971988 567626073 /nfs/dbraw/zinc/62/60/73/567626073.db2.gz NFXFJIUIIKJDCC-UHFFFAOYSA-N 0 1 390.285 3.136 10 0 GGAEMN CC(C)(C(=O)N1CCO[C@@H](c2ccc(F)c(Br)c2)C1)c1c[nH]cn1 ZINC000621958535 567626218 /nfs/dbraw/zinc/62/62/18/567626218.db2.gz NJRIAMKHQUBKMV-CQSZACIVSA-N 0 1 396.260 3.189 10 0 GGAEMN CC(C)(C(=O)N1CCO[C@H](c2ccc(F)c(Br)c2)C1)c1c[nH]cn1 ZINC000621958534 567626344 /nfs/dbraw/zinc/62/63/44/567626344.db2.gz NJRIAMKHQUBKMV-AWEZNQCLSA-N 0 1 396.260 3.189 10 0 GGAEMN CN(C)[C@@H](CNC(=O)CSCC(=O)OC(C)(C)C)c1ccc(Cl)cc1 ZINC000530830891 567627174 /nfs/dbraw/zinc/62/71/74/567627174.db2.gz UYDQDCQTLNQMFU-HNNXBMFYSA-N 0 1 386.945 3.134 10 0 GGAEMN O[C@H]([C@@H]1CCCN1Cc1nc2ccc(Br)cc2[nH]1)C(F)(F)F ZINC000480781037 567630862 /nfs/dbraw/zinc/63/08/62/567630862.db2.gz QEZATQJBJLRIGF-WCQYABFASA-N 0 1 378.192 3.213 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1cc(Br)c2ccccc2c1 ZINC000645491020 567632467 /nfs/dbraw/zinc/63/24/67/567632467.db2.gz JXMKKMJBEUKFIX-UHFFFAOYSA-N 0 1 386.253 3.315 10 0 GGAEMN CCOc1cc(CN2CCCC[C@@H]2CCC(=O)NC)cc(Br)c1O ZINC000459549145 567636011 /nfs/dbraw/zinc/63/60/11/567636011.db2.gz MRCLOUHFLCZMJR-CQSZACIVSA-N 0 1 399.329 3.434 10 0 GGAEMN Brc1ccc2c(ccnc2N2CCN(C[C@@H]3CCCO3)CC2)c1 ZINC000665688856 567636154 /nfs/dbraw/zinc/63/61/54/567636154.db2.gz LLRQGOMOBASVSE-INIZCTEOSA-N 0 1 376.298 3.298 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@@H](C)NC(=O)c2ccc(Br)s2)n1 ZINC000572403491 567636280 /nfs/dbraw/zinc/63/62/80/567636280.db2.gz MHRCKRBKTSRIRM-RKDXNWHRSA-N 0 1 387.303 3.431 10 0 GGAEMN Cc1nnc(SCC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)[nH]1 ZINC000531046430 567639138 /nfs/dbraw/zinc/63/91/38/567639138.db2.gz FRMGDTJSDJQTDO-UHFFFAOYSA-N 0 1 396.498 3.127 10 0 GGAEMN Cc1n[nH]c(SCC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)n1 ZINC000531046430 567639141 /nfs/dbraw/zinc/63/91/41/567639141.db2.gz FRMGDTJSDJQTDO-UHFFFAOYSA-N 0 1 396.498 3.127 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000596622838 567644277 /nfs/dbraw/zinc/64/42/77/567644277.db2.gz JKRZAPCKJZPQPR-SNVBAGLBSA-N 0 1 381.217 3.066 10 0 GGAEMN CCc1[nH]nc(C(=O)N(C)Cc2c(C)cc(C)nc2OC)c1Br ZINC000622262278 567646419 /nfs/dbraw/zinc/64/64/19/567646419.db2.gz MRGTWPPYRRWVGG-UHFFFAOYSA-N 0 1 381.274 3.027 10 0 GGAEMN OC[C@]1(O)CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000459657876 567647524 /nfs/dbraw/zinc/64/75/24/567647524.db2.gz XOLTWTOIMVRXIB-SFHVURJKSA-N 0 1 377.897 3.035 10 0 GGAEMN CC[C@H](C)c1nc([C@H](C)NC(=O)Cc2ccc(Br)cc2O)n[nH]1 ZINC000506863205 567647658 /nfs/dbraw/zinc/64/76/58/567647658.db2.gz VSPZDCHYQLFQKX-UWVGGRQHSA-N 0 1 381.274 3.206 10 0 GGAEMN COCCN1CC[C@@H](NC(=O)N2CCC[C@H]2c2ccc(Br)cc2)C1 ZINC000531228839 567647798 /nfs/dbraw/zinc/64/77/98/567647798.db2.gz YDPAKPXCFPYESX-SJORKVTESA-N 0 1 396.329 3.016 10 0 GGAEMN C[C@@H]1CCC[C@@H](C)N1CCNS(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000481014484 567651674 /nfs/dbraw/zinc/65/16/74/567651674.db2.gz ONUDSNOBOPXZFI-ZIAGYGMSSA-N 0 1 378.460 3.333 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)N[C@@H]1COc2c1cccc2Cl ZINC000666108024 567654181 /nfs/dbraw/zinc/65/41/81/567654181.db2.gz MOUQWYVIFKUQED-QMTHXVAHSA-N 0 1 383.673 3.376 10 0 GGAEMN CC(C)[C@H](NC(=O)c1cccc(Br)c1O)c1nnc2ccccn21 ZINC000531360519 567655875 /nfs/dbraw/zinc/65/58/75/567655875.db2.gz VMWRMQAQEDHKMF-AWEZNQCLSA-N 0 1 389.253 3.325 10 0 GGAEMN COCc1nc(CNC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000666122309 567656297 /nfs/dbraw/zinc/65/62/97/567656297.db2.gz LPDMUMQNINQFFF-CYBMUJFWSA-N 0 1 384.267 3.305 10 0 GGAEMN COCc1nnc(CNC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000666122309 567656304 /nfs/dbraw/zinc/65/63/04/567656304.db2.gz LPDMUMQNINQFFF-CYBMUJFWSA-N 0 1 384.267 3.305 10 0 GGAEMN C[C@@H](NCCCOc1cccc(I)c1)c1ccn(C)n1 ZINC000459771684 567658412 /nfs/dbraw/zinc/65/84/12/567658412.db2.gz ZCXJJWNNYVVVTG-GFCCVEGCSA-N 0 1 385.249 3.144 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(OC(C)C)nc2)cc1Cl ZINC000441337734 567660616 /nfs/dbraw/zinc/66/06/16/567660616.db2.gz VFBLAYUJZUEKTC-UHFFFAOYSA-N 0 1 384.841 3.110 10 0 GGAEMN COC(=O)[C@H](NCc1nc2ccc(Br)cc2[nH]1)c1cccc(O)c1 ZINC000481178607 567660945 /nfs/dbraw/zinc/66/09/45/567660945.db2.gz WWJNAAOMHNQPGW-MRXNPFEDSA-N 0 1 390.237 3.035 10 0 GGAEMN COC(=O)[C@@H](NCc1nc2ccc(Br)cc2[nH]1)c1cccc(O)c1 ZINC000481178606 567661389 /nfs/dbraw/zinc/66/13/89/567661389.db2.gz WWJNAAOMHNQPGW-INIZCTEOSA-N 0 1 390.237 3.035 10 0 GGAEMN CCC[C@H](NCc1ccc(S(N)(=O)=O)c(Br)c1)c1ccccn1 ZINC000666260113 567661747 /nfs/dbraw/zinc/66/17/47/567661747.db2.gz WUZIJIYQLBRFMN-AWEZNQCLSA-N 0 1 398.326 3.123 10 0 GGAEMN CCC[C@@H](NCc1ccc(S(N)(=O)=O)c(Br)c1)c1ccccn1 ZINC000666260114 567661979 /nfs/dbraw/zinc/66/19/79/567661979.db2.gz WUZIJIYQLBRFMN-CQSZACIVSA-N 0 1 398.326 3.123 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000441514004 567667060 /nfs/dbraw/zinc/66/70/60/567667060.db2.gz OYYFBUFYDZDSPM-AWEZNQCLSA-N 0 1 378.270 3.334 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000441516547 567667359 /nfs/dbraw/zinc/66/73/59/567667359.db2.gz ULQWKQRVUKYSMV-AWEZNQCLSA-N 0 1 378.270 3.334 10 0 GGAEMN O=C(N[C@@H]1COc2ccc(F)cc2C1)c1n[nH]c2ccc(Br)cc21 ZINC000572808103 567667810 /nfs/dbraw/zinc/66/78/10/567667810.db2.gz YVKCOHPZPVSUOX-LBPRGKRZSA-N 0 1 390.212 3.198 10 0 GGAEMN C[C@H](CNS(=O)(=O)c1cc(F)c(Br)cc1F)CC(F)F ZINC000645795019 567668802 /nfs/dbraw/zinc/66/88/02/567668802.db2.gz HTGLQQQMPWDJOX-LURJTMIESA-N 0 1 378.185 3.297 10 0 GGAEMN Cc1sc(Br)c(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c1C ZINC000441608699 567670621 /nfs/dbraw/zinc/67/06/21/567670621.db2.gz CIYWSHOSDAJSOB-UHFFFAOYSA-N 0 1 393.266 3.355 10 0 GGAEMN Cc1nc([C@H](C)NC(=O)N[C@H]2CSCc3ccc(Br)cc32)n[nH]1 ZINC000666400083 567672239 /nfs/dbraw/zinc/67/22/39/567672239.db2.gz AWJNMUKSESYFBS-SDBXPKJASA-N 0 1 396.314 3.224 10 0 GGAEMN O=C(NCCN1CCCCC1)c1c(F)c(F)c(Br)c(F)c1F ZINC000666424139 567675864 /nfs/dbraw/zinc/67/58/64/567675864.db2.gz FWIFYVVPWWOUFC-UHFFFAOYSA-N 0 1 383.183 3.221 10 0 GGAEMN OCC[C@@H]1CSCCN1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000441897474 567678154 /nfs/dbraw/zinc/67/81/54/567678154.db2.gz FQFILNWKTVHICM-MRXNPFEDSA-N 0 1 394.338 3.206 10 0 GGAEMN CC1=CCN(CCNC(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000460213047 567678988 /nfs/dbraw/zinc/67/89/88/567678988.db2.gz HSOPNPAXCDBBJK-UHFFFAOYSA-N 0 1 386.323 3.149 10 0 GGAEMN CC(=O)NCCN(CCC[C@@H]1CCOC1)Cc1ccc(Br)s1 ZINC000645898056 567679841 /nfs/dbraw/zinc/67/98/41/567679841.db2.gz RKWSDFCSNOYAEQ-CQSZACIVSA-N 0 1 389.359 3.265 10 0 GGAEMN COC(=O)[C@@](C)(CNCc1c(F)cncc1Br)c1ccccc1 ZINC000597110071 567681782 /nfs/dbraw/zinc/68/17/82/567681782.db2.gz JIFPJMAPKIHPSY-KRWDZBQOSA-N 0 1 381.245 3.204 10 0 GGAEMN COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1c(F)cncc1Br ZINC000597120323 567683190 /nfs/dbraw/zinc/68/31/90/567683190.db2.gz FKJDHHJREKLEIW-OCCSQVGLSA-N 0 1 395.272 3.493 10 0 GGAEMN O[C@@H](CCNCc1cc(Cl)ccc1I)C(F)(F)F ZINC000597127504 567684248 /nfs/dbraw/zinc/68/42/48/567684248.db2.gz HLDWPBIBWHROPG-JTQLQIEISA-N 0 1 393.574 3.348 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@@H](NCc1nn(C)cc1Br)CC3 ZINC000573059089 567684733 /nfs/dbraw/zinc/68/47/33/567684733.db2.gz QJCHTYZONDBCKA-NSHDSACASA-N 0 1 389.297 3.320 10 0 GGAEMN C[C@@H](NC(=O)c1cccc(Br)c1O)c1cn(-c2ccccc2)nn1 ZINC000531880591 567685641 /nfs/dbraw/zinc/68/56/41/567685641.db2.gz DDUGHMJCHJLYHW-LLVKDONJSA-N 0 1 387.237 3.226 10 0 GGAEMN CC(C)c1noc(CCCNS(=O)(=O)c2c(Cl)ccc(F)c2F)n1 ZINC000553798424 567685857 /nfs/dbraw/zinc/68/58/57/567685857.db2.gz OGZMKFRYXLPHSI-UHFFFAOYSA-N 0 1 379.816 3.036 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCC(=O)N2CCC[C@H]2C)CC1 ZINC000645974321 567686020 /nfs/dbraw/zinc/68/60/20/567686020.db2.gz PJIAIZIACCNKHF-CYBMUJFWSA-N 0 1 381.314 3.437 10 0 GGAEMN C[N@H+]1CCCN(C(=O)NCC2(Cc3ccc(Br)cc3)CC2)CC1 ZINC000666551235 567686056 /nfs/dbraw/zinc/68/60/56/567686056.db2.gz QLKDLMWHVVJRHJ-UHFFFAOYSA-N 0 1 380.330 3.119 10 0 GGAEMN COCCOc1c(Cl)cc(NC(=O)N(C)CC2CN(C)C2)cc1Cl ZINC000666549520 567686111 /nfs/dbraw/zinc/68/61/11/567686111.db2.gz XBESEWRWORMWQQ-UHFFFAOYSA-N 0 1 376.284 3.044 10 0 GGAEMN OC1([C@H]2CCCC[N@H+]2Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000573081618 567686445 /nfs/dbraw/zinc/68/64/45/567686445.db2.gz PCFGLLIPMSBDMB-CQSZACIVSA-N 0 1 378.270 3.379 10 0 GGAEMN OC1([C@H]2CCCCN2Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000573081618 567686452 /nfs/dbraw/zinc/68/64/52/567686452.db2.gz PCFGLLIPMSBDMB-CQSZACIVSA-N 0 1 378.270 3.379 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCC(=O)Nc2cccnc2)CC1 ZINC000645973899 567687124 /nfs/dbraw/zinc/68/71/24/567687124.db2.gz YCRAIUNZLBVMHT-UHFFFAOYSA-N 0 1 390.281 3.460 10 0 GGAEMN CC1=CC[N@@H+](CCNC(=O)N=c2[n-]nc(-c3cccc(Cl)c3)s2)CC1 ZINC000481558628 567687848 /nfs/dbraw/zinc/68/78/48/567687848.db2.gz OURPCYPDYYZTLS-UHFFFAOYSA-N 0 1 377.901 3.054 10 0 GGAEMN Cc1cc(Br)c(CNC(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)s1 ZINC000666640882 567691217 /nfs/dbraw/zinc/69/12/17/567691217.db2.gz YRWDTAAFZNHYPA-GXTWGEPZSA-N 0 1 386.359 3.445 10 0 GGAEMN C[C@H]1Cc2c[nH]nc2[C@@H](C(=O)N2CCOc3cc(Br)ccc3C2)C1 ZINC000623226761 567692096 /nfs/dbraw/zinc/69/20/96/567692096.db2.gz LRULRCPFRUOQCY-NHYWBVRUSA-N 0 1 390.281 3.259 10 0 GGAEMN CN(C)[C@@H]1CCc2cc(Br)ccc2N(S(=O)(=O)c2ccoc2)C1 ZINC000623230306 567692474 /nfs/dbraw/zinc/69/24/74/567692474.db2.gz WRUJQNZNPGYFHV-CQSZACIVSA-N 0 1 399.310 3.114 10 0 GGAEMN O=C(NC1CCN(Cc2ccc(F)cc2)CC1)c1ncsc1Br ZINC000573157595 567692716 /nfs/dbraw/zinc/69/27/16/567692716.db2.gz IUVYSLHTBUPCEO-UHFFFAOYSA-N 0 1 398.301 3.439 10 0 GGAEMN CC(C)n1ncc2c1C[C@@H](NS(=O)(=O)c1c(Cl)ccc(F)c1F)CC2 ZINC000553867598 567693485 /nfs/dbraw/zinc/69/34/85/567693485.db2.gz QNSMDWJAGREMTK-NSHDSACASA-N 0 1 389.855 3.231 10 0 GGAEMN NS(=O)(=O)C[C@@H]1CCCN1Cc1cccc(SCc2ccccc2)c1 ZINC000553888570 567696223 /nfs/dbraw/zinc/69/62/23/567696223.db2.gz IZKCJFNPMMIURP-SFHVURJKSA-N 0 1 376.547 3.232 10 0 GGAEMN C[C@@](N)(C(=O)NCc1ccn(C2CCCC2)n1)c1ccc(Br)cc1 ZINC000573204102 567696539 /nfs/dbraw/zinc/69/65/39/567696539.db2.gz IHUKREDDMHUJJP-SFHVURJKSA-N 0 1 391.313 3.251 10 0 GGAEMN O=C(N[C@@H]1CCN(C(=O)C2CCCCC2)C1)c1cccc(Br)c1O ZINC000532131957 567699165 /nfs/dbraw/zinc/69/91/65/567699165.db2.gz IMXSIMSWEBAQRH-CYBMUJFWSA-N 0 1 395.297 3.066 10 0 GGAEMN CCOC(=O)C[C@H]1C[C@H](OC)CN1CCCc1ccccc1Br ZINC000481737746 567699343 /nfs/dbraw/zinc/69/93/43/567699343.db2.gz PQOOFNDIVROONA-CVEARBPZSA-N 0 1 384.314 3.424 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1 ZINC000460718432 567699399 /nfs/dbraw/zinc/69/93/99/567699399.db2.gz LEWYCWYWCAYYOB-ZIAGYGMSSA-N 0 1 383.330 3.237 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1ccnn1Cc1c(Cl)cccc1Cl ZINC000666803259 567703998 /nfs/dbraw/zinc/70/39/98/567703998.db2.gz YOGBZNLTAWBLFU-UHFFFAOYSA-N 0 1 382.295 3.264 10 0 GGAEMN COc1cccc([C@@H]2CN(C(=O)c3cccc(Br)c3O)CCO2)c1 ZINC000532266519 567705576 /nfs/dbraw/zinc/70/55/76/567705576.db2.gz VWSHKXVBRARQGR-INIZCTEOSA-N 0 1 392.249 3.377 10 0 GGAEMN O=S(=O)(Nc1cccc2ccncc21)c1cc2c(cc1Cl)OCCO2 ZINC000532290986 567707016 /nfs/dbraw/zinc/70/70/16/567707016.db2.gz LLRVSJIBVOXHKS-UHFFFAOYSA-N 0 1 376.821 3.460 10 0 GGAEMN CC(C)[C@H]1CN(C)CCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507809706 567708663 /nfs/dbraw/zinc/70/86/63/567708663.db2.gz SFIIOJAHQQYCFF-JKSUJKDBSA-N 0 1 396.329 3.254 10 0 GGAEMN CO[C@H]1CCCC[C@@H]1N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000442809026 567709450 /nfs/dbraw/zinc/70/94/50/567709450.db2.gz IYHNKJGJWHEIHJ-IIMNLJJBSA-N 0 1 381.325 3.249 10 0 GGAEMN O=S(=O)(Nc1ccc(OC(F)(F)F)cc1O)c1ccc2c(c1)CCO2 ZINC000442835911 567710804 /nfs/dbraw/zinc/71/08/04/567710804.db2.gz FXJLEAQBGRHUEZ-UHFFFAOYSA-N 0 1 375.324 3.027 10 0 GGAEMN COCc1ccccc1S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1O ZINC000442839824 567711445 /nfs/dbraw/zinc/71/14/45/567711445.db2.gz YMSLTCCWLDUDOZ-UHFFFAOYSA-N 0 1 377.340 3.238 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)N1CCN2CCC1CC2 ZINC000507872359 567712117 /nfs/dbraw/zinc/71/21/17/567712117.db2.gz JEKQSOFQIGUZTD-UHFFFAOYSA-N 0 1 387.318 3.128 10 0 GGAEMN O=C(c1cc(C(F)(F)F)ccc1Br)N1CCN2CCC1CC2 ZINC000507874555 567712131 /nfs/dbraw/zinc/71/21/31/567712131.db2.gz QGNYFWQDWINQHQ-UHFFFAOYSA-N 0 1 377.204 3.388 10 0 GGAEMN O=S(=O)(Nc1ccc(OC(F)(F)F)cc1O)c1ccc2c(c1)COC2 ZINC000442844501 567712617 /nfs/dbraw/zinc/71/26/17/567712617.db2.gz VUUQKOSQRNFVIA-UHFFFAOYSA-N 0 1 375.324 3.122 10 0 GGAEMN CCC[C@@H](NCCNS(=O)(=O)c1ccc(Cl)cc1F)c1ccccn1 ZINC000442874772 567713657 /nfs/dbraw/zinc/71/36/57/567713657.db2.gz VAEMUUCMIZULAF-OAHLLOKOSA-N 0 1 385.892 3.283 10 0 GGAEMN CC[C@H](NC(=O)C(=O)N1CCC(c2cnc[nH]2)CC1)c1ccc(Cl)s1 ZINC000554160769 567714079 /nfs/dbraw/zinc/71/40/79/567714079.db2.gz SUVSJTWCGCCACW-LBPRGKRZSA-N 0 1 380.901 3.098 10 0 GGAEMN COCc1ccc(OC)c(S(=O)(=O)Nc2ccc(C(C)=O)c(Cl)c2)c1 ZINC000507903375 567715154 /nfs/dbraw/zinc/71/51/54/567715154.db2.gz FLKAQIMMNUYGJH-UHFFFAOYSA-N 0 1 383.853 3.498 10 0 GGAEMN CCC(CC)c1nnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)s1 ZINC000666969443 567715409 /nfs/dbraw/zinc/71/54/09/567715409.db2.gz RIRYPBCZHLSFPY-GHMZBOCLSA-N 0 1 381.420 3.364 10 0 GGAEMN COc1ccc([C@H](N[C@@H]2CCCNC2=O)c2ccccc2)cc1Br ZINC000532441499 567716853 /nfs/dbraw/zinc/71/68/53/567716853.db2.gz TYPXNGYARYVXIQ-SJLPKXTDSA-N 0 1 389.293 3.415 10 0 GGAEMN Cc1cc(CN[C@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)ncc1Br ZINC000623513633 567717974 /nfs/dbraw/zinc/71/79/74/567717974.db2.gz GLIARSRPWKLXEP-KSSFIOAISA-N 0 1 388.309 3.432 10 0 GGAEMN C[C@@H](CCc1ccc(Br)cc1)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000667033587 567720205 /nfs/dbraw/zinc/72/02/05/567720205.db2.gz UGSWFECFOOMVLV-GXTWGEPZSA-N 0 1 376.298 3.415 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2csc(C(F)(F)F)c2)Oc2ccccc21 ZINC000623556656 567722110 /nfs/dbraw/zinc/72/21/10/567722110.db2.gz RJXHCBQZJAHLNU-NSHDSACASA-N 0 1 377.409 3.091 10 0 GGAEMN FC(F)(F)[C@H](CNCc1cc2c(c(Br)c1)OCO2)n1cccn1 ZINC000623596044 567725276 /nfs/dbraw/zinc/72/52/76/567725276.db2.gz CHMKADWXCMPJKX-LBPRGKRZSA-N 0 1 392.175 3.268 10 0 GGAEMN Cc1cc(Br)c(CNC[C@@H](O)[C@H]2CCCO2)cc1Br ZINC000623620016 567725285 /nfs/dbraw/zinc/72/52/85/567725285.db2.gz CTLGNLMUJVVEJE-ZIAGYGMSSA-N 0 1 393.119 3.150 10 0 GGAEMN Cc1cc(Br)c(CNC[C@H](O)[C@H]2CCCO2)cc1Br ZINC000623620015 567725488 /nfs/dbraw/zinc/72/54/88/567725488.db2.gz CTLGNLMUJVVEJE-UONOGXRCSA-N 0 1 393.119 3.150 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N(CCCO)Cc1ccccc1 ZINC000532625994 567726391 /nfs/dbraw/zinc/72/63/91/567726391.db2.gz LRYOZHSJUWWFQR-UHFFFAOYSA-N 0 1 388.265 3.350 10 0 GGAEMN CO[C@@H](C)[C@@H](C)NC(=O)c1sccc1S(=O)(=O)Nc1ccc(C)cc1 ZINC000461273935 567727107 /nfs/dbraw/zinc/72/71/07/567727107.db2.gz JMXHWPMUAOAAHT-OLZOCXBDSA-N 0 1 382.507 3.011 10 0 GGAEMN COCc1nc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)cs1 ZINC000623644799 567728052 /nfs/dbraw/zinc/72/80/52/567728052.db2.gz AUXIETIQEGYXDS-KRWDZBQOSA-N 0 1 397.338 3.062 10 0 GGAEMN O=C(NCc1n[nH]c(C2CC2)n1)Nc1cnc(-c2ccc(Cl)s2)nc1 ZINC000646545869 567728881 /nfs/dbraw/zinc/72/88/81/567728881.db2.gz ZJFANFHQAKTOCI-UHFFFAOYSA-N 0 1 375.845 3.176 10 0 GGAEMN Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@H]1CCNC1=O ZINC000532705194 567729801 /nfs/dbraw/zinc/72/98/01/567729801.db2.gz ZQGXGGPMNCABFE-ZANVPECISA-N 0 1 380.311 3.420 10 0 GGAEMN Cc1sc2nc(C)nc(SCC(=O)N3C[C@H]4CCC[C@@H](C3)N4)c2c1C ZINC000573680937 567730188 /nfs/dbraw/zinc/73/01/88/567730188.db2.gz KHINDQSTVFDDMY-OKILXGFUSA-N 0 1 376.551 3.062 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2ccc(Cl)c(F)c2)C1 ZINC000443154659 567736157 /nfs/dbraw/zinc/73/61/57/567736157.db2.gz GYZMNHWBYPKJTR-OAHLLOKOSA-N 0 1 388.936 3.185 10 0 GGAEMN Cc1noc(C)c1C[C@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000554568728 567736958 /nfs/dbraw/zinc/73/69/58/567736958.db2.gz XODOKFRGAOPZCY-QMMMGPOBSA-N 0 1 377.242 3.291 10 0 GGAEMN O=C(Nc1nc(SCc2ccccc2)ns1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000667218239 567737047 /nfs/dbraw/zinc/73/70/47/567737047.db2.gz GHYIIWRCSKJJQI-OKILXGFUSA-N 0 1 375.523 3.189 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H](C)Cc2cc(Br)ccc2F)n[nH]1 ZINC000532848328 567738816 /nfs/dbraw/zinc/73/88/16/567738816.db2.gz GBMCNNZEOCJAET-WDEREUQCSA-N 0 1 397.292 3.481 10 0 GGAEMN Cn1nccc1[C@@H]1CCCCN1C[C@H](O)COc1ccc(Br)cc1 ZINC000532888136 567740914 /nfs/dbraw/zinc/74/09/14/567740914.db2.gz SNCKTWIHMNWGJZ-YJBOKZPZSA-N 0 1 394.313 3.150 10 0 GGAEMN CCOc1c(Br)cc(CN[C@H]2CCN(C3CCC3)C2=O)cc1OC ZINC000623839955 567740997 /nfs/dbraw/zinc/74/09/97/567740997.db2.gz ITALCMRZXWIWLS-HNNXBMFYSA-N 0 1 397.313 3.099 10 0 GGAEMN Cc1c([C@@H](C)N[C@H]2COCC2(C)C)nnn1-c1cccc(Br)c1 ZINC000573894637 567742789 /nfs/dbraw/zinc/74/27/89/567742789.db2.gz JAHRCVGJBNHQMC-ABAIWWIYSA-N 0 1 379.302 3.414 10 0 GGAEMN O[C@@H](CNCc1cn(-c2ccc(Cl)cc2Cl)nn1)Cc1ccccc1 ZINC000554717685 567744377 /nfs/dbraw/zinc/74/43/77/567744377.db2.gz GCSGVRICSNYKMT-MRXNPFEDSA-N 0 1 377.275 3.267 10 0 GGAEMN O=C(NCCCC(F)(F)F)c1n[nH]c2ccc(I)cc21 ZINC000508358407 567744810 /nfs/dbraw/zinc/74/48/10/567744810.db2.gz CWAQWLOTHMDPJA-UHFFFAOYSA-N 0 1 397.138 3.240 10 0 GGAEMN O=C(Nc1ncc(C2CC[NH2+]CC2)s1)c1cc(Br)ccc1[O-] ZINC000573953366 567746727 /nfs/dbraw/zinc/74/67/27/567746727.db2.gz ZXIPLQJAQOQTOT-UHFFFAOYSA-N 0 1 382.283 3.331 10 0 GGAEMN OC[C@@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1ncc(Br)cc1F ZINC000624049034 567756205 /nfs/dbraw/zinc/75/62/05/567756205.db2.gz ZESLHEGYAOKPOO-YOEHRIQHSA-N 0 1 394.288 3.278 10 0 GGAEMN CCN1CCN(CC(=O)N[C@@H](c2ccsc2)c2ccc(Cl)cc2)CC1 ZINC000461969667 567757402 /nfs/dbraw/zinc/75/74/02/567757402.db2.gz XFBDQJVOYBNODX-LJQANCHMSA-N 0 1 377.941 3.245 10 0 GGAEMN O=C1[C@@H](NCc2cccc(I)c2)CCN1c1ccccc1 ZINC000574143839 567759018 /nfs/dbraw/zinc/75/90/18/567759018.db2.gz WYKQTXLAAVRPHB-INIZCTEOSA-N 0 1 392.240 3.186 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1cc(Cl)ccc1SC)C1CCOCC1 ZINC000647125601 567760708 /nfs/dbraw/zinc/76/07/08/567760708.db2.gz FQEQMARLBSERAT-AWEZNQCLSA-N 0 1 379.931 3.245 10 0 GGAEMN CO[C@H](CS(=O)(=O)Nc1cc(Cl)ccc1SC)C1CCOCC1 ZINC000647125602 567761538 /nfs/dbraw/zinc/76/15/38/567761538.db2.gz FQEQMARLBSERAT-CQSZACIVSA-N 0 1 379.931 3.245 10 0 GGAEMN COc1ncc(S(=O)(=O)Nc2ccc(C)c(NC(C)=O)c2C)cc1Cl ZINC000647125020 567761875 /nfs/dbraw/zinc/76/18/75/567761875.db2.gz PYLNJFCIAUCNRD-UHFFFAOYSA-N 0 1 383.857 3.120 10 0 GGAEMN O=C(CCC(F)(F)F)Nc1nc2ccc(I)cc2[nH]1 ZINC000598422583 567765023 /nfs/dbraw/zinc/76/50/23/567765023.db2.gz FUOMSTREEVIEJP-UHFFFAOYSA-N 0 1 383.111 3.449 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cnc(OC)c(Cl)c2)ccc1OC(C)C ZINC000647130616 567763274 /nfs/dbraw/zinc/76/32/74/567763274.db2.gz QZTVNRHZDBFERF-UHFFFAOYSA-N 0 1 386.857 3.340 10 0 GGAEMN C[C@@H]1C[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1=O ZINC000598422991 567764885 /nfs/dbraw/zinc/76/48/85/567764885.db2.gz INGLUPQSJVDPQU-RKDXNWHRSA-N 0 1 397.216 3.111 10 0 GGAEMN C[C@H]1C[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1=O ZINC000598422989 567764969 /nfs/dbraw/zinc/76/49/69/567764969.db2.gz INGLUPQSJVDPQU-DTWKUNHWSA-N 0 1 397.216 3.111 10 0 GGAEMN C[C@H]1C[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1=O ZINC000598422990 567765321 /nfs/dbraw/zinc/76/53/21/567765321.db2.gz INGLUPQSJVDPQU-IUCAKERBSA-N 0 1 397.216 3.111 10 0 GGAEMN O=C(Nc1ccc(-c2ccc(Cl)s2)nn1)N1CC[C@H](N2CC=CC2)C1 ZINC000667681475 567765669 /nfs/dbraw/zinc/76/56/69/567765669.db2.gz KJDFAHLJEAUZGR-LBPRGKRZSA-N 0 1 375.885 3.337 10 0 GGAEMN C[C@H](F)CCNS(=O)(=O)c1scc(Br)c1Br ZINC000555414953 567783501 /nfs/dbraw/zinc/78/35/01/567783501.db2.gz SPOFHKBKFWMLNH-YFKPBYRVSA-N 0 1 395.113 3.300 10 0 GGAEMN COc1coc(CNC2(c3ccc(Br)cc3)CCOCC2)cc1=O ZINC000533352994 567765943 /nfs/dbraw/zinc/76/59/43/567765943.db2.gz YYBZTQAETTXWHO-UHFFFAOYSA-N 0 1 394.265 3.206 10 0 GGAEMN COCCC1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1 ZINC000598425071 567766134 /nfs/dbraw/zinc/76/61/34/567766134.db2.gz UBQDXOKVZQIMIK-UHFFFAOYSA-N 0 1 399.232 3.313 10 0 GGAEMN CSC1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1 ZINC000598427074 567766155 /nfs/dbraw/zinc/76/61/55/567766155.db2.gz FXZPTWJNZOVLSX-UHFFFAOYSA-N 0 1 387.246 3.392 10 0 GGAEMN CC(C)OCCCC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598427773 567766171 /nfs/dbraw/zinc/76/61/71/567766171.db2.gz KMTUXMHCGSWXIN-UHFFFAOYSA-N 0 1 387.221 3.311 10 0 GGAEMN CN(C)Cc1ccsc1C(=O)NCCN1CCc2c(Cl)cccc2C1 ZINC000443559539 567766600 /nfs/dbraw/zinc/76/66/00/567766600.db2.gz ONIXMTUEJVQTIJ-UHFFFAOYSA-N 0 1 377.941 3.251 10 0 GGAEMN COC[C@H](C)[C@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428235 567767194 /nfs/dbraw/zinc/76/71/94/567767194.db2.gz NMXDHLGLTISCCI-IUCAKERBSA-N 0 1 387.221 3.025 10 0 GGAEMN C[C@@H]1C(=O)CC[C@H]1CC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428249 567767293 /nfs/dbraw/zinc/76/72/93/567767293.db2.gz NSXOROZZPQFLOU-IUCAKERBSA-N 0 1 397.216 3.111 10 0 GGAEMN O=C(Nc1nc2ccc(I)cc2[nH]1)[C@@H]1CCCSC1 ZINC000598428120 567767338 /nfs/dbraw/zinc/76/73/38/567767338.db2.gz MBFMNDPNWJUZHH-MRVPVSSYSA-N 0 1 387.246 3.249 10 0 GGAEMN C[C@]1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CC1(F)F ZINC000598428456 567767348 /nfs/dbraw/zinc/76/73/48/567767348.db2.gz PEYGACDXYTWMRQ-LLVKDONJSA-N 0 1 377.132 3.151 10 0 GGAEMN CO[C@H]1CCC[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)C1 ZINC000598428189 567767721 /nfs/dbraw/zinc/76/77/21/567767721.db2.gz MQUKEQLBLHBSGG-ONGXEEELSA-N 0 1 399.232 3.311 10 0 GGAEMN CO[C@@H]1CCC[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)C1 ZINC000598428188 567767855 /nfs/dbraw/zinc/76/78/55/567767855.db2.gz MQUKEQLBLHBSGG-MWLCHTKSSA-N 0 1 399.232 3.311 10 0 GGAEMN O=C(Nc1cccc(-c2cn[nH]n2)c1)c1n[nH]c2ccc(Br)cc21 ZINC000443677735 567769781 /nfs/dbraw/zinc/76/97/81/567769781.db2.gz UEMGOYIZNMDHRI-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN CCN1CC[C@H](NCC(=O)Nc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555125791 567770536 /nfs/dbraw/zinc/77/05/36/567770536.db2.gz LUXGAOSVJBNPGM-HOCLYGCPSA-N 0 1 382.892 3.299 10 0 GGAEMN CCN1CC[C@@H](NCC(=O)Nc2nccs2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000555125792 567770990 /nfs/dbraw/zinc/77/09/90/567770990.db2.gz LUXGAOSVJBNPGM-ZBFHGGJFSA-N 0 1 382.892 3.299 10 0 GGAEMN C[C@H](NC[C@H]1CN(Cc2ccncc2)CCO1)c1sccc1Br ZINC000624266070 567771203 /nfs/dbraw/zinc/77/12/03/567771203.db2.gz FLFLJVUWEACKRK-ZFWWWQNUSA-N 0 1 396.354 3.457 10 0 GGAEMN CN(C)c1ncc(CN[C@H](CCO)c2cccc(OC(F)(F)F)c2)s1 ZINC000647236055 567773025 /nfs/dbraw/zinc/77/30/25/567773025.db2.gz QQKMFOTZHNRCSF-CQSZACIVSA-N 0 1 375.416 3.321 10 0 GGAEMN CCCc1cc(C(=O)N2Cc3sc(C(=O)OC)c(Br)c3C2)n[nH]1 ZINC000598539246 567773693 /nfs/dbraw/zinc/77/36/93/567773693.db2.gz JJJHZCGMYJQZMY-UHFFFAOYSA-N 0 1 398.282 3.129 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)NCc2cc(Cl)cc(Cl)c2)CC1 ZINC000624321758 567773999 /nfs/dbraw/zinc/77/39/99/567773999.db2.gz AQSOHNABUXDOIL-UHFFFAOYSA-N 0 1 386.323 3.390 10 0 GGAEMN COc1ccc([C@@H](C)N[C@@H]2CCO[C@@H]2c2nc(C)no2)c(Br)c1 ZINC000624305092 567774063 /nfs/dbraw/zinc/77/40/63/567774063.db2.gz VWADMJBUNOTRCJ-ZWZTZDBGSA-N 0 1 382.258 3.330 10 0 GGAEMN COC(=O)c1cnc([C@@H]2CCCN(C(=O)c3ccc(O)c(Cl)c3)C2)s1 ZINC000598563356 567776660 /nfs/dbraw/zinc/77/66/60/567776660.db2.gz UDBPDXNMOULPPJ-LLVKDONJSA-N 0 1 380.853 3.309 10 0 GGAEMN CCSc1cccc(F)c1NS(=O)(=O)C[C@@H](OC)C1CCOCC1 ZINC000647276446 567776838 /nfs/dbraw/zinc/77/68/38/567776838.db2.gz GQTRIVXBRFUIEV-CQSZACIVSA-N 0 1 377.503 3.121 10 0 GGAEMN CCOC(=O)C1([S@@](C)=O)CCN(CCCCc2cccc(Cl)c2)CC1 ZINC000598618761 567779841 /nfs/dbraw/zinc/77/98/41/567779841.db2.gz QAKWHHGHRSDUEK-RUZDIDTESA-N 0 1 385.957 3.439 10 0 GGAEMN Cn1cnc(CCCN[C@@H](c2ccco2)c2ccc(Br)cc2)n1 ZINC000647327400 567780364 /nfs/dbraw/zinc/78/03/64/567780364.db2.gz ZZWDXSNBUKDJKO-QGZVFWFLSA-N 0 1 375.270 3.482 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NCC[C@@H]1CC1(F)F ZINC000598622776 567780386 /nfs/dbraw/zinc/78/03/86/567780386.db2.gz RLAMEBHEGIFKNR-SSDOTTSWSA-N 0 1 388.219 3.104 10 0 GGAEMN COc1ccc2c(c1)C[C@@H](NCc1cc(OC)c(O)cc1Br)CO2 ZINC000647361611 567780964 /nfs/dbraw/zinc/78/09/64/567780964.db2.gz LTTPJEKQKYHRLV-CYBMUJFWSA-N 0 1 394.265 3.265 10 0 GGAEMN C[C@@H]1CC[N@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@@H]1C(=O)[O-] ZINC000647368310 567781935 /nfs/dbraw/zinc/78/19/35/567781935.db2.gz TUYOAXARRNCYMW-SCZZXKLOSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@@H]1C(=O)[O-] ZINC000647368310 567781939 /nfs/dbraw/zinc/78/19/39/567781939.db2.gz TUYOAXARRNCYMW-SCZZXKLOSA-N 0 1 386.271 3.103 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)C(C)(C)c1cnc[nH]1 ZINC000598685162 567782668 /nfs/dbraw/zinc/78/26/68/567782668.db2.gz ZRJJSUXZOJTMQY-UHFFFAOYSA-N 0 1 377.491 3.457 10 0 GGAEMN C[C@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CCCO1 ZINC000667947088 567784622 /nfs/dbraw/zinc/78/46/22/567784622.db2.gz FYLHHLNTPTVFEN-RISCZKNCSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCCO1 ZINC000667947088 567784624 /nfs/dbraw/zinc/78/46/24/567784624.db2.gz FYLHHLNTPTVFEN-RISCZKNCSA-N 0 1 393.285 3.056 10 0 GGAEMN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N1[C@H](C)CN(C)C[C@H]1C ZINC000533755428 567785311 /nfs/dbraw/zinc/78/53/11/567785311.db2.gz CRBDQTYZVJGOPG-VXGBXAGGSA-N 0 1 378.314 3.332 10 0 GGAEMN COCC[C@@H](Cc1cccc(Br)c1)C(=O)N1[C@H](C)CN(C)C[C@@H]1C ZINC000533778586 567786122 /nfs/dbraw/zinc/78/61/22/567786122.db2.gz YJPBXGKVBNZPIU-UXLLHSPISA-N 0 1 397.357 3.195 10 0 GGAEMN CC(C)(C)n1cc(Br)c(C(=O)Nc2cnn(-c3ccncc3)c2)n1 ZINC000668005187 567787635 /nfs/dbraw/zinc/78/76/35/567787635.db2.gz OHIUTGCBRRAWMC-UHFFFAOYSA-N 0 1 389.257 3.234 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)c1ccc(CN(C)C)nc1 ZINC000555538901 567787784 /nfs/dbraw/zinc/78/77/84/567787784.db2.gz OJBDTVNCHSQINE-UHFFFAOYSA-N 0 1 395.244 3.309 10 0 GGAEMN O=C(Nc1nc(-c2ccc[nH]2)cs1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000668018342 567788852 /nfs/dbraw/zinc/78/88/52/567788852.db2.gz IOHCTTKRWXODJP-ZJUUUORDSA-N 0 1 375.372 3.061 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000668027379 567790277 /nfs/dbraw/zinc/79/02/77/567790277.db2.gz HZBQZMOSKGCPNK-SJCJKPOMSA-N 0 1 380.275 3.422 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000668027380 567790315 /nfs/dbraw/zinc/79/03/15/567790315.db2.gz HZBQZMOSKGCPNK-SJKOYZFVSA-N 0 1 380.275 3.422 10 0 GGAEMN COCCN1CCCN(C(=O)c2c(C)cc(C)c(Br)c2C)CC1 ZINC000624620121 567791615 /nfs/dbraw/zinc/79/16/15/567791615.db2.gz VNTDMNRVENPDLI-UHFFFAOYSA-N 0 1 383.330 3.169 10 0 GGAEMN COc1cc(NC(=O)N(C)CC2CN(C)C2)c(Cl)cc1Br ZINC000668037396 567791899 /nfs/dbraw/zinc/79/18/99/567791899.db2.gz XGMBUBRLEZAWQE-UHFFFAOYSA-N 0 1 376.682 3.136 10 0 GGAEMN CC(C)(Cc1ccc(Br)cc1)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000668042424 567792900 /nfs/dbraw/zinc/79/29/00/567792900.db2.gz SOOUFYBSJZCQHJ-CYBMUJFWSA-N 0 1 376.298 3.415 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc(Br)ccc2OC)[C@H]1n1cccn1 ZINC000555646343 567793605 /nfs/dbraw/zinc/79/36/05/567793605.db2.gz VLFCRCAKLOXPQY-DJIMGWMZSA-N 0 1 380.286 3.163 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cc(OC)ccc2Br)[C@@H]1n1cccn1 ZINC000555646770 567793632 /nfs/dbraw/zinc/79/36/32/567793632.db2.gz FMIRKLSSEDCUIT-BBWFWOEESA-N 0 1 380.286 3.163 10 0 GGAEMN C[C@@H](CN1CCC(c2ccc(OC(F)(F)F)cc2)CC1)CS(C)(=O)=O ZINC000555729338 567796618 /nfs/dbraw/zinc/79/66/18/567796618.db2.gz TVEUZHVMSNOFHG-ZDUSSCGKSA-N 0 1 379.444 3.445 10 0 GGAEMN Brc1ccc2nc(CN3CCC(O[C@H]4CCOC4)CC3)[nH]c2c1 ZINC000574768246 567796730 /nfs/dbraw/zinc/79/67/30/567796730.db2.gz MBZJCKBOPKJYLK-AWEZNQCLSA-N 0 1 380.286 3.095 10 0 GGAEMN C[C@H]1Cc2cn[nH]c2[C@H](C(=O)Nc2cc(I)ccc2O)C1 ZINC000598934187 567798697 /nfs/dbraw/zinc/79/86/97/567798697.db2.gz OLRCVTCPQYUPHU-GZMMTYOYSA-N 0 1 397.216 3.025 10 0 GGAEMN CN(C(=O)c1cc(Cl)cc(Br)c1F)[C@H]1CN2CCC1CC2 ZINC000444268274 567798894 /nfs/dbraw/zinc/79/88/94/567798894.db2.gz MELDYPIMYMZNJH-ZDUSSCGKSA-N 0 1 375.669 3.408 10 0 GGAEMN CCCCN(CCOC)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444260753 567799330 /nfs/dbraw/zinc/79/93/30/567799330.db2.gz BQZNIWJROMVXLE-UHFFFAOYSA-N 0 1 381.270 3.179 10 0 GGAEMN CO[C@@H](C)CN(C(=O)c1c[nH]c2ccc(Br)cc2c1=O)C(C)C ZINC000444251906 567799531 /nfs/dbraw/zinc/79/95/31/567799531.db2.gz VPGLQDZMVYECGH-NSHDSACASA-N 0 1 381.270 3.176 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCCN(C[C@@H]3CCCO3)CC2)c1 ZINC000624764734 567799637 /nfs/dbraw/zinc/79/96/37/567799637.db2.gz JNEAJZIZQNZEPR-AWEZNQCLSA-N 0 1 399.304 3.224 10 0 GGAEMN O=C(N[C@H]1CCOC2(CCC2)C1)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444333806 567801727 /nfs/dbraw/zinc/80/17/27/567801727.db2.gz CESBPOZYZOHHAI-LBPRGKRZSA-N 0 1 391.265 3.122 10 0 GGAEMN CC1(C)CCC[C@](CO)(NCc2ncc(I)s2)C1 ZINC000598994895 567801823 /nfs/dbraw/zinc/80/18/23/567801823.db2.gz JDQAUNAWAHNZQX-ZDUSSCGKSA-N 0 1 380.295 3.169 10 0 GGAEMN Cc1cc(C2(NCc3ccc(I)cc3)CCOCC2)on1 ZINC000599019093 567802633 /nfs/dbraw/zinc/80/26/33/567802633.db2.gz CFWCZBKWZUAELT-UHFFFAOYSA-N 0 1 398.244 3.383 10 0 GGAEMN Cc1cc(C2(NCc3cccc(I)c3)CCOCC2)on1 ZINC000599021379 567803054 /nfs/dbraw/zinc/80/30/54/567803054.db2.gz XMXYIVMAFVQXHG-UHFFFAOYSA-N 0 1 398.244 3.383 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000534257733 567804648 /nfs/dbraw/zinc/80/46/48/567804648.db2.gz XANAFPZAGAGFRO-GHMZBOCLSA-N 0 1 380.290 3.121 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000534257734 567805265 /nfs/dbraw/zinc/80/52/65/567805265.db2.gz XANAFPZAGAGFRO-MNOVXSKESA-N 0 1 380.290 3.121 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@H]2CCN(c3ccccc3Br)C2=O)n1 ZINC000574988987 567807298 /nfs/dbraw/zinc/80/72/98/567807298.db2.gz ZHVXBAAKXAKHQY-DGCLKSJQSA-N 0 1 393.285 3.399 10 0 GGAEMN Cn1cc([C@H](NCc2ccc(F)c(Br)c2)C2(CO)CCC2)cn1 ZINC000647943593 567807563 /nfs/dbraw/zinc/80/75/63/567807563.db2.gz RLVCNJKGFRPMQG-INIZCTEOSA-N 0 1 382.277 3.315 10 0 GGAEMN CCOCC[C@H](O)CN1CCC[C@@H]1c1ccccc1I ZINC000444645873 567809843 /nfs/dbraw/zinc/80/98/43/567809843.db2.gz IHZNECXWKKOEGZ-XJKSGUPXSA-N 0 1 389.277 3.216 10 0 GGAEMN CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cc(F)cc(Cl)c1 ZINC000534408985 567810613 /nfs/dbraw/zinc/81/06/13/567810613.db2.gz INSWKDWXZSAEEM-KRWDZBQOSA-N 0 1 382.888 3.374 10 0 GGAEMN CCOCC[C@@H](O)CN1CCC[C@H]1c1ccc(I)cc1 ZINC000444647852 567811050 /nfs/dbraw/zinc/81/10/50/567811050.db2.gz GAFYVQGBTFMUBG-CVEARBPZSA-N 0 1 389.277 3.216 10 0 GGAEMN CN(C)S(=O)(=O)[C@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000575095321 567812184 /nfs/dbraw/zinc/81/21/84/567812184.db2.gz HDYNOZLHCUYQOM-KRWDZBQOSA-N 0 1 382.526 3.410 10 0 GGAEMN CS(=O)(=O)c1ccc(CN[C@H](c2ccccc2)C2(CO)CC=CC2)s1 ZINC000648068800 567812668 /nfs/dbraw/zinc/81/26/68/567812668.db2.gz CVWGMAMQSJFGIW-GOSISDBHSA-N 0 1 377.531 3.311 10 0 GGAEMN C[C@@]12COC[C@]1(C)CN(Cc1ccc(Br)cc1N1CCOCC1)C2 ZINC000668514766 567812688 /nfs/dbraw/zinc/81/26/88/567812688.db2.gz IEJLWERUEOFYDP-KDURUIRLSA-N 0 1 395.341 3.144 10 0 GGAEMN CS(=O)(=O)c1ccc(CN[C@@H](c2ccccc2)C2(CO)CC=CC2)s1 ZINC000648068801 567812705 /nfs/dbraw/zinc/81/27/05/567812705.db2.gz CVWGMAMQSJFGIW-SFHVURJKSA-N 0 1 377.531 3.311 10 0 GGAEMN CCCN1CCC[C@@H]1C(=O)Nc1cnn(-c2ccccc2Br)c1 ZINC000534467016 567812892 /nfs/dbraw/zinc/81/28/92/567812892.db2.gz QEAGEVOHKMXNAM-MRXNPFEDSA-N 0 1 377.286 3.448 10 0 GGAEMN O=C([C@H]1Cc2ccccc2CN1)N1CCc2c(F)cc(Br)cc2C1 ZINC000648101824 567813167 /nfs/dbraw/zinc/81/31/67/567813167.db2.gz FXKLZXLJERBZSN-GOSISDBHSA-N 0 1 389.268 3.187 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2sc(C)cc2Br)C1 ZINC000648072966 567813356 /nfs/dbraw/zinc/81/33/56/567813356.db2.gz YBHAZGDKNZKPCI-GFCCVEGCSA-N 0 1 385.249 3.319 10 0 GGAEMN C[C@H](NC(=O)[C@H](N)c1cccc(Cl)c1)C1CCN(CC(F)(F)F)CC1 ZINC000648172129 567814430 /nfs/dbraw/zinc/81/44/30/567814430.db2.gz KODPGFZCNAGBBA-XHDPSFHLSA-N 0 1 377.838 3.119 10 0 GGAEMN C[C@@H](NC(=O)[C@@H](N)c1cccc(Cl)c1)C1CCN(CC(F)(F)F)CC1 ZINC000648172126 567814567 /nfs/dbraw/zinc/81/45/67/567814567.db2.gz KODPGFZCNAGBBA-ABAIWWIYSA-N 0 1 377.838 3.119 10 0 GGAEMN CN1CCN(c2nc3ccc(Cl)cc3n3c(-c4ccccc4)nnc23)CC1 ZINC000085416426 570226471 /nfs/dbraw/zinc/22/64/71/570226471.db2.gz NSKLPVKCWTVGNO-UHFFFAOYSA-N 0 1 378.867 3.350 10 0 GGAEMN O=C(NC[C@H]1CCCO1)c1ccc(CN2CCN(c3ccc(F)cc3)CC2)cc1 ZINC000034668730 570292981 /nfs/dbraw/zinc/29/29/81/570292981.db2.gz HYRXRZKFHHJDFP-JOCHJYFZSA-N 0 1 397.494 3.057 10 0 GGAEMN COCCNC(=O)c1ccc(CN2CCN(c3ccc(Cl)cc3)CC2)cc1 ZINC000034684559 570301439 /nfs/dbraw/zinc/30/14/39/570301439.db2.gz ZBLVIOOQGOFFFE-UHFFFAOYSA-N 0 1 387.911 3.038 10 0 GGAEMN Cc1cccc(N2CCN(Cc3ccc(C(=O)N4CCOCC4)cc3)CC2)c1C ZINC000034684879 570301721 /nfs/dbraw/zinc/30/17/21/570301721.db2.gz KQNJTSCKBAMYBA-UHFFFAOYSA-N 0 1 393.531 3.098 10 0 GGAEMN C[C@H](CC(=O)N1CCC([N@@H+](C)CC(=O)[O-])CC1)c1ccccc1C(F)(F)F ZINC000186624037 570306297 /nfs/dbraw/zinc/30/62/97/570306297.db2.gz HKGUDMGRMGNOSZ-CYBMUJFWSA-N 0 1 386.414 3.206 10 0 GGAEMN O=C1N=C(c2ccccn2)NC12CCN(Cc1ccc(-c3ccccn3)cc1)CC2 ZINC000063846025 570324783 /nfs/dbraw/zinc/32/47/83/570324783.db2.gz JEULNIIEIXEFBN-UHFFFAOYSA-N 0 1 397.482 3.055 10 0 GGAEMN Cc1cc(C)cc(C(=O)N2CCc3n[nH]c(C(=O)N4CCC(C)CC4)c3C2)c1 ZINC000034809665 570334024 /nfs/dbraw/zinc/33/40/24/570334024.db2.gz PEQDCFGRHHCJQU-UHFFFAOYSA-N 0 1 380.492 3.097 10 0 GGAEMN CC1CCC(NC(=O)[C@@H]2CCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)CC1 ZINC000035508049 570379518 /nfs/dbraw/zinc/37/95/18/570379518.db2.gz APYZSKPGGGFZQN-IIIMJFFVSA-N 0 1 395.507 3.019 10 0 GGAEMN CC1CCC(NC(=O)[C@H]2CCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)CC1 ZINC000035508052 570379556 /nfs/dbraw/zinc/37/95/56/570379556.db2.gz APYZSKPGGGFZQN-NXYGQSRBSA-N 0 1 395.507 3.019 10 0 GGAEMN Cc1ccc(-c2nnc(CCNS(=O)(=O)c3cccc(Cl)c3C)[nH]2)cc1 ZINC000035509251 570379879 /nfs/dbraw/zinc/37/98/79/570379879.db2.gz PXFWMQBZFFNCGW-UHFFFAOYSA-N 0 1 390.896 3.263 10 0 GGAEMN COc1ccc2[nH]c3c([nH]c(=S)n(CCC(=O)NCCC(C)C)c3=O)c2c1 ZINC000004950929 570380747 /nfs/dbraw/zinc/38/07/47/570380747.db2.gz CLZUGYUVCGXFOS-UHFFFAOYSA-N 0 1 388.493 3.101 10 0 GGAEMN COc1ccc(F)c(CN2CCC[C@]3(CC[N@@H+](Cc4cccnc4)C3)C2=O)c1 ZINC000011937371 570449473 /nfs/dbraw/zinc/44/94/73/570449473.db2.gz LEDJJNXXFIOLQB-JOCHJYFZSA-N 0 1 383.467 3.244 10 0 GGAEMN CCc1cccc(CC)c1NC(=O)CSc1nc(O)cc(=O)n1CC(C)C ZINC000032957981 570452827 /nfs/dbraw/zinc/45/28/27/570452827.db2.gz VOQLDIPTWJMSMK-UHFFFAOYSA-N 0 1 389.521 3.461 10 0 GGAEMN CNC(=O)COc1ccc(NC(=O)c2[nH]c(-c3cccc(Cl)c3)nc2C)cc1 ZINC000130314079 570463876 /nfs/dbraw/zinc/46/38/76/570463876.db2.gz FQEKAUFQZWWSRA-UHFFFAOYSA-N 0 1 398.850 3.416 10 0 GGAEMN CC(C)CNC(=O)[C@@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@H]12 ZINC000035894110 570474293 /nfs/dbraw/zinc/47/42/93/570474293.db2.gz ATJSGHZSKHAGRG-FYYLOGMGSA-N 0 1 395.522 3.461 10 0 GGAEMN Cc1nccn1-c1ccc(CNC(=O)[C@@H](C)N(C)Cc2ccccc2)cc1F ZINC000072289321 570481809 /nfs/dbraw/zinc/48/18/09/570481809.db2.gz CVPCIEHWZFKZTR-MRXNPFEDSA-N 0 1 380.467 3.457 10 0 GGAEMN Cc1ccc(Nc2n[nH]nc2C(=O)N2CCN(C3CCCCC3)CC2)cc1C ZINC000067284519 570496069 /nfs/dbraw/zinc/49/60/69/570496069.db2.gz RIVIEZBTDPVCEV-UHFFFAOYSA-N 0 1 382.512 3.256 10 0 GGAEMN COc1ccc(-c2ccc(NS(=O)(=O)c3cc(C)ccc3OC)cc2)nn1 ZINC000005204223 570506068 /nfs/dbraw/zinc/50/60/68/570506068.db2.gz AGANMGCVFOWSRD-UHFFFAOYSA-N 0 1 385.445 3.270 10 0 GGAEMN Cc1nn(C)c(C)c1-c1cc(C(=O)N(C)Cc2nc3c(s2)CCCC3)n[nH]1 ZINC000176843936 570511431 /nfs/dbraw/zinc/51/14/31/570511431.db2.gz BXRXBEWEPUGTKD-UHFFFAOYSA-N 0 1 384.509 3.035 10 0 GGAEMN COc1ccccc1NC(=O)CCN1CCN(C/C=C\c2ccccc2)CC1 ZINC000033933166 570515008 /nfs/dbraw/zinc/51/50/08/570515008.db2.gz BQSUOECUCVKPAI-YFHOEESVSA-N 0 1 379.504 3.355 10 0 GGAEMN COCCCN(Cc1ccc(F)cc1F)C[C@@H](O)COc1ccc(OC)cc1 ZINC000036099715 570538174 /nfs/dbraw/zinc/53/81/74/570538174.db2.gz XGKSATLEYOUDLZ-GOSISDBHSA-N 0 1 395.446 3.252 10 0 GGAEMN CCOC[C@H](O)CN(Cc1ccc(F)cc1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036145868 570548946 /nfs/dbraw/zinc/54/89/46/570548946.db2.gz MOWJCXHJKHMGKH-RTWAWAEBSA-N 0 1 386.467 3.218 10 0 GGAEMN Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)NCc2c[nH]nn2)cc1 ZINC000072311711 570553203 /nfs/dbraw/zinc/55/32/03/570553203.db2.gz LRPKAZSIZWUPAA-UHFFFAOYSA-N 0 1 376.395 3.035 10 0 GGAEMN CCOc1ccccc1NS(=O)(=O)c1cc(-c2ccc(=O)[nH]n2)ccc1CC ZINC000064837212 570560184 /nfs/dbraw/zinc/56/01/84/570560184.db2.gz WGNVLOVIMGEWIG-UHFFFAOYSA-N 0 1 399.472 3.199 10 0 GGAEMN C[C@H](CN1CCN(C)CC1)NC(=O)N(CCc1ccccc1)c1ccccc1 ZINC000225505102 570581021 /nfs/dbraw/zinc/58/10/21/570581021.db2.gz XDPYDNZQDUXIPU-HXUWFJFHSA-N 0 1 380.536 3.081 10 0 GGAEMN CCc1ccc(NS(=O)(=O)c2cc3c(cc2Cl)N(C(C)=O)CCO3)cc1 ZINC000006779701 570587327 /nfs/dbraw/zinc/58/73/27/570587327.db2.gz YIYSDCDLKLONPR-UHFFFAOYSA-N 0 1 394.880 3.449 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2cccc(Cl)c2)cc(C(=O)N2CCCCC2)n1C ZINC000064922183 570593402 /nfs/dbraw/zinc/59/34/02/570593402.db2.gz MMTZBILSXKRRND-UHFFFAOYSA-N 0 1 395.912 3.414 10 0 GGAEMN Cc1nc(C)c(Cc2ccc(Cl)cc2)c(N2CCN(CC(C)(C)O)CC2)n1 ZINC000036316565 570615032 /nfs/dbraw/zinc/61/50/32/570615032.db2.gz QEJBDFBEBFDSQM-UHFFFAOYSA-N 0 1 388.943 3.231 10 0 GGAEMN COc1ccc(-c2nnc(CCNC(=O)c3ccccc3C(F)(F)F)[nH]2)cc1 ZINC000064969261 570619881 /nfs/dbraw/zinc/61/98/81/570619881.db2.gz ZMUBWKAUMDHTAE-UHFFFAOYSA-N 0 1 390.365 3.472 10 0 biogenic GGAEMN Cc1ccccc1Cc1c(C)nc(C)nc1N1CCN(C[C@H](O)C(C)C)CC1 ZINC000036340114 570625422 /nfs/dbraw/zinc/62/54/22/570625422.db2.gz XSIJXOCEFSPFGD-QFIPXVFZSA-N 0 1 382.552 3.132 10 0 GGAEMN Cc1ccccc1Cc1c(C)nc(C)nc1N1CCN(C[C@@H](O)C(C)C)CC1 ZINC000036340115 570625495 /nfs/dbraw/zinc/62/54/95/570625495.db2.gz XSIJXOCEFSPFGD-JOCHJYFZSA-N 0 1 382.552 3.132 10 0 GGAEMN O=C(CN1CCCC1)N1N=C(c2ccccc2)C[C@H]1c1ccc2c(c1)OCO2 ZINC000036344395 570626274 /nfs/dbraw/zinc/62/62/74/570626274.db2.gz GKWJPQSIUQHQRB-IBGZPJMESA-N 0 1 377.444 3.189 10 0 GGAEMN CCN1CCN(CC(=O)N2N=C(c3ccccc3)C[C@H]2c2ccc(F)cc2)CC1 ZINC000036345189 570627694 /nfs/dbraw/zinc/62/76/94/570627694.db2.gz BROBXPWCDBLISD-QFIPXVFZSA-N 0 1 394.494 3.141 10 0 GGAEMN COc1ccc(C)cc1NC(=O)[C@@H](NCCCN1CCCC1=O)c1ccccc1 ZINC000006837963 570638921 /nfs/dbraw/zinc/63/89/21/570638921.db2.gz GVDRVEYHNUBFBR-QFIPXVFZSA-N 0 1 395.503 3.286 10 0 GGAEMN O=C(NCCN1CCN(Cc2ccccc2)CC1)C1(n2cccc2)CCCCC1 ZINC000033019357 570639476 /nfs/dbraw/zinc/63/94/76/570639476.db2.gz VLLYDZVGXNOJCS-UHFFFAOYSA-N 0 1 394.563 3.082 10 0 GGAEMN O=C(CCN(C(=O)c1ccc(Cl)cc1)C1CCCCCC1)N1CCNCC1 ZINC000045966573 570649869 /nfs/dbraw/zinc/64/98/69/570649869.db2.gz JTTPGOMDDXDKPO-UHFFFAOYSA-N 0 1 391.943 3.327 10 0 GGAEMN Cc1ccc(C(=O)N(CCC(=O)N2CCNCC2)Cc2cccc(Cl)c2)cc1 ZINC000045966951 570649897 /nfs/dbraw/zinc/64/98/97/570649897.db2.gz RBULQMYVOUDTAW-UHFFFAOYSA-N 0 1 399.922 3.113 10 0 GGAEMN Cc1cccnc1NC(=O)[C@H]1CCCN(C[C@@H](O)c2ccc(F)c(F)c2)C1 ZINC000229750268 570666339 /nfs/dbraw/zinc/66/63/39/570666339.db2.gz BEIQDRWUQSYACO-MAUKXSAKSA-N 0 1 375.419 3.052 10 0 GGAEMN CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)Nc1cccc2c1CCCC2 ZINC000006887515 570682234 /nfs/dbraw/zinc/68/22/34/570682234.db2.gz MHKBGQJPHYGXDB-UHFFFAOYSA-N 0 1 376.478 3.488 10 0 GGAEMN Cc1ccc2nc(SCC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)[nH]c2c1 ZINC000006908905 570698801 /nfs/dbraw/zinc/69/88/01/570698801.db2.gz HDLULXODQUCPHV-UHFFFAOYSA-N 0 1 389.502 3.097 10 0 GGAEMN Cc1ccc(CNC(=O)CC(C)(C)CC2=Nc3ccccc3S(=O)(=O)N2)cc1 ZINC000006914166 570700946 /nfs/dbraw/zinc/70/09/46/570700946.db2.gz CMFJCMRNARWLBF-UHFFFAOYSA-N 0 1 399.516 3.440 10 0 GGAEMN Cc1nn2c(nc(CSc3nc(Cc4ccccc4)c(C)[nH]3)cc2=O)s1 ZINC000058144696 570710735 /nfs/dbraw/zinc/71/07/35/570710735.db2.gz SKNPUARDAGBZRI-UHFFFAOYSA-N 0 1 383.502 3.374 10 0 GGAEMN C[C@H](NCC(=O)NCC(=O)Nc1ccc(F)cc1)c1cccc(C(F)(F)F)c1 ZINC000058160030 570712211 /nfs/dbraw/zinc/71/22/11/570712211.db2.gz ORSGXPYUVNQJDE-LBPRGKRZSA-N 0 1 397.372 3.250 10 0 GGAEMN CC(=O)c1cc2c(cc1NC(=O)CN[C@@H](C)c1ccc(F)c(F)c1)OCO2 ZINC000058172524 570715385 /nfs/dbraw/zinc/71/53/85/570715385.db2.gz JZOZBCHKOQLXGA-JTQLQIEISA-N 0 1 376.359 3.185 10 0 GGAEMN COc1ccc([C@@H](CN2CCN(C)CC2)NC(=O)Nc2ccc(C)cc2C)cc1 ZINC000058298229 570725446 /nfs/dbraw/zinc/72/54/46/570725446.db2.gz KJTOJVBRARBZBW-JOCHJYFZSA-N 0 1 396.535 3.422 10 0 GGAEMN CCc1noc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2ccc(F)cc2)n1 ZINC000065194562 570725656 /nfs/dbraw/zinc/72/56/56/570725656.db2.gz NGEYPESMOKLKBQ-UHFFFAOYSA-N 0 1 378.429 3.194 10 0 GGAEMN CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)c2nccn2C)cc1)c1cccs1 ZINC000058331404 570727900 /nfs/dbraw/zinc/72/79/00/570727900.db2.gz ISGSUTBBZQAIIX-MRXNPFEDSA-N 0 1 397.504 3.137 10 0 GGAEMN COc1ccc(-n2cc(C(=O)c3cc(C)ccc3O)cc(C(C)=O)c2=O)cc1 ZINC000012971381 570732900 /nfs/dbraw/zinc/73/29/00/570732900.db2.gz CGQUJOPDTQECRD-UHFFFAOYSA-N 0 1 377.396 3.294 10 0 GGAEMN CCCCN1CCN(Cc2nc(-c3ccc(N4CCCCCC4)nc3)no2)CC1 ZINC000065216275 570734498 /nfs/dbraw/zinc/73/44/98/570734498.db2.gz FMUMHHVYBOOKFG-UHFFFAOYSA-N 0 1 398.555 3.430 10 0 GGAEMN COc1ccc(NC(=O)NCCc2n[nH]c(Cc3ccc(C)cc3)n2)cc1OC ZINC000033062543 570748485 /nfs/dbraw/zinc/74/84/85/570748485.db2.gz QLHFVZAIQKAQNB-UHFFFAOYSA-N 0 1 395.463 3.085 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)CC1 ZINC000249174746 570763685 /nfs/dbraw/zinc/76/36/85/570763685.db2.gz YMKPDAUNKPQYRD-BMFZPTHFSA-N 0 1 398.425 3.206 10 0 GGAEMN O=C(c1cn2ccnc(-c3ccccc3)c2n1)N1CCN(C2CCCCC2)CC1 ZINC000065274366 570776205 /nfs/dbraw/zinc/77/62/05/570776205.db2.gz GDZNDADJLOEFMY-UHFFFAOYSA-N 0 1 389.503 3.487 10 0 GGAEMN CCCCN1CCN(C(=O)c2cn3ccnc(-c4ccc(F)cc4)c3n2)CC1 ZINC000065274518 570776769 /nfs/dbraw/zinc/77/67/69/570776769.db2.gz XHNZERGGGYHBNF-UHFFFAOYSA-N 0 1 381.455 3.093 10 0 GGAEMN CCC(=O)c1ccc(OCC(=O)Nc2ccccc2N2CCN(C)CC2)cc1 ZINC000007105842 570789322 /nfs/dbraw/zinc/78/93/22/570789322.db2.gz JHXONXNITXENCE-UHFFFAOYSA-N 0 1 381.476 3.049 10 0 GGAEMN CC[C@@]1(C(=O)[O-])C[C@H](C(=O)NC2(C(C)C)CC2)[C@H](c2ccc(OC)cc2)[N@H+]1C ZINC000067909462 570796797 /nfs/dbraw/zinc/79/67/97/570796797.db2.gz FHIOJTJDFUMFKS-SPEDKVCISA-N 0 1 388.508 3.226 10 0 GGAEMN CCOC1(c2nc([C@H]3CCCO3)no2)CCN(Cc2ccc3c[nH]nc3c2)CC1 ZINC000583615941 570801022 /nfs/dbraw/zinc/80/10/22/570801022.db2.gz SXQCZEIAAXPSBQ-GOSISDBHSA-N 0 1 397.479 3.325 10 0 GGAEMN CCNC(=O)NC(=O)[C@H](Sc1nc(-c2cccs2)n[nH]1)c1ccccc1 ZINC000006035534 570816157 /nfs/dbraw/zinc/81/61/57/570816157.db2.gz YRRNPDMPLHWIGT-CYBMUJFWSA-N 0 1 387.490 3.212 10 0 GGAEMN Cc1cccc(N2CCN(C(=O)CN3CCC[C@@H]3c3cccn3C)CC2)c1C ZINC000007251296 570820240 /nfs/dbraw/zinc/82/02/40/570820240.db2.gz HCVWBMSMASUVEI-JOCHJYFZSA-N 0 1 380.536 3.128 10 0 GGAEMN Cc1cccc(N2CCN(C(=O)CN3CCC[C@H]3c3cccn3C)CC2)c1C ZINC000007251299 570820308 /nfs/dbraw/zinc/82/03/08/570820308.db2.gz HCVWBMSMASUVEI-QFIPXVFZSA-N 0 1 380.536 3.128 10 0 GGAEMN Cc1cccc(N2CCN(CCC(=O)Nc3ccc4c(c3)OCCO4)CC2)c1C ZINC000012509055 570824238 /nfs/dbraw/zinc/82/42/38/570824238.db2.gz KCJJQQMPGKHKSK-UHFFFAOYSA-N 0 1 395.503 3.225 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2O)n[nH]1)NC12CC3CC(CC(C3)C1)C2 ZINC000032810066 570832349 /nfs/dbraw/zinc/83/23/49/570832349.db2.gz HYKMJSWHFJMXOV-UHFFFAOYSA-N 0 1 384.505 3.354 10 0 GGAEMN Cc1ccc2nc(SCC(=O)NCCc3ccc4c(c3)OCCO4)[nH]c2c1 ZINC000012530811 570833809 /nfs/dbraw/zinc/83/38/09/570833809.db2.gz QNBRDRSSCAVFQD-UHFFFAOYSA-N 0 1 383.473 3.094 10 0 GGAEMN O=C(CNCc1ccc2c(c1)OCO2)Nc1ccccc1C(=O)c1ccccc1 ZINC000003233418 570839758 /nfs/dbraw/zinc/83/97/58/570839758.db2.gz MLKIDJFDDVYCQB-UHFFFAOYSA-N 0 1 388.423 3.375 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)ccc1NC(=O)CCc1ccc2c(c1)OCCO2 ZINC000012548857 570850663 /nfs/dbraw/zinc/85/06/63/570850663.db2.gz SRFWVOCHAKOOFT-UHFFFAOYSA-N 0 1 395.503 3.089 10 0 GGAEMN C[C@H](c1ccccc1)N1CC[C@](F)(COC(=O)c2cnc3ccccn3c2=O)C1 ZINC000170595882 570853261 /nfs/dbraw/zinc/85/32/61/570853261.db2.gz USJMGWMYBNHPLP-OPAMFIHVSA-N 0 1 395.434 3.027 10 0 GGAEMN COc1ccc2nc([C@H](C)NC(=O)[C@@H]3CC(c4cccc(F)c4)=NO3)[nH]c2c1 ZINC000170600527 570858232 /nfs/dbraw/zinc/85/82/32/570858232.db2.gz MEHASNSEUIJPAW-VOJFVSQTSA-N 0 1 382.395 3.081 10 0 GGAEMN COC(=O)c1cccc(F)c1NS(=O)(=O)c1ccccc1OC(F)(F)F ZINC000170602171 570861618 /nfs/dbraw/zinc/86/16/18/570861618.db2.gz ABINRPKBKRZOKW-UHFFFAOYSA-N 0 1 393.314 3.312 10 0 GGAEMN Cc1cc2[nH]ncc2cc1NC(=O)[C@@H]1CS[C@]2(c3ccccc3)CCC(=O)N12 ZINC000170611494 570868161 /nfs/dbraw/zinc/86/81/61/570868161.db2.gz ZUNFQRZLGXDSEV-RXVVDRJESA-N 0 1 392.484 3.401 10 0 GGAEMN Cc1cc2[nH]ncc2cc1NC(=O)[C@H]1CS[C@]2(c3ccccc3)CCC(=O)N12 ZINC000170611495 570868277 /nfs/dbraw/zinc/86/82/77/570868277.db2.gz ZUNFQRZLGXDSEV-NQIIRXRSSA-N 0 1 392.484 3.401 10 0 GGAEMN Cc1ccc(CN(C)[C@@H](C)C(=O)NC(=O)Nc2ccc3c(c2)OCCO3)c(C)c1 ZINC000015023941 570872809 /nfs/dbraw/zinc/87/28/09/570872809.db2.gz CDZHSAXPKLALOK-INIZCTEOSA-N 0 1 397.475 3.243 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)COc3ccc(C(C)(C)C)cc3)cn2)CC1 ZINC000012613486 570890482 /nfs/dbraw/zinc/89/04/82/570890482.db2.gz ZWNXTIRPBSIZKX-UHFFFAOYSA-N 0 1 382.508 3.148 10 0 GGAEMN C[C@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)N1CCC[C@H](C)C1 ZINC000104216513 570897534 /nfs/dbraw/zinc/89/75/34/570897534.db2.gz PCJRGBRXXORJRI-UONOGXRCSA-N 0 1 385.430 3.223 10 0 GGAEMN Cc1noc2ncc(C(=O)Nc3cc(Cl)ccc3N3CCN(C)CC3)cc12 ZINC000032905844 570906332 /nfs/dbraw/zinc/90/63/32/570906332.db2.gz GSEWNMBSMYJTOM-UHFFFAOYSA-N 0 1 385.855 3.189 10 0 GGAEMN COC[C@@H](O)CN(Cc1ccccc1)C[C@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000104983061 570911761 /nfs/dbraw/zinc/91/17/61/570911761.db2.gz ZJVZTHUDMZHKBW-VQTJNVASSA-N 0 1 388.895 3.343 10 0 GGAEMN O=C(CSc1nccn1-c1ccccc1)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000032909720 570912021 /nfs/dbraw/zinc/91/20/21/570912021.db2.gz OQRXAPOPPPZZJR-LJQANCHMSA-N 0 1 392.528 3.355 10 0 GGAEMN C[C@H](SCc1ccccc1)C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000105778825 570931973 /nfs/dbraw/zinc/93/19/73/570931973.db2.gz AIFOQZYIZDUUBW-UGKGYDQZSA-N 0 1 397.588 3.413 10 0 GGAEMN CCc1nc(SCc2noc(CCC(=O)Nc3ccc(C)cc3C)n2)n[nH]1 ZINC000033270852 570947091 /nfs/dbraw/zinc/94/70/91/570947091.db2.gz HOCRFRJAMKFCAD-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN CCc1n[nH]c(SCc2noc(CCC(=O)Nc3ccc(C)cc3C)n2)n1 ZINC000033270852 570947093 /nfs/dbraw/zinc/94/70/93/570947093.db2.gz HOCRFRJAMKFCAD-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN CCN1CCN(c2ccc(C(=O)OC)cc2NC(=O)CCc2ccccc2)CC1 ZINC000033278749 570953333 /nfs/dbraw/zinc/95/33/33/570953333.db2.gz HNUABVYZNARXLN-UHFFFAOYSA-N 0 1 395.503 3.186 10 0 GGAEMN Cc1noc(C)c1CCNC(=O)N1CCC[C@@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000181727748 570970273 /nfs/dbraw/zinc/97/02/73/570970273.db2.gz ZVWVPUQYQUAXIP-QGZVFWFLSA-N 0 1 394.479 3.208 10 0 GGAEMN Cc1noc(C)c1CCNC(=O)N1CCC[C@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000181727724 570970418 /nfs/dbraw/zinc/97/04/18/570970418.db2.gz ZVWVPUQYQUAXIP-KRWDZBQOSA-N 0 1 394.479 3.208 10 0 GGAEMN COc1ccccc1N1CCN(C(=O)c2n[nH]c3c2CCc2ccccc2-3)CC1 ZINC000033313882 570972173 /nfs/dbraw/zinc/97/21/73/570972173.db2.gz USUADRYMQXPUHP-UHFFFAOYSA-N 0 1 388.471 3.146 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCN1C[C@H](C)O ZINC000108096382 570982733 /nfs/dbraw/zinc/98/27/33/570982733.db2.gz BZHPCWHKQXLQCJ-FUHWJXTLSA-N 0 1 384.480 3.183 10 0 GGAEMN CC(C)(C)CNC(=O)c1[nH]cnc1C(=O)NCc1ccc(C(F)(F)F)cc1 ZINC000033327546 570983489 /nfs/dbraw/zinc/98/34/89/570983489.db2.gz AGDYVULDMBHFRS-UHFFFAOYSA-N 0 1 382.386 3.134 10 0 GGAEMN O=C(NCc1ccc(F)cc1Cl)c1nc[nH]c1C(=O)NCc1ccccc1 ZINC000033327540 570983621 /nfs/dbraw/zinc/98/36/21/570983621.db2.gz GZUHMZYUNQDWCP-UHFFFAOYSA-N 0 1 386.814 3.062 10 0 GGAEMN O=C(NC[C@@H]1C[C@H](O)CN1Cc1ccccc1)C1(c2ccc(F)cc2)CCCC1 ZINC000108143946 570984602 /nfs/dbraw/zinc/98/46/02/570984602.db2.gz XHIDGBOSWSKYDQ-VXKWHMMOSA-N 0 1 396.506 3.389 10 0 GGAEMN CCOc1ccc(OCC(=O)NC2CCN(Cc3ccccc3OC)CC2)cc1 ZINC000170649061 570985052 /nfs/dbraw/zinc/98/50/52/570985052.db2.gz PVRMNFUQQHUAQM-UHFFFAOYSA-N 0 1 398.503 3.254 10 0 GGAEMN O=C(CCN1CCN(c2ccc(C(F)(F)F)cn2)CC1)Nc1cccc(F)c1 ZINC000012741657 570986204 /nfs/dbraw/zinc/98/62/04/570986204.db2.gz HONCXOAQBQIQDY-UHFFFAOYSA-N 0 1 396.388 3.390 10 0 GGAEMN O=C(CCn1c(=O)c2[nH]c3ccccc3c2[nH]c1=S)NCc1ccccc1 ZINC000004793255 570993076 /nfs/dbraw/zinc/99/30/76/570993076.db2.gz YDOJZQBENIKHQX-UHFFFAOYSA-N 0 1 378.457 3.247 10 0 GGAEMN Cc1ccc(NC(=O)CN2CCC[C@H](Cc3nnc4ccccn43)C2)c(C)c1 ZINC000252570984 570995923 /nfs/dbraw/zinc/99/59/23/570995923.db2.gz XMROSJQWWUIUIJ-GOSISDBHSA-N 0 1 377.492 3.239 10 0 GGAEMN CCCN(Cc1ccc(OC)c(OC)c1)Cc1cc(=O)n2ccc(C)cc2n1 ZINC000045974089 571007272 /nfs/dbraw/zinc/00/72/72/571007272.db2.gz SVCAXKBHIRUDHI-UHFFFAOYSA-N 0 1 381.476 3.432 10 0 GGAEMN O=S(=O)(N[C@H]1CCCN(CCCc2nc3ccccc3o2)C1)c1ccccc1 ZINC000084558670 571023001 /nfs/dbraw/zinc/02/30/01/571023001.db2.gz BACGRVOHSCUGFQ-KRWDZBQOSA-N 0 1 399.516 3.203 10 0 GGAEMN O=C(Nc1ccccc1)[C@@H]1CCC[N@@H+](Cc2cc(=O)oc3cc([O-])ccc23)C1 ZINC000012777339 571031108 /nfs/dbraw/zinc/03/11/08/571031108.db2.gz MWTTZDAKYPVJHN-OAHLLOKOSA-N 0 1 378.428 3.349 10 0 GGAEMN O=C(Nc1ccccc1)[C@@H]1CCC[N@H+](Cc2cc(=O)oc3cc([O-])ccc23)C1 ZINC000012777339 571031109 /nfs/dbraw/zinc/03/11/09/571031109.db2.gz MWTTZDAKYPVJHN-OAHLLOKOSA-N 0 1 378.428 3.349 10 0 GGAEMN COc1ccc(OC)c([C@H](C)NC(=O)CN2CCC(c3ccc(O)cc3)CC2)c1 ZINC000055103100 1406885557 /nfs/dbraw/zinc/88/55/57/1406885557.db2.gz DXSWCHCYNHYOPZ-INIZCTEOSA-N 0 1 398.503 3.466 10 0 GGAEMN COc1ccc(S(=O)(=O)[N-]c2c(CC[NH+]3CCCC3)cccc2OC)cc1 ZINC000001495549 1398303571 /nfs/dbraw/zinc/30/35/71/1398303571.db2.gz AUFYGMVUOUHBSQ-UHFFFAOYSA-N 0 1 390.505 3.143 10 0 GGAEMN CCOC(=O)C1=C(c2ccccc2)NC(=O)N[C@H]1c1ccc(O)c(OCC)c1 ZINC000003253459 1398330831 /nfs/dbraw/zinc/33/08/31/1398330831.db2.gz MJZXWGQYRWOMMF-IBGZPJMESA-N 0 1 382.416 3.119 10 0 GGAEMN Cc1cccc(NC(=S)Nc2ccc(S(=O)(=O)Nc3ncccn3)cc2)c1 ZINC000003305386 1398333690 /nfs/dbraw/zinc/33/36/90/1398333690.db2.gz LPPSZDWEWQOBBH-UHFFFAOYSA-N 0 1 399.501 3.395 10 0 GGAEMN COC(=O)c1sc2[nH]c(CN[C@H]3CCCc4ccccc43)nc(=O)c2c1C ZINC000003328006 1398335341 /nfs/dbraw/zinc/33/53/41/1398335341.db2.gz HVXWHFCYQXTGKE-AWEZNQCLSA-N 0 1 383.473 3.247 10 0 GGAEMN Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000008367091 1398827033 /nfs/dbraw/zinc/82/70/33/1398827033.db2.gz CUNVDETWXQFWGP-GOSISDBHSA-N 0 1 395.894 3.233 10 0 GGAEMN COc1cn(CC(=O)Nc2cccc(C)c2C)c(CN2CCCCC2)cc1=O ZINC000008602093 1398841530 /nfs/dbraw/zinc/84/15/30/1398841530.db2.gz QWHDCQPDZGALQL-UHFFFAOYSA-N 0 1 383.492 3.098 10 0 GGAEMN COc1ccccc1CNC(=O)C1CCN(c2nc3ccc(C)cc3[nH]2)CC1 ZINC000008599405 1398841557 /nfs/dbraw/zinc/84/15/57/1398841557.db2.gz WYJVLTDLRZBTEE-UHFFFAOYSA-N 0 1 378.476 3.413 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2)n[nH]1)N1CCN(c2ccc(F)cc2)CC1 ZINC000008617175 1398841862 /nfs/dbraw/zinc/84/18/62/1398841862.db2.gz WTQBHOUAYWCHJQ-UHFFFAOYSA-N 0 1 397.479 3.052 10 0 GGAEMN Cc1ccc(N2C[C@H](C(=O)NC[C@H](c3ccco3)N3CCCCC3)CC2=O)cc1 ZINC000009451272 1398858757 /nfs/dbraw/zinc/85/87/57/1398858757.db2.gz YYNAYXNPXNWTNI-UYAOXDASSA-N 0 1 395.503 3.284 10 0 GGAEMN Cc1ccc(N2C[C@@H](C(=O)NC[C@@H](c3ccco3)N3CCCCC3)CC2=O)cc1 ZINC000009451268 1398858811 /nfs/dbraw/zinc/85/88/11/1398858811.db2.gz YYNAYXNPXNWTNI-ICSRJNTNSA-N 0 1 395.503 3.284 10 0 GGAEMN Cc1c(C(=O)N2CCCCC2)c(S(=O)(=O)Nc2ccccc2)c(C)n1C ZINC000009685153 1398863301 /nfs/dbraw/zinc/86/33/01/1398863301.db2.gz LBMZCMYIUITYIS-UHFFFAOYSA-N 0 1 375.494 3.069 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2cccc(C)c2C)c1C(=O)N1CCCC1 ZINC000009684072 1398863311 /nfs/dbraw/zinc/86/33/11/1398863311.db2.gz GGKHFFFYJXUSEB-UHFFFAOYSA-N 0 1 375.494 3.285 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2cc(C)ccc2C)c1C(=O)N1CCCC1 ZINC000009684168 1398863411 /nfs/dbraw/zinc/86/34/11/1398863411.db2.gz JIXPHEWMZMFTLY-UHFFFAOYSA-N 0 1 375.494 3.285 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2ccc(C)c(C)c2)c(C)n1C ZINC000009684762 1398863521 /nfs/dbraw/zinc/86/35/21/1398863521.db2.gz MNNOISQXJSOVQG-UHFFFAOYSA-N 0 1 389.521 3.296 10 0 GGAEMN O=C(CSc1nc(C=Cc2ccco2)n[nH]1)Nc1ccc2c(c1)OCCO2 ZINC000010624507 1398905007 /nfs/dbraw/zinc/90/50/07/1398905007.db2.gz NYSNLHHCGVOVTI-GQCTYLIASA-N 0 1 384.417 3.070 10 0 GGAEMN CC[C@@H]1c2cccn2CCN1C(=O)c1cc(COc2cccc(OC)c2)n[nH]1 ZINC000012306239 1399037513 /nfs/dbraw/zinc/03/75/13/1399037513.db2.gz IBEYXDGARFZDSP-LJQANCHMSA-N 0 1 380.448 3.406 10 0 GGAEMN O=C(NC[C@@H](O)CN1CCc2ccccc2C1)Nc1cccc2c1CCCC2 ZINC000043316422 1403746493 /nfs/dbraw/zinc/74/64/93/1403746493.db2.gz BUTZWBWCUGOZQD-HXUWFJFHSA-N 0 1 379.504 3.106 10 0 GGAEMN COc1ccc(OC)c(CNCc2cc3c(c(Br)c2)OCO3)c1 ZINC000043630619 1403793941 /nfs/dbraw/zinc/79/39/41/1403793941.db2.gz AOJHGEZAJPVNKK-UHFFFAOYSA-N 0 1 380.238 3.485 10 0 GGAEMN O=C(c1cc(-c2cccc(Cl)c2)[nH]n1)N1CCN(c2ccc(O)cc2)CC1 ZINC000046455022 1404424056 /nfs/dbraw/zinc/42/40/56/1404424056.db2.gz GKWPYAOBTXLFBQ-UHFFFAOYSA-N 0 1 382.851 3.398 10 0 GGAEMN CC(C)OCCCNC(=O)C1CCN(CCOc2ccccc2Cl)CC1 ZINC000047770383 1404937028 /nfs/dbraw/zinc/93/70/28/1404937028.db2.gz GIFQHSMFCRMHSU-UHFFFAOYSA-N 0 1 382.932 3.362 10 0 GGAEMN COC(=O)Nc1ccc(CNC(=O)NC[C@@H](c2cccs2)N(C)C)cc1 ZINC000047833122 1404967242 /nfs/dbraw/zinc/96/72/42/1404967242.db2.gz FAKQPUIZMIJLOH-HNNXBMFYSA-N 0 1 376.482 3.029 10 0 GGAEMN CNC(=O)c1ccc(CNCc2cnn(-c3ccc(Br)cc3)c2)cc1 ZINC000048711212 1405264772 /nfs/dbraw/zinc/26/47/72/1405264772.db2.gz HICIUKWJFCQILQ-UHFFFAOYSA-N 0 1 399.292 3.284 10 0 GGAEMN O=C(CN1CCC(c2ccc(O)cc2)CC1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000052467952 1406061016 /nfs/dbraw/zinc/06/10/16/1406061016.db2.gz GEEHEVWOEGOVSV-LJQANCHMSA-N 0 1 393.531 3.214 10 0 GGAEMN Fc1ccccc1-c1nnc2ccc(N3CCN(Cc4ccccc4)CC3)nn21 ZINC000057126553 1407529474 /nfs/dbraw/zinc/52/94/74/1407529474.db2.gz HYMYGJWLFZWPQU-UHFFFAOYSA-N 0 1 388.450 3.253 10 0 GGAEMN O=C(NCCN1CCN(Cc2ccccc2)CC1)N[C@@H]1CCCc2ccccc21 ZINC000060916780 1408051516 /nfs/dbraw/zinc/05/15/16/1408051516.db2.gz FMSXCTHZUAWISC-HSZRJFAPSA-N 0 1 392.547 3.181 10 0 GGAEMN COc1ccc(CNC(=O)CNCc2cccc(OCc3ccccn3)c2)cc1 ZINC000064410884 1408549073 /nfs/dbraw/zinc/54/90/73/1408549073.db2.gz GAXWAPVIHCOOFJ-UHFFFAOYSA-N 0 1 391.471 3.075 10 0 GGAEMN CCOc1c(Cl)cc(CNCC(=O)NCc2ccc(OC)cc2)cc1OC ZINC000064411137 1408549548 /nfs/dbraw/zinc/54/95/48/1408549548.db2.gz DPUICCQMTXLGDM-UHFFFAOYSA-N 0 1 392.883 3.162 10 0 GGAEMN Cc1cc(C)c(S(=O)(=O)NCCc2nnc(-c3ccc(F)cc3)[nH]2)c(C)c1 ZINC000064969562 1408632732 /nfs/dbraw/zinc/63/27/32/1408632732.db2.gz JFXFBCYVNVDWAX-UHFFFAOYSA-N 0 1 388.468 3.057 10 0 GGAEMN Cc1ccc(C[C@H]2CCCN(CC(=O)NCc3ccc4c(c3)OCO4)C2)cc1 ZINC000065261212 1408657223 /nfs/dbraw/zinc/65/72/23/1408657223.db2.gz FXAVFLKQQDVVLM-HXUWFJFHSA-N 0 1 380.488 3.295 10 0 GGAEMN CC(C)c1nn(C)c(Cl)c1CNC[C@H](c1cccc(F)c1)N1CCOCC1 ZINC000066877173 1408939479 /nfs/dbraw/zinc/93/94/79/1408939479.db2.gz HCEGDVHOTMYDCZ-GOSISDBHSA-N 0 1 394.922 3.499 10 0 GGAEMN CC(C)c1nn(C)c(Cl)c1CNC[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000066877171 1408939850 /nfs/dbraw/zinc/93/98/50/1408939850.db2.gz HCEGDVHOTMYDCZ-SFHVURJKSA-N 0 1 394.922 3.499 10 0 GGAEMN CC[C@H](C)Oc1cc(CNCc2cccc(S(=O)(=O)NC)c2)ccc1OC ZINC000066988778 1408973248 /nfs/dbraw/zinc/97/32/48/1408973248.db2.gz FHGFDFHNMXEYDW-HNNXBMFYSA-N 0 1 392.521 3.070 10 0 GGAEMN CC[C@@H](C)Oc1cc(CNCc2cccc(S(=O)(=O)NC)c2)ccc1OC ZINC000066988777 1408973351 /nfs/dbraw/zinc/97/33/51/1408973351.db2.gz FHGFDFHNMXEYDW-OAHLLOKOSA-N 0 1 392.521 3.070 10 0 GGAEMN COc1cccc(NC(=O)CN(C)C(=O)CN[C@H](C)c2ccc(Cl)cc2)c1 ZINC000067131933 1409016401 /nfs/dbraw/zinc/01/64/01/1409016401.db2.gz FEWZGCDRMVZPNE-CQSZACIVSA-N 0 1 389.883 3.096 10 0 GGAEMN CC[C@H](C)NC(=O)c1cccc(CNCc2cn(C)nc2-c2cccnc2)c1 ZINC000067212774 1409044688 /nfs/dbraw/zinc/04/46/88/1409044688.db2.gz GTCIYMRRUIQURJ-INIZCTEOSA-N 0 1 377.492 3.300 10 0 GGAEMN CC[C@H](C)NC(=O)c1cccc(CNCc2cn(C)nc2-c2ccncc2)c1 ZINC000067212808 1409044863 /nfs/dbraw/zinc/04/48/63/1409044863.db2.gz DBNLGIJFPWWFOH-INIZCTEOSA-N 0 1 377.492 3.300 10 0 GGAEMN O[C@H](CNCc1cccc2c1OCCO2)COc1cccc(Cl)c1Cl ZINC000067979839 1409269319 /nfs/dbraw/zinc/26/93/19/1409269319.db2.gz GMLNLQCYPCQFAD-CYBMUJFWSA-N 0 1 384.259 3.294 10 0 GGAEMN C[C@H](NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)C1(N2CCOCC2)CCCC1 ZINC000176656688 1428393214 /nfs/dbraw/zinc/39/32/14/1428393214.db2.gz BTLRZLCPWTXDGI-JYJNAYRXSA-N 0 1 378.463 3.218 10 0 GGAEMN O=C(CCN1CCN(c2ccc(Cl)cc2)CC1)N1CCc2sccc2C1 ZINC000069032530 1409548145 /nfs/dbraw/zinc/54/81/45/1409548145.db2.gz FOAVSYNYCFNTAO-UHFFFAOYSA-N 0 1 389.952 3.499 10 0 GGAEMN C[C@@H](Cc1ccccc1F)NC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1 ZINC000069286285 1409605230 /nfs/dbraw/zinc/60/52/30/1409605230.db2.gz DKCQQHOGFSSSGO-AVRDEDQJSA-N 0 1 398.526 3.045 10 0 GGAEMN O=C(C=Cc1ccccc1)NCC(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1 ZINC000069538825 1409649885 /nfs/dbraw/zinc/64/98/85/1409649885.db2.gz RVVGDLPIQOXPBD-MDZDMXLPSA-N 0 1 382.370 3.123 10 0 GGAEMN COc1cccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)c1OC ZINC000069756125 1409692422 /nfs/dbraw/zinc/69/24/22/1409692422.db2.gz CAIHNTPTOJPNGQ-UHFFFAOYSA-N 0 1 381.432 3.155 10 0 GGAEMN COC(=O)c1cccn1C1CCN([C@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)CC1 ZINC000071792469 1409823726 /nfs/dbraw/zinc/82/37/26/1409823726.db2.gz SREHHTMXZGWCTC-YWTNHNAXSA-N 0 1 389.540 3.241 10 0 GGAEMN COC(=O)c1cccn1C1CCN([C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)CC1 ZINC000071792470 1409823743 /nfs/dbraw/zinc/82/37/43/1409823743.db2.gz SREHHTMXZGWCTC-DODZYUBVSA-N 0 1 389.540 3.241 10 0 GGAEMN COC(=O)CCOc1ccccc1NS(=O)(=O)c1ccc(OC)c(Cl)c1 ZINC000078902598 1409942008 /nfs/dbraw/zinc/94/20/08/1409942008.db2.gz YYCXXHJZHYKWDR-UHFFFAOYSA-N 0 1 399.852 3.091 10 0 GGAEMN COC(=O)c1ccc(CCN2CCN(c3cc(C)nc(C(C)C)n3)CC2)cc1 ZINC000079072701 1409955155 /nfs/dbraw/zinc/95/51/55/1409955155.db2.gz FVRBHKWPXHTHKS-UHFFFAOYSA-N 0 1 382.508 3.060 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)cc1F ZINC000086234462 1410044239 /nfs/dbraw/zinc/04/42/39/1410044239.db2.gz GUEJJLVMJYQMID-MSOLQXFVSA-N 0 1 375.488 3.255 10 0 GGAEMN O=C(Nc1ccc(F)cc1)N1CCC2(CC1)COCCN(Cc1cccnc1)C2 ZINC000096078196 1410322628 /nfs/dbraw/zinc/32/26/28/1410322628.db2.gz YOMOEUPOYMAJOA-UHFFFAOYSA-N 0 1 398.482 3.367 10 0 GGAEMN CC(C)CN1CCN(C(=O)c2ccc3ncnc(N4CCCCC4)c3c2)CC1 ZINC000096399967 1410331740 /nfs/dbraw/zinc/33/17/40/1410331740.db2.gz OZNHYZFEWQABHM-UHFFFAOYSA-N 0 1 381.524 3.034 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)/C=C\c3cnn(-c4ccccc4)c3)cc2)CC1 ZINC000097998696 1410393603 /nfs/dbraw/zinc/39/36/03/1410393603.db2.gz VSZJYYCGUGBQJV-GHXNOFRVSA-N 0 1 387.487 3.276 10 0 GGAEMN CCn1cnnc1[C@H]1CCCN(CC(=O)N(Cc2ccccc2)C(C)(C)C)C1 ZINC000103477158 1410862064 /nfs/dbraw/zinc/86/20/64/1410862064.db2.gz QGXMLVHAZUDCSY-IBGZPJMESA-N 0 1 383.540 3.305 10 0 GGAEMN NC(=O)C1CCN(c2ncccc2CNCc2cc(Cl)cc(Cl)c2)CC1 ZINC000105430165 1411065737 /nfs/dbraw/zinc/06/57/37/1411065737.db2.gz CEZDSEZYFQHMGH-UHFFFAOYSA-N 0 1 393.318 3.380 10 0 GGAEMN O[C@H](CNCc1c(F)cccc1N1CCCC1)COc1ccc(F)c(F)c1 ZINC000105499881 1411072571 /nfs/dbraw/zinc/07/25/71/1411072571.db2.gz GNUIWRRMASAYLA-CQSZACIVSA-N 0 1 380.410 3.234 10 0 GGAEMN COc1cccc(CNC[C@H](O)COc2ccc(F)c(F)c2)c1OC(C)C ZINC000105499903 1411073154 /nfs/dbraw/zinc/07/31/54/1411073154.db2.gz AGJDKBMXPBIDLH-HNNXBMFYSA-N 0 1 381.419 3.290 10 0 GGAEMN CN(C)CCN(CC(=O)OC(C)(C)C)C(=O)CCC(=O)c1ccc(Cl)cc1 ZINC000110056669 1411828190 /nfs/dbraw/zinc/82/81/90/1411828190.db2.gz FUISAXLDJYYVEO-UHFFFAOYSA-N 0 1 396.915 3.035 10 0 GGAEMN CC(C)C[C@@H](C)Oc1cc(CNCc2cnc(N3CCOCC3)s2)ccn1 ZINC000111387716 1411938796 /nfs/dbraw/zinc/93/87/96/1411938796.db2.gz GXWNXODEWDXHLZ-MRXNPFEDSA-N 0 1 390.553 3.478 10 0 GGAEMN COc1ccc(-c2n[nH]c(CNC(=O)N[C@H](C)Cc3ccccc3F)n2)cc1 ZINC000111837520 1412035628 /nfs/dbraw/zinc/03/56/28/1412035628.db2.gz CRTWQTMCCALGJQ-CYBMUJFWSA-N 0 1 383.427 3.050 10 0 GGAEMN COc1ccc(-c2nc(CNC(=O)N[C@H](C)Cc3ccccc3F)n[nH]2)cc1 ZINC000111837520 1412035636 /nfs/dbraw/zinc/03/56/36/1412035636.db2.gz CRTWQTMCCALGJQ-CYBMUJFWSA-N 0 1 383.427 3.050 10 0 GGAEMN O=C1[C@@H](NCc2ccc(OC[C@@H]3CCCO3)cc2)CCN1c1ccccc1F ZINC000112366737 1412136258 /nfs/dbraw/zinc/13/62/58/1412136258.db2.gz HJMJFTOLGIXIMF-ICSRJNTNSA-N 0 1 384.451 3.279 10 0 GGAEMN C[C@H](N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)C(=O)Nc1ncccn1 ZINC000112527330 1412162596 /nfs/dbraw/zinc/16/25/96/1412162596.db2.gz FRHUWFYMFQZZMH-HOTGVXAUSA-N 0 1 389.459 3.407 10 0 GGAEMN COc1cc([C@@H](C)N[C@@H](C)C(=O)Nc2ncccn2)ccc1OC1CCCC1 ZINC000112529026 1412163026 /nfs/dbraw/zinc/16/30/26/1412163026.db2.gz GREHBEDAEUYXHO-CABCVRRESA-N 0 1 384.480 3.484 10 0 GGAEMN COc1cc([C@H](C)N[C@@H](C)C(=O)Nc2ncccn2)ccc1OC1CCCC1 ZINC000112529023 1412163299 /nfs/dbraw/zinc/16/32/99/1412163299.db2.gz GREHBEDAEUYXHO-GJZGRUSLSA-N 0 1 384.480 3.484 10 0 GGAEMN COc1ccc(CCNC(=O)[C@H](C)N[C@@H](C)c2ccc(F)c(F)c2)cc1OC ZINC000114745697 1412516128 /nfs/dbraw/zinc/51/61/28/1412516128.db2.gz DJXXWOFNNIAKQF-KBPBESRZSA-N 0 1 392.446 3.380 10 0 GGAEMN COc1ccc(CNCc2cccc(CN3CCOCC3)c2)c(OC(F)F)c1 ZINC000114758848 1412520730 /nfs/dbraw/zinc/52/07/30/1412520730.db2.gz CLJMGCXQMWHJHB-UHFFFAOYSA-N 0 1 392.446 3.419 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cccc(CNCc3ccncc3)c2)cc1 ZINC000115627047 1412738870 /nfs/dbraw/zinc/73/88/70/1412738870.db2.gz BXYBNSCHJRJQPS-UHFFFAOYSA-N 0 1 383.473 3.181 10 0 GGAEMN COc1ccccc1[C@H](C)NC(=O)[C@@H](C)Sc1nc(-c2ccccn2)n[nH]1 ZINC000117114059 1413001185 /nfs/dbraw/zinc/00/11/85/1413001185.db2.gz CZKTYVZODCLPOG-QWHCGFSZSA-N 0 1 383.477 3.233 10 0 GGAEMN COc1ccccc1[C@H](C)NC(=O)[C@H](C)Sc1nc(-c2ccccn2)n[nH]1 ZINC000117114064 1413001728 /nfs/dbraw/zinc/00/17/28/1413001728.db2.gz CZKTYVZODCLPOG-STQMWFEESA-N 0 1 383.477 3.233 10 0 GGAEMN Cc1ccc(N2CCC[C@H](NC(=O)CCc3nc4cccc(C)c4[nH]3)C2=O)cc1 ZINC000177336714 1428696775 /nfs/dbraw/zinc/69/67/75/1428696775.db2.gz RJMGBYZXJFDNKC-IBGZPJMESA-N 0 1 390.487 3.424 10 0 GGAEMN CC(=O)N(C)C1CCN([C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)CC1 ZINC000119844122 1413590340 /nfs/dbraw/zinc/59/03/40/1413590340.db2.gz HKYYRXOLPRFDNB-SJORKVTESA-N 0 1 381.520 3.348 10 0 GGAEMN COc1cc(OC)c(OC)cc1CN1CCC(C(=O)N2CCCCCC2)CC1 ZINC000119903778 1413611814 /nfs/dbraw/zinc/61/18/14/1413611814.db2.gz UEHKYQKXZDBRCM-UHFFFAOYSA-N 0 1 390.524 3.327 10 0 GGAEMN CCOc1cc(CNc2cccc(CN3CCC[C@@H]3C(N)=O)c2)ccc1OC ZINC000120058167 1413670422 /nfs/dbraw/zinc/67/04/22/1413670422.db2.gz GKCGTZVIASLZOL-LJQANCHMSA-N 0 1 383.492 3.156 10 0 GGAEMN CCOc1cc(CNc2cccc(CN3CCC[C@H]3C(N)=O)c2)ccc1OC ZINC000120058324 1413671079 /nfs/dbraw/zinc/67/10/79/1413671079.db2.gz GKCGTZVIASLZOL-IBGZPJMESA-N 0 1 383.492 3.156 10 0 GGAEMN NC(=O)[C@H]1CCCN1Cc1cccc(NCc2csc(-c3ccccn3)n2)c1 ZINC000120072883 1413675977 /nfs/dbraw/zinc/67/59/77/1413675977.db2.gz FNJWMCCIGNWMBX-LJQANCHMSA-N 0 1 393.516 3.267 10 0 GGAEMN NC(=O)[C@@H]1CCCN1Cc1cccc(NCc2csc(-c3ccccn3)n2)c1 ZINC000120073026 1413676734 /nfs/dbraw/zinc/67/67/34/1413676734.db2.gz FNJWMCCIGNWMBX-IBGZPJMESA-N 0 1 393.516 3.267 10 0 GGAEMN Cc1nn(-c2ccccc2)cc1CNc1cccc(CN2CCC[C@H]2C(N)=O)c1 ZINC000120110630 1413691822 /nfs/dbraw/zinc/69/18/22/1413691822.db2.gz BHCIDRNUXUCKHV-QFIPXVFZSA-N 0 1 389.503 3.243 10 0 GGAEMN COc1cc2c(c(CNc3cccc(CN4CCC[C@@H]4C(N)=O)c3)c1)O[C@H](C)C2 ZINC000120124118 1413696807 /nfs/dbraw/zinc/69/68/07/1413696807.db2.gz FRZKRWZONILQHM-QVKFZJNVSA-N 0 1 395.503 3.080 10 0 GGAEMN NC(=O)[C@H]1CCCN1Cc1cccc(NCc2ccc(OCC(F)F)cc2)c1 ZINC000120125909 1413697648 /nfs/dbraw/zinc/69/76/48/1413697648.db2.gz HEDPUTGEJSYLAD-LJQANCHMSA-N 0 1 389.446 3.392 10 0 GGAEMN COCCOc1ccc([C@H](C)N[C@H](C)C(=O)NC2CCCCC2)cc1OC ZINC000120350830 1413799558 /nfs/dbraw/zinc/79/95/58/1413799558.db2.gz HSCZYTJQZBGZDM-JKSUJKDBSA-N 0 1 378.513 3.208 10 0 GGAEMN COc1cc(CN2CCC(C(=O)N3CCCCCC3)CC2)cc(OC)c1OC ZINC000121046416 1413988055 /nfs/dbraw/zinc/98/80/55/1413988055.db2.gz XCLPLJBMWARJHN-UHFFFAOYSA-N 0 1 390.524 3.327 10 0 GGAEMN COc1ccc(CN2CCN(Cc3sccc3C)CC2)c(OC)c1OC ZINC000121070912 1413996548 /nfs/dbraw/zinc/99/65/48/1413996548.db2.gz HPBIBIIHAWBREB-UHFFFAOYSA-N 0 1 376.522 3.400 10 0 GGAEMN C[C@H]1CN(Cc2ccccc2)CCN1CC(=O)Nc1ccccc1OC(F)F ZINC000121189995 1414038972 /nfs/dbraw/zinc/03/89/72/1414038972.db2.gz BCMRSQNPSIYIGD-INIZCTEOSA-N 0 1 389.446 3.433 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000121430326 1414119630 /nfs/dbraw/zinc/11/96/30/1414119630.db2.gz ICVNNXCBTMBWEU-RLFYNMQTSA-N 0 1 383.467 3.390 10 0 GGAEMN CC(C)(C)OC(=O)N[C@H]1CCCN(C(=O)c2cn[nH]c2-c2ccccc2F)C1 ZINC000125048487 1415099666 /nfs/dbraw/zinc/09/96/66/1415099666.db2.gz CKMHWKDEUDLNMC-ZDUSSCGKSA-N 0 1 388.443 3.345 10 0 GGAEMN C[C@H](NCC(=O)NCc1ccccc1Cn1cccn1)c1ccc(F)c(F)c1 ZINC000126298860 1415410032 /nfs/dbraw/zinc/41/00/32/1415410032.db2.gz HMCKLVSGAJXAIR-HNNXBMFYSA-N 0 1 384.430 3.177 10 0 GGAEMN COc1ccc(Br)c(CNC[C@H](O)c2cc(OC)cc(OC)c2)c1 ZINC000128183694 1415933467 /nfs/dbraw/zinc/93/34/67/1415933467.db2.gz BYMXOTQDEGCAQI-SFHVURJKSA-N 0 1 396.281 3.298 10 0 GGAEMN Cn1nc(C2CCC2)cc1NS(=O)(=O)c1ccccc1OC(F)(F)F ZINC000128856112 1416085982 /nfs/dbraw/zinc/08/59/82/1416085982.db2.gz NKZKDJKQQNGLSZ-UHFFFAOYSA-N 0 1 375.372 3.387 10 0 GGAEMN O=C([C@H](Sc1ccccc1)c1ccccc1)N1CCC[C@@H](c2nn[nH]n2)C1 ZINC000129270578 1416182778 /nfs/dbraw/zinc/18/27/78/1416182778.db2.gz HSJBWTHFFDPAFU-SJLPKXTDSA-N 0 1 379.489 3.439 10 0 GGAEMN COc1ccccc1-c1cc(C(=O)N2CCC(C(=O)N[C@@H](C)C(C)C)CC2)n[nH]1 ZINC000129276746 1416183804 /nfs/dbraw/zinc/18/38/04/1416183804.db2.gz HRKZGSXXGUPHTC-HNNXBMFYSA-N 0 1 398.507 3.098 10 0 GGAEMN Cc1[nH]c(S(=O)(=O)Cc2cnn(C)c2C(F)(F)F)nc1Cc1ccccc1 ZINC000131100962 1416508668 /nfs/dbraw/zinc/50/86/68/1416508668.db2.gz BQICCBNVUGUNKU-UHFFFAOYSA-N 0 1 398.410 3.035 10 0 GGAEMN Cn1c(CNC[C@H](O)COc2ccc(F)cc2)nc2cc(C(F)(F)F)ccc21 ZINC000131146967 1416516211 /nfs/dbraw/zinc/51/62/11/1416516211.db2.gz DMSXYERWHQTSHE-AWEZNQCLSA-N 0 1 397.372 3.261 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCCCC[C@H]2C[C@H](O)c2ccccc2)[nH]1 ZINC000131705390 1416600501 /nfs/dbraw/zinc/60/05/01/1416600501.db2.gz DGBFOINVIXOHIK-ROUUACIJSA-N 0 1 388.537 3.490 10 0 GGAEMN CCCOc1ccc(CNCCS(=O)(=O)c2ccc(F)cc2)cc1OC ZINC000132579956 1416787923 /nfs/dbraw/zinc/78/79/23/1416787923.db2.gz HZJVDSUJLUEICI-UHFFFAOYSA-N 0 1 381.469 3.187 10 0 GGAEMN CC(C)NC(=O)c1ccc(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)cc1 ZINC000132888406 1416827490 /nfs/dbraw/zinc/82/74/90/1416827490.db2.gz BIYOHGZTIYQJKV-UHFFFAOYSA-N 0 1 388.276 3.327 10 0 GGAEMN O=C1[C@@H](NCc2ccc(N3CCCC3)nc2)CCN1CCCc1ccccc1 ZINC000133315178 1416877710 /nfs/dbraw/zinc/87/77/10/1416877710.db2.gz FHRWYQBMFMTPFY-NRFANRHFSA-N 0 1 378.520 3.005 10 0 GGAEMN C[C@H](c1ccccc1)N(C)C(=O)C(=O)Nc1ccccc1CN1CCSCC1 ZINC000143091657 1417612585 /nfs/dbraw/zinc/61/25/85/1417612585.db2.gz GOUIAAXOMMIUHB-QGZVFWFLSA-N 0 1 397.544 3.394 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2cc(Cl)c(OC)c(OC)c2)C1=O ZINC000151581741 1418031669 /nfs/dbraw/zinc/03/16/69/1418031669.db2.gz FHORAITXUTWDLC-HNNXBMFYSA-N 0 1 390.867 3.261 10 0 GGAEMN CN1CCN(Cc2cccc(NC(=O)[C@H]3C[C@H]3c3cccc(F)c3F)c2)CC1 ZINC000152277563 1418191837 /nfs/dbraw/zinc/19/18/37/1418191837.db2.gz GZBZHRJDLKEGHR-OALUTQOASA-N 0 1 385.458 3.454 10 0 GGAEMN CN1CCN(Cc2cccc(NC(=O)[C@@H]3C[C@H]3c3cccc(F)c3F)c2)CC1 ZINC000152277468 1418192071 /nfs/dbraw/zinc/19/20/71/1418192071.db2.gz GZBZHRJDLKEGHR-RBUKOAKNSA-N 0 1 385.458 3.454 10 0 GGAEMN COc1cccc(C(=O)N2CCN(Cc3cnc(-c4ccccc4)[nH]3)CC2)c1 ZINC000179423914 1429370150 /nfs/dbraw/zinc/37/01/50/1429370150.db2.gz NKCIKXQLRJAMKE-UHFFFAOYSA-N 0 1 376.460 3.043 10 0 GGAEMN C[C@H](Cc1ccccc1F)NC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000179557254 1429431210 /nfs/dbraw/zinc/43/12/10/1429431210.db2.gz CLDHNSZIVDIEBI-SNVBAGLBSA-N 0 1 390.365 3.326 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)N[C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000179585217 1429453092 /nfs/dbraw/zinc/45/30/92/1429453092.db2.gz CYOLKWNCQFEPPH-OFQRWUPVSA-N 0 1 398.450 3.129 10 0 GGAEMN C[C@H](NCCS(=O)(=O)c1ccccc1)c1ccc(OCc2nccn2C)cc1 ZINC000154125197 1422843980 /nfs/dbraw/zinc/84/39/80/1422843980.db2.gz ASMQERAXUYDIRP-KRWDZBQOSA-N 0 1 399.516 3.124 10 0 GGAEMN O=C1CCCc2cc(NS(=O)(=O)c3cnc(Cl)c(Cl)c3)ccc2N1 ZINC000154427263 1422887430 /nfs/dbraw/zinc/88/74/30/1422887430.db2.gz XRXPBHCMOOKKKS-UHFFFAOYSA-N 0 1 386.260 3.464 10 0 GGAEMN CC(C)(C)OC(=O)N[C@H]1CCCN(Cc2ccccc2N2CCOCC2)C1 ZINC000154904724 1423075279 /nfs/dbraw/zinc/07/52/79/1423075279.db2.gz RHBHQTIXQYTHGT-SFHVURJKSA-N 0 1 375.513 3.012 10 0 GGAEMN COc1ccc([C@@H]2CCN(CC(=O)N(C)Cc3ccc(OC)c(OC)c3)C2)cc1 ZINC000155321010 1423316099 /nfs/dbraw/zinc/31/60/99/1423316099.db2.gz GAXNOGLFRKQSFK-LJQANCHMSA-N 0 1 398.503 3.160 10 0 GGAEMN Cc1ccccc1COc1cccc(CC(=O)N2CCC[C@H](c3nn[nH]n3)C2)c1 ZINC000155483550 1423382201 /nfs/dbraw/zinc/38/22/01/1423382201.db2.gz CIZCGEUEXNYYOD-SFHVURJKSA-N 0 1 391.475 3.036 10 0 GGAEMN O=C(CNCc1cc(Br)cc(C(F)(F)F)c1)NCC(F)(F)F ZINC000155616586 1423449050 /nfs/dbraw/zinc/44/90/50/1423449050.db2.gz CYMZZVAMCIAESC-UHFFFAOYSA-N 0 1 393.125 3.236 10 0 GGAEMN CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(Cc3nn[n-]n3)cc2)cc1)C(C)C ZINC000120622808 1423686031 /nfs/dbraw/zinc/68/60/31/1423686031.db2.gz IEJZUOBIUQFVNI-UHFFFAOYSA-N 0 1 378.480 3.273 10 0 GGAEMN CC[N@H+](Cc1ccc(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cc1)C(C)C ZINC000120622808 1423686032 /nfs/dbraw/zinc/68/60/32/1423686032.db2.gz IEJZUOBIUQFVNI-UHFFFAOYSA-N 0 1 378.480 3.273 10 0 GGAEMN CC[N@@H+](Cc1ccc(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)cc1)C(C)C ZINC000120622808 1423686036 /nfs/dbraw/zinc/68/60/36/1423686036.db2.gz IEJZUOBIUQFVNI-UHFFFAOYSA-N 0 1 378.480 3.273 10 0 GGAEMN C[C@H]1CCN(CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1n1ccnc1 ZINC000156511564 1423821020 /nfs/dbraw/zinc/82/10/20/1423821020.db2.gz BOQYGGIQNOBAEJ-UGKGYDQZSA-N 0 1 380.536 3.247 10 0 GGAEMN CC1(C(=O)Nc2ccc(Cc3nnn[n-]3)cc2)CC[NH+](Cc2ccccc2)CC1 ZINC000184870491 1424063398 /nfs/dbraw/zinc/06/33/98/1424063398.db2.gz OCAVUTXJMNWVEF-UHFFFAOYSA-N 0 1 390.491 3.031 10 0 GGAEMN O=C1[C@H](NCc2cnn(-c3ccc(Cl)cc3)c2)CCCN1CC(F)(F)F ZINC000158361322 1424237034 /nfs/dbraw/zinc/23/70/34/1424237034.db2.gz DNHIMKHGZGUFIO-OAHLLOKOSA-N 0 1 386.805 3.169 10 0 GGAEMN CCc1nc([C@H]2CN(C(=O)Nc3ccccc3N3CCCCCC3)CCO2)n[nH]1 ZINC000158496676 1424272486 /nfs/dbraw/zinc/27/24/86/1424272486.db2.gz WWGGQNHXBWTNRU-GOSISDBHSA-N 0 1 398.511 3.353 10 0 GGAEMN C[C@H]1CCN(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)C[C@@H]1n1ccnc1 ZINC000159018727 1424397235 /nfs/dbraw/zinc/39/72/35/1424397235.db2.gz GDDIUKQFKOCAKR-YJBOKZPZSA-N 0 1 392.450 3.026 10 0 GGAEMN CCN(C[C@@H](O)c1ccc(C)cc1)[C@@H](C)C(=O)Nc1cc(C(=O)OC)ccc1C ZINC000159950614 1424555688 /nfs/dbraw/zinc/55/56/88/1424555688.db2.gz FKSJMMHXLWXAPQ-LAUBAEHRSA-N 0 1 398.503 3.473 10 0 GGAEMN COc1cc(OC)cc(N2CC[C@H](NCc3cnc(CC(C)C)s3)C2=O)c1 ZINC000162719513 1424884472 /nfs/dbraw/zinc/88/44/72/1424884472.db2.gz GDVJXQXNEPFAGP-SFHVURJKSA-N 0 1 389.521 3.254 10 0 GGAEMN Cc1ccc(CNCc2cccnc2N2CCOCC2)cc1Br ZINC000163473179 1425004437 /nfs/dbraw/zinc/00/44/37/1425004437.db2.gz FEOXYIKMFORQQL-UHFFFAOYSA-N 0 1 376.298 3.279 10 0 GGAEMN C[C@@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccc(F)cc1F ZINC000163489802 1425007377 /nfs/dbraw/zinc/00/73/77/1425007377.db2.gz HCMBYYSCGXVJDO-NWDGAFQWSA-N 0 1 382.432 3.046 10 0 GGAEMN CC(=O)NCCCN1CCN(Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000164493656 1425117629 /nfs/dbraw/zinc/11/76/29/1425117629.db2.gz HLPWNNJQFAGVIK-UHFFFAOYSA-N 0 1 375.513 3.198 10 0 GGAEMN COc1cccc(CN2CCC[C@H](COc3ccccc3C(=O)NC3CC3)C2)n1 ZINC000169765294 1425250138 /nfs/dbraw/zinc/25/01/38/1425250138.db2.gz LFNVYNKVGIHCFR-KRWDZBQOSA-N 0 1 395.503 3.273 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC(OCCOc2ccc(F)cc2)CC1 ZINC000169776384 1425253349 /nfs/dbraw/zinc/25/33/49/1425253349.db2.gz BEDGRKZSFLTHOW-UHFFFAOYSA-N 0 1 383.423 3.402 10 0 GGAEMN Cc1cnc(CC2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)n1CC1CC1 ZINC000169788086 1425257652 /nfs/dbraw/zinc/25/76/52/1425257652.db2.gz OSAOFUPUOHHRDN-OAQYLSRUSA-N 0 1 395.503 3.223 10 0 GGAEMN CCn1cc(CN2CCC[C@H](c3nc(CCOCc4ccccc4)no3)C2)cn1 ZINC000169788454 1425258009 /nfs/dbraw/zinc/25/80/09/1425258009.db2.gz VMTHEONOGHZKKD-FQEVSTJZSA-N 0 1 395.507 3.425 10 0 GGAEMN Cc1nc(Cl)ccc1NS(=O)(=O)c1cc(Br)ccc1N ZINC000235809378 1433373798 /nfs/dbraw/zinc/37/37/98/1433373798.db2.gz QABMALXFTDMKCT-UHFFFAOYSA-N 0 1 376.663 3.189 10 0 GGAEMN CN1CCN(Cc2cccc(NC(=O)c3cnc(-c4ccncc4)s3)c2)CC1 ZINC000172801914 1426195671 /nfs/dbraw/zinc/19/56/71/1426195671.db2.gz RWZXWHXMERTHMT-UHFFFAOYSA-N 0 1 393.516 3.205 10 0 GGAEMN Cc1c(C(=O)N2CCN(C3CCCC3)CC2)nnn1-c1ccc(Cl)cc1F ZINC000173051461 1426323572 /nfs/dbraw/zinc/32/35/72/1426323572.db2.gz IHPDYBPGNJULJT-UHFFFAOYSA-N 0 1 391.878 3.069 10 0 GGAEMN COc1ccc(-c2cc(C(=O)N3CCO[C@@H](c4n[nH]c(C)n4)C3)sc2C)cc1 ZINC000173087534 1426337230 /nfs/dbraw/zinc/33/72/30/1426337230.db2.gz NFFAZLFWFAEVIR-QGZVFWFLSA-N 0 1 398.488 3.372 10 0 GGAEMN COc1ccc(CN2CCC(N3CCNC3=O)CC2)cc1SC(F)(F)F ZINC000173550462 1426723497 /nfs/dbraw/zinc/72/34/97/1426723497.db2.gz FORMFKRUDGSROA-UHFFFAOYSA-N 0 1 389.443 3.297 10 0 GGAEMN CCc1cc2oc(=O)cc(CN3CCC[C@@H]3CN3CCOCC3)c2cc1Cl ZINC000173689330 1426821724 /nfs/dbraw/zinc/82/17/24/1426821724.db2.gz GYASLLZNVYJGDV-QGZVFWFLSA-N 0 1 390.911 3.305 10 0 GGAEMN CCc1ccc(OC[C@H](O)CN2CCc3c(cccc3N3CCOC3=O)C2)cc1 ZINC000174060305 1426979765 /nfs/dbraw/zinc/97/97/65/1426979765.db2.gz WKDLIIIOEZCFQK-LJQANCHMSA-N 0 1 396.487 3.004 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)[nH]1 ZINC000174651714 1427288972 /nfs/dbraw/zinc/28/89/72/1427288972.db2.gz FAMOFQULGLNJHS-UHFFFAOYSA-N 0 1 387.509 3.250 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2ccc(Oc3cccnc3)c(F)c2)[nH]1 ZINC000174665564 1427296955 /nfs/dbraw/zinc/29/69/55/1427296955.db2.gz FLOXTNKIZRWJHW-UHFFFAOYSA-N 0 1 387.440 3.238 10 0 GGAEMN COc1ccc([C@@H]2CC[N@@H+](CCCF)C[C@@H]2[N-]C(=O)C(F)(F)F)cc1F ZINC000180173618 1429779164 /nfs/dbraw/zinc/77/91/64/1429779164.db2.gz ADFAQKDAANGHFX-JSGCOSHPSA-N 0 1 380.357 3.030 10 0 GGAEMN COC(=O)[C@@H](NC(=O)c1cccc(-c2nnc[nH]2)c1)c1ccc2ccccc2c1 ZINC000180915561 1430111564 /nfs/dbraw/zinc/11/15/64/1430111564.db2.gz BBSXMKKACNRBQI-IBGZPJMESA-N 0 1 386.411 3.269 10 0 GGAEMN CC(C)c1nc2n(n1)C[C@@H](NC(=O)Nc1ccc3nc(C(F)F)[nH]c3c1)CC2 ZINC000181106545 1430212552 /nfs/dbraw/zinc/21/25/52/1430212552.db2.gz DRUAVKGWVBNNOB-NSHDSACASA-N 0 1 389.410 3.352 10 0 GGAEMN COc1ccc2c(c1)[nH]cc(C(=O)N1CCO[C@@H](Cc3ccccc3)C1)c2=O ZINC000181191100 1430243420 /nfs/dbraw/zinc/24/34/20/1430243420.db2.gz LCKLEAQULKQTHA-KRWDZBQOSA-N 0 1 378.428 3.033 10 0 GGAEMN C[C@H](NCC(=O)Nc1ccnn1C1CCCC1)c1cccc(N2CCCC2=O)c1 ZINC000181441608 1430300293 /nfs/dbraw/zinc/30/02/93/1430300293.db2.gz CFDANLIJZMSGNK-INIZCTEOSA-N 0 1 395.507 3.414 10 0 GGAEMN COc1ccc(Nc2nc(C(=O)N3CCCC[C@@H]3c3nnc[nH]3)cs2)cc1 ZINC000182108746 1430413370 /nfs/dbraw/zinc/41/33/70/1430413370.db2.gz CBNCCXCKYUUOHB-OAHLLOKOSA-N 0 1 384.465 3.381 10 0 GGAEMN C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC(CC(=O)N(C)C)CC1 ZINC000182220330 1430432092 /nfs/dbraw/zinc/43/20/92/1430432092.db2.gz HWTAVDOPMWDXDM-AWEZNQCLSA-N 0 1 397.922 3.016 10 0 GGAEMN Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N(C)C[C@H](C)c1nn[nH]n1 ZINC000183419677 1430706779 /nfs/dbraw/zinc/70/67/79/1430706779.db2.gz NFXMHALWFNAINE-ZETCQYMHSA-N 0 1 384.387 3.012 10 0 GGAEMN COc1cc(Br)cc(CN2CCCN(c3ccccn3)CC2)c1O ZINC000184807536 1430983619 /nfs/dbraw/zinc/98/36/19/1430983619.db2.gz RDJREPUVYDOUGI-UHFFFAOYSA-N 0 1 392.297 3.271 10 0 GGAEMN COC(=O)c1ccc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)c(F)c1 ZINC000186029121 1431314013 /nfs/dbraw/zinc/31/40/13/1431314013.db2.gz ISZIKJPFWALHQK-QILLFSRXSA-N 0 1 392.471 3.347 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(Cc3cc(F)cc4c3OCOC4)C[C@@H]21 ZINC000186036495 1431316396 /nfs/dbraw/zinc/31/63/96/1431316396.db2.gz XIUCCFXQUGJIDR-DOPJRALCSA-N 0 1 392.471 3.427 10 0 GGAEMN C[C@@H](NC(=O)[C@H](C)N1CCC(Cn2cncn2)CC1)c1cccc2ccccc21 ZINC000186224210 1431356726 /nfs/dbraw/zinc/35/67/26/1431356726.db2.gz ACIKDXALSNOFMO-MSOLQXFVSA-N 0 1 391.519 3.409 10 0 GGAEMN CCOC(=O)c1nn(C)cc1CN1CCCCC[C@H]1C[C@H](O)c1ccccc1 ZINC000186265420 1431366283 /nfs/dbraw/zinc/36/62/83/1431366283.db2.gz DLJNDWNQFSLOTM-PMACEKPBSA-N 0 1 385.508 3.465 10 0 GGAEMN CN1CCOc2ccc(NC(=O)NNC(=O)c3c(Cl)cccc3Cl)cc21 ZINC000186350355 1431389792 /nfs/dbraw/zinc/38/97/92/1431389792.db2.gz GFCYEIUTLBCBIT-UHFFFAOYSA-N 0 1 395.246 3.289 10 0 GGAEMN COc1ccc(C[C@H](C)CN2CCN(CC(=O)Nc3ccccc3)CC2)cc1F ZINC000186605632 1431466779 /nfs/dbraw/zinc/46/67/79/1431466779.db2.gz GCUWITALDJTPEN-SFHVURJKSA-N 0 1 399.510 3.269 10 0 GGAEMN COc1ccccc1CN(CCO)C[C@H](O)c1ccc(F)c(Br)c1 ZINC000186943662 1431573112 /nfs/dbraw/zinc/57/31/12/1431573112.db2.gz CQOCFCLTZDGQFY-KRWDZBQOSA-N 0 1 398.272 3.125 10 0 GGAEMN COc1ccccc1CN(CCO)C[C@@H](O)c1ccc(F)c(Br)c1 ZINC000186943683 1431573354 /nfs/dbraw/zinc/57/33/54/1431573354.db2.gz CQOCFCLTZDGQFY-QGZVFWFLSA-N 0 1 398.272 3.125 10 0 GGAEMN C[C@H]1CN(CC(C)(C)O)CCN1C(=O)COC(c1ccccc1)c1ccccc1 ZINC000186950842 1431574912 /nfs/dbraw/zinc/57/49/12/1431574912.db2.gz IAMZBPFZWIOLOT-IBGZPJMESA-N 0 1 396.531 3.096 10 0 GGAEMN COc1ccc(-c2ccncc2)cc1CN[C@H]1CC(=O)N(CC(F)(F)F)C1 ZINC000187255434 1431668692 /nfs/dbraw/zinc/66/86/92/1431668692.db2.gz TWWDQKQQSQLQNM-INIZCTEOSA-N 0 1 379.382 3.010 10 0 GGAEMN C[C@H](CCc1ccccc1)NC(=O)c1n[nH]c2c1CN(C(=O)OC(C)(C)C)CC2 ZINC000187314128 1431693317 /nfs/dbraw/zinc/69/33/17/1431693317.db2.gz LEFKEXXDQVBZJU-OAHLLOKOSA-N 0 1 398.507 3.454 10 0 GGAEMN O=C(NC1CCC(Oc2ncccc2Cl)CC1)N1CCN2CCCC[C@@H]2C1 ZINC000187542494 1431762116 /nfs/dbraw/zinc/76/21/16/1431762116.db2.gz FYGBEGVKXJPKAL-AQFXKWCLSA-N 0 1 392.931 3.305 10 0 GGAEMN C[C@H]1c2ccccc2CCN1C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2 ZINC000187804030 1431814443 /nfs/dbraw/zinc/81/44/43/1431814443.db2.gz GCLGOVZYYRNFES-AWEZNQCLSA-N 0 1 396.491 3.462 10 0 GGAEMN Cc1cc(N2CC[C@@H](NCc3ccc(F)nc3)C2=O)ccc1Br ZINC000189182644 1432059650 /nfs/dbraw/zinc/05/96/50/1432059650.db2.gz CWYBLLDAZIPBKZ-OAHLLOKOSA-N 0 1 378.245 3.187 10 0 GGAEMN CCN(CCc1nccs1)[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000189752367 1432223732 /nfs/dbraw/zinc/22/37/32/1432223732.db2.gz DSBGTSLQAPLKAO-KRWDZBQOSA-N 0 1 379.476 3.477 10 0 GGAEMN C[C@H](NC(=O)[C@H](C)N1CCN(CC(C)(C)O)[C@@H](C)C1)c1cccc2ccccc21 ZINC000189879476 1432260565 /nfs/dbraw/zinc/26/05/65/1432260565.db2.gz HOYKAFANLVXRFT-FHWLQOOXSA-N 0 1 397.563 3.183 10 0 GGAEMN C[C@H]1C[N@@H+](Cc2cc(Br)cc(Br)c2[O-])CC[C@@H]1O ZINC000190048183 1432310710 /nfs/dbraw/zinc/31/07/10/1432310710.db2.gz AFBOSVYGJYLEJA-UFBFGSQYSA-N 0 1 379.092 3.120 10 0 GGAEMN COc1cc(S(=O)(=O)N(C)C2CCN(Cc3ccccc3)CC2)ccc1F ZINC000190657177 1432433849 /nfs/dbraw/zinc/43/38/49/1432433849.db2.gz SRMQUBQOSASZEH-UHFFFAOYSA-N 0 1 392.496 3.119 10 0 GGAEMN COc1cc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)ccc1F ZINC000190759853 1432469978 /nfs/dbraw/zinc/46/99/78/1432469978.db2.gz XPQVKOPZSOVKFU-WBVHZDCISA-N 0 1 392.496 3.166 10 0 GGAEMN O=C(Nc1ccc(-c2n[nH]c(-c3ccccc3)n2)cc1)[C@H]1CCCCC(=O)N1 ZINC000194384305 1433169941 /nfs/dbraw/zinc/16/99/41/1433169941.db2.gz DATAABZNOXWUPX-QGZVFWFLSA-N 0 1 375.432 3.136 10 0 GGAEMN O=C(Nc1ccc(-c2nc(-c3ccccc3)n[nH]2)cc1)[C@H]1CCCCC(=O)N1 ZINC000194384305 1433169943 /nfs/dbraw/zinc/16/99/43/1433169943.db2.gz DATAABZNOXWUPX-QGZVFWFLSA-N 0 1 375.432 3.136 10 0 GGAEMN CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)[C@H]1Cc2ccccc2CN1 ZINC000237118370 1433389698 /nfs/dbraw/zinc/38/96/98/1433389698.db2.gz GUTKUSJUNAMYCP-JOCHJYFZSA-N 0 1 392.478 3.321 10 0 GGAEMN COc1ccc(CNC(=O)CNCc2cc(C)c(OC(F)F)c(C)c2)cc1 ZINC000237285583 1433395747 /nfs/dbraw/zinc/39/57/47/1433395747.db2.gz HXXSHIRYRLPSHR-UHFFFAOYSA-N 0 1 378.419 3.319 10 0 GGAEMN CCOC(=O)c1ccc(NC(=O)Nc2ccc(N3CCN(C)CC3)cc2)cc1 ZINC000242766042 1433447405 /nfs/dbraw/zinc/44/74/05/1433447405.db2.gz DPDZTAWKCOAGFO-UHFFFAOYSA-N 0 1 382.464 3.259 10 0 GGAEMN COC(=O)c1ccccc1NC(=S)Nc1ccc(N2CCN(C)CC2)cc1 ZINC000244272457 1433452435 /nfs/dbraw/zinc/45/24/35/1433452435.db2.gz WPEPZLQIDGIUIQ-UHFFFAOYSA-N 0 1 384.505 3.034 10 0 GGAEMN CCN(C[C@@H](O)c1ccc(C)cc1)[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000245749443 1433510790 /nfs/dbraw/zinc/51/07/90/1433510790.db2.gz GLWJAGSIMXZXJA-IIBYNOLFSA-N 0 1 383.492 3.336 10 0 GGAEMN CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)N[C@H](CC)c2ccc(F)cc2F)C1 ZINC000245835904 1433524044 /nfs/dbraw/zinc/52/40/44/1433524044.db2.gz BEEKTGKILLAGTJ-HBUWYVDXSA-N 0 1 382.451 3.196 10 0 GGAEMN CCC[C@H]1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CCN1CCOC ZINC000245857862 1433528235 /nfs/dbraw/zinc/52/82/35/1433528235.db2.gz DXEJHXYWLWVAEY-NQIIRXRSSA-N 0 1 399.539 3.076 10 0 GGAEMN COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(-c2cccc(OC)c2)[nH]n1 ZINC000246843794 1433677115 /nfs/dbraw/zinc/67/71/15/1433677115.db2.gz CGTCWBWTRJXCIQ-JVPBZIDWSA-N 0 1 383.448 3.032 10 0 GGAEMN C[C@H](CCc1cccc(F)c1)N1CCN(CC(=O)N2C[C@H](C)C[C@H](C)C2)CC1 ZINC000248383470 1433790518 /nfs/dbraw/zinc/79/05/18/1433790518.db2.gz AFSBXCNDHVIQOY-HSALFYBXSA-N 0 1 389.559 3.269 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(Cc3cc(F)cc4c3OCOC4)C[C@@H]12 ZINC000248634355 1433812674 /nfs/dbraw/zinc/81/26/74/1433812674.db2.gz XIUCCFXQUGJIDR-FSPWUOQZSA-N 0 1 392.471 3.427 10 0 GGAEMN CCOC(=O)c1nn(C)cc1CN1CCCCC[C@H]1C[C@@H](O)c1ccccc1 ZINC000248677645 1433814863 /nfs/dbraw/zinc/81/48/63/1433814863.db2.gz DLJNDWNQFSLOTM-VQTJNVASSA-N 0 1 385.508 3.465 10 0 GGAEMN C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC[C@@H](c2cc[nH]n2)C1 ZINC000249680412 1433848695 /nfs/dbraw/zinc/84/86/95/1433848695.db2.gz AMTVNJPQVZSRSP-UONOGXRCSA-N 0 1 378.879 3.429 10 0 GGAEMN CC(=O)NC[C@@H]1CCCN([C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000249810233 1433852539 /nfs/dbraw/zinc/85/25/39/1433852539.db2.gz HPIVIIBCNORQHC-AOIWGVFYSA-N 0 1 381.520 3.254 10 0 GGAEMN Cc1ccccc1OC[C@H](O)CN1CCCC[C@H]1CNC(=O)OC(C)(C)C ZINC000251002552 1433857642 /nfs/dbraw/zinc/85/76/42/1433857642.db2.gz ZGXJKNAWUDUMCA-ZWKOTPCHSA-N 0 1 378.513 3.114 10 0 GGAEMN Cc1cc(C(=O)N2CCCC[C@@H]2c2noc(COc3ccc(F)cc3)n2)n[nH]1 ZINC000257176121 1433893456 /nfs/dbraw/zinc/89/34/56/1433893456.db2.gz AETWGKDIGJIGAF-MRXNPFEDSA-N 0 1 385.399 3.187 10 0 GGAEMN CC(C)S(=O)(=O)N1CCC(N2C[C@@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257175367 1433893467 /nfs/dbraw/zinc/89/34/67/1433893467.db2.gz AUKAXYQZQGECMU-LJQANCHMSA-N 0 1 384.586 3.003 10 0 GGAEMN Cc1noc(-c2ccccc2O[C@@H]2CCN(C(=O)c3[nH]nc4ccccc43)C2)n1 ZINC000257196380 1433894912 /nfs/dbraw/zinc/89/49/12/1433894912.db2.gz YCYUDZUGDVHIIS-CQSZACIVSA-N 0 1 389.415 3.215 10 0 GGAEMN C[C@H]1CCCC[C@H]1N(C)C(=O)CN1CCC(CNC(=O)OC(C)(C)C)CC1 ZINC000261379267 1433895415 /nfs/dbraw/zinc/89/54/15/1433895415.db2.gz DOBWBXMSLIONMJ-FUHWJXTLSA-N 0 1 381.561 3.260 10 0 GGAEMN C[C@@H]1CCCC[C@H]1N(C)C(=O)CN1CCC(CNC(=O)OC(C)(C)C)CC1 ZINC000261379268 1433895542 /nfs/dbraw/zinc/89/55/42/1433895542.db2.gz DOBWBXMSLIONMJ-SJLPKXTDSA-N 0 1 381.561 3.260 10 0 GGAEMN CC(C)[C@H](C)N1Cc2cccc(NC(=O)C(=O)N(C)C[C@H]3CCCCO3)c2C1 ZINC000263942455 1434051458 /nfs/dbraw/zinc/05/14/58/1434051458.db2.gz DHFDFVQUJKFMIS-FUHWJXTLSA-N 0 1 387.524 3.013 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)[nH]1 ZINC000266785495 1434375185 /nfs/dbraw/zinc/37/51/85/1434375185.db2.gz AOEOQCQAHIUJJD-AWEZNQCLSA-N 0 1 382.436 3.391 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)[nH]1 ZINC000266805441 1434377244 /nfs/dbraw/zinc/37/72/44/1434377244.db2.gz HQWMEWBUHXTTQL-SECBINFHSA-N 0 1 380.424 3.218 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(C)c(OCC3CCOCC3)c2)[nH]1 ZINC000266827317 1434379459 /nfs/dbraw/zinc/37/94/59/1434379459.db2.gz HGWRVJLWXFUBRV-UHFFFAOYSA-N 0 1 390.509 3.348 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)n1 ZINC000267139790 1434410139 /nfs/dbraw/zinc/41/01/39/1434410139.db2.gz GXIHCXDFDUIMJD-WOJBJXKFSA-N 0 1 376.460 3.155 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)n1 ZINC000267139789 1434410145 /nfs/dbraw/zinc/41/01/45/1434410145.db2.gz GXIHCXDFDUIMJD-VQTJNVASSA-N 0 1 376.460 3.155 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N1CCC[C@H](c2nc(C)n[nH]2)C1 ZINC000268433443 1434522369 /nfs/dbraw/zinc/52/23/69/1434522369.db2.gz FSMORDYXTDQGLJ-DOMZBBRYSA-N 0 1 395.463 3.269 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N1CCC[C@H](c2nnc(C)[nH]2)C1 ZINC000268433443 1434522372 /nfs/dbraw/zinc/52/23/72/1434522372.db2.gz FSMORDYXTDQGLJ-DOMZBBRYSA-N 0 1 395.463 3.269 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@@H]1CS(=O)(=O)c2ccccc21)CC3 ZINC000272814078 1434933091 /nfs/dbraw/zinc/93/30/91/1434933091.db2.gz CEERUSPWTMNIPJ-RNODOKPDSA-N 0 1 382.485 3.152 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@H](N[C@@H]1CS(=O)(=O)c2ccccc21)CC3 ZINC000272814080 1434933115 /nfs/dbraw/zinc/93/31/15/1434933115.db2.gz CEERUSPWTMNIPJ-ZUOKHONESA-N 0 1 382.485 3.152 10 0 GGAEMN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@H](C)c2ccc([S@@](C)=O)cc2)c1 ZINC000272890324 1434938979 /nfs/dbraw/zinc/93/89/79/1434938979.db2.gz DRECLGZHLWJJRS-MWSMCUOVSA-N 0 1 387.505 3.060 10 0 GGAEMN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000272890320 1434939021 /nfs/dbraw/zinc/93/90/21/1434939021.db2.gz DRECLGZHLWJJRS-IVAFGUPBSA-N 0 1 387.505 3.060 10 0 GGAEMN CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@H](C)c2ccc([S@](C)=O)cc2)c1 ZINC000272890326 1434939072 /nfs/dbraw/zinc/93/90/72/1434939072.db2.gz DRECLGZHLWJJRS-VXKZXEGRSA-N 0 1 387.505 3.060 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)/C=C/c2ccc(SC(F)F)cc2)CC1 ZINC000275589805 1435150872 /nfs/dbraw/zinc/15/08/72/1435150872.db2.gz HGYAITQZSXWMTK-RZIFZGNASA-N 0 1 398.475 3.412 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)NCc2cnn(Cc3ccccc3)c2)n[nH]1 ZINC000277095868 1435261465 /nfs/dbraw/zinc/26/14/65/1435261465.db2.gz DRADIQNWYXAWGC-HUUCEWRRSA-N 0 1 381.484 3.123 10 0 GGAEMN CC(=O)CC1(C(=O)NC2CCN(CCOc3ccc(Cl)cc3)CC2)CCC1 ZINC000278754848 1435420299 /nfs/dbraw/zinc/42/02/99/1435420299.db2.gz FQOAMRJYWVHVTM-UHFFFAOYSA-N 0 1 392.927 3.449 10 0 GGAEMN CN1CCO[C@H]2CN(c3nc(-c4cccc(Cl)c4)nc4c3CCCC4)C[C@H]21 ZINC000301659897 719464206 /nfs/dbraw/zinc/46/42/06/719464206.db2.gz MGENGWOEIWVLDR-MOPGFXCFSA-N 0 1 384.911 3.195 10 0 GGAEMN CN1CCO[C@@H]2CN(c3nc(-c4cccc(Cl)c4)nc4c3CCCC4)C[C@@H]21 ZINC000301659899 719464602 /nfs/dbraw/zinc/46/46/02/719464602.db2.gz MGENGWOEIWVLDR-RBUKOAKNSA-N 0 1 384.911 3.195 10 0 GGAEMN CN1CCO[C@@H]2CN(c3nc(-c4cccc(Cl)c4)nc4c3CCCC4)C[C@H]21 ZINC000301659900 719464658 /nfs/dbraw/zinc/46/46/58/719464658.db2.gz MGENGWOEIWVLDR-RTBURBONSA-N 0 1 384.911 3.195 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@H](C(=O)[O-])c2ccccc2)[C@@H]1c1cccs1 ZINC000780584827 939138977 /nfs/dbraw/zinc/13/89/77/939138977.db2.gz HMIVPYJRLMZZNH-BPQIPLTHSA-N 0 1 387.505 3.256 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N[C@H](C(=O)[O-])c2ccccc2)[C@H]1c1cccs1 ZINC000780584835 939139548 /nfs/dbraw/zinc/13/95/48/939139548.db2.gz HMIVPYJRLMZZNH-NJAFHUGGSA-N 0 1 387.505 3.256 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)NC2(C(=O)[O-])CCCCC2)[C@H]1c1cccs1 ZINC000780585503 939139576 /nfs/dbraw/zinc/13/95/76/939139576.db2.gz OWFGOLFDTICMBH-HOCLYGCPSA-N 0 1 379.526 3.218 10 0 GGAEMN C[C@@H](CNC(=O)N[C@@H](C(=O)[O-])c1ccc2ccccc2c1)[N@H+]1CCC[C@@H](C)C1 ZINC000908811651 939325235 /nfs/dbraw/zinc/32/52/35/939325235.db2.gz AAWACHKUEXGHPB-GQIGUUNPSA-N 0 1 383.492 3.385 10 0 GGAEMN O=C([O-])[C@H](NC(=O)NCCC[N@H+]1CCc2ccccc2C1)C1CCCCCC1 ZINC000908819525 939327920 /nfs/dbraw/zinc/32/79/20/939327920.db2.gz DXFNBHGQCMRPNP-HXUWFJFHSA-N 0 1 387.524 3.158 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)NCCC[N@H+]1CCc2ccccc2C1)C1CCCCCC1 ZINC000908819524 939328021 /nfs/dbraw/zinc/32/80/21/939328021.db2.gz DXFNBHGQCMRPNP-FQEVSTJZSA-N 0 1 387.524 3.158 10 0 GGAEMN C[C@@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@@H+]1CCc2sccc2C1 ZINC000908851423 939336583 /nfs/dbraw/zinc/33/65/83/939336583.db2.gz LCISRXLVOZVNOI-XOBRGWDASA-N 0 1 393.553 3.218 10 0 GGAEMN C[C@@H](CNC(=O)N[C@@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2sccc2C1 ZINC000908851423 939336588 /nfs/dbraw/zinc/33/65/88/939336588.db2.gz LCISRXLVOZVNOI-XOBRGWDASA-N 0 1 393.553 3.218 10 0 GGAEMN C[C@H](CNC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[N@H+]1CCc2ccccc2C1 ZINC000908914667 939351502 /nfs/dbraw/zinc/35/15/02/939351502.db2.gz ZXUAZDWXXSSCNA-OPAMFIHVSA-N 0 1 387.524 3.156 10 0 GGAEMN C[C@@]1(CNC(=O)N[C@H](C(=O)[O-])c2ccccc2F)CCC[N@H+]1Cc1ccccc1 ZINC000908958650 939361110 /nfs/dbraw/zinc/36/11/10/939361110.db2.gz AILMOCKXNLTPGC-UGKGYDQZSA-N 0 1 399.466 3.305 10 0 GGAEMN C[C@H]1CC[C@@](NC(=O)NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)(C(=O)[O-])CC1 ZINC000908959713 939361795 /nfs/dbraw/zinc/36/17/95/939361795.db2.gz LALYTTFVUQHELZ-ZPMCFJSWSA-N 0 1 387.524 3.374 10 0 GGAEMN CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N[C@H](C(=O)[O-])c2cccc(OC)c2)C1 ZINC000908960864 939362415 /nfs/dbraw/zinc/36/24/15/939362415.db2.gz HOGNUFGDWJWIBO-QAPCUYQASA-N 0 1 391.512 3.021 10 0 GGAEMN C[C@@H](CNC(=O)N[C@@H](C(=O)[O-])C1CCCCCC1)[N@@H+](C)Cc1ccccc1 ZINC000908990422 939367184 /nfs/dbraw/zinc/36/71/84/939367184.db2.gz RPKGSNARRZVKSG-QFBILLFUSA-N 0 1 375.513 3.230 10 0 GGAEMN O=C([O-])[C@H](NC(=O)NC[C@@H]1CCC[N@H+]1Cc1ccccc1)C1CCCCCC1 ZINC000908998796 939369300 /nfs/dbraw/zinc/36/93/00/939369300.db2.gz UTONDPNOGUYMRU-VQTJNVASSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@@H]1[C@H](NC(=O)N[C@]2(C(=O)[O-])CCCC(C)(C)C2)CC[N@H+]1Cc1ccccc1 ZINC000908999854 939369343 /nfs/dbraw/zinc/36/93/43/939369343.db2.gz CWKIXXRUSXYPAH-RADWXHQJSA-N 0 1 387.524 3.372 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1 ZINC000909071786 939377045 /nfs/dbraw/zinc/37/70/45/939377045.db2.gz ZHQPHWRTNQYKEY-RADWXHQJSA-N 0 1 387.524 3.230 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1 ZINC000909071788 939377405 /nfs/dbraw/zinc/37/74/05/939377405.db2.gz ZHQPHWRTNQYKEY-TVTNDZMWSA-N 0 1 387.524 3.230 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)[C@H]1CCC[N@@H+](CCc2ccccc2)C1)C1CCCCCC1 ZINC000911780713 939781719 /nfs/dbraw/zinc/78/17/19/939781719.db2.gz CUFOTPXIERCXTF-SFTDATJTSA-N 0 1 386.536 3.481 10 0 GGAEMN C[C@H](NC(=O)N[C@@H](C(=O)[O-])C1CCCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041376 939798776 /nfs/dbraw/zinc/79/87/76/939798776.db2.gz NNLDBZKNRLKRJI-KVSKMBFKSA-N 0 1 379.545 3.362 10 0 GGAEMN CCCc1ccc(C(=O)N[C@@]2(C(=O)[O-])CCC[N@@H+](Cc3ccccc3)C2)cc1 ZINC001123268515 939817938 /nfs/dbraw/zinc/81/79/38/939817938.db2.gz RYHGBMGTWDFUHT-QHCPKHFHSA-N 0 1 380.488 3.488 10 0 GGAEMN Cc1ccc(Cl)cc1C(=O)N[C@@]1(C(=O)[O-])CCC[N@@H+](Cc2ccccc2)C1 ZINC001123270589 939818363 /nfs/dbraw/zinc/81/83/63/939818363.db2.gz JLOZWGJZFWURKO-NRFANRHFSA-N 0 1 386.879 3.498 10 0 GGAEMN O=C([O-])[C@]1(NC(=O)c2coc(C(F)F)c2)CCC[N@@H+](Cc2ccccc2)C1 ZINC001123277879 939819439 /nfs/dbraw/zinc/81/94/39/939819439.db2.gz OPGKLQLDYBGIGP-IBGZPJMESA-N 0 1 378.375 3.066 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)[C@@H](C(=O)[O-])C2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000663108742 939855675 /nfs/dbraw/zinc/85/56/75/939855675.db2.gz VSKZZDOFTRWQAD-HYVNUMGLSA-N 0 1 398.425 3.315 10 0 GGAEMN O=C([O-])[C@H](Cc1c[nH]c2cc(F)ccc12)[NH2+]Cc1c[nH]c(-c2ccccc2)n1 ZINC000426835221 1126092993 /nfs/dbraw/zinc/09/29/93/1126092993.db2.gz QMLKQQMZIXXQOV-IBGZPJMESA-N 0 1 378.407 3.483 10 0 GGAEMN COc1cc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc2c1OCCO2 ZINC000604766677 1126100429 /nfs/dbraw/zinc/10/04/29/1126100429.db2.gz ZCDPVSUGNQZESA-HNAYVOBHSA-N 0 1 397.393 3.091 10 0 GGAEMN Cn1nc(C(F)(F)F)cc1CN[C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000657362538 1126104453 /nfs/dbraw/zinc/10/44/53/1126104453.db2.gz CQDKXWIKDREKOA-GXTWGEPZSA-N 0 1 381.320 3.063 10 0 GGAEMN Cn1cc(-c2nc(CN[C@@](C)(CO)Cc3ccc(Cl)cc3)cs2)cn1 ZINC000865772607 1126116664 /nfs/dbraw/zinc/11/66/64/1126116664.db2.gz PAWFVAFQPIAHIG-GOSISDBHSA-N 0 1 376.913 3.280 10 0 GGAEMN COc1ccccc1C[C@@](C)(CO)NCc1nc(C)c(Br)s1 ZINC000922304280 1126134532 /nfs/dbraw/zinc/13/45/32/1126134532.db2.gz OTYJUGOWXYILOH-INIZCTEOSA-N 0 1 385.327 3.306 10 0 GGAEMN C[C@](CO)(Cc1ccccc1F)NCc1ccn(-c2c(F)cccc2F)n1 ZINC001308117360 1126163344 /nfs/dbraw/zinc/16/33/44/1126163344.db2.gz IIQQCDBDOXOHOZ-HXUWFJFHSA-N 0 1 375.394 3.373 10 0 GGAEMN COc1cc(CN[C@](C)(CO)Cc2ccccc2F)c(Br)cn1 ZINC001308117705 1126163529 /nfs/dbraw/zinc/16/35/29/1126163529.db2.gz KYFQWUZTOUCCPO-KRWDZBQOSA-N 0 1 383.261 3.075 10 0 GGAEMN COc1cc(CN[C@@](C)(CO)Cc2ccccc2F)c(Br)cn1 ZINC001308117707 1126163647 /nfs/dbraw/zinc/16/36/47/1126163647.db2.gz KYFQWUZTOUCCPO-QGZVFWFLSA-N 0 1 383.261 3.075 10 0 GGAEMN Cn1nc(C(F)(F)F)c(CN[C@](C)(CO)Cc2ccc(F)cc2)c1Cl ZINC001460858173 1126192194 /nfs/dbraw/zinc/19/21/94/1126192194.db2.gz AIEACTOSLGYJPH-HNNXBMFYSA-N 0 1 379.785 3.315 10 0 GGAEMN COc1ncc(Br)cc1CN[C@](C)(CO)Cc1ccccc1F ZINC001473839165 1126199679 /nfs/dbraw/zinc/19/96/79/1126199679.db2.gz UIHTWOJVKKVYHL-KRWDZBQOSA-N 0 1 383.261 3.075 10 0 GGAEMN Cn1nc(C(F)(F)F)c(CN[C@@](C)(CO)Cc2ccccc2F)c1Cl ZINC001620623602 1126241125 /nfs/dbraw/zinc/24/11/25/1126241125.db2.gz CBDZAEDQEPHOCW-OAHLLOKOSA-N 0 1 379.785 3.315 10 0 GGAEMN O[C@@H]([C@H](Cc1ccccc1)NCc1cccc(Br)n1)C(F)(F)F ZINC001648158311 1126250165 /nfs/dbraw/zinc/25/01/65/1126250165.db2.gz KPSMWYNDZFCRHX-ZFWWWQNUSA-N 0 1 389.215 3.468 10 0 GGAEMN O=c1cc(C[NH2+][C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c2ccc([O-])cc2o1 ZINC001654629485 1126254087 /nfs/dbraw/zinc/25/40/87/1126254087.db2.gz GFDRAGNQWINNIG-QFBILLFUSA-N 0 1 393.361 3.123 10 0 GGAEMN OC[C@@]1(NCc2c(F)cncc2F)CCc2cc(Br)ccc2C1 ZINC001655060916 1126254827 /nfs/dbraw/zinc/25/48/27/1126254827.db2.gz JMYSJKRWTDFICJ-QGZVFWFLSA-N 0 1 383.236 3.132 10 0 GGAEMN COc1ccc(C[C@@](C)(CO)NCc2nc3c4ccccc4oc3c(=O)[nH]2)cc1 ZINC001655736928 1126256115 /nfs/dbraw/zinc/25/61/15/1126256115.db2.gz WRHQBGXXQGOPBM-QFIPXVFZSA-N 0 1 393.443 3.174 10 0 GGAEMN COc1ccc(C[C@@](C)(CO)[NH2+]Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1 ZINC001655736928 1126256119 /nfs/dbraw/zinc/25/61/19/1126256119.db2.gz WRHQBGXXQGOPBM-QFIPXVFZSA-N 0 1 393.443 3.174 10 0 GGAEMN Cc1nn(C)c(Cl)c1CN[C@@](C)(CO)Cc1ccc(Br)cc1 ZINC001655737058 1126256353 /nfs/dbraw/zinc/25/63/53/1126256353.db2.gz ZOKMXNFJDSRSKY-MRXNPFEDSA-N 0 1 386.721 3.228 10 0 GGAEMN O[C@H]([C@H](Cc1ccccc1)NCc1ccnc(Br)c1)C(F)(F)F ZINC001659943893 1126264003 /nfs/dbraw/zinc/26/40/03/1126264003.db2.gz MBWRRHSHKDUNKZ-DZGCQCFKSA-N 0 1 389.215 3.468 10 0 GGAEMN COc1ccc(OC)c([C@@H](O)CN2CCC(Oc3ccc(F)cc3)CC2)c1 ZINC000019551122 210261122 /nfs/dbraw/zinc/26/11/22/210261122.db2.gz OODGXAREDRFKJL-FQEVSTJZSA-N 0 1 375.440 3.420 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cncc(C(=O)NCc3ccccc3)c2)cc1 ZINC000017050977 210200691 /nfs/dbraw/zinc/20/06/91/210200691.db2.gz QDXABFNINHMCAK-UHFFFAOYSA-N 0 1 381.457 3.121 10 0 GGAEMN COc1ccc(NC(=O)CCc2c(C)[nH]n(-c3ccc(F)cc3)c2=O)cc1OC ZINC000016199874 210187397 /nfs/dbraw/zinc/18/73/97/210187397.db2.gz LKNGPTWRQKEHRI-UHFFFAOYSA-N 0 1 399.422 3.202 10 0 GGAEMN Cc1cc(N2CCCCC2)nc(N2CCN(C(=O)Nc3ccc(F)cc3)CC2)n1 ZINC000015825141 210171108 /nfs/dbraw/zinc/17/11/08/210171108.db2.gz OEDUUEBRVQRTLI-UHFFFAOYSA-N 0 1 398.486 3.269 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@@H](C)CS2 ZINC000015730810 210165806 /nfs/dbraw/zinc/16/58/06/210165806.db2.gz UKFHYXOGGCSZIS-LBPRGKRZSA-N 0 1 392.502 3.485 10 0 GGAEMN CCCc1nn2c(nc(CSc3nc(-c4ccc(C)cc4)n[nH]3)cc2=O)s1 ZINC000015732015 210165358 /nfs/dbraw/zinc/16/53/58/210165358.db2.gz UIJYEOMFJBPXKM-UHFFFAOYSA-N 0 1 398.517 3.489 10 0 GGAEMN CCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cc(-c3ccccc3)n[nH]2)c1 ZINC000015423719 210157707 /nfs/dbraw/zinc/15/77/07/210157707.db2.gz UUAPFKLCIJBQBJ-UHFFFAOYSA-N 0 1 398.488 3.360 10 0 GGAEMN Cc1nc(C)c(CC(=O)N2CCC[C@H](N3CCN(c4ccccc4)CC3)C2)s1 ZINC000015061621 210145854 /nfs/dbraw/zinc/14/58/54/210145854.db2.gz MHNGOWZPSAOKHU-FQEVSTJZSA-N 0 1 398.576 3.116 10 0 GGAEMN CCN1C(=O)N(Cc2ccccn2)C(=O)C12CCN(C/C=C/c1ccco1)CC2 ZINC000014749217 210126493 /nfs/dbraw/zinc/12/64/93/210126493.db2.gz XGTIFYKASPFKOM-VMPITWQZSA-N 0 1 394.475 3.007 10 0 GGAEMN CCc1ccc(C(=O)CCC(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)cc1 ZINC000014371083 210116041 /nfs/dbraw/zinc/11/60/41/210116041.db2.gz RVNSBXUZZCGGJL-UHFFFAOYSA-N 0 1 383.473 3.169 10 0 GGAEMN C[C@H](NCC(=O)N(C)CC(=O)NCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000012996606 210043634 /nfs/dbraw/zinc/04/36/34/210043634.db2.gz HVVARTMJTUIQAF-LBPRGKRZSA-N 0 1 398.290 3.012 10 0 GGAEMN Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)Nc1ccc(F)c(F)c1 ZINC000012934128 210032107 /nfs/dbraw/zinc/03/21/07/210032107.db2.gz DJFDUODXHSXALG-UHFFFAOYSA-N 0 1 375.350 3.463 10 0 GGAEMN O=C(CSc1ncnc2sccc21)N[C@@H]1CCN(Cc2ccccc2)C1 ZINC000012881938 210022911 /nfs/dbraw/zinc/02/29/11/210022911.db2.gz PSXNVTCIBKFBJK-OAHLLOKOSA-N 0 1 384.530 3.174 10 0 GGAEMN COc1ccc([C@@H]2CCCCCN2CC(=O)Nc2ccc(C(N)=O)cc2)cc1 ZINC000012879457 210022243 /nfs/dbraw/zinc/02/22/43/210022243.db2.gz RHYRMHDYLGNLKD-FQEVSTJZSA-N 0 1 381.476 3.350 10 0 GGAEMN C[C@@H](NC(=O)CN1CCC(C(=O)Nc2ccccc2)CC1)c1ccc(F)cc1 ZINC000012889971 210021936 /nfs/dbraw/zinc/02/19/36/210021936.db2.gz HVVYYHYPOQUUMV-MRXNPFEDSA-N 0 1 383.467 3.354 10 0 GGAEMN C[C@H](Sc1nc(C=Cc2cccs2)n[nH]1)C(=O)NC(=O)NC(C)(C)C ZINC000012753498 210000122 /nfs/dbraw/zinc/00/01/22/210000122.db2.gz WDFHBCCBARDEFO-JARNTUPDSA-N 0 1 379.511 3.142 10 0 GGAEMN Cc1c(C(=O)N2CCCCC2)c(S(=O)(=O)Nc2ccc(F)cc2)c(C)n1C ZINC000009684990 209841170 /nfs/dbraw/zinc/84/11/70/209841170.db2.gz AKXPFKQYLPJCSH-UHFFFAOYSA-N 0 1 393.484 3.208 10 0 GGAEMN C[C@H](NC(=O)CSc1nc(-c2ccccc2)n[nH]1)c1ccc2c(c1)OCCO2 ZINC000008574591 209784314 /nfs/dbraw/zinc/78/43/14/209784314.db2.gz QKGUFWOTJPHIGH-ZDUSSCGKSA-N 0 1 396.472 3.212 10 0 GGAEMN Cc1c(C(=O)Nc2ccc(F)cc2)sc2nc(C)nc(N3CCN(C)CC3)c12 ZINC000002911920 209396774 /nfs/dbraw/zinc/39/67/74/209396774.db2.gz JKELYZGLWWUFCO-UHFFFAOYSA-N 0 1 399.495 3.451 10 0 GGAEMN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N2CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC2)c1 ZINC000186667304 209327158 /nfs/dbraw/zinc/32/71/58/209327158.db2.gz OWDPMXRHQWQLDM-ZWKOTPCHSA-N 0 1 390.524 3.283 10 0 GGAEMN Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N2CCC[C@@H]([N@@H+](C)CC(=O)[O-])CC2)c1 ZINC000186667325 209327167 /nfs/dbraw/zinc/32/71/67/209327167.db2.gz OWDPMXRHQWQLDM-QZTJIDSGSA-N 0 1 390.524 3.283 10 0 GGAEMN O=C1c2ccccc2C(=O)N1c1ccccc1NS(=O)(=O)c1ccccc1 ZINC000001097908 209300190 /nfs/dbraw/zinc/30/01/90/209300190.db2.gz DJBZBXLVOQPIML-UHFFFAOYSA-N 0 1 378.409 3.288 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)c2ccc(COc3ccccc3)cc2)CC1 ZINC000186653342 209263868 /nfs/dbraw/zinc/26/38/68/209263868.db2.gz ZLBWBGVAJMAOFR-HXUWFJFHSA-N 0 1 396.487 3.277 10 0 GGAEMN CCOC(=O)C1(c2ccccc2)CCN(C[C@@H](O)COc2ccccc2)CC1 ZINC000005650533 209232222 /nfs/dbraw/zinc/23/22/22/209232222.db2.gz ZDAXTCOLRCZCRR-HXUWFJFHSA-N 0 1 383.488 3.023 10 0 GGAEMN COc1cc(O)c2c(c1)oc(-c1cc(OC)c(OC)c(OC)c1)c(OC)c2=O ZINC000014436796 209192036 /nfs/dbraw/zinc/19/20/36/209192036.db2.gz SUNUQCQIFHHEOW-UHFFFAOYSA-N 0 1 388.372 3.209 10 0 in-vitro GGAEMN COc1ccc(C(=O)C=C([O-])C(=O)Nc2cc(Cl)c(OC)cc2OC)cc1 ZINC000101354852 211399169 /nfs/dbraw/zinc/39/91/69/211399169.db2.gz YBJCKIPMRWHWGP-UHFFFAOYSA-N 0 1 391.807 3.146 10 0 GGAEMN COc1ccc(C(=O)C=C(O)C(=O)Nc2cc(Cl)c(OC)cc2OC)cc1 ZINC000101354852 211399171 /nfs/dbraw/zinc/39/91/71/211399171.db2.gz YBJCKIPMRWHWGP-UHFFFAOYSA-N 0 1 391.807 3.146 10 0 GGAEMN COc1ccccc1-n1c(O)c2c(-c3ccccc3)nn(-c3ccccc3)c2c1O ZINC000100909365 211392137 /nfs/dbraw/zinc/39/21/37/211392137.db2.gz ARQPBWSEFOXJPJ-IFMALSPDSA-N 0 1 397.434 3.478 10 0 GGAEMN C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)NCc1c[nH]nn1 ZINC000097011709 211355113 /nfs/dbraw/zinc/35/51/13/211355113.db2.gz JLUXEIKNZAFQJT-SNVBAGLBSA-N 0 1 377.857 3.051 10 0 GGAEMN COc1ccc(CN2CCCN(C(=O)/C=C\c3ccc4c(c3)CCO4)CC2)cc1 ZINC000097044446 211356969 /nfs/dbraw/zinc/35/69/69/211356969.db2.gz ZQVGTOHCEFKBCJ-POHAHGRESA-N 0 1 392.499 3.378 10 0 GGAEMN Cc1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2cc(-c3cccnc3)[nH]n2)C1 ZINC000096324755 211335269 /nfs/dbraw/zinc/33/52/69/211335269.db2.gz QRYGAGZAWMIFDM-KRWDZBQOSA-N 0 1 389.459 3.271 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)cc1 ZINC000096324796 211334852 /nfs/dbraw/zinc/33/48/52/211334852.db2.gz SHRILZPRWYJFBM-QGZVFWFLSA-N 0 1 389.459 3.271 10 0 GGAEMN O=C(Nc1ccc(F)cc1)C1CCN(C(=O)c2cc(-c3ccncc3)[nH]n2)CC1 ZINC000096324569 211334958 /nfs/dbraw/zinc/33/49/58/211334958.db2.gz ZTEACBAWBXAKHI-UHFFFAOYSA-N 0 1 393.422 3.102 10 0 GGAEMN O=C(Nc1cccc(F)c1)[C@H]1CCCN(C(=O)c2cc(-c3cccnc3)[nH]n2)C1 ZINC000096324741 211334726 /nfs/dbraw/zinc/33/47/26/211334726.db2.gz OOIVRBZRLQVOCN-HNNXBMFYSA-N 0 1 393.422 3.102 10 0 GGAEMN CCCN1CCN(C(=O)Cc2c3[nH]cccc-3c(=O)n2-c2ccc(C)cc2)CC1 ZINC000096386963 211340034 /nfs/dbraw/zinc/34/00/34/211340034.db2.gz FXCOMGWYEXOYLP-FQEVSTJZSA-N 0 1 392.503 3.036 10 0 GGAEMN CCc1noc(-c2c(C)[nH]c(C)c2S(=O)(=O)Nc2ccc(OC)cc2C)n1 ZINC000096379820 211338155 /nfs/dbraw/zinc/33/81/55/211338155.db2.gz NEEZNVNBICMFBA-UHFFFAOYSA-N 0 1 390.465 3.362 10 0 GGAEMN CCc1nnc(-c2[nH]c(C)c(S(=O)(=O)Nc3ccc(OC)c(F)c3)c2C)o1 ZINC000096379459 211338110 /nfs/dbraw/zinc/33/81/10/211338110.db2.gz ZICCRVCJNRNVGA-UHFFFAOYSA-N 0 1 394.428 3.192 10 0 GGAEMN CCc1nnc(-c2[nH]c(C)c(S(=O)(=O)Nc3cc(F)ccc3C)c2C)o1 ZINC000096379458 211337780 /nfs/dbraw/zinc/33/77/80/211337780.db2.gz RLYZHNQVVADJSL-UHFFFAOYSA-N 0 1 378.429 3.492 10 0 GGAEMN CC(C)CN1CCN(C(=O)c2ccc3c(c2)CC(=O)N3Cc2ccccc2)CC1 ZINC000096386235 211337802 /nfs/dbraw/zinc/33/78/02/211337802.db2.gz YTUYBRXMELFVCS-UHFFFAOYSA-N 0 1 391.515 3.190 10 0 GGAEMN COc1ccccc1[C@@H](C)N[C@@H](C)C(=O)N1CCN(Cc2ccccc2)CC1 ZINC000096178650 211316730 /nfs/dbraw/zinc/31/67/30/211316730.db2.gz ILXNTVCVEYRCIO-MOPGFXCFSA-N 0 1 381.520 3.079 10 0 GGAEMN COc1ccccc1[C@H](C)N[C@@H](C)C(=O)N1CCN(Cc2ccccc2)CC1 ZINC000096178649 211316501 /nfs/dbraw/zinc/31/65/01/211316501.db2.gz ILXNTVCVEYRCIO-OALUTQOASA-N 0 1 381.520 3.079 10 0 GGAEMN Cc1noc(C)c1CN1CCC2(CC1)NCCn1c(-c3ccc(F)cc3)cnc12 ZINC000096145055 211308162 /nfs/dbraw/zinc/30/81/62/211308162.db2.gz CXZWBJUJSXIFIM-UHFFFAOYSA-N 0 1 395.482 3.389 10 0 GGAEMN OCC[C@@H]1CN(Cc2ccnc3ccccc23)CCN1Cc1ccc(F)cc1 ZINC000095505246 211257265 /nfs/dbraw/zinc/25/72/65/211257265.db2.gz STDFPLSSKRMKIS-OAQYLSRUSA-N 0 1 379.479 3.443 10 0 GGAEMN C[C@H](OC(=O)[C@@H]1CCCc2cn[nH]c21)C(=O)Nc1ccc(Br)cc1 ZINC000095443978 211241249 /nfs/dbraw/zinc/24/12/49/211241249.db2.gz NPHQPRADJSJNLX-IINYFYTJSA-N 0 1 392.253 3.163 10 0 GGAEMN COc1cc2c(cc1OC)C(=O)[C@@H]([C@@H](O)C1=CCN(Cc3ccccc3)CC1)C2 ZINC000095080116 211218149 /nfs/dbraw/zinc/21/81/49/211218149.db2.gz CCNWYZVPJNRXDT-OFNKIYASSA-N 0 1 393.483 3.252 10 0 GGAEMN O=c1[nH]c2ccc([S@@](=O)CCN3CCC(Cc4ccccc4)CC3)cc2o1 ZINC000090676934 211187312 /nfs/dbraw/zinc/18/73/12/211187312.db2.gz RXYVUTNKSXMMJS-HHHXNRCGSA-N 0 1 384.501 3.183 10 0 GGAEMN NC(=O)c1ccc(NC(=O)CN2CCC(c3c[nH]c4ccccc43)CC2)cc1 ZINC000089866588 211185714 /nfs/dbraw/zinc/18/57/14/211185714.db2.gz GXQRNVBSVOJRSV-UHFFFAOYSA-N 0 1 376.460 3.085 10 0 GGAEMN O=C(c1cccc(CN2CC[C@@H](OCc3ccccn3)C2)c1)N1CCCCC1 ZINC000089883761 211184998 /nfs/dbraw/zinc/18/49/98/211184998.db2.gz DNVQRXHLMFLYAZ-JOCHJYFZSA-N 0 1 379.504 3.499 10 0 GGAEMN Cc1ccc([C@@H](C)CCN2CCn3nc(CCC(=O)N4CCCC4)cc3C2)o1 ZINC000091486830 211194616 /nfs/dbraw/zinc/19/46/16/211194616.db2.gz BIGLTDCKJCCOPO-KRWDZBQOSA-N 0 1 384.524 3.349 10 0 GGAEMN O=C(Nc1ccc(F)cc1)[C@@H]1CCCN(C(=O)c2cc(-c3ccncc3)[nH]n2)C1 ZINC000085690463 211178580 /nfs/dbraw/zinc/17/85/80/211178580.db2.gz FRXFYFFCJJIVDE-OAHLLOKOSA-N 0 1 393.422 3.102 10 0 GGAEMN Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)c1 ZINC000085690631 211178284 /nfs/dbraw/zinc/17/82/84/211178284.db2.gz CZENTUDBORWKMP-KRWDZBQOSA-N 0 1 389.459 3.271 10 0 GGAEMN Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)cc1 ZINC000085690621 211177556 /nfs/dbraw/zinc/17/75/56/211177556.db2.gz DHQGBGZKFJJZBC-KRWDZBQOSA-N 0 1 389.459 3.271 10 0 GGAEMN CN(C)C(=O)NCc1cc2n(n1)CCCN(Cc1ccc3ccccc3c1)C2 ZINC000082099091 211160258 /nfs/dbraw/zinc/16/02/58/211160258.db2.gz LBQMAYYDTKQFBJ-UHFFFAOYSA-N 0 1 377.492 3.213 10 0 GGAEMN Cc1ccc(NC(=O)C2CCN(c3nc4[nH]cnc(=O)c4s3)CC2)cc1C ZINC000073666559 211127006 /nfs/dbraw/zinc/12/70/06/211127006.db2.gz HTEQBQJJNFKTHF-UHFFFAOYSA-N 0 1 383.477 3.264 10 0 GGAEMN CCCC(=O)Nc1ccc(CNC(=O)c2c[n-]c3[nH+]c(C)ccc3c2=O)cc1 ZINC000071960191 211065810 /nfs/dbraw/zinc/06/58/10/211065810.db2.gz XFDQRGSKQNTJBA-UHFFFAOYSA-N 0 1 378.432 3.312 10 0 GGAEMN O=C([C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)N1CCN2CCCC[C@@H]2C1 ZINC000069421038 211038768 /nfs/dbraw/zinc/03/87/68/211038768.db2.gz RKFPLJBINYJPPP-CABCVRRESA-N 0 1 396.318 3.043 10 0 GGAEMN CC[C@@]1(C(=O)[O-])C[C@H](C(=O)NCCC(C)C)[C@H](c2ccc(OC)cc2)[N@H+]1C ZINC000067834077 211023367 /nfs/dbraw/zinc/02/33/67/211023367.db2.gz ZAMWJRMSPHZZEC-WFXMLNOXSA-N 0 1 376.497 3.084 10 0 GGAEMN NC(=O)c1ccnc(NCc2nc(-c3cccc(F)c3)c(-c3ccccn3)[nH]2)c1 ZINC000067880158 211026586 /nfs/dbraw/zinc/02/65/86/211026586.db2.gz NWFATCSZCJRDOC-UHFFFAOYSA-N 0 1 388.406 3.384 10 0 GGAEMN Cc1nnnn1CCCN1CCc2onc(-c3ccc(C(F)(F)F)cc3)c2C1 ZINC000067841667 211025232 /nfs/dbraw/zinc/02/52/32/211025232.db2.gz IZQAONATCOYYIW-UHFFFAOYSA-N 0 1 392.385 3.104 10 0 GGAEMN CC[C@@]1(C(=O)[O-])C[C@H](C(=O)N(C)CC(C)C)[C@H](c2ccc(OC)cc2)[N@H+]1C ZINC000067840920 211024663 /nfs/dbraw/zinc/02/46/63/211024663.db2.gz FFYXDNCYMYLSPQ-WFXMLNOXSA-N 0 1 376.497 3.036 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@@H](c3[nH]ncc3Cc3ccccc3)C2)c(=O)[nH]1 ZINC000067714545 211017991 /nfs/dbraw/zinc/01/79/91/211017991.db2.gz FAUBGDLQNWXUAW-QGZVFWFLSA-N 0 1 376.460 3.017 10 0 GGAEMN Cc1cccc(O[C@@H](C)C(=O)NCc2ccccc2CN2CCN(C)CC2)c1C ZINC000040121254 210775583 /nfs/dbraw/zinc/77/55/83/210775583.db2.gz MPIXCYPICLWOID-FQEVSTJZSA-N 0 1 395.547 3.135 10 0 GGAEMN O=C([O-])COc1nc(-c2ccccc2F)nc2c1C[N@H+](Cc1ccccc1)CC2 ZINC000073696501 210747384 /nfs/dbraw/zinc/74/73/84/210747384.db2.gz VRTLOGHWUQNWCW-UHFFFAOYSA-N 0 1 393.418 3.304 10 0 GGAEMN O=C([O-])COc1nc(-c2ccccc2F)nc2c1C[N@@H+](Cc1ccccc1)CC2 ZINC000073696501 210747387 /nfs/dbraw/zinc/74/73/87/210747387.db2.gz VRTLOGHWUQNWCW-UHFFFAOYSA-N 0 1 393.418 3.304 10 0 GGAEMN Cc1ccc(Cc2nc(CCNS(=O)(=O)c3c(C)cc(C)cc3C)n[nH]2)cc1 ZINC000035509275 210690225 /nfs/dbraw/zinc/69/02/25/210690225.db2.gz VQDLFFFCEAATHX-UHFFFAOYSA-N 0 1 398.532 3.150 10 0 GGAEMN O=C(Cc1ccccc1)N1CCC[C@@H](N2CCN(c3ccc(F)cc3)CC2)C1 ZINC000034676478 210658572 /nfs/dbraw/zinc/65/85/72/210658572.db2.gz WOPMEQUXFYDIFQ-JOCHJYFZSA-N 0 1 381.495 3.181 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2ccc3c(c2)-c2oncc2CO3)c(OC)c1 ZINC000033171173 210628454 /nfs/dbraw/zinc/62/84/54/210628454.db2.gz DWYYFHCAHWNHLQ-UHFFFAOYSA-N 0 1 388.401 3.052 10 0 GGAEMN COc1ccc(-c2n[nH]cc2CN2CCC(O)(c3cccnc3)CC2)cc1F ZINC000023232011 210439488 /nfs/dbraw/zinc/43/94/88/210439488.db2.gz CXQLRJZSWMWZPU-UHFFFAOYSA-N 0 1 382.439 3.103 10 0 GGAEMN O=C(CN1CCN(CCc2ccccc2)CC1)Nc1ccc(Cl)cc1F ZINC000022930140 210428007 /nfs/dbraw/zinc/42/80/07/210428007.db2.gz BWCPZMOWFSBMFY-UHFFFAOYSA-N 0 1 375.875 3.278 10 0 GGAEMN COc1ccc2c(c1)CCc1c-2n[nH]c1C(=O)Nc1cccc2nsnc21 ZINC000021883214 210399518 /nfs/dbraw/zinc/39/95/18/210399518.db2.gz KUNGLBSHHXQIRA-UHFFFAOYSA-N 0 1 377.429 3.441 10 0 GGAEMN COc1ccc(CN2CCC[C@H]2c2c(C)noc2C)cc1CN1CCOCC1 ZINC000021719842 210391316 /nfs/dbraw/zinc/39/13/16/210391316.db2.gz QWUCYHALXHIPDX-FQEVSTJZSA-N 0 1 385.508 3.469 10 0 GGAEMN Cc1c(C(=O)Nc2ccccc2F)sc2ncnc(N3CCN(C)CC3)c12 ZINC000021636571 210387413 /nfs/dbraw/zinc/38/74/13/210387413.db2.gz GVZLYSJDRZMJGS-UHFFFAOYSA-N 0 1 385.468 3.143 10 0 GGAEMN CN(C)c1ccc(Br)cc1NS(=O)(=O)c1ccc(Cl)nc1 ZINC000037976195 210395876 /nfs/dbraw/zinc/39/58/76/210395876.db2.gz BHIJSPJQVPYCLA-UHFFFAOYSA-N 0 1 390.690 3.364 10 0 GGAEMN COc1ccccc1N1CCN(CCCNC(=O)Nc2ccc(C)cc2)CC1 ZINC000021175129 210379253 /nfs/dbraw/zinc/37/92/53/210379253.db2.gz OGZZVKFSVKZSIT-UHFFFAOYSA-N 0 1 382.508 3.337 10 0 GGAEMN CCCN1CCN(C(=O)C[C@@H](c2cccs2)N2Cc3ccccc3C2=O)CC1 ZINC000021530485 210384243 /nfs/dbraw/zinc/38/42/43/210384243.db2.gz XGJUPKCRDSZGPY-IBGZPJMESA-N 0 1 397.544 3.390 10 0 GGAEMN COc1ccccc1N1CCN(CCCNC(=O)Nc2cccc(C)c2)CC1 ZINC000021175141 210380636 /nfs/dbraw/zinc/38/06/36/210380636.db2.gz ZOZZLCUTZHZLOH-UHFFFAOYSA-N 0 1 382.508 3.337 10 0 GGAEMN O=C(Nc1c[nH]c2ccccc2c1=O)NC1CCN(Cc2ccccc2)CC1 ZINC000021172484 210379435 /nfs/dbraw/zinc/37/94/35/210379435.db2.gz CCLXLLHYPJOJNL-UHFFFAOYSA-N 0 1 376.460 3.314 10 0 GGAEMN COc1ccccc1-c1n[nH]c(SCc2cc(=O)n3c(C)csc3n2)n1 ZINC000020982684 210371735 /nfs/dbraw/zinc/37/17/35/210371735.db2.gz ZUPQCAUSPWBCCS-UHFFFAOYSA-N 0 1 385.474 3.150 10 0 GGAEMN CCc1ccc(-c2cc(C(=O)N3CCN(C(=O)c4cccs4)CC3)n[nH]2)cc1 ZINC000020930398 210370807 /nfs/dbraw/zinc/37/08/07/210370807.db2.gz JKBSXHHTGLMFOT-UHFFFAOYSA-N 0 1 394.500 3.299 10 0 GGAEMN Cc1c(C(=O)N2CCC(C)CC2)c(S(=O)(=O)Nc2ccccc2)c(C)n1C ZINC000021030548 210374878 /nfs/dbraw/zinc/37/48/78/210374878.db2.gz HSHXGDIDCCNRHS-UHFFFAOYSA-N 0 1 389.521 3.315 10 0 GGAEMN Cc1noc2ncnc(NCCCN3CCN(c4cc(C)ccc4C)CC3)c12 ZINC000020575190 210347368 /nfs/dbraw/zinc/34/73/68/210347368.db2.gz QNDHWKPHMCAOAN-UHFFFAOYSA-N 0 1 380.496 3.167 10 0 GGAEMN CN1CCN(CCNC(=O)c2cc3c(s2)c2ccccc2nc3Cl)CC1 ZINC000020286224 210327940 /nfs/dbraw/zinc/32/79/40/210327940.db2.gz RFBGXAJZFXTBTG-UHFFFAOYSA-N 0 1 388.924 3.080 10 0 GGAEMN Cc1ccc2nc(-c3cnn(C)c3)c(C)c(C(=O)N3CCCN(C)CC3)c2c1 ZINC000020256794 210323599 /nfs/dbraw/zinc/32/35/99/210323599.db2.gz RJKJOSPEHYQJSS-UHFFFAOYSA-N 0 1 377.492 3.030 10 0 GGAEMN O=C(CN1CCCC1)Nc1ccc(N2CCn3c4ccccc4nc3C2)cc1 ZINC000019855253 210304630 /nfs/dbraw/zinc/30/46/30/210304630.db2.gz FNVQIMWZHJUJPC-UHFFFAOYSA-N 0 1 375.476 3.091 10 0 GGAEMN Cc1ccc2n1CCN(C(=O)c1cc(COc3ccc4c(c3)OCO4)n[nH]1)[C@@H]2C ZINC000011820056 221130010 /nfs/dbraw/zinc/13/00/10/221130010.db2.gz ZYINPMGPOBHDCK-CQSZACIVSA-N 0 1 394.431 3.044 10 0 GGAEMN CC(C)c1n[nH]c(SCC(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)n1 ZINC000014232205 221305398 /nfs/dbraw/zinc/30/53/98/221305398.db2.gz FRVFNSUQBDVHPN-UHFFFAOYSA-N 0 1 393.944 3.018 10 0 GGAEMN CC(C)c1nc(SCC(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)n[nH]1 ZINC000014232205 221305400 /nfs/dbraw/zinc/30/54/00/221305400.db2.gz FRVFNSUQBDVHPN-UHFFFAOYSA-N 0 1 393.944 3.018 10 0 GGAEMN Cc1sc2nc(-c3ccccc3)nc(N3CCN(CCCO)CC3)c2c1C ZINC000058174999 136154913 /nfs/dbraw/zinc/15/49/13/136154913.db2.gz VEKXFHGNBDWDCT-UHFFFAOYSA-N 0 1 382.533 3.480 10 0 GGAEMN Cc1cccc(C(=O)N2CCN(c3cc(C)nc(N4CCCCC4)n3)CC2)c1 ZINC000064799756 136157642 /nfs/dbraw/zinc/15/76/42/136157642.db2.gz KQHHJOCRBSNVAB-UHFFFAOYSA-N 0 1 379.508 3.046 10 0 GGAEMN COCCN1CCN(c2nnc(-c3ccc(OC)cc3)c3ccccc32)C[C@@H]1C ZINC000096006382 136183229 /nfs/dbraw/zinc/18/32/29/136183229.db2.gz IYEJEZVNFQYLQP-KRWDZBQOSA-N 0 1 392.503 3.462 10 0 GGAEMN COc1cc(CN[C@H]2CCCN(c3ccccc3Cl)C2=O)cc2c1OCO2 ZINC000097009653 136187915 /nfs/dbraw/zinc/18/79/15/136187915.db2.gz WAKSCCUJWXNUQR-HNNXBMFYSA-N 0 1 388.851 3.363 10 0 GGAEMN Cc1cc(-n2nnc(C[N@H+]3CCC[C@H](C(=O)[O-])C3)c2-c2ccncc2)ccc1F ZINC000057345521 526081418 /nfs/dbraw/zinc/08/14/18/526081418.db2.gz VCPLNLIMCRBMGH-INIZCTEOSA-N 0 1 395.438 3.073 10 0 GGAEMN O=C(Cc1cn2ccsc2n1)NC1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000009157035 527320747 /nfs/dbraw/zinc/32/07/47/527320747.db2.gz HNHOREZHHMJKAR-UHFFFAOYSA-N 0 1 388.924 3.373 10 0 GGAEMN O=C([O-])COc1nc(Nc2ccccc2)nc2c1C[N@H+](Cc1ccccc1)CC2 ZINC000073696837 527620319 /nfs/dbraw/zinc/62/03/19/527620319.db2.gz QVTXANZYASKGAV-UHFFFAOYSA-N 0 1 390.443 3.242 10 0 GGAEMN O=C([O-])COc1nc(Nc2ccccc2)nc2c1C[N@@H+](Cc1ccccc1)CC2 ZINC000073696837 527620327 /nfs/dbraw/zinc/62/03/27/527620327.db2.gz QVTXANZYASKGAV-UHFFFAOYSA-N 0 1 390.443 3.242 10 0 GGAEMN CC(C)CN1CCN(Cc2nc(-c3ccc(N4CCC(C)CC4)nc3)no2)CC1 ZINC000065216201 535103550 /nfs/dbraw/zinc/10/35/50/535103550.db2.gz VNNHSIKZVLVGAE-UHFFFAOYSA-N 0 1 398.555 3.142 10 0 GGAEMN COc1cc(Br)c(F)cc1S(=O)(=O)NC(C)(C)C(C)(F)F ZINC000656186124 566883641 /nfs/dbraw/zinc/88/36/41/566883641.db2.gz FPRBOBOJWATJMI-UHFFFAOYSA-N 0 1 390.221 3.309 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1cc(F)c(Br)c(Cl)c1)C1CC1 ZINC000582785462 566893209 /nfs/dbraw/zinc/89/32/09/566893209.db2.gz IKGBJWWEGQFJKF-NSHDSACASA-N 0 1 386.670 3.408 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)Nc2nnc(C(F)(F)F)s2)ccc1F ZINC000115750710 564198538 /nfs/dbraw/zinc/19/85/38/564198538.db2.gz LZWPRJXKQQZIMW-UHFFFAOYSA-N 0 1 377.367 3.079 10 0 GGAEMN Cc1[nH]c(=S)sc1CC(=O)N[C@@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000116252487 564206300 /nfs/dbraw/zinc/20/63/00/564206300.db2.gz GCXFKUUOWODKHV-SWLSCSKDSA-N 0 1 376.551 3.078 10 0 GGAEMN COc1ccc(CN2CC[C@H](c3cnn(C)c3)C2)c(Br)c1OC ZINC000116318941 564207884 /nfs/dbraw/zinc/20/78/84/564207884.db2.gz FAKRFEOHYLBPMK-LBPRGKRZSA-N 0 1 380.286 3.189 10 0 GGAEMN CC[C@@H](Cc1cccc(Br)c1)C(=O)NCCCCN1CCOCC1 ZINC000117238668 564224636 /nfs/dbraw/zinc/22/46/36/564224636.db2.gz OOEBPDHGACUNAG-KRWDZBQOSA-N 0 1 397.357 3.246 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2cc(Br)ccc2F)CCN1CCOC ZINC000117457491 564227315 /nfs/dbraw/zinc/22/73/15/564227315.db2.gz NKTITVQNTLHZLB-ZDUSSCGKSA-N 0 1 388.281 3.163 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2ccc(Br)cc2C)CCN1CCOC ZINC000117437417 564227425 /nfs/dbraw/zinc/22/74/25/564227425.db2.gz NGZFPJKMBXZVMD-OAHLLOKOSA-N 0 1 384.318 3.332 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2ccc(C)cc2Br)CCN1CCOC ZINC000117436056 564227565 /nfs/dbraw/zinc/22/75/65/564227565.db2.gz IRFABFBFIJKRFQ-AWEZNQCLSA-N 0 1 384.318 3.332 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2cccc(Br)c2C)CCN1CCOC ZINC000117453199 564227750 /nfs/dbraw/zinc/22/77/50/564227750.db2.gz JHBBAOXJBDDXMV-CQSZACIVSA-N 0 1 384.318 3.332 10 0 GGAEMN Cc1c(Cl)cccc1NC(=O)CSC1=Nc2ccccc2S(=O)(=O)N1 ZINC000006918668 564230335 /nfs/dbraw/zinc/23/03/35/564230335.db2.gz WHKPYHPYWUJWFB-UHFFFAOYSA-N 0 1 395.893 3.491 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNc3ncncc3Br)cc2)C[C@H](C)O1 ZINC000473108065 564239851 /nfs/dbraw/zinc/23/98/51/564239851.db2.gz KETRSTSACOHHFK-OKILXGFUSA-N 0 1 391.313 3.460 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNc3ncncc3Br)cc2)C[C@@H](C)O1 ZINC000473108066 564239950 /nfs/dbraw/zinc/23/99/50/564239950.db2.gz KETRSTSACOHHFK-ZIAGYGMSSA-N 0 1 391.313 3.460 10 0 GGAEMN COc1ccc(NC(=O)CSc2nc(-c3ccncc3)n[nH]2)cc1Cl ZINC000008074322 564244967 /nfs/dbraw/zinc/24/49/67/564244967.db2.gz TYEOOQPYOIBSQX-UHFFFAOYSA-N 0 1 375.841 3.260 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCCc2cc(Br)ccc2F)n[nH]1 ZINC000118995166 564250261 /nfs/dbraw/zinc/25/02/61/564250261.db2.gz ZNXMMBAGERPJDX-JTQLQIEISA-N 0 1 383.265 3.093 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCCc2cc(Br)ccc2F)n[nH]1 ZINC000118995040 564250330 /nfs/dbraw/zinc/25/03/30/564250330.db2.gz ZNXMMBAGERPJDX-SNVBAGLBSA-N 0 1 383.265 3.093 10 0 GGAEMN CC(C)Cn1c(=O)cc(O)nc1SCC(=O)Nc1ccc(Cl)cc1F ZINC000009442262 564253012 /nfs/dbraw/zinc/25/30/12/564253012.db2.gz BUSWEDVVRBLYFI-UHFFFAOYSA-N 0 1 385.848 3.128 10 0 GGAEMN Cc1ccc(NC(=O)CSC2=Nc3ccccc3S(=O)(=O)N2)cc1Cl ZINC000009530221 564254058 /nfs/dbraw/zinc/25/40/58/564254058.db2.gz OLICPTUMZNNHFT-UHFFFAOYSA-N 0 1 395.893 3.491 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)[C@@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000119168103 564258244 /nfs/dbraw/zinc/25/82/44/564258244.db2.gz ASAMCMNOFZEGIC-XJKSGUPXSA-N 0 1 381.314 3.259 10 0 GGAEMN CCn1nc(C)c(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)c1C ZINC000119733970 564285792 /nfs/dbraw/zinc/28/57/92/564285792.db2.gz LMKCWYISCPSDMG-UHFFFAOYSA-N 0 1 389.301 3.357 10 0 GGAEMN CN1C[C@@H](NCc2csc(-c3cccc(Br)c3)n2)CCC1=O ZINC000119932816 564296114 /nfs/dbraw/zinc/29/61/14/564296114.db2.gz GWNBSYANGYJDAF-ZDUSSCGKSA-N 0 1 380.311 3.283 10 0 GGAEMN C[C@H](NC(=O)NCCCN1C[C@@H](C)O[C@H](C)C1)c1cccc(Br)c1 ZINC000120484889 564321586 /nfs/dbraw/zinc/32/15/86/564321586.db2.gz OIUDCXTYNLGYMK-KFWWJZLASA-N 0 1 398.345 3.309 10 0 GGAEMN C[C@@H](C1CC1)N(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000120518782 564323892 /nfs/dbraw/zinc/32/38/92/564323892.db2.gz STYRWLABSYZIIX-JTQLQIEISA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@@H](C1CC1)N(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000120518782 564323898 /nfs/dbraw/zinc/32/38/98/564323898.db2.gz STYRWLABSYZIIX-JTQLQIEISA-N 0 1 378.274 3.174 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H](C)C(=O)Nc1ccccc1Br ZINC000023762070 564326146 /nfs/dbraw/zinc/32/61/46/564326146.db2.gz MQXPLPPOJBIMAO-SECBINFHSA-N 0 1 385.287 3.276 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H](C)C(=O)N(C)Cc1c(F)cccc1Cl ZINC000023763976 564327166 /nfs/dbraw/zinc/32/71/66/564327166.db2.gz DPEQBZUUTJIFKC-JTQLQIEISA-N 0 1 386.880 3.325 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)c(Cl)cc1F ZINC000120662119 564331720 /nfs/dbraw/zinc/33/17/20/564331720.db2.gz CATVFCLOHPAEMH-VIFPVBQESA-N 0 1 384.816 3.308 10 0 GGAEMN C[C@@H](O)CN1CCN(C(=O)CCCc2cc(Cl)sc2Cl)C[C@H]1C ZINC000120678495 564332818 /nfs/dbraw/zinc/33/28/18/564332818.db2.gz XMAFGBWJJPYREM-VXGBXAGGSA-N 0 1 379.353 3.291 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(-c3nncn3C)c2)c(Cl)cc1F ZINC000120827897 564339242 /nfs/dbraw/zinc/33/92/42/564339242.db2.gz DKLCITLGPRXEHA-UHFFFAOYSA-N 0 1 380.832 3.384 10 0 GGAEMN O=C1CCCN1CCCNCc1csc(COc2ccc(Cl)cc2)n1 ZINC000120991953 564347199 /nfs/dbraw/zinc/34/71/99/564347199.db2.gz GEOBTACZPGOGIS-UHFFFAOYSA-N 0 1 379.913 3.478 10 0 GGAEMN O=C(Cc1ccc(Br)s1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000121038509 564350224 /nfs/dbraw/zinc/35/02/24/564350224.db2.gz BLRSNPXQCZFXBX-NSHDSACASA-N 0 1 395.326 3.455 10 0 GGAEMN O=C(Cc1ccc(Br)s1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000121038660 564350258 /nfs/dbraw/zinc/35/02/58/564350258.db2.gz BLRSNPXQCZFXBX-LLVKDONJSA-N 0 1 395.326 3.455 10 0 GGAEMN Cc1nc(-c2ccc(S(=O)(=O)N[C@H]3CN(C(C)C)C[C@@H]3C)s2)cs1 ZINC000121069513 564351341 /nfs/dbraw/zinc/35/13/41/564351341.db2.gz YYICOWIDRPWKOG-AAEUAGOBSA-N 0 1 385.580 3.187 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC[C@H](C)Oc2ccccc2Br)n[nH]1 ZINC000121162426 564356930 /nfs/dbraw/zinc/35/69/30/564356930.db2.gz NZJRYJZICXUBBN-YPMHNXCESA-N 0 1 395.301 3.178 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC[C@@H](C)Oc2ccccc2Br)n[nH]1 ZINC000121162075 564357194 /nfs/dbraw/zinc/35/71/94/564357194.db2.gz NZJRYJZICXUBBN-DGCLKSJQSA-N 0 1 395.301 3.178 10 0 GGAEMN COC(=O)c1cccc(NS(=O)(=O)c2ccccc2Br)c1C ZINC000028249406 564361450 /nfs/dbraw/zinc/36/14/50/564361450.db2.gz RWABDFLMWPLEDU-UHFFFAOYSA-N 0 1 384.251 3.345 10 0 GGAEMN Cc1cnccc1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000121415004 564368832 /nfs/dbraw/zinc/36/88/32/564368832.db2.gz VHFFSXNVGPCJLK-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1cnccc1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000121415004 564368836 /nfs/dbraw/zinc/36/88/36/564368836.db2.gz VHFFSXNVGPCJLK-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN C[C@@H](NCc1cc(Br)ccc1F)c1ccc(S(N)(=O)=O)cc1 ZINC000121525889 564372787 /nfs/dbraw/zinc/37/27/87/564372787.db2.gz XJFBCVHFPREFFI-SNVBAGLBSA-N 0 1 387.274 3.086 10 0 GGAEMN Cc1ccc(NC(=O)CN2CCCC[C@H]2c2nnc[nH]2)c(Br)c1 ZINC000121694136 564381230 /nfs/dbraw/zinc/38/12/30/564381230.db2.gz RZIHBIYXXPZQAI-AWEZNQCLSA-N 0 1 378.274 3.041 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)Cc2ccccc2Br)n[nH]1 ZINC000121885815 564391325 /nfs/dbraw/zinc/39/13/25/564391325.db2.gz BHXAKRJVOZVXLJ-NEPJUHHUSA-N 0 1 379.302 3.342 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)Cc2ccccc2Br)n[nH]1 ZINC000121885497 564391503 /nfs/dbraw/zinc/39/15/03/564391503.db2.gz BHXAKRJVOZVXLJ-RYUDHWBXSA-N 0 1 379.302 3.342 10 0 GGAEMN CN(CC1CCOCC1)C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1 ZINC000122063629 564399409 /nfs/dbraw/zinc/39/94/09/564399409.db2.gz DZUDWYJHVZKXPS-UHFFFAOYSA-N 0 1 378.270 3.338 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)NCCCN1CCc2ccccc2C1 ZINC000032433777 564399712 /nfs/dbraw/zinc/39/97/12/564399712.db2.gz QEYQTYWTEMPAEJ-UHFFFAOYSA-N 0 1 378.925 3.375 10 0 GGAEMN CC[C@H](CO)N1CCN(CCSc2ccnc3cc(Cl)ccc32)CC1 ZINC000122107524 564400412 /nfs/dbraw/zinc/40/04/12/564400412.db2.gz IHNYRYDCYKNQDM-MRXNPFEDSA-N 0 1 379.957 3.369 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H](C)Cc2ccc(F)c(Br)c2)n[nH]1 ZINC000122161053 564402556 /nfs/dbraw/zinc/40/25/56/564402556.db2.gz YJYQFEWKRWVSEL-MNOVXSKESA-N 0 1 397.292 3.481 10 0 GGAEMN CCCCNC(=O)[C@H]1CCCN(c2nc3ccc(Br)cc3[nH]2)C1 ZINC000033071325 564409788 /nfs/dbraw/zinc/40/97/88/564409788.db2.gz OVXGGJVWQQKRRV-LBPRGKRZSA-N 0 1 379.302 3.458 10 0 GGAEMN COCCN1CCc2nc(SCc3ccc(F)cc3Cl)[nH]c(=O)c2C1 ZINC000033287213 564412638 /nfs/dbraw/zinc/41/26/38/564412638.db2.gz ZCWZRQYJBKXINN-UHFFFAOYSA-N 0 1 383.876 3.272 10 0 GGAEMN CN(CCC1CC1)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000122570732 564419301 /nfs/dbraw/zinc/41/93/01/564419301.db2.gz ZVIGOOVALXSQDW-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN CN(CCC1CC1)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000122570732 564419303 /nfs/dbraw/zinc/41/93/03/564419303.db2.gz ZVIGOOVALXSQDW-UHFFFAOYSA-N 0 1 378.274 3.176 10 0 GGAEMN Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)CN(C)C)c(Br)c1 ZINC000040692837 564427897 /nfs/dbraw/zinc/42/78/97/564427897.db2.gz SMJRYQSAUKBECH-CYBMUJFWSA-N 0 1 377.348 3.012 10 0 GGAEMN C[C@@H](NCCCS(C)(=O)=O)c1ccc(Br)cc1Br ZINC000041660307 564435841 /nfs/dbraw/zinc/43/58/41/564435841.db2.gz WWQILYWNHWKQQY-SECBINFHSA-N 0 1 399.148 3.297 10 0 GGAEMN C[C@H](NC[C@H]1COCCO1)c1ccc(Br)cc1Br ZINC000041660422 564435855 /nfs/dbraw/zinc/43/58/55/564435855.db2.gz HQVINFRCYIEZJG-ONGXEEELSA-N 0 1 379.092 3.278 10 0 GGAEMN CCSc1cc(Cl)ccc1C(=O)N1CCO[C@H](c2n[nH]c(CC)n2)C1 ZINC000123692758 564458599 /nfs/dbraw/zinc/45/85/99/564458599.db2.gz YWBXANMDDAPWIZ-ZDUSSCGKSA-N 0 1 380.901 3.346 10 0 GGAEMN Cc1ncc(CN[C@@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)s1 ZINC000123747389 564460032 /nfs/dbraw/zinc/46/00/32/564460032.db2.gz BFIONNSBJUCGTD-AWEZNQCLSA-N 0 1 379.551 3.477 10 0 GGAEMN C[C@H](C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1)c1ccc(Br)s1 ZINC000123957760 564467396 /nfs/dbraw/zinc/46/73/96/564467396.db2.gz BYAMZTKHCORCRN-ZETCQYMHSA-N 0 1 393.266 3.228 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3cc(Cl)cc(Br)c3)cc21 ZINC000124045549 564470602 /nfs/dbraw/zinc/47/06/02/564470602.db2.gz FJTQNUSOCJEUNK-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3c(Br)cccc3C2)n[nH]1 ZINC000124359366 564479920 /nfs/dbraw/zinc/47/99/20/564479920.db2.gz GHVZDCQMAATJGI-NSHDSACASA-N 0 1 377.286 3.180 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000124504812 564484563 /nfs/dbraw/zinc/48/45/63/564484563.db2.gz RPZGTIPTZASGBN-ZYHUDNBSSA-N 0 1 380.261 3.479 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000124505052 564484942 /nfs/dbraw/zinc/48/49/42/564484942.db2.gz RPZGTIPTZASGBN-JQWIXIFHSA-N 0 1 380.261 3.479 10 0 GGAEMN CC1=C(C(=O)OC(C)(C)C)[C@@H](c2ccccc2Br)n2nnnc2N1 ZINC000045896106 564491893 /nfs/dbraw/zinc/49/18/93/564491893.db2.gz FTYJZOBJSZECMS-CYBMUJFWSA-N 0 1 392.257 3.066 10 0 GGAEMN CC(C)[C@H](CNC(=O)NCc1ccc(Cl)cc1Cl)N1CCN(C)CC1 ZINC000125325590 564511209 /nfs/dbraw/zinc/51/12/09/564511209.db2.gz UYWHHZRTHLEQLD-KRWDZBQOSA-N 0 1 387.355 3.065 10 0 GGAEMN O[C@H](COC[C@@H]1CCCO1)CN(Cc1csc(Br)c1)C1CC1 ZINC000125344408 564512262 /nfs/dbraw/zinc/51/22/62/564512262.db2.gz OMUZSKNMLCCJLF-GJZGRUSLSA-N 0 1 390.343 3.032 10 0 GGAEMN CN(Cc1ccc2c(c1)OCCO2)[C@@H](CO)c1cccc(Br)c1 ZINC000125758123 564526059 /nfs/dbraw/zinc/52/60/59/564526059.db2.gz MXXNZVFDYCGVRN-INIZCTEOSA-N 0 1 378.266 3.386 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N[C@H]1CCSc2ccc(Cl)cc21 ZINC000048256522 564534626 /nfs/dbraw/zinc/53/46/26/564534626.db2.gz PJBLAFQXDJKFFZ-INIZCTEOSA-N 0 1 383.945 3.289 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1ccc(C2SCCCS2)cc1 ZINC000048285609 564535408 /nfs/dbraw/zinc/53/54/08/564535408.db2.gz ZATKWHHCXYAGEP-UHFFFAOYSA-N 0 1 380.579 3.398 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1csc(-c2cccc(Cl)c2)n1 ZINC000048284448 564535528 /nfs/dbraw/zinc/53/55/28/564535528.db2.gz MQXUUZKXMQWVJZ-UHFFFAOYSA-N 0 1 379.913 3.306 10 0 GGAEMN C[C@@H](N[C@@H](C)c1cccc(Cl)c1)C(=O)Nc1ccccc1S(C)(=O)=O ZINC000126215030 564541102 /nfs/dbraw/zinc/54/11/02/564541102.db2.gz YCGIMYRVGIUOJP-QWHCGFSZSA-N 0 1 380.897 3.421 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Nc2cncc(Br)c2)c2ccccc2)n[nH]1 ZINC000126506995 564551462 /nfs/dbraw/zinc/55/14/62/564551462.db2.gz MMLQHOYSDIFDSG-AWEZNQCLSA-N 0 1 387.241 3.182 10 0 GGAEMN CC(C)N(CC(F)(F)F)C(=O)CSc1nc(C(F)(F)F)cc(=O)[nH]1 ZINC000127017731 564570332 /nfs/dbraw/zinc/57/03/32/564570332.db2.gz JRFIGDPJRVMJJU-UHFFFAOYSA-N 0 1 377.310 3.092 10 0 GGAEMN Cn1ccnc1[C@H](NCCC(=O)Nc1ccc(Br)cc1)C1CC1 ZINC000127648162 564590409 /nfs/dbraw/zinc/59/04/09/564590409.db2.gz QRINUJDLXLLFBT-MRXNPFEDSA-N 0 1 377.286 3.252 10 0 GGAEMN Cc1nnc(SCC(=O)Nc2ccnn2Cc2ccc(Cl)cc2Cl)[nH]1 ZINC000053673842 564592881 /nfs/dbraw/zinc/59/28/81/564592881.db2.gz LPLTZEKWGKNYDM-UHFFFAOYSA-N 0 1 397.291 3.396 10 0 GGAEMN Cc1n[nH]c(SCC(=O)Nc2ccnn2Cc2ccc(Cl)cc2Cl)n1 ZINC000053673842 564592884 /nfs/dbraw/zinc/59/28/84/564592884.db2.gz LPLTZEKWGKNYDM-UHFFFAOYSA-N 0 1 397.291 3.396 10 0 GGAEMN O=C(CSCC(F)(F)F)N1CCC(c2ncc(C(F)(F)F)[nH]2)CC1 ZINC000127796588 564596468 /nfs/dbraw/zinc/59/64/68/564596468.db2.gz HZCSTUINVVJDPV-UHFFFAOYSA-N 0 1 375.338 3.430 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C[C@@H](C)O ZINC000127810664 564596933 /nfs/dbraw/zinc/59/69/33/564596933.db2.gz CBURVFWDBTXUMF-IAQYHMDHSA-N 0 1 378.822 3.276 10 0 GGAEMN COc1cc(CN2CCN(C3CC3)CC2)cc(Br)c1OC(F)F ZINC000127874461 564599059 /nfs/dbraw/zinc/59/90/59/564599059.db2.gz ODEXKTBHKYUXAK-UHFFFAOYSA-N 0 1 391.256 3.339 10 0 GGAEMN CN(C)c1nc(NCc2cnc(-c3ccc(Br)cc3)s2)n[nH]1 ZINC000485386516 564613337 /nfs/dbraw/zinc/61/33/37/564613337.db2.gz JQBDILZBHMXKGO-UHFFFAOYSA-N 0 1 379.287 3.369 10 0 GGAEMN C[C@@H](NCCNC(=O)C1CC1)c1ccc(Br)cc1Br ZINC000128318496 564614129 /nfs/dbraw/zinc/61/41/29/564614129.db2.gz LLIMORVPDHRANF-SECBINFHSA-N 0 1 390.119 3.388 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000128529447 564621246 /nfs/dbraw/zinc/62/12/46/564621246.db2.gz ARJFVKDIPXKZAX-SSDOTTSWSA-N 0 1 395.289 3.276 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000128539861 564621730 /nfs/dbraw/zinc/62/17/30/564621730.db2.gz XNKZPHWIGFCODB-LLVKDONJSA-N 0 1 382.507 3.267 10 0 GGAEMN C[C@H](NCc1ccc(F)cc1C(F)(F)F)c1ccc(S(N)(=O)=O)cc1 ZINC000129423333 564648538 /nfs/dbraw/zinc/64/85/38/564648538.db2.gz FWZVCZVSXYSAOX-JTQLQIEISA-N 0 1 376.375 3.343 10 0 GGAEMN COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCN(C2CCOCC2)CC1 ZINC000129411351 564648638 /nfs/dbraw/zinc/64/86/38/564648638.db2.gz DWOZWDKSACAYEC-QGZVFWFLSA-N 0 1 387.307 3.004 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2cc(C)ccc2Br)CCN1CCOC ZINC000129656542 564655565 /nfs/dbraw/zinc/65/55/65/564655565.db2.gz ZJXHCIMPTYQYQR-CQSZACIVSA-N 0 1 384.318 3.332 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)Cc3ccc(Br)cc3)[nH]c21 ZINC000129969931 564665904 /nfs/dbraw/zinc/66/59/04/564665904.db2.gz DAWXTMCPZIQZCJ-UHFFFAOYSA-N 0 1 394.294 3.253 10 0 GGAEMN CC[C@@H](NCC(=O)Nc1sccc1C(N)=O)c1ccc(Br)cc1 ZINC000057456007 564667727 /nfs/dbraw/zinc/66/77/27/564667727.db2.gz SOXFFHASXJXXMI-CYBMUJFWSA-N 0 1 396.310 3.289 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3cc4c(cccc4Br)[nH]3)cc21 ZINC000130411552 564679719 /nfs/dbraw/zinc/67/97/19/564679719.db2.gz FRMVEXJBRLDQRU-UHFFFAOYSA-N 0 1 398.220 3.158 10 0 GGAEMN COc1c(C)cnc(CNC(=O)c2cc(C)cc(Br)c2O)c1C ZINC000058421698 564683416 /nfs/dbraw/zinc/68/34/16/564683416.db2.gz ZFXMOSLLPFMZKK-UHFFFAOYSA-N 0 1 379.254 3.414 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SCc2nnc(C3CC3)n2C)n1 ZINC000130515537 564684996 /nfs/dbraw/zinc/68/49/96/564684996.db2.gz UELDLMNZYBWEQY-UHFFFAOYSA-N 0 1 376.873 3.432 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)n[nH]1 ZINC000130598031 564686859 /nfs/dbraw/zinc/68/68/59/564686859.db2.gz GCGALUBPDOOQKE-ZETCQYMHSA-N 0 1 389.670 3.364 10 0 GGAEMN C[C@@H](N[C@H](C)c1cccc(Br)c1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000130923637 564695331 /nfs/dbraw/zinc/69/53/31/564695331.db2.gz ZYARFRGLULVFIW-VXGBXAGGSA-N 0 1 390.281 3.226 10 0 GGAEMN O=S(=O)(Nc1cnoc1)c1ccc(Br)cc1Br ZINC000060393551 564698157 /nfs/dbraw/zinc/69/81/57/564698157.db2.gz DSRMUIVARIELHH-UHFFFAOYSA-N 0 1 382.033 3.000 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1ccn(-c2ccncc2)n1 ZINC000525649152 564704405 /nfs/dbraw/zinc/70/44/05/564704405.db2.gz KEOIXQBBYFMQDI-UHFFFAOYSA-N 0 1 387.237 3.220 10 0 GGAEMN Cc1sc2ncnc(SCC(=O)N3CCCN(C4CC4)CC3)c2c1C ZINC000061605727 564706859 /nfs/dbraw/zinc/70/68/59/564706859.db2.gz OZZZCZVVOHTLFA-UHFFFAOYSA-N 0 1 376.551 3.097 10 0 GGAEMN C[C@H]1CN(CCCOc2cccc(I)c2)[C@@H](C)CO1 ZINC000064140828 564726408 /nfs/dbraw/zinc/72/64/08/564726408.db2.gz HEHWCOAKLZPJLE-STQMWFEESA-N 0 1 375.250 3.169 10 0 GGAEMN CNS(=O)(=O)c1cccc(CN[C@@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000131947586 564728887 /nfs/dbraw/zinc/72/88/87/564728887.db2.gz GJIOZHYDFKMAGL-QGZVFWFLSA-N 0 1 380.897 3.252 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)NCc2cscn2)cc1 ZINC000132004192 564730951 /nfs/dbraw/zinc/73/09/51/564730951.db2.gz MCEQSQOVDAPIAX-UHFFFAOYSA-N 0 1 393.515 3.244 10 0 GGAEMN COCCNC(=O)[C@H]1CC[C@@H](C)N(CCOc2c(Cl)cccc2Cl)C1 ZINC000064994745 564738878 /nfs/dbraw/zinc/73/88/78/564738878.db2.gz XXPRJCNMOLEDIU-KGLIPLIRSA-N 0 1 389.323 3.235 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000065297657 564741983 /nfs/dbraw/zinc/74/19/83/564741983.db2.gz NEJVIMIBPZLYAU-XJKSGUPXSA-N 0 1 389.323 3.066 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1ccc2c(c1)COC2 ZINC000132875652 564756036 /nfs/dbraw/zinc/75/60/36/564756036.db2.gz RZOHBYINIRZKML-UHFFFAOYSA-N 0 1 384.251 3.289 10 0 GGAEMN C[C@@H](NCc1ccc(Br)c(F)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000133290608 564769502 /nfs/dbraw/zinc/76/95/02/564769502.db2.gz CDUZOWGRALHDMQ-SNVBAGLBSA-N 0 1 387.274 3.086 10 0 GGAEMN O=C1CCCN1C[C@H](O)CN(Cc1ccccc1Br)C1CCCC1 ZINC000133450430 564774158 /nfs/dbraw/zinc/77/41/58/564774158.db2.gz GKNOOCGEIRZILL-KRWDZBQOSA-N 0 1 395.341 3.177 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCO[C@H](c2ccc(Br)cc2)C1 ZINC000133548318 564777861 /nfs/dbraw/zinc/77/78/61/564777861.db2.gz INYYWXWOCAWWOR-YOEHRIQHSA-N 0 1 390.281 3.192 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCO[C@@H](c2cccc(Br)c2)C1 ZINC000134147814 564795044 /nfs/dbraw/zinc/79/50/44/564795044.db2.gz JPSYAKVECNBLRH-RHSMWYFYSA-N 0 1 390.281 3.192 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCO[C@H](c2ccccc2Br)C1 ZINC000134220817 564796029 /nfs/dbraw/zinc/79/60/29/564796029.db2.gz JVPGRNJMHGOUFD-SJCJKPOMSA-N 0 1 390.281 3.192 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@H](O)COc1cc(Cl)ccc1Cl ZINC000067653512 564796808 /nfs/dbraw/zinc/79/68/08/564796808.db2.gz UWRRZQNQZFVPFP-HOCLYGCPSA-N 0 1 389.323 3.066 10 0 GGAEMN OCC[C@]1(CNCc2csc(-c3cccc(Br)c3)n2)CCOC1 ZINC000134426787 564802832 /nfs/dbraw/zinc/80/28/32/564802832.db2.gz DLHRWVPCBZGSLP-QGZVFWFLSA-N 0 1 397.338 3.451 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccccc2C(F)(F)F)cc1S(C)(=O)=O ZINC000134636959 564809930 /nfs/dbraw/zinc/80/99/30/564809930.db2.gz WQMGDEBMFZZZOX-UHFFFAOYSA-N 0 1 393.408 3.218 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)c(Cl)cc1F ZINC000134635207 564810288 /nfs/dbraw/zinc/81/02/88/564810288.db2.gz OXNUBHZJQVHAEJ-UHFFFAOYSA-N 0 1 391.873 3.300 10 0 GGAEMN CS(=O)(=O)c1ccc(-c2nc(CSc3nc(C4CC4)n[nH]3)co2)cc1 ZINC000134685843 564812722 /nfs/dbraw/zinc/81/27/22/564812722.db2.gz UDHADVKYKXJAJU-UHFFFAOYSA-N 0 1 376.463 3.033 10 0 GGAEMN CS(=O)(=O)c1ccc(-c2nc(CSc3n[nH]c(C4CC4)n3)co2)cc1 ZINC000134685843 564812726 /nfs/dbraw/zinc/81/27/26/564812726.db2.gz UDHADVKYKXJAJU-UHFFFAOYSA-N 0 1 376.463 3.033 10 0 GGAEMN Cc1nn(CCS(C)(=O)=O)c(C)c1[C@@H](C)N[C@@H]1CCCc2sccc21 ZINC000134965600 564820304 /nfs/dbraw/zinc/82/03/04/564820304.db2.gz NWXONNBYYKNETP-MLGOLLRUSA-N 0 1 381.567 3.334 10 0 GGAEMN COCCN1CCC[C@H]1CNC(=O)c1cc2cc(Br)ccc2o1 ZINC000069505477 564840616 /nfs/dbraw/zinc/84/06/16/564840616.db2.gz HOUPMXQREMCDDZ-AWEZNQCLSA-N 0 1 381.270 3.036 10 0 GGAEMN O=S(=O)(Nc1ccc2ncccc2c1)c1cc2c(cc1Cl)OCCO2 ZINC000135937724 564843219 /nfs/dbraw/zinc/84/32/19/564843219.db2.gz IKAVJJWIVLQCEU-UHFFFAOYSA-N 0 1 376.821 3.460 10 0 GGAEMN CCCCN(CCCc1nc(-c2cccs2)no1)[C@H]1CCS(=O)(=O)C1 ZINC000071089657 564855113 /nfs/dbraw/zinc/85/51/13/564855113.db2.gz NFPNXIXELFBQDA-AWEZNQCLSA-N 0 1 383.539 3.020 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cnc3ccccc3c2)cc1Cl ZINC000137176369 564859172 /nfs/dbraw/zinc/85/91/72/564859172.db2.gz RQNNUZUOCQIPOT-UHFFFAOYSA-N 0 1 376.821 3.476 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Br)cc1)N1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000140469858 564872319 /nfs/dbraw/zinc/87/23/19/564872319.db2.gz JRJAOBQKJAFUMI-HBUWYVDXSA-N 0 1 381.314 3.403 10 0 GGAEMN CN1C(=O)C[C@H](NC(=O)c2ccc(O)c(Cl)c2)[C@@H]1c1ccc(Cl)cc1 ZINC000091770776 564872962 /nfs/dbraw/zinc/87/29/62/564872962.db2.gz CNWCZXHKOKOBIL-YOEHRIQHSA-N 0 1 379.243 3.401 10 0 GGAEMN CCn1c(NC(=O)c2ccc(COC)o2)nc2cc(Br)ccc21 ZINC000092107719 564875181 /nfs/dbraw/zinc/87/51/81/564875181.db2.gz OHQYHLNEFMVELG-UHFFFAOYSA-N 0 1 378.226 3.232 10 0 GGAEMN COCCNC(=O)[C@H]1CC[C@H](C)N(CCOc2c(Cl)cccc2Cl)C1 ZINC000144338380 564877370 /nfs/dbraw/zinc/87/73/70/564877370.db2.gz XXPRJCNMOLEDIU-KBPBESRZSA-N 0 1 389.323 3.235 10 0 GGAEMN CCCOc1c(Br)cc(CN2CCCC[C@H]2CC(N)=O)cc1OC ZINC000092589085 564879249 /nfs/dbraw/zinc/87/92/49/564879249.db2.gz FERNYMBNHNHWBX-AWEZNQCLSA-N 0 1 399.329 3.476 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1CCCC[C@H]1CC(N)=O ZINC000092588991 564879371 /nfs/dbraw/zinc/87/93/71/564879371.db2.gz DATTUUUKBQMHJY-INIZCTEOSA-N 0 1 399.329 3.094 10 0 GGAEMN CCCOc1c(Br)cc(CN2CCCC[C@@H]2CC(N)=O)cc1OC ZINC000092589083 564879626 /nfs/dbraw/zinc/87/96/26/564879626.db2.gz FERNYMBNHNHWBX-CQSZACIVSA-N 0 1 399.329 3.476 10 0 GGAEMN COc1ccc(Br)c(S(=O)(=O)Nc2ccc3c(C)n[nH]c3c2)c1 ZINC000093909465 564892835 /nfs/dbraw/zinc/89/28/35/564892835.db2.gz URLDGAQDTCQYTF-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN O=C(Nc1ccn(-c2ccc(Br)cc2)n1)[C@@H]1CCCc2[nH]ncc21 ZINC000498863832 564910800 /nfs/dbraw/zinc/91/08/00/564910800.db2.gz CXQGYXKGXNPTKD-CYBMUJFWSA-N 0 1 386.253 3.417 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC2(c3ccc(Br)cc3)CC2)n[nH]1 ZINC000151362925 564915855 /nfs/dbraw/zinc/91/58/55/564915855.db2.gz ZWDFLROCPQACMR-LLVKDONJSA-N 0 1 377.286 3.400 10 0 GGAEMN Cc1ccc(I)c(C(=O)Nc2nc(-c3ccco3)n[nH]2)c1 ZINC000101636201 564919839 /nfs/dbraw/zinc/91/98/39/564919839.db2.gz UMFXEBRUEIIPEH-UHFFFAOYSA-N 0 1 394.172 3.230 10 0 GGAEMN C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)NCCCCN1CCOCC1 ZINC000101789948 564922516 /nfs/dbraw/zinc/92/25/16/564922516.db2.gz FLWJUEYNNHOPCP-CQSZACIVSA-N 0 1 388.339 3.336 10 0 GGAEMN C[C@H](NC(=O)c1ccc2c(c1)[nH]c(=S)n(C)c2=O)c1ccc(Cl)s1 ZINC000102309683 564928538 /nfs/dbraw/zinc/92/85/38/564928538.db2.gz UDECSSRIOQANFR-QMMMGPOBSA-N 0 1 379.894 3.428 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)Nc2ccc(Cl)c(Br)c2)CC1 ZINC000151627394 564930113 /nfs/dbraw/zinc/93/01/13/564930113.db2.gz YGFOBHWAZQRNMG-LBPRGKRZSA-N 0 1 390.709 3.023 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)Nc2ccc(Cl)c(Br)c2)CC1 ZINC000151627451 564930477 /nfs/dbraw/zinc/93/04/77/564930477.db2.gz YGFOBHWAZQRNMG-GFCCVEGCSA-N 0 1 390.709 3.023 10 0 GGAEMN C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1cccc(Br)c1 ZINC000102675210 564931848 /nfs/dbraw/zinc/93/18/48/564931848.db2.gz VELBMWUJHMQYID-LBPRGKRZSA-N 0 1 383.311 3.290 10 0 GGAEMN CO[C@@H](C)c1cccc(NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)c1 ZINC000102747899 564934273 /nfs/dbraw/zinc/93/42/73/564934273.db2.gz RAUVZCQLDXQMCO-JTQLQIEISA-N 0 1 380.853 3.343 10 0 GGAEMN CCn1nc(C)cc1C(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000102752704 564935369 /nfs/dbraw/zinc/93/53/69/564935369.db2.gz PTWKGJBGIHZDEQ-UHFFFAOYSA-N 0 1 375.230 3.011 10 0 GGAEMN C[C@H]1CC[C@H](C(N)=O)CN1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000103283408 564945505 /nfs/dbraw/zinc/94/55/05/564945505.db2.gz QXWVYWIDPQXQOP-AAEUAGOBSA-N 0 1 378.270 3.190 10 0 GGAEMN Cc1nc([C@@H](NC(=O)c2sccc2Br)c2ccccc2)n[nH]1 ZINC000103280938 564945522 /nfs/dbraw/zinc/94/55/22/564945522.db2.gz BHDRWMCBBPEZPY-LBPRGKRZSA-N 0 1 377.267 3.457 10 0 GGAEMN Cc1[nH]c2nc(S(=O)(=O)Cc3ccccc3F)nc-2cc1Br ZINC000152063580 564946030 /nfs/dbraw/zinc/94/60/30/564946030.db2.gz QEXRDAUVFKJFHN-UHFFFAOYSA-N 0 1 384.230 3.142 10 0 GGAEMN O[C@H](COc1ccc(Cl)cc1Cl)CN1CC[C@H](Oc2cccnc2)C1 ZINC000152288208 564953807 /nfs/dbraw/zinc/95/38/07/564953807.db2.gz PZXBMLBEAPFEHP-HOCLYGCPSA-N 0 1 383.275 3.281 10 0 GGAEMN O=S(=O)(Nc1cccc(-c2nc[nH]n2)c1)c1cc(F)ccc1Br ZINC000152463204 564959521 /nfs/dbraw/zinc/95/95/21/564959521.db2.gz OHYLTSYVBFUOGH-UHFFFAOYSA-N 0 1 397.229 3.174 10 0 GGAEMN Cc1cc2c[nH]nc2cc1NS(=O)(=O)c1cc2c(cc1Cl)OCCO2 ZINC000105388259 564965832 /nfs/dbraw/zinc/96/58/32/564965832.db2.gz SCDBUKBCAWVPKE-UHFFFAOYSA-N 0 1 379.825 3.097 10 0 GGAEMN O=C(NCc1cccs1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000105570037 564968594 /nfs/dbraw/zinc/96/85/94/564968594.db2.gz OBLAPQUEWCFXSM-UHFFFAOYSA-N 0 1 392.282 3.295 10 0 GGAEMN O=C(NCc1cccs1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000105570037 564968596 /nfs/dbraw/zinc/96/85/96/564968596.db2.gz OBLAPQUEWCFXSM-UHFFFAOYSA-N 0 1 392.282 3.295 10 0 GGAEMN C[C@H]1CCC[C@H]1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000105570346 564968779 /nfs/dbraw/zinc/96/87/79/564968779.db2.gz CCBQTNMTGVJDSB-GXFFZTMASA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@H]1CCC[C@H]1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000105570346 564968783 /nfs/dbraw/zinc/96/87/83/564968783.db2.gz CCBQTNMTGVJDSB-GXFFZTMASA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N1CCN2CCCC[C@@H]2C1 ZINC000152733689 564969390 /nfs/dbraw/zinc/96/93/90/564969390.db2.gz OOVCGKYWXVKFLX-DZGCQCFKSA-N 0 1 383.305 3.464 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N1CCN2CCCC[C@@H]2C1 ZINC000152733783 564969818 /nfs/dbraw/zinc/96/98/18/564969818.db2.gz OOVCGKYWXVKFLX-UKRRQHHQSA-N 0 1 383.305 3.464 10 0 GGAEMN CC[C@H](CO)N1CCN(C(=O)Nc2ccc(Br)cc2C(C)C)CC1 ZINC000152787529 564971586 /nfs/dbraw/zinc/97/15/86/564971586.db2.gz UQWUPYLCLOVMQF-OAHLLOKOSA-N 0 1 398.345 3.493 10 0 GGAEMN CC[C@@H]1CN([C@@H](C)C(=O)Nc2cccc(Cl)c2Cl)CCN1CCOC ZINC000106114834 564978294 /nfs/dbraw/zinc/97/82/94/564978294.db2.gz LCHOIPPPMNODNS-UONOGXRCSA-N 0 1 388.339 3.363 10 0 GGAEMN CC[C@H]1CN([C@@H](C)C(=O)Nc2cccc(Cl)c2Cl)CCN1CCOC ZINC000106114836 564978321 /nfs/dbraw/zinc/97/83/21/564978321.db2.gz LCHOIPPPMNODNS-KBPBESRZSA-N 0 1 388.339 3.363 10 0 GGAEMN CC[C@H]1CN([C@@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)CCN1CCOC ZINC000106114369 564978328 /nfs/dbraw/zinc/97/83/28/564978328.db2.gz MJEUEFFCBPTFQD-ZFWWWQNUSA-N 0 1 388.339 3.363 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2c(Cl)cccc2Cl)C[C@@H]1CC ZINC000106119132 564978561 /nfs/dbraw/zinc/97/85/61/564978561.db2.gz GUSBFKAYLFKABL-AWEZNQCLSA-N 0 1 388.339 3.365 10 0 GGAEMN Cc1nc(C)n(C[C@H]2CCCN(C[C@H](O)c3cccc(Br)c3)C2)n1 ZINC000106180504 564979329 /nfs/dbraw/zinc/97/93/29/564979329.db2.gz ZCXGIWFRXQVMFS-YJBOKZPZSA-N 0 1 393.329 3.103 10 0 GGAEMN C[C@H](CN1CCN(C)CC1)NC(=O)N[C@@H](C)c1c(Cl)ccc(F)c1Cl ZINC000106539697 564984502 /nfs/dbraw/zinc/98/45/02/564984502.db2.gz MVCQQFSOSLFRIY-NEPJUHHUSA-N 0 1 391.318 3.129 10 0 GGAEMN CCCCNC(=O)CCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000153242733 564989330 /nfs/dbraw/zinc/98/93/30/564989330.db2.gz QLIJOGQRNSGYBO-UHFFFAOYSA-N 0 1 386.367 3.460 10 0 GGAEMN COc1cc([C@H](C)NCCNS(=O)(=O)c2cccc(Cl)c2)ccc1F ZINC000153312590 564991246 /nfs/dbraw/zinc/99/12/46/564991246.db2.gz DUIRRYOICYSWSG-LBPRGKRZSA-N 0 1 386.876 3.117 10 0 GGAEMN CC[C@H]1CN(CCC(=O)Nc2ccc(Cl)cc2F)CCN1CC(F)F ZINC000153437851 564995312 /nfs/dbraw/zinc/99/53/12/564995312.db2.gz JRIHHCLRPPMFJU-ZDUSSCGKSA-N 0 1 377.838 3.469 10 0 GGAEMN Cc1cc(C(=O)Nc2ccc3[nH]nnc3c2)nn1-c1ccc(Br)cc1 ZINC000153524875 564999062 /nfs/dbraw/zinc/99/90/62/564999062.db2.gz WRAYYYHGDANVSW-UHFFFAOYSA-N 0 1 397.236 3.467 10 0 GGAEMN Cc1ccc(Br)c(C(=O)N2CCC(N3CCO[C@H](C)C3)CC2)c1 ZINC000153545892 564999848 /nfs/dbraw/zinc/99/98/48/564999848.db2.gz YQTPGDAQHKCELN-CQSZACIVSA-N 0 1 381.314 3.083 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2cc(Cl)cc(Br)c2)[nH]n1 ZINC000153564406 565000726 /nfs/dbraw/zinc/00/07/26/565000726.db2.gz ZOLIQDVVXNYJLK-UHFFFAOYSA-N 0 1 380.633 3.478 10 0 GGAEMN COc1cc(C(=O)NCC2([NH+]3CCSCC3)CCCC2)cc(Cl)c1[O-] ZINC000153575981 565001490 /nfs/dbraw/zinc/00/14/90/565001490.db2.gz DAAQHOBFQGOLII-UHFFFAOYSA-N 0 1 384.929 3.146 10 0 GGAEMN O=S(=O)(c1ccc(Br)s1)N1CCCC[C@H](N2CCCC2)C1 ZINC000107708515 565002664 /nfs/dbraw/zinc/00/26/64/565002664.db2.gz DSNRZCVJDSZLFV-LBPRGKRZSA-N 0 1 393.372 3.150 10 0 GGAEMN Brc1cc2c(c(CN3CCC(Cn4cccn4)CC3)c1)OCC2 ZINC000153874995 565014960 /nfs/dbraw/zinc/01/49/60/565014960.db2.gz KXROBZPORJCWLG-UHFFFAOYSA-N 0 1 376.298 3.493 10 0 GGAEMN COCCN1CCN(Cc2coc(-c3ccc(Br)cc3)n2)C[C@H]1C ZINC000108867422 565018248 /nfs/dbraw/zinc/01/82/48/565018248.db2.gz ACMWBFVHTKAVNV-CQSZACIVSA-N 0 1 394.313 3.257 10 0 GGAEMN Cc1cc(C(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c(C)cc1Br ZINC000153974019 565020074 /nfs/dbraw/zinc/02/00/74/565020074.db2.gz OWZUAYDAGXMIHX-HNNXBMFYSA-N 0 1 395.341 3.391 10 0 GGAEMN O=C(Nc1ccn(-c2ccncc2)n1)c1cc(Br)cc2[nH]cnc21 ZINC000503599075 565024173 /nfs/dbraw/zinc/02/41/73/565024173.db2.gz FGWQJTMMFVZHPK-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN O=C(Nc1ccn(-c2ccncc2)n1)c1cc(Br)cc2nc[nH]c21 ZINC000503599075 565024175 /nfs/dbraw/zinc/02/41/75/565024175.db2.gz FGWQJTMMFVZHPK-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN Cc1[nH+]ccn1C[C@H]1CCC[N@H+]1[C@@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000154575680 565045104 /nfs/dbraw/zinc/04/51/04/565045104.db2.gz PTTFGFTXXSWINK-SUMWQHHRSA-N 0 1 391.313 3.446 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Br)c(Cl)c2)CCN1C ZINC000154696702 565049853 /nfs/dbraw/zinc/04/98/53/565049853.db2.gz MUABOXVIZRWDLW-GHMZBOCLSA-N 0 1 395.750 3.206 10 0 GGAEMN Cc1cccc2nc(CNC(=O)COc3ccc(Br)cc3F)[nH]c21 ZINC000154965539 565058316 /nfs/dbraw/zinc/05/83/16/565058316.db2.gz DIHGLHXVGFKGHO-UHFFFAOYSA-N 0 1 392.228 3.468 10 0 GGAEMN COCC[N@H+]1CCC[C@@H]1CNC(=O)N(C)[C@H](C)c1ccccc1Br ZINC000111864423 565058355 /nfs/dbraw/zinc/05/83/55/565058355.db2.gz BUFLZNYUBBEWFA-HUUCEWRRSA-N 0 1 398.345 3.262 10 0 GGAEMN O=S(=O)(CCNC1(c2ccc(Cl)cc2)CCOCC1)c1ccccc1 ZINC000112347678 565062708 /nfs/dbraw/zinc/06/27/08/565062708.db2.gz SDHXFRXWTQSGSC-UHFFFAOYSA-N 0 1 379.909 3.409 10 0 GGAEMN O=C(C[C@H]1CSCCS1)N1CCC(c2ncc(C(F)(F)F)[nH]2)CC1 ZINC000155443979 565067792 /nfs/dbraw/zinc/06/77/92/565067792.db2.gz RTYHGBQPBTXMEP-NSHDSACASA-N 0 1 379.473 3.373 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1COc2ccccc21 ZINC000113165695 565068145 /nfs/dbraw/zinc/06/81/45/565068145.db2.gz CYPNQZZORUZZDQ-CQSZACIVSA-N 0 1 399.248 3.027 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1COc2ccccc21 ZINC000113165695 565068147 /nfs/dbraw/zinc/06/81/47/565068147.db2.gz CYPNQZZORUZZDQ-CQSZACIVSA-N 0 1 399.248 3.027 10 0 GGAEMN CCCOc1c(Br)cc(C(=O)N2[C@@H](C)CN(C)C[C@@H]2C)cc1OC ZINC000155772495 565071495 /nfs/dbraw/zinc/07/14/95/565071495.db2.gz QIFQVDLVRFTSIP-STQMWFEESA-N 0 1 399.329 3.411 10 0 GGAEMN CN(C)Cc1ccccc1CNC(=O)C(=O)c1ccc(Br)cc1 ZINC000114314739 565073701 /nfs/dbraw/zinc/07/37/01/565073701.db2.gz OJCCPOBHWSEOHK-UHFFFAOYSA-N 0 1 375.266 3.010 10 0 GGAEMN COc1cccc([C@@H](CNC(=O)Cc2ccc(Br)s2)N(C)C)c1 ZINC000114315170 565073737 /nfs/dbraw/zinc/07/37/37/565073737.db2.gz RVPVFLFSIVLSQL-OAHLLOKOSA-N 0 1 397.338 3.481 10 0 GGAEMN Cc1ccc(CN(CCN(C)C)C(=O)C(=O)c2ccc(Br)cc2)o1 ZINC000114321186 565073903 /nfs/dbraw/zinc/07/39/03/565073903.db2.gz WKQAYHTUYIASHR-UHFFFAOYSA-N 0 1 393.281 3.124 10 0 GGAEMN CC[C@H]1C[C@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCO1 ZINC000183597509 565081139 /nfs/dbraw/zinc/08/11/39/565081139.db2.gz JZOMQWWDBSHHSR-OCCSQVGLSA-N 0 1 393.285 3.056 10 0 GGAEMN CC[C@H]1C[C@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCO1 ZINC000183597509 565081144 /nfs/dbraw/zinc/08/11/44/565081144.db2.gz JZOMQWWDBSHHSR-OCCSQVGLSA-N 0 1 393.285 3.056 10 0 GGAEMN Cc1cc(NC(=O)[C@H](C)N[C@H](CO)c2ccccc2)ccc1Br ZINC000183626288 565083428 /nfs/dbraw/zinc/08/34/28/565083428.db2.gz MKCQHRXJHUEUNF-SUMWQHHRSA-N 0 1 377.282 3.408 10 0 GGAEMN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2c(C)nn(C)c2Cl)C1 ZINC000266583565 565085124 /nfs/dbraw/zinc/08/51/24/565085124.db2.gz IRXGSJJANWZMAN-LBPRGKRZSA-N 0 1 380.842 3.005 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3c(Br)ccc(F)c3C2)n[nH]1 ZINC000183767685 565093713 /nfs/dbraw/zinc/09/37/13/565093713.db2.gz FTZQTESKZUOPIJ-JTQLQIEISA-N 0 1 395.276 3.319 10 0 GGAEMN Cc1cc(NC(=O)[C@@H](C)N2CCC(n3cncn3)CC2)ccc1Br ZINC000156584979 565096540 /nfs/dbraw/zinc/09/65/40/565096540.db2.gz TVIGLCRJZZNKLP-CYBMUJFWSA-N 0 1 392.301 3.013 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000292129489 565099626 /nfs/dbraw/zinc/09/96/26/565099626.db2.gz XQYMGNYAMSAWPH-MRVPVSSYSA-N 0 1 392.911 3.001 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2ccc(F)cc2)[C@@H]1c1cccs1 ZINC000369674716 565104845 /nfs/dbraw/zinc/10/48/45/565104845.db2.gz YMFMQBOEEJENJA-CRAIPNDOSA-N 0 1 382.526 3.390 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2ccc(F)cc2)[C@H]1c1cccs1 ZINC000369674718 565104869 /nfs/dbraw/zinc/10/48/69/565104869.db2.gz YMFMQBOEEJENJA-QAPCUYQASA-N 0 1 382.526 3.390 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2ccc(F)cc2)[C@H]1c1cccs1 ZINC000369674719 565105012 /nfs/dbraw/zinc/10/50/12/565105012.db2.gz YMFMQBOEEJENJA-YJBOKZPZSA-N 0 1 382.526 3.390 10 0 GGAEMN CC(C)(C)c1nc(CS(=O)(=O)Cc2ccc(Br)s2)n[nH]1 ZINC000292370104 565112560 /nfs/dbraw/zinc/11/25/60/565112560.db2.gz GKRMWJMWBHWCFX-UHFFFAOYSA-N 0 1 378.317 3.041 10 0 GGAEMN Cn1cnc(-c2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc2)n1 ZINC000370071990 565126923 /nfs/dbraw/zinc/12/69/23/565126923.db2.gz KAKOKERGYAJCNB-UHFFFAOYSA-N 0 1 397.236 3.373 10 0 GGAEMN CO[C@@H](C)c1nc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cs1 ZINC000267725875 565128744 /nfs/dbraw/zinc/12/87/44/565128744.db2.gz LTJCANQLJBLNDI-QMMMGPOBSA-N 0 1 395.282 3.419 10 0 GGAEMN O=C(NCc1cc(F)cc(Br)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000370226509 565134425 /nfs/dbraw/zinc/13/44/25/565134425.db2.gz HEOFFCMNLOLYKZ-UHFFFAOYSA-N 0 1 381.249 3.401 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000268153658 565142037 /nfs/dbraw/zinc/14/20/37/565142037.db2.gz NAICFXHKCXLLRU-NSHDSACASA-N 0 1 381.217 3.381 10 0 GGAEMN Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000370415132 565142080 /nfs/dbraw/zinc/14/20/80/565142080.db2.gz MFLPPEUCLSHUTC-HNNXBMFYSA-N 0 1 388.269 3.345 10 0 GGAEMN O=C(N[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CCCc2[nH]ncc21 ZINC000268191642 565143463 /nfs/dbraw/zinc/14/34/63/565143463.db2.gz ZWDLOXNATRFHAP-BXUZGUMPSA-N 0 1 376.254 3.232 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1ccc(I)c(F)c1 ZINC000184551863 565144104 /nfs/dbraw/zinc/14/41/04/565144104.db2.gz FGWPMSNSSFDEOF-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1ccc(I)c(F)c1 ZINC000184551863 565144108 /nfs/dbraw/zinc/14/41/08/565144108.db2.gz FGWPMSNSSFDEOF-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN COc1cc(C)c(Br)cc1NC(=O)N1CCN2CCCC[C@H]2C1 ZINC000184549578 565144166 /nfs/dbraw/zinc/14/41/66/565144166.db2.gz MVJRHXSJEOEPCA-ZDUSSCGKSA-N 0 1 382.302 3.468 10 0 GGAEMN COc1ccc(CCC(=O)Nc2nc(C3CCC3)n[nH]2)cc1Br ZINC000184556101 565144332 /nfs/dbraw/zinc/14/43/32/565144332.db2.gz BPMYJSROIOKAMG-UHFFFAOYSA-N 0 1 379.258 3.415 10 0 GGAEMN COc1ccc(CCC(=O)Nc2n[nH]c(C3CCC3)n2)cc1Br ZINC000184556101 565144336 /nfs/dbraw/zinc/14/43/36/565144336.db2.gz BPMYJSROIOKAMG-UHFFFAOYSA-N 0 1 379.258 3.415 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1cnn(-c2cccc(Br)c2)c1 ZINC000184560663 565144415 /nfs/dbraw/zinc/14/44/15/565144415.db2.gz ILAIZZVDJZDMTO-UHFFFAOYSA-N 0 1 387.241 3.273 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1cnn(-c2cccc(Br)c2)c1 ZINC000184560663 565144418 /nfs/dbraw/zinc/14/44/18/565144418.db2.gz ILAIZZVDJZDMTO-UHFFFAOYSA-N 0 1 387.241 3.273 10 0 GGAEMN Cc1cccc(C(=O)Nc2nc(C3CCC3)n[nH]2)c1I ZINC000184554994 565144471 /nfs/dbraw/zinc/14/44/71/565144471.db2.gz DZMLQEQFJBSRJT-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN Cc1cccc(C(=O)Nc2n[nH]c(C3CCC3)n2)c1I ZINC000184554994 565144474 /nfs/dbraw/zinc/14/44/74/565144474.db2.gz DZMLQEQFJBSRJT-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1ccc(F)c(I)c1 ZINC000184634665 565148866 /nfs/dbraw/zinc/14/88/66/565148866.db2.gz MBYMOFBUZPGALZ-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1ccc(F)c(I)c1 ZINC000184634665 565148872 /nfs/dbraw/zinc/14/88/72/565148872.db2.gz MBYMOFBUZPGALZ-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)N[C@H]2CCc3nc[nH]c3C2)cc1Br ZINC000370672130 565155548 /nfs/dbraw/zinc/15/55/48/565155548.db2.gz BOAHKJFUOOTNBT-JQWIXIFHSA-N 0 1 393.285 3.099 10 0 GGAEMN O=C(Nc1ccccc1Br)C1CCN(C[C@@H](O)C(F)(F)F)CC1 ZINC000158207871 565161293 /nfs/dbraw/zinc/16/12/93/565161293.db2.gz KBICIBRYVQNNTQ-CYBMUJFWSA-N 0 1 395.219 3.023 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Nc2ccc(I)cc2)n[nH]1 ZINC000158260705 565162392 /nfs/dbraw/zinc/16/23/92/565162392.db2.gz LDGKNAJHZARCEQ-SECBINFHSA-N 0 1 384.221 3.075 10 0 GGAEMN Oc1ccc(N2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)cc1 ZINC000184933349 565166427 /nfs/dbraw/zinc/16/64/27/565166427.db2.gz QMEIFJTWWZPVJO-UHFFFAOYSA-N 0 1 387.281 3.353 10 0 GGAEMN O=C1C[C@@H](c2ccccc2)N(Cc2nc3ccc(Br)cc3[nH]2)CCN1 ZINC000184961339 565167448 /nfs/dbraw/zinc/16/74/48/565167448.db2.gz PFUJTZZMAXNGCW-KRWDZBQOSA-N 0 1 399.292 3.389 10 0 GGAEMN COc1ccc([C@@H](CO)N(C)Cc2nc3ccc(Br)cc3[nH]2)cc1 ZINC000184970835 565168604 /nfs/dbraw/zinc/16/86/04/565168604.db2.gz IRMBWXORRNCHCB-QGZVFWFLSA-N 0 1 390.281 3.499 10 0 GGAEMN Brc1ccc2nc(CN3CCC(OC[C@H]4CCCO4)CC3)[nH]c2c1 ZINC000184980077 565168934 /nfs/dbraw/zinc/16/89/34/565168934.db2.gz CMKDKNHUQQPCIF-OAHLLOKOSA-N 0 1 394.313 3.485 10 0 GGAEMN O=S(=O)(C=Cc1ccc(Br)cc1)N[C@H]1CCCc2cn[nH]c21 ZINC000268816085 565169090 /nfs/dbraw/zinc/16/90/90/565169090.db2.gz VTTBQYLREXDZFG-VFNNOXKTSA-N 0 1 382.283 3.140 10 0 GGAEMN CCCNC(=O)C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000184969641 565169274 /nfs/dbraw/zinc/16/92/74/565169274.db2.gz XODYDPORARTXGX-UHFFFAOYSA-N 0 1 379.302 3.064 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Nc2cccc(I)c2)n[nH]1 ZINC000158425176 565170005 /nfs/dbraw/zinc/17/00/05/565170005.db2.gz SRGAFOHLHKLRON-VIFPVBQESA-N 0 1 384.221 3.075 10 0 GGAEMN O[C@H](CN1CCC(Cn2cccn2)CC1)c1ccc(F)c(Br)c1 ZINC000185004345 565170554 /nfs/dbraw/zinc/17/05/54/565170554.db2.gz YKAMUIACZSKWRZ-QGZVFWFLSA-N 0 1 382.277 3.230 10 0 GGAEMN Cc1cc2cc(S(=O)(=O)N(C)[C@@H]3CCN(C)[C@H](C)C3)ccc2nc1Cl ZINC000293527418 565173555 /nfs/dbraw/zinc/17/35/55/565173555.db2.gz PCVRPMCWWGGCGS-UKRRQHHQSA-N 0 1 381.929 3.300 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOC[C@@H]1c1ccco1 ZINC000371035986 565173684 /nfs/dbraw/zinc/17/36/84/565173684.db2.gz JJZKYNFEIGJWPV-CYBMUJFWSA-N 0 1 376.210 3.132 10 0 GGAEMN Cc1cc(Br)ccc1CNCc1cnc(N2CCOCC2)c(F)c1 ZINC000185075321 565176147 /nfs/dbraw/zinc/17/61/47/565176147.db2.gz SUDXVUUUFMJDOW-UHFFFAOYSA-N 0 1 394.288 3.418 10 0 GGAEMN Cc1c(Br)scc1C(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000185093983 565177332 /nfs/dbraw/zinc/17/73/32/565177332.db2.gz NUSZYBLMRYFBLL-LLVKDONJSA-N 0 1 387.343 3.144 10 0 GGAEMN C[C@](O)(CN1CCCN(CC(F)F)CC1)c1ccc(Br)cc1F ZINC000293778023 565183800 /nfs/dbraw/zinc/18/38/00/565183800.db2.gz LNNIIAVLXQYZLS-INIZCTEOSA-N 0 1 395.263 3.069 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NCC(=O)Nc1ccc(Br)cc1C ZINC000158873235 565186004 /nfs/dbraw/zinc/18/60/04/565186004.db2.gz BPIUHQMGJVOJAD-UHFFFAOYSA-N 0 1 393.285 3.281 10 0 GGAEMN CCN(CC)C(=O)[C@H]1CCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000158931926 565186826 /nfs/dbraw/zinc/18/68/26/565186826.db2.gz DQZIYRPKKLRJAI-OAHLLOKOSA-N 0 1 379.302 3.158 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000158931800 565187517 /nfs/dbraw/zinc/18/75/17/565187517.db2.gz DQZIYRPKKLRJAI-HNNXBMFYSA-N 0 1 379.302 3.158 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc(Br)cc(C(F)(F)F)c1 ZINC000371358785 565188440 /nfs/dbraw/zinc/18/84/40/565188440.db2.gz DGUHOLJGNROPDX-NSHDSACASA-N 0 1 388.187 3.478 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1cccs1 ZINC000269381880 565188784 /nfs/dbraw/zinc/18/87/84/565188784.db2.gz VKTJHIZILWPVOE-CABCVRRESA-N 0 1 383.583 3.095 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1ccn(-c2ccc(Cl)cc2Cl)n1 ZINC000371454327 565193793 /nfs/dbraw/zinc/19/37/93/565193793.db2.gz GOGRQJJSEQBEGW-LLVKDONJSA-N 0 1 376.247 3.190 10 0 GGAEMN CC(C)C[C@H](CO)N(C)CC(=O)Nc1ccc(Br)cc1Cl ZINC000185335207 565196019 /nfs/dbraw/zinc/19/60/19/565196019.db2.gz QDDHYBDRRIWQNA-GFCCVEGCSA-N 0 1 377.710 3.380 10 0 GGAEMN O[C@@H](COC1CCOCC1)CN1CCC[C@H]1c1ccc(Br)s1 ZINC000371715969 565207225 /nfs/dbraw/zinc/20/72/25/565207225.db2.gz MFJZYUHRZNVZDZ-OCCSQVGLSA-N 0 1 390.343 3.204 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC2(CCOCC2)[C@H]1C1CC1 ZINC000294398643 565210565 /nfs/dbraw/zinc/21/05/65/565210565.db2.gz XIXPUOZIKQWGBN-MRXNPFEDSA-N 0 1 390.281 3.357 10 0 GGAEMN O=C(Cc1ccc(Br)c(F)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000371840828 565211480 /nfs/dbraw/zinc/21/14/80/565211480.db2.gz MDDPBPXXJBJKKP-INIZCTEOSA-N 0 1 389.228 3.155 10 0 GGAEMN O=C(Cc1sccc1Br)NC1CCN(Cc2ccncc2)CC1 ZINC000294469097 565214755 /nfs/dbraw/zinc/21/47/55/565214755.db2.gz NFRYHVWFQYBYNB-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCc2ccccc2[C@@H]1CO ZINC000185686388 565216097 /nfs/dbraw/zinc/21/60/97/565216097.db2.gz VEJJZQKVCHNPMW-INIZCTEOSA-N 0 1 386.249 3.057 10 0 GGAEMN CN1CC[C@H](NC(=O)c2[nH]nc(C3CC3)c2Br)[C@@H]1c1ccccc1 ZINC000270638792 565224867 /nfs/dbraw/zinc/22/48/67/565224867.db2.gz KLUBREIDXBBACM-GUYCJALGSA-N 0 1 389.297 3.225 10 0 GGAEMN CN1CC[C@@H](NC(=O)c2[nH]nc(C3CC3)c2Br)[C@@H]1c1ccccc1 ZINC000270638789 565225264 /nfs/dbraw/zinc/22/52/64/565225264.db2.gz KLUBREIDXBBACM-DYVFJYSZSA-N 0 1 389.297 3.225 10 0 GGAEMN Cc1c(Br)scc1C(=O)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000372236353 565226775 /nfs/dbraw/zinc/22/67/75/565226775.db2.gz MXDWMVWRQUKZIL-LBPRGKRZSA-N 0 1 377.267 3.457 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000270769924 565229067 /nfs/dbraw/zinc/22/90/67/565229067.db2.gz RQCASKXMFJZKIT-CABZTGNLSA-N 0 1 394.273 3.014 10 0 GGAEMN O[C@@H](CN1CCC(c2nnc3n2CCC3)CC1)c1ccc(Cl)cc1Cl ZINC000372288543 565230005 /nfs/dbraw/zinc/23/00/05/565230005.db2.gz SASSPUBDMVJKPW-INIZCTEOSA-N 0 1 381.307 3.444 10 0 GGAEMN CSc1ccc(S(=O)(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)cc1Cl ZINC000372461124 565240749 /nfs/dbraw/zinc/24/07/49/565240749.db2.gz ZEBSAYFXVUMGQS-OAHLLOKOSA-N 0 1 394.909 3.248 10 0 GGAEMN C[C@@H](CO)[C@H](C)NCc1coc(-c2ccc(I)cc2)n1 ZINC000295071403 565243397 /nfs/dbraw/zinc/24/33/97/565243397.db2.gz AHXXSEGIKLTKSS-QWRGUYRKSA-N 0 1 386.233 3.053 10 0 GGAEMN Cn1nc(CCNC(=O)c2n[nH]c3ccc(Br)cc32)c2ccccc21 ZINC000186201787 565246127 /nfs/dbraw/zinc/24/61/27/565246127.db2.gz CTENHFXBOGDRQK-UHFFFAOYSA-N 0 1 398.264 3.185 10 0 GGAEMN CSC[C@@H](CCO)N[C@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186210014 565247503 /nfs/dbraw/zinc/24/75/03/565247503.db2.gz XJYSDIWRUXZNLW-HZPDHXFCSA-N 0 1 382.327 3.032 10 0 GGAEMN O=C(NCc1sccc1Br)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000372613171 565247835 /nfs/dbraw/zinc/24/78/35/565247835.db2.gz XQTUSSJHFGUKCJ-ZDUSSCGKSA-N 0 1 392.282 3.218 10 0 GGAEMN O=S1(=O)CC[C@H](N[C@H]2CCN(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000186238827 565248533 /nfs/dbraw/zinc/24/85/33/565248533.db2.gz DXLRKXUQPNDMSO-YJBOKZPZSA-N 0 1 376.909 3.427 10 0 GGAEMN O=C1[C@@H](N[C@@H]2CCOc3c(Br)cccc32)CCN1CC(F)(F)F ZINC000271435757 565253352 /nfs/dbraw/zinc/25/33/52/565253352.db2.gz FLBYEMYEECYRJR-NEPJUHHUSA-N 0 1 393.203 3.026 10 0 GGAEMN CC(C)C(=O)NCCCN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186301224 565253549 /nfs/dbraw/zinc/25/35/49/565253549.db2.gz ZUFBHGXPJVHLNT-KRWDZBQOSA-N 0 1 391.313 3.080 10 0 GGAEMN O=S1(=O)CC[C@H](N[C@H]2CCN(c3ccc(Cl)cc3)C2)c2ccccc21 ZINC000186310071 565254272 /nfs/dbraw/zinc/25/42/72/565254272.db2.gz NPCVLKSQUQFYMP-YJBOKZPZSA-N 0 1 376.909 3.427 10 0 GGAEMN O=S1(=O)CC[C@H](N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c2ccccc21 ZINC000186310028 565254850 /nfs/dbraw/zinc/25/48/50/565254850.db2.gz NPCVLKSQUQFYMP-QAPCUYQASA-N 0 1 376.909 3.427 10 0 GGAEMN Brc1ccccc1OCCN1CCC(c2nnc3n2CCC3)CC1 ZINC000372836443 565256519 /nfs/dbraw/zinc/25/65/19/565256519.db2.gz JXYKMGRUBXBXMQ-UHFFFAOYSA-N 0 1 391.313 3.245 10 0 GGAEMN O=S(=O)(Cc1c(Cl)cccc1Cl)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000372878658 565259076 /nfs/dbraw/zinc/25/90/76/565259076.db2.gz PBLWRSXUAVPHSB-OAHLLOKOSA-N 0 1 397.287 3.321 10 0 GGAEMN OCC1(CN[C@H](c2ccc(Br)cc2)c2cncnc2)CCCC1 ZINC000186426105 565260407 /nfs/dbraw/zinc/26/04/07/565260407.db2.gz QZHQZOPJEOVOPZ-QGZVFWFLSA-N 0 1 376.298 3.471 10 0 GGAEMN COC(=O)c1cc(NC(=O)N[C@H]2CCCc3cn[nH]c32)ccc1Br ZINC000271755673 565267326 /nfs/dbraw/zinc/26/73/26/565267326.db2.gz YOSUTCLNQULQJJ-ZDUSSCGKSA-N 0 1 393.241 3.158 10 0 GGAEMN CO[C@@H]1COCC[C@@H]1CC(=O)Nc1cc(Br)cc(Cl)c1O ZINC000295477193 565268526 /nfs/dbraw/zinc/26/85/26/565268526.db2.gz JANOVLVPTKMSJC-PRHODGIISA-N 0 1 378.650 3.188 10 0 GGAEMN CSc1cc(C(=O)N2CCC([N@@H+](C)CC(=O)[O-])CC2)c(Cl)cc1Cl ZINC000186620733 565272418 /nfs/dbraw/zinc/27/24/18/565272418.db2.gz FRIMGNXXAWUOAF-UHFFFAOYSA-N 0 1 391.320 3.336 10 0 GGAEMN COC[C@H](C)OC[C@@H](O)CN1CCC[C@H]1c1ccc(Br)s1 ZINC000373181502 565274244 /nfs/dbraw/zinc/27/42/44/565274244.db2.gz UFXLQBXWZNRRBD-AVGNSLFASA-N 0 1 378.332 3.060 10 0 GGAEMN COc1nccnc1CNC1CCN(Cc2ccc(Br)cc2)CC1 ZINC000295604173 565275976 /nfs/dbraw/zinc/27/59/76/565275976.db2.gz FVZPUZDGVPINOQ-UHFFFAOYSA-N 0 1 391.313 3.002 10 0 GGAEMN COc1cc(C(=O)N[C@H](c2nnc[nH]2)c2ccccc2)sc1Br ZINC000373267531 565276633 /nfs/dbraw/zinc/27/66/33/565276633.db2.gz SGPRJZDRNRDOFP-LBPRGKRZSA-N 0 1 393.266 3.157 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000186673582 565277577 /nfs/dbraw/zinc/27/75/77/565277577.db2.gz BDHMYTKQOMNQGR-UHFFFAOYSA-N 0 1 379.913 3.444 10 0 GGAEMN C[C@@H](c1ccc(CN2CCC(N(C)S(C)(=O)=O)CC2)cc1)C(F)(F)F ZINC000295685751 565281826 /nfs/dbraw/zinc/28/18/26/565281826.db2.gz NAOICPOSXNPELB-ZDUSSCGKSA-N 0 1 378.460 3.208 10 0 GGAEMN Brc1ccc2nc(CN3CCCN(c4nccs4)CC3)[nH]c2c1 ZINC000186757592 565283804 /nfs/dbraw/zinc/28/38/04/565283804.db2.gz CEWHMBZAHFVEEH-UHFFFAOYSA-N 0 1 392.326 3.494 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2ccn(-c3cccc(Br)c3)n2)n[nH]1 ZINC000161676739 565290597 /nfs/dbraw/zinc/29/05/97/565290597.db2.gz HIAXVSGNVGIMDH-LLVKDONJSA-N 0 1 388.269 3.027 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)c2cnn(-c3ccc(Br)cc3)c2)n[nH]1 ZINC000161778541 565292362 /nfs/dbraw/zinc/29/23/62/565292362.db2.gz VHJRQWAQCRJWEL-NSHDSACASA-N 0 1 388.269 3.027 10 0 GGAEMN Cc1nccc(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)n1 ZINC000373605853 565294075 /nfs/dbraw/zinc/29/40/75/565294075.db2.gz ATBGDWNLCZVVHI-UHFFFAOYSA-N 0 1 389.297 3.398 10 0 GGAEMN CCOc1c(Br)cc(C(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1OC ZINC000162009960 565301118 /nfs/dbraw/zinc/30/11/18/565301118.db2.gz UCKZIDQOFYYYQR-SNVBAGLBSA-N 0 1 396.285 3.249 10 0 GGAEMN C[C@@H](N[C@H]1CCCN(c2ncccn2)C1)c1ncc(Br)cc1F ZINC000187023976 565302670 /nfs/dbraw/zinc/30/26/70/565302670.db2.gz RGTXICGEHJZEEJ-YPMHNXCESA-N 0 1 380.265 3.093 10 0 GGAEMN Cc1nnc(SCCC(=O)N2C[C@@H](c3cccc(Cl)c3)OC[C@@H]2C)[nH]1 ZINC000187049377 565304712 /nfs/dbraw/zinc/30/47/12/565304712.db2.gz FMYWRPAAYKREOG-NHYWBVRUSA-N 0 1 380.901 3.237 10 0 GGAEMN Cn1cc(NS(=O)(=O)Cc2cc(Cl)ccc2F)c(-c2ccccn2)n1 ZINC000373908716 565310293 /nfs/dbraw/zinc/31/02/93/565310293.db2.gz JEACAUVDXJQWEZ-UHFFFAOYSA-N 0 1 380.832 3.217 10 0 GGAEMN OC[C@]1(NCc2nc3ccc(Br)cc3[nH]2)CCOc2ccccc21 ZINC000374134247 565322006 /nfs/dbraw/zinc/32/20/06/565322006.db2.gz AHOOPKSBKGMSAR-GOSISDBHSA-N 0 1 388.265 3.085 10 0 GGAEMN CN(CC1CCOCC1)C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000162629916 565323206 /nfs/dbraw/zinc/32/32/06/565323206.db2.gz ABJNUDUATXJYFI-UHFFFAOYSA-N 0 1 378.270 3.338 10 0 GGAEMN CC(C)c1nc2n(n1)C[C@@H](N[C@@H](C)c1ncc(Br)cc1F)CC2 ZINC000187328982 565323893 /nfs/dbraw/zinc/32/38/93/565323893.db2.gz DDTYCTJBYZDUAQ-JQWIXIFHSA-N 0 1 382.281 3.364 10 0 GGAEMN Cc1c(Cl)cc(NC(=O)C(=O)N2CCC(c3cnc[nH]3)CC2)cc1Cl ZINC000374212575 565325807 /nfs/dbraw/zinc/32/58/07/565325807.db2.gz QRQPJTICIAOUII-UHFFFAOYSA-N 0 1 381.263 3.370 10 0 GGAEMN O=C(Cc1sccc1Br)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000296710052 565330857 /nfs/dbraw/zinc/33/08/57/565330857.db2.gz GHWJUOBMMFGXEU-NSHDSACASA-N 0 1 395.326 3.455 10 0 GGAEMN O=C(Cc1sccc1Br)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000296710049 565331192 /nfs/dbraw/zinc/33/11/92/565331192.db2.gz GHWJUOBMMFGXEU-LLVKDONJSA-N 0 1 395.326 3.455 10 0 GGAEMN Cc1cc(F)ccc1CS(=O)(=O)c1nc2cc(Br)c(C)[nH]c-2n1 ZINC000187438165 565331922 /nfs/dbraw/zinc/33/19/22/565331922.db2.gz HNCVCFUJIMBFRQ-UHFFFAOYSA-N 0 1 398.257 3.450 10 0 GGAEMN COc1cc(Br)ccc1CN[C@@H](Cc1ccc(Cl)cc1)C(N)=O ZINC000187438789 565332111 /nfs/dbraw/zinc/33/21/11/565332111.db2.gz CMLGOJTWGPKMMV-HNNXBMFYSA-N 0 1 397.700 3.297 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cc(F)cc(Br)c1 ZINC000162933754 565332418 /nfs/dbraw/zinc/33/24/18/565332418.db2.gz NUGHIHWLWHVYKC-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN C[C@H]1CN(C(=O)NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)CCS1 ZINC000187456586 565333706 /nfs/dbraw/zinc/33/37/06/565333706.db2.gz DBVKFYDFYCQBRS-SWLSCSKDSA-N 0 1 375.460 3.455 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N1CCc2c(Cl)cc(Cl)cc2C1 ZINC000163008792 565334241 /nfs/dbraw/zinc/33/42/41/565334241.db2.gz APJJQKMXVDTBJD-UHFFFAOYSA-N 0 1 386.323 3.174 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)Nc3cc(Br)c(C)cc3C)CCO2)n[nH]1 ZINC000187538825 565339715 /nfs/dbraw/zinc/33/97/15/565339715.db2.gz PPKDOLYIMKPUNM-CQSZACIVSA-N 0 1 394.273 3.098 10 0 GGAEMN CC(C)n1cc(Br)cc1-c1nc([C@@H]2CN3CCC[C@H]3CO2)no1 ZINC000273853024 565340261 /nfs/dbraw/zinc/34/02/61/565340261.db2.gz CISFHVHUJOHYJF-JSGCOSHPSA-N 0 1 381.274 3.417 10 0 GGAEMN C[C@H](N[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccc(Cl)cc1 ZINC000163248500 565340911 /nfs/dbraw/zinc/34/09/11/565340911.db2.gz FIFCUKVJNKGVOS-STQMWFEESA-N 0 1 380.897 3.421 10 0 GGAEMN CN(C)c1ncc(NS(=O)(=O)c2cc(Cl)cc(C(F)(F)F)c2)cn1 ZINC000187585550 565343256 /nfs/dbraw/zinc/34/32/56/565343256.db2.gz XYISFAHAOBWWPT-UHFFFAOYSA-N 0 1 380.779 3.016 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCC[C@H]1COc1ccc(F)cc1 ZINC000374562890 565345801 /nfs/dbraw/zinc/34/58/01/565345801.db2.gz RDUJDXRRUNRHGT-NSHDSACASA-N 0 1 385.511 3.128 10 0 GGAEMN C[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1ccccc1Cl ZINC000163470843 565346620 /nfs/dbraw/zinc/34/66/20/565346620.db2.gz DWVGHZGCYILNNE-CHWSQXEVSA-N 0 1 380.897 3.421 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccc(F)cc1Cl)c1ccc(S(C)(=O)=O)cc1 ZINC000163536141 565347939 /nfs/dbraw/zinc/34/79/39/565347939.db2.gz TXBFNWAMJSUXPO-LLVKDONJSA-N 0 1 384.860 3.172 10 0 GGAEMN COC(=O)c1cc(NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)ccc1Br ZINC000187711281 565349657 /nfs/dbraw/zinc/34/96/57/565349657.db2.gz IEPJMIUZAOZPJA-SECBINFHSA-N 0 1 395.257 3.020 10 0 GGAEMN O=C(COc1cc(Cl)cc(Cl)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000374843039 565356470 /nfs/dbraw/zinc/35/64/70/565356470.db2.gz UPEJTGVATQLCOW-INIZCTEOSA-N 0 1 377.231 3.396 10 0 GGAEMN O=C(Cc1ccc(F)c(Br)c1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000374837014 565356859 /nfs/dbraw/zinc/35/68/59/565356859.db2.gz HSEOFANHBDGZIK-MRXNPFEDSA-N 0 1 389.228 3.155 10 0 GGAEMN O=C(Cc1ccc(F)c(Br)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000374837013 565356974 /nfs/dbraw/zinc/35/69/74/565356974.db2.gz HSEOFANHBDGZIK-INIZCTEOSA-N 0 1 389.228 3.155 10 0 GGAEMN C[C@@H]1N(C(=O)c2[nH]nc3ccc(Br)cc32)CCC12CCOCC2 ZINC000374973017 565363130 /nfs/dbraw/zinc/36/31/30/565363130.db2.gz OBTGVWVFVPDDFO-NSHDSACASA-N 0 1 378.270 3.357 10 0 GGAEMN CCOc1cc(CN2CCC[C@@H](Cn3ccnn3)C2)cc(Br)c1O ZINC000297309841 565367727 /nfs/dbraw/zinc/36/77/27/565367727.db2.gz BQIKTHBGBIANDE-CYBMUJFWSA-N 0 1 395.301 3.057 10 0 GGAEMN C[C@@H]1CC[C@@](CO)(N(C)Cc2nc(-c3cccc(Br)c3)no2)C1 ZINC000187973135 565367911 /nfs/dbraw/zinc/36/79/11/565367911.db2.gz BWPWPDXACBTXAE-SJKOYZFVSA-N 0 1 380.286 3.482 10 0 GGAEMN O=C(COc1ccccc1-c1nnc[nH]1)Nc1ccc(Br)cc1F ZINC000165366198 565369218 /nfs/dbraw/zinc/36/92/18/565369218.db2.gz CADSSLKTMDZJOR-UHFFFAOYSA-N 0 1 391.200 3.391 10 0 GGAEMN Brc1ccc(-c2nnc(COc3ccccc3-c3nnc[nH]3)o2)o1 ZINC000165397845 565369799 /nfs/dbraw/zinc/36/97/99/565369799.db2.gz FKZCQOHTQPUOEN-UHFFFAOYSA-N 0 1 388.181 3.456 10 0 GGAEMN C[C@@H]1CC[C@@](CO)(N(C)CC(=O)Nc2c(F)cc(F)cc2Br)C1 ZINC000187994822 565370113 /nfs/dbraw/zinc/37/01/13/565370113.db2.gz VYYCGUWSZPKZPU-QLJPJBMISA-N 0 1 391.256 3.149 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Nc2ccc(Br)nc2)c2ccccc2)n[nH]1 ZINC000166388932 565375050 /nfs/dbraw/zinc/37/50/50/565375050.db2.gz KWKXWUNLXPUKMF-AWEZNQCLSA-N 0 1 387.241 3.182 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc(F)cc2CSC)c1 ZINC000167120585 565377308 /nfs/dbraw/zinc/37/73/08/565377308.db2.gz OJTGQHVYURFRCL-CYBMUJFWSA-N 0 1 382.526 3.448 10 0 GGAEMN CO[C@@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)CC[C@H]1C ZINC000188106413 565378914 /nfs/dbraw/zinc/37/89/14/565378914.db2.gz JBLKAOYAODNRPK-DGCLKSJQSA-N 0 1 378.270 3.336 10 0 GGAEMN Clc1ccc2c(c1)nccc2SCCN1CCOC[C@H]1c1nnc[nH]1 ZINC000375284961 565379189 /nfs/dbraw/zinc/37/91/89/565379189.db2.gz XHBZQJKUQPDALU-HNNXBMFYSA-N 0 1 375.885 3.172 10 0 GGAEMN Brc1cccc2c1CC[C@@H]2NCc1cccc(N2CCOCC2)n1 ZINC000274756163 565379794 /nfs/dbraw/zinc/37/97/94/565379794.db2.gz HMIUQFRIYJDTNY-SFHVURJKSA-N 0 1 388.309 3.458 10 0 GGAEMN O=S(=O)(Nc1ncccc1F)c1cc(Cl)ccc1OC[C@H]1CCOC1 ZINC000188153627 565383617 /nfs/dbraw/zinc/38/36/17/565383617.db2.gz BCFWNBIIDDNZPC-NSHDSACASA-N 0 1 386.832 3.090 10 0 GGAEMN O=C([C@@H]1CCc2[nH]nnc2C1)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000375489330 565392578 /nfs/dbraw/zinc/39/25/78/565392578.db2.gz YDTVTLOALYSEKG-HWPZZCPQSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@@H]1CCc2nn[nH]c2C1)N1CCC[C@H]1c1cc(F)cc(Br)c1 ZINC000375489330 565392582 /nfs/dbraw/zinc/39/25/82/565392582.db2.gz YDTVTLOALYSEKG-HWPZZCPQSA-N 0 1 393.260 3.175 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)c1cccc(-c2nnc[nH]2)c1 ZINC000188441346 565401281 /nfs/dbraw/zinc/40/12/81/565401281.db2.gz AUFSTBOGAQQYDU-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1cn2ccc(Br)cc2n1 ZINC000375759644 565405311 /nfs/dbraw/zinc/40/53/11/565405311.db2.gz RIAVIPWXRUFXAQ-UHFFFAOYSA-N 0 1 383.209 3.134 10 0 GGAEMN Cc1nc([C@H](NC(=O)Nc2cccc(Br)n2)c2ccccc2)n[nH]1 ZINC000188505620 565405256 /nfs/dbraw/zinc/40/52/56/565405256.db2.gz HYJWHPFIRPFPNR-CQSZACIVSA-N 0 1 387.241 3.182 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ncc(Br)s2)CC1 ZINC000188521973 565406971 /nfs/dbraw/zinc/40/69/71/565406971.db2.gz ZENFLNIBGAXFSC-UHFFFAOYSA-N 0 1 395.326 3.300 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)NCCCc1cn[nH]c1C ZINC000188563413 565408792 /nfs/dbraw/zinc/40/87/92/565408792.db2.gz OATBMUZNGRUMBV-LBPRGKRZSA-N 0 1 395.301 3.482 10 0 GGAEMN CN(Cc1cc(-c2cnn(C)c2)no1)C[C@H](O)c1cccc(Br)c1 ZINC000298355273 565411271 /nfs/dbraw/zinc/41/12/71/565411271.db2.gz MRHVVJDBRBIGIM-KRWDZBQOSA-N 0 1 391.269 3.003 10 0 GGAEMN O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CCN2CCC1CC2 ZINC000188609725 565412339 /nfs/dbraw/zinc/41/23/39/565412339.db2.gz VHUDDZCHANNUMX-UHFFFAOYSA-N 0 1 377.204 3.388 10 0 GGAEMN Cc1cc(C(=O)N2CCN3CCC2CC3)nn1-c1ccc(Cl)cc1Cl ZINC000188658969 565416249 /nfs/dbraw/zinc/41/62/49/565416249.db2.gz HYDHWPVCRLJOQA-UHFFFAOYSA-N 0 1 379.291 3.408 10 0 GGAEMN O=C(NCc1cc(F)cc(Br)c1)c1n[nH]nc1-c1ccccc1 ZINC000188708146 565419398 /nfs/dbraw/zinc/41/93/98/565419398.db2.gz CUUQDZVAZPNTSI-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN CC(C)CCO[C@H](C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171222433 565419574 /nfs/dbraw/zinc/41/95/74/565419574.db2.gz JSGFMFHDGIQBOW-GFCCVEGCSA-N 0 1 395.301 3.302 10 0 GGAEMN CC(C)CCO[C@H](C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171222433 565419578 /nfs/dbraw/zinc/41/95/78/565419578.db2.gz JSGFMFHDGIQBOW-GFCCVEGCSA-N 0 1 395.301 3.302 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cccc(F)c1 ZINC000171223765 565419662 /nfs/dbraw/zinc/41/96/62/565419662.db2.gz UODHJDQJKHXWFW-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccc(F)c1 ZINC000171223765 565419667 /nfs/dbraw/zinc/41/96/67/565419667.db2.gz UODHJDQJKHXWFW-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN Cc1cccc(CNCc2ccc(Br)cc2N2CCOCC2)n1 ZINC000188703557 565419688 /nfs/dbraw/zinc/41/96/88/565419688.db2.gz LCLFDLMFXCGPRT-UHFFFAOYSA-N 0 1 376.298 3.279 10 0 GGAEMN Cc1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C)o1 ZINC000171223036 565419725 /nfs/dbraw/zinc/41/97/25/565419725.db2.gz IBPAUSFWBJGKHS-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN Cc1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)o1 ZINC000171223036 565419727 /nfs/dbraw/zinc/41/97/27/565419727.db2.gz IBPAUSFWBJGKHS-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN CN(C(=O)CCCCc1cn[nH]n1)[C@H]1CCOc2ccc(Br)cc21 ZINC000376067851 565420332 /nfs/dbraw/zinc/42/03/32/565420332.db2.gz MDLJJSBTJGTTSA-HNNXBMFYSA-N 0 1 393.285 3.262 10 0 GGAEMN CN(C(=O)CCCCc1cn[nH]n1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000376067855 565420375 /nfs/dbraw/zinc/42/03/75/565420375.db2.gz MDLJJSBTJGTTSA-OAHLLOKOSA-N 0 1 393.285 3.262 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)Nc1nccs1 ZINC000171247357 565421648 /nfs/dbraw/zinc/42/16/48/565421648.db2.gz ZXECTOJFTXMEGZ-UHFFFAOYSA-N 0 1 379.243 3.012 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)Nc1nccs1 ZINC000171247357 565421654 /nfs/dbraw/zinc/42/16/54/565421654.db2.gz ZXECTOJFTXMEGZ-UHFFFAOYSA-N 0 1 379.243 3.012 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc2[nH]cnc2c1 ZINC000171275384 565423674 /nfs/dbraw/zinc/42/36/74/565423674.db2.gz IAGFECVSFMRESE-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc2[nH]cnc2c1 ZINC000171275384 565423678 /nfs/dbraw/zinc/42/36/78/565423678.db2.gz IAGFECVSFMRESE-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN Cc1ccc(CC(=O)NCCc2nnc(-c3ccccc3)[nH]2)cc1Br ZINC000188844618 565426245 /nfs/dbraw/zinc/42/62/45/565426245.db2.gz HXYKYNWCWAXMHV-UHFFFAOYSA-N 0 1 399.292 3.444 10 0 GGAEMN CCc1c(NC(=O)CCCCC(N)=O)[nH]nc1-c1ccc(Br)cc1 ZINC000188864552 565428981 /nfs/dbraw/zinc/42/89/81/565428981.db2.gz CSRWNQSSDFUDGF-UHFFFAOYSA-N 0 1 393.285 3.386 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C1 ZINC000188941131 565434479 /nfs/dbraw/zinc/43/44/79/565434479.db2.gz QHLMASSGKGBYDB-LLVKDONJSA-N 0 1 380.901 3.313 10 0 GGAEMN CCCn1nccc1NS(=O)(=O)c1cc(Cl)ccc1O[C@@H](C)COC ZINC000188990940 565436687 /nfs/dbraw/zinc/43/66/87/565436687.db2.gz XIFHLSLPUMYMDB-LBPRGKRZSA-N 0 1 387.889 3.161 10 0 GGAEMN COc1ccc(Br)cc1CNC(=O)[C@H](Cc1ccccc1)N(C)C ZINC000171615318 565439353 /nfs/dbraw/zinc/43/93/53/565439353.db2.gz LJGVBQUXEOZCBE-KRWDZBQOSA-N 0 1 391.309 3.247 10 0 GGAEMN CN(C)[C@@H](Cc1ccccc1)C(=O)NCc1cc(F)ccc1Br ZINC000171674548 565443059 /nfs/dbraw/zinc/44/30/59/565443059.db2.gz NNWLBIMZQDLOGZ-KRWDZBQOSA-N 0 1 379.273 3.377 10 0 GGAEMN COC(=O)COc1ccc([C@H](C)NCc2ccc(Br)cn2)cc1 ZINC000299224274 565443177 /nfs/dbraw/zinc/44/31/77/565443177.db2.gz IDLLVOROGOXOGS-LBPRGKRZSA-N 0 1 379.254 3.247 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)CCSc1nnc(C)[nH]1 ZINC000189144696 565446607 /nfs/dbraw/zinc/44/66/07/565446607.db2.gz LVVSDHOVJDHTOK-SECBINFHSA-N 0 1 399.314 3.244 10 0 GGAEMN CC(=O)Nc1cc(F)c(S(=O)(=O)Nc2ccc3c(c2)CCO3)cc1Cl ZINC000171750437 565448291 /nfs/dbraw/zinc/44/82/91/565448291.db2.gz CGEXGDXDIFQEJO-UHFFFAOYSA-N 0 1 384.816 3.173 10 0 GGAEMN CN(C)[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1cccs1 ZINC000171771099 565449309 /nfs/dbraw/zinc/44/93/09/565449309.db2.gz BXLGRTYCCXHCBG-CYBMUJFWSA-N 0 1 393.310 3.420 10 0 GGAEMN COc1cc(Br)ccc1CNCc1cnc2nc(C)cc(C)n12 ZINC000189187032 565450291 /nfs/dbraw/zinc/45/02/91/565450291.db2.gz MDTKCPGTGOWYBP-UHFFFAOYSA-N 0 1 375.270 3.407 10 0 GGAEMN CCc1nc(CCNC(=O)c2n[nH]c3ccc(Br)cc32)cs1 ZINC000171773297 565451097 /nfs/dbraw/zinc/45/10/97/565451097.db2.gz ZZUSFEMRJFHEHV-UHFFFAOYSA-N 0 1 379.283 3.317 10 0 GGAEMN Cc1cnn([C@@H]2CCCN(C(=O)c3[nH]nc4ccc(Br)cc43)C2)c1 ZINC000171810535 565451532 /nfs/dbraw/zinc/45/15/32/565451532.db2.gz SUFYFIDDDQTTDQ-CYBMUJFWSA-N 0 1 388.269 3.308 10 0 GGAEMN O=c1[nH]c2ccccc2cc1CN1CCN(c2ccc(Br)cn2)CC1 ZINC000171917218 565458304 /nfs/dbraw/zinc/45/83/04/565458304.db2.gz LPHFOMIZOIKRDA-UHFFFAOYSA-N 0 1 399.292 3.008 10 0 GGAEMN O=C(NCCCOCC(F)(F)F)c1n[nH]c2ccc(Br)cc21 ZINC000171957655 565458850 /nfs/dbraw/zinc/45/88/50/565458850.db2.gz HTYUYFXQRNDOLA-UHFFFAOYSA-N 0 1 380.164 3.024 10 0 GGAEMN Cn1c(CNC(=O)c2n[nH]c3ccc(Br)cc32)nc2ccccc21 ZINC000171947512 565459542 /nfs/dbraw/zinc/45/95/42/565459542.db2.gz DINARLPZKCPPHG-UHFFFAOYSA-N 0 1 384.237 3.142 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1CCO[C@H](c2nccs2)C1 ZINC000189399178 565463381 /nfs/dbraw/zinc/46/33/81/565463381.db2.gz XIQBCENPXHMBRU-JTQLQIEISA-N 0 1 380.882 3.462 10 0 GGAEMN CCCN(C(=O)c1cccs1)C1CCN(C[C@@H](O)CC(F)(F)F)CC1 ZINC000189581650 565476312 /nfs/dbraw/zinc/47/63/12/565476312.db2.gz AFQKRKGPCPZXGD-AWEZNQCLSA-N 0 1 378.460 3.378 10 0 GGAEMN CCCN(C(=O)c1cccs1)C1CCN(C[C@H](O)CC(F)(F)F)CC1 ZINC000189581629 565476504 /nfs/dbraw/zinc/47/65/04/565476504.db2.gz AFQKRKGPCPZXGD-CQSZACIVSA-N 0 1 378.460 3.378 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cccc(Cl)c2Br)CCN1C ZINC000277135202 565477699 /nfs/dbraw/zinc/47/76/99/565477699.db2.gz ZCJWJRXNJHFRLV-GHMZBOCLSA-N 0 1 395.750 3.206 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3cc(Br)ccc3C2)n[nH]1 ZINC000189612023 565477708 /nfs/dbraw/zinc/47/77/08/565477708.db2.gz UASHMOPKEORGQH-LLVKDONJSA-N 0 1 377.286 3.180 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cccc(Cl)c2Br)CCN1C ZINC000277135210 565478336 /nfs/dbraw/zinc/47/83/36/565478336.db2.gz ZCJWJRXNJHFRLV-QWRGUYRKSA-N 0 1 395.750 3.206 10 0 GGAEMN O=C(c1c[nH]c2ccccc2c1=O)N1CCc2cccc(Br)c2C1 ZINC000172388643 565482578 /nfs/dbraw/zinc/48/25/78/565482578.db2.gz ZRYJYLDOENDHKY-UHFFFAOYSA-N 0 1 383.245 3.489 10 0 GGAEMN Cc1csc(C(=O)NCCN2CCCC[C@@H]2C)c1I ZINC000189713050 565483260 /nfs/dbraw/zinc/48/32/60/565483260.db2.gz XWNJFEJYULHQNO-NSHDSACASA-N 0 1 392.306 3.265 10 0 GGAEMN Cc1csc(C(=O)NCCN2CCCC[C@H]2C)c1I ZINC000189713068 565483436 /nfs/dbraw/zinc/48/34/36/565483436.db2.gz XWNJFEJYULHQNO-LLVKDONJSA-N 0 1 392.306 3.265 10 0 GGAEMN FC(F)(F)c1cnc(C2CCN(c3ncc(Br)cn3)CC2)[nH]1 ZINC000301404677 565484061 /nfs/dbraw/zinc/48/40/61/565484061.db2.gz FPWVRLXMIAXEKJ-UHFFFAOYSA-N 0 1 376.180 3.365 10 0 GGAEMN O[C@H](COC[C@@H]1CCCO1)CN1CCC(c2ccccc2Br)CC1 ZINC000189807294 565489239 /nfs/dbraw/zinc/48/92/39/565489239.db2.gz NLKJVWQSFZYTEO-IRXDYDNUSA-N 0 1 398.341 3.185 10 0 GGAEMN CCc1cc(=O)n2nc(NC[C@H](c3ccc(Cl)cc3)N(C)C)sc2n1 ZINC000301486791 565489850 /nfs/dbraw/zinc/48/98/50/565489850.db2.gz XZMXPFYNNDFJHR-CQSZACIVSA-N 0 1 377.901 3.082 10 0 GGAEMN O=S(=O)(Nc1cc(F)cc(F)c1)c1ccc(N2CCCSCC2)nc1 ZINC000301512701 565492411 /nfs/dbraw/zinc/49/24/11/565492411.db2.gz KYCNAJNKUAPRIU-UHFFFAOYSA-N 0 1 385.461 3.104 10 0 GGAEMN CN(CCN1CCN(c2ccccc2)CC1)Cc1cncc(Br)c1 ZINC000172597405 565493661 /nfs/dbraw/zinc/49/36/61/565493661.db2.gz CDNZETYEWGNWAI-UHFFFAOYSA-N 0 1 389.341 3.098 10 0 GGAEMN O=C(Nc1nncs1)C1CCN(Cc2ccc(CSC(F)F)o2)CC1 ZINC000377715040 565494687 /nfs/dbraw/zinc/49/46/87/565494687.db2.gz JKHMVVFZUCNJSQ-UHFFFAOYSA-N 0 1 388.465 3.438 10 0 GGAEMN CN1CC[C@H](N[C@@H](C(N)=O)c2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000377730298 565496164 /nfs/dbraw/zinc/49/61/64/565496164.db2.gz XUNCVBUGRDDVCA-RCCFBDPRSA-N 0 1 388.309 3.011 10 0 GGAEMN Cc1cc(I)ccc1NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000377762922 565497032 /nfs/dbraw/zinc/49/70/32/565497032.db2.gz OFFXWAMEDLALTP-NSHDSACASA-N 0 1 396.232 3.002 10 0 GGAEMN O=C(Nc1cccc2cc(Br)cnc21)N[C@H]1CCc2nc[nH]c2C1 ZINC000377757855 565497072 /nfs/dbraw/zinc/49/70/72/565497072.db2.gz GFZZFYAXIFPVTQ-LBPRGKRZSA-N 0 1 386.253 3.399 10 0 GGAEMN O=C(Nc1cccc2cc(Br)cnc21)N[C@@H]1CCc2nc[nH]c2C1 ZINC000377757854 565497361 /nfs/dbraw/zinc/49/73/61/565497361.db2.gz GFZZFYAXIFPVTQ-GFCCVEGCSA-N 0 1 386.253 3.399 10 0 GGAEMN CC(C)CCN(C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000172660190 565497561 /nfs/dbraw/zinc/49/75/61/565497561.db2.gz FNYFJDNAJMOROB-UHFFFAOYSA-N 0 1 380.290 3.422 10 0 GGAEMN CC(C)CCN(C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000172660190 565497565 /nfs/dbraw/zinc/49/75/65/565497565.db2.gz FNYFJDNAJMOROB-UHFFFAOYSA-N 0 1 380.290 3.422 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C2CC2)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000377845168 565502718 /nfs/dbraw/zinc/50/27/18/565502718.db2.gz OXJCRKFKAAOYQA-CZUORRHYSA-N 0 1 376.444 3.170 10 0 GGAEMN Cc1ccc(NC(=O)[C@H](C)N2CCN3CCCC[C@@H]3C2)c(Br)c1 ZINC000172801986 565504939 /nfs/dbraw/zinc/50/49/39/565504939.db2.gz YUDYCWNXCVQZRN-LSDHHAIUSA-N 0 1 380.330 3.255 10 0 GGAEMN O=C(CN1CCN2CCCC[C@@H]2C1)Nc1ccc(Br)cc1Cl ZINC000172802936 565505367 /nfs/dbraw/zinc/50/53/67/565505367.db2.gz NDVYOZCKWBANPI-CYBMUJFWSA-N 0 1 386.721 3.211 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378063460 565510287 /nfs/dbraw/zinc/51/02/87/565510287.db2.gz XDPSLFSMYXYQBY-AWEZNQCLSA-N 0 1 377.286 3.180 10 0 GGAEMN CCN(Cc1cc(Br)ccc1F)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378067463 565510401 /nfs/dbraw/zinc/51/04/01/565510401.db2.gz HRKUESVRRNOCDH-CYBMUJFWSA-N 0 1 395.276 3.400 10 0 GGAEMN Ic1ccc([C@@H]2CCCN2c2ncnc3[nH]cnc32)cc1 ZINC000301812557 565511072 /nfs/dbraw/zinc/51/10/72/565511072.db2.gz FIMAOFHCVXKUGK-LBPRGKRZSA-N 0 1 391.216 3.299 10 0 GGAEMN Cc1cc(Br)ccc1SCC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378198824 565515371 /nfs/dbraw/zinc/51/53/71/565515371.db2.gz HJMZKAFNNJJLPY-GFCCVEGCSA-N 0 1 380.311 3.246 10 0 GGAEMN CC[C@@H](Cc1cccc(Br)c1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378200159 565515482 /nfs/dbraw/zinc/51/54/82/565515482.db2.gz JZDCQNSYEHSUGD-ZFWWWQNUSA-N 0 1 376.298 3.415 10 0 GGAEMN Clc1ccc(CCN2CCN(c3ncnc4[nH]cnc43)CC2)cc1Cl ZINC000301894457 565517044 /nfs/dbraw/zinc/51/70/44/565517044.db2.gz PJMKZYMWPOQFDO-UHFFFAOYSA-N 0 1 377.279 3.024 10 0 GGAEMN CC(C)Oc1cc(Br)cc(C(=O)N[C@@H]2CCc3nc[nH]c3C2)c1 ZINC000378315894 565521533 /nfs/dbraw/zinc/52/15/33/565521533.db2.gz WYVJGHWXHGIDRH-CYBMUJFWSA-N 0 1 378.270 3.247 10 0 GGAEMN O=C(Cc1csc(-c2ccc(Cl)s2)n1)N[C@H]1CCc2nc[nH]c2C1 ZINC000378320299 565521562 /nfs/dbraw/zinc/52/15/62/565521562.db2.gz XHWFDLCGAWYCII-VIFPVBQESA-N 0 1 378.910 3.464 10 0 GGAEMN COc1cc(Br)ccc1CN1CCC[C@H]1C[C@H](O)c1cnn(C)c1 ZINC000378611331 565536547 /nfs/dbraw/zinc/53/65/47/565536547.db2.gz OYZQJJOZSCBXNM-IRXDYDNUSA-N 0 1 394.313 3.279 10 0 GGAEMN COc1cc(Br)ccc1CN1CCC[C@@H]1C[C@@H](O)c1cnn(C)c1 ZINC000378611330 565536526 /nfs/dbraw/zinc/53/65/26/565536526.db2.gz OYZQJJOZSCBXNM-IAGOWNOFSA-N 0 1 394.313 3.279 10 0 GGAEMN CCOC(=O)c1cc(C(=O)Nc2cc(Br)c(F)cc2F)on1 ZINC000379290127 565539039 /nfs/dbraw/zinc/53/90/39/565539039.db2.gz JFEXGAIRGLGQQB-UHFFFAOYSA-N 0 1 375.125 3.144 10 0 GGAEMN Cc1ncsc1C[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([O-])c(Cl)c2)C1 ZINC000190529401 565540115 /nfs/dbraw/zinc/54/01/15/565540115.db2.gz WAPLYXBVCNGWFV-ZDUSSCGKSA-N 0 1 379.913 3.405 10 0 GGAEMN CC[C@H]1CN(c2nnc(Cc3ccc(Cl)cc3)s2)CCN1C[C@H](C)O ZINC000302402655 565540749 /nfs/dbraw/zinc/54/07/49/565540749.db2.gz FXYNGQKLXOAURD-BBRMVZONSA-N 0 1 380.945 3.064 10 0 GGAEMN C[C@H]1CN(C2CCN(C(=O)COc3cc(Cl)cc(Cl)c3)CC2)CCO1 ZINC000173252810 565540930 /nfs/dbraw/zinc/54/09/30/565540930.db2.gz WJPDDZSGVGONRO-ZDUSSCGKSA-N 0 1 387.307 3.084 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C ZINC000173277320 565542970 /nfs/dbraw/zinc/54/29/70/565542970.db2.gz RWRDONOSFZFZRU-ZYHUDNBSSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Br)ccc2Cl)CCN1C ZINC000173274335 565542981 /nfs/dbraw/zinc/54/29/81/565542981.db2.gz YPEKDPPJPOXVOI-PWSUYJOCSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)CCN1C ZINC000173273634 565543117 /nfs/dbraw/zinc/54/31/17/565543117.db2.gz PSFAQNGMALQESI-MNOVXSKESA-N 0 1 382.860 3.045 10 0 GGAEMN COc1cc(Cl)c(S(=O)(=O)N(C)[C@H]2CCN(C)[C@@H](C)C2)cc1Cl ZINC000173274529 565543217 /nfs/dbraw/zinc/54/32/17/565543217.db2.gz XYLCTXOYTYUUCB-QWRGUYRKSA-N 0 1 381.325 3.105 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2ccc(F)c(F)c2)[C@@H]1c1cccs1 ZINC000173322775 565547855 /nfs/dbraw/zinc/54/78/55/565547855.db2.gz OBHCTKGQCCQKCJ-YVEFUNNKSA-N 0 1 386.489 3.388 10 0 GGAEMN Cn1ncc(Br)c1CNC[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000278280489 565548756 /nfs/dbraw/zinc/54/87/56/565548756.db2.gz AIXMOXKTAURLFI-CYBMUJFWSA-N 0 1 379.085 3.313 10 0 GGAEMN Cn1ncc(Br)c1CNC[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000278280492 565548953 /nfs/dbraw/zinc/54/89/53/565548953.db2.gz AIXMOXKTAURLFI-ZDUSSCGKSA-N 0 1 379.085 3.313 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2cccc(F)c2F)[C@@H]1c1cccs1 ZINC000173324123 565549278 /nfs/dbraw/zinc/54/92/78/565549278.db2.gz CGLGDUZXMGOFNH-YVEFUNNKSA-N 0 1 386.489 3.388 10 0 GGAEMN Cn1ncc(Br)c1CNCCc1nc(-c2ccc(Cl)cc2)no1 ZINC000278300276 565549451 /nfs/dbraw/zinc/54/94/51/565549451.db2.gz CBSGNIDPZLSJTK-UHFFFAOYSA-N 0 1 396.676 3.218 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@@H](C)c3ncc(Br)cc3F)C2)n(C)n1 ZINC000278412822 565556316 /nfs/dbraw/zinc/55/63/16/565556316.db2.gz HTOJCWGRJFQCKS-GXTWGEPZSA-N 0 1 396.308 3.345 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@H](C)c3ncc(Br)cc3F)C2)n(C)n1 ZINC000278412833 565556979 /nfs/dbraw/zinc/55/69/79/565556979.db2.gz HTOJCWGRJFQCKS-TZMCWYRMSA-N 0 1 396.308 3.345 10 0 GGAEMN CC(=O)NCCCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1 ZINC000190783716 565558404 /nfs/dbraw/zinc/55/84/04/565558404.db2.gz DIBUYQZQCKCDDB-HNNXBMFYSA-N 0 1 393.285 3.162 10 0 GGAEMN COc1cc(Br)c(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)[O-])cc1OC ZINC000390991827 565559705 /nfs/dbraw/zinc/55/97/05/565559705.db2.gz GZTZLEZVKKBPCY-PKWAYOAASA-N 0 1 384.270 3.151 10 0 GGAEMN CC1=CCN(CCNc2ncc(Cn3cc(Br)cn3)s2)CC1 ZINC000302847428 565560540 /nfs/dbraw/zinc/56/05/40/565560540.db2.gz HFEHYCHDPVMJAR-UHFFFAOYSA-N 0 1 382.331 3.214 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(Cl)c(S(C)(=O)=O)c2)c(C)s1 ZINC000190832519 565562102 /nfs/dbraw/zinc/56/21/02/565562102.db2.gz DRWHELZTBIWQTM-UHFFFAOYSA-N 0 1 379.912 3.223 10 0 GGAEMN Cn1ncc(Br)c1CNCCc1nc(-c2ccncc2)cs1 ZINC000278565950 565566321 /nfs/dbraw/zinc/56/63/21/565566321.db2.gz WTMDAOCMJNWSPU-UHFFFAOYSA-N 0 1 378.299 3.033 10 0 GGAEMN Cc1csc(C(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)c1Br ZINC000190892701 565567882 /nfs/dbraw/zinc/56/78/82/565567882.db2.gz ULDQXDDKGYUOSV-LBPRGKRZSA-N 0 1 387.343 3.144 10 0 GGAEMN COc1cc2ccnc(NCc3nn(C)cc3Br)c2cc1OC ZINC000393336556 565568244 /nfs/dbraw/zinc/56/82/44/565568244.db2.gz HFVDDWAQOKVZGQ-UHFFFAOYSA-N 0 1 377.242 3.360 10 0 GGAEMN COc1ccnc(N2CCN(CCCSc3ccccc3Cl)CC2)n1 ZINC000303155029 565569038 /nfs/dbraw/zinc/56/90/38/565569038.db2.gz FZTSEFRDFIIQJN-UHFFFAOYSA-N 0 1 378.929 3.443 10 0 GGAEMN OC[C@H]1CCC[C@@H](NCc2c(Br)cncc2Br)C1 ZINC000394532221 565571047 /nfs/dbraw/zinc/57/10/47/565571047.db2.gz PGYONUIERAFDAS-VHSXEESVSA-N 0 1 378.108 3.247 10 0 GGAEMN C[C@H]1CC[C@H](C(N)=O)CN1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000173660441 565574459 /nfs/dbraw/zinc/57/44/59/565574459.db2.gz JPAUVNKFKXMLGQ-AAEUAGOBSA-N 0 1 378.270 3.190 10 0 GGAEMN C[C@H]1CC[C@H](C(N)=O)CN1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173660665 565574791 /nfs/dbraw/zinc/57/47/91/565574791.db2.gz WACHWZHZXKQZSM-AAEUAGOBSA-N 0 1 378.270 3.190 10 0 GGAEMN FC(F)(F)c1cnc(CNC[C@H](c2cccs2)N2CCOCC2)s1 ZINC000278767735 565576496 /nfs/dbraw/zinc/57/64/96/565576496.db2.gz YAVNMIKIQSOPTL-LLVKDONJSA-N 0 1 377.457 3.387 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)CCSc2nnc(C)[nH]2)cc1Br ZINC000173706237 565576823 /nfs/dbraw/zinc/57/68/23/565576823.db2.gz DOBHBOGMPAOWNZ-SECBINFHSA-N 0 1 399.314 3.244 10 0 GGAEMN CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1nc(Cl)cs1 ZINC000278812143 565578756 /nfs/dbraw/zinc/57/87/56/565578756.db2.gz UESMDPPLFMQVTE-UHFFFAOYSA-N 0 1 380.901 3.199 10 0 GGAEMN C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[C@]2(CNC(=O)C2)C1 ZINC000278833856 565579905 /nfs/dbraw/zinc/57/99/05/565579905.db2.gz IPIQRURKKQRXFV-QGHHPUGFSA-N 0 1 381.263 3.316 10 0 GGAEMN CN(C(=O)c1nscc1Br)[C@H]1CCN(Cc2ccccc2)C1 ZINC000404887142 565584182 /nfs/dbraw/zinc/58/41/82/565584182.db2.gz FYSICBAPLBZJBY-ZDUSSCGKSA-N 0 1 380.311 3.252 10 0 GGAEMN CN(C(=O)c1nscc1Br)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000404887139 565584459 /nfs/dbraw/zinc/58/44/59/565584459.db2.gz FYSICBAPLBZJBY-CYBMUJFWSA-N 0 1 380.311 3.252 10 0 GGAEMN C[C@H]1[C@@H](NC(=O)c2nscc2Br)CCN1Cc1ccccc1 ZINC000404939379 565584503 /nfs/dbraw/zinc/58/45/03/565584503.db2.gz LKIIDWPMOUFQJR-FZMZJTMJSA-N 0 1 380.311 3.298 10 0 GGAEMN CCc1nc([C@@H]2CN(Cc3cc(Br)c(Cl)s3)CCO2)n[nH]1 ZINC000191155396 565584907 /nfs/dbraw/zinc/58/49/07/565584907.db2.gz DCIUJJDZNUQSQN-JTQLQIEISA-N 0 1 391.722 3.418 10 0 GGAEMN C[C@@H](Cn1cccn1)NCc1cc(Cl)ccc1I ZINC000405195457 565585419 /nfs/dbraw/zinc/58/54/19/565585419.db2.gz BIDWXELELVZMJQ-JTQLQIEISA-N 0 1 375.641 3.319 10 0 GGAEMN CN(C)C[C@H]1CCCCN1S(=O)(=O)c1c(Cl)cccc1Br ZINC000405097151 565585629 /nfs/dbraw/zinc/58/56/29/565585629.db2.gz TUEIQQHPZQLCFW-LLVKDONJSA-N 0 1 395.750 3.207 10 0 GGAEMN CN(C)C[C@@H]1CCCCN1S(=O)(=O)c1c(Cl)cccc1Br ZINC000405097157 565585901 /nfs/dbraw/zinc/58/59/01/565585901.db2.gz TUEIQQHPZQLCFW-NSHDSACASA-N 0 1 395.750 3.207 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2cc(F)ccc2OCC(F)(F)F)[nH]1 ZINC000173783892 565585944 /nfs/dbraw/zinc/58/59/44/565585944.db2.gz DJEWSBQXGMMVES-UHFFFAOYSA-N 0 1 378.351 3.314 10 0 GGAEMN C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@]2(CNC(=O)C2)C1 ZINC000278933348 565586291 /nfs/dbraw/zinc/58/62/91/565586291.db2.gz SYOKJCMQEKXZHI-QGHHPUGFSA-N 0 1 381.263 3.316 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000191195370 565587500 /nfs/dbraw/zinc/58/75/00/565587500.db2.gz XATDPXCPYDUXFK-SIVJFFJCSA-N 0 1 378.270 3.099 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2ccc(Cl)cc2Cl)n[nH]1 ZINC000407976915 565588273 /nfs/dbraw/zinc/58/82/73/565588273.db2.gz OBCXKACBFSBAOB-LBPRGKRZSA-N 0 1 375.281 3.336 10 0 GGAEMN Cn1cc([C@@H]2CSCCN2Cc2nc3ccc(Br)cc3[nH]2)cn1 ZINC000191221259 565589045 /nfs/dbraw/zinc/58/90/45/565589045.db2.gz RRRBJLLAHLUQCJ-HNNXBMFYSA-N 0 1 392.326 3.349 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3cc(C)ccc3Br)C2)n[nH]1 ZINC000407978239 565589287 /nfs/dbraw/zinc/58/92/87/565589287.db2.gz WXZFQTWTOWEPJI-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@H]2CCCCN2C(=O)c2ccccc2I)n[nH]1 ZINC000407982299 565589477 /nfs/dbraw/zinc/58/94/77/565589477.db2.gz XRGPJSATJLLDMM-CYBMUJFWSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1cc([C@@H]2CCCN(S(=O)(=O)c3cc(Br)ccc3C)C2)n[nH]1 ZINC000407977812 565589968 /nfs/dbraw/zinc/58/99/68/565589968.db2.gz UJWONHCKIVBBMP-CYBMUJFWSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)c2cccc(I)c2)n[nH]1 ZINC000407981278 565590010 /nfs/dbraw/zinc/59/00/10/565590010.db2.gz RSMAHDRTBNEHFG-ZDUSSCGKSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)N1CCCC[C@H]1c1nnc[nH]1 ZINC000408145647 565597296 /nfs/dbraw/zinc/59/72/96/565597296.db2.gz JUOPSGJWPHBTFJ-ZDUSSCGKSA-N 0 1 399.314 3.100 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)C[C@H]1C ZINC000408209889 565599077 /nfs/dbraw/zinc/59/90/77/565599077.db2.gz WSPZDXSLCJDRFQ-BFQNTYOBSA-N 0 1 386.323 3.077 10 0 GGAEMN C[C@@H]1[C@H](C)N(C(=O)Nc2cnn(-c3ncc(Cl)cc3Cl)c2)CCN1C ZINC000408209360 565599376 /nfs/dbraw/zinc/59/93/76/565599376.db2.gz ZXYYGNVUBYELFC-MNOVXSKESA-N 0 1 383.283 3.130 10 0 GGAEMN Cc1nnc(SCCC(=O)NCC(C)(C)c2ccc(Br)cc2)[nH]1 ZINC000173975680 565602582 /nfs/dbraw/zinc/60/25/82/565602582.db2.gz HNAIPPAXUOAWPP-UHFFFAOYSA-N 0 1 397.342 3.452 10 0 GGAEMN CC(C)(C)c1nnsc1C(=O)NCC1(N2CCSCC2)CCCCC1 ZINC000191417818 565602653 /nfs/dbraw/zinc/60/26/53/565602653.db2.gz XSZKGMXNAPFVKL-UHFFFAOYSA-N 0 1 382.599 3.317 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@]2(CCCOC2)C1 ZINC000408297168 565603039 /nfs/dbraw/zinc/60/30/39/565603039.db2.gz IDXSWMSYGNRRMC-QGZVFWFLSA-N 0 1 378.270 3.358 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@]2(CCCOC2)C1 ZINC000408297163 565603259 /nfs/dbraw/zinc/60/32/59/565603259.db2.gz IDXSWMSYGNRRMC-KRWDZBQOSA-N 0 1 378.270 3.358 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H](C)Cc2ccc(Br)cc2)[nH]1 ZINC000173976989 565604194 /nfs/dbraw/zinc/60/41/94/565604194.db2.gz PSFAYIAPKNUPPR-JTQLQIEISA-N 0 1 383.315 3.105 10 0 GGAEMN Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000174003976 565605270 /nfs/dbraw/zinc/60/52/70/565605270.db2.gz RDXQDXYXNLJHRC-SECBINFHSA-N 0 1 390.285 3.037 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN2CCCC[C@@H]2C1 ZINC000191456836 565605673 /nfs/dbraw/zinc/60/56/73/565605673.db2.gz OKYOLVPNMFWWKX-DZGCQCFKSA-N 0 1 396.329 3.398 10 0 GGAEMN Cc1c(Br)cccc1CC(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000191516157 565609924 /nfs/dbraw/zinc/60/99/24/565609924.db2.gz RCKHEJMMEFRLLD-CQSZACIVSA-N 0 1 395.341 3.012 10 0 GGAEMN NC(=O)c1coc(CN[C@H](c2cccc(Br)c2)C2CCOCC2)c1 ZINC000191549857 565612595 /nfs/dbraw/zinc/61/25/95/565612595.db2.gz UNPKBHBUOBFLGT-KRWDZBQOSA-N 0 1 393.281 3.399 10 0 GGAEMN CNC(=O)C[C@H](C)N[C@H](C)c1ccc(Br)cc1Br ZINC000323078957 565612794 /nfs/dbraw/zinc/61/27/94/565612794.db2.gz YITVZEKDKOEGHT-DTWKUNHWSA-N 0 1 378.108 3.387 10 0 GGAEMN CCc1nc([C@H]2CN(Cc3cc(Br)ccc3Cl)CCO2)n[nH]1 ZINC000174100404 565613269 /nfs/dbraw/zinc/61/32/69/565613269.db2.gz IAHJBSNKUNEJHR-CYBMUJFWSA-N 0 1 385.693 3.357 10 0 GGAEMN CCc1nc([C@@H]2CN(Cc3ccc(Cl)cc3Br)CCO2)n[nH]1 ZINC000174100315 565613331 /nfs/dbraw/zinc/61/33/31/565613331.db2.gz IPIISNKOFYDMIQ-ZDUSSCGKSA-N 0 1 385.693 3.357 10 0 GGAEMN CC(C)Oc1cc(Br)cc(C(=O)NCCCCN2CCOCC2)c1 ZINC000174097950 565613374 /nfs/dbraw/zinc/61/33/74/565613374.db2.gz XFTXNIHOMDQJTC-UHFFFAOYSA-N 0 1 399.329 3.079 10 0 GGAEMN CCc1nc([C@H]2CN(Cc3ccc(Cl)cc3Br)CCO2)n[nH]1 ZINC000174100328 565613661 /nfs/dbraw/zinc/61/36/61/565613661.db2.gz IPIISNKOFYDMIQ-CYBMUJFWSA-N 0 1 385.693 3.357 10 0 GGAEMN Cc1ccc(CN[C@H]2CCCOc3ccc(Br)cc32)c(=O)n1C ZINC000279479312 565614122 /nfs/dbraw/zinc/61/41/22/565614122.db2.gz KQBGPMFHWOCAJZ-INIZCTEOSA-N 0 1 377.282 3.460 10 0 GGAEMN O=C([O-])[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1Cc1nc(-c2cccc(Br)c2)no1 ZINC000326494314 565625286 /nfs/dbraw/zinc/62/52/86/565625286.db2.gz YNDJNICNXHHEDO-WHOFXGATSA-N 0 1 392.253 3.184 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)c1cnc2cnccc2c1 ZINC000409624814 565627960 /nfs/dbraw/zinc/62/79/60/565627960.db2.gz NBOVNAKMWJVUIJ-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN CC(C)NC(=O)CC[N@H+]1CCC[C@@H]1c1ccc(I)cc1 ZINC000174428259 565634313 /nfs/dbraw/zinc/63/43/13/565634313.db2.gz HBJDMFMYRHIXIB-OAHLLOKOSA-N 0 1 386.277 3.343 10 0 GGAEMN CC(C)NC(=O)CCN1CCC[C@@H]1c1ccc(I)cc1 ZINC000174428259 565634317 /nfs/dbraw/zinc/63/43/17/565634317.db2.gz HBJDMFMYRHIXIB-OAHLLOKOSA-N 0 1 386.277 3.343 10 0 GGAEMN NC(=O)[C@H](Cc1ccc(F)cc1)N[C@H]1CCOc2c(Br)cccc21 ZINC000409874564 565645282 /nfs/dbraw/zinc/64/52/82/565645282.db2.gz KIRWCLYWANHYIA-HOTGVXAUSA-N 0 1 393.256 3.098 10 0 GGAEMN CSc1cccc(N(C2CCN(C)CC2)S(=O)(=O)c2cccnc2)c1 ZINC000191968949 565646454 /nfs/dbraw/zinc/64/64/54/565646454.db2.gz BUOCYWPVUFELNA-UHFFFAOYSA-N 0 1 377.535 3.093 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(F)c(Br)cc1Cl ZINC000280022903 565647223 /nfs/dbraw/zinc/64/72/23/565647223.db2.gz VIPRCIKNWNNBAT-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)c2cc3sc(N4CCCC4)nc3s2)n[nH]1 ZINC000280025876 565647423 /nfs/dbraw/zinc/64/74/23/565647423.db2.gz UMBVUYOSJBDXFR-SNVBAGLBSA-N 0 1 375.523 3.351 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)Cc2c(F)ccc(Br)c2F)c1 ZINC000409991627 565656036 /nfs/dbraw/zinc/65/60/36/565656036.db2.gz JJLDDHNAWGWLIA-UHFFFAOYSA-N 0 1 384.224 3.365 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)c(Br)c2)CCN1C ZINC000192214523 565670134 /nfs/dbraw/zinc/67/01/34/565670134.db2.gz FNESZTSJZSOJIB-QWRGUYRKSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)c(Br)c2)CCN1C ZINC000192214519 565670350 /nfs/dbraw/zinc/67/03/50/565670350.db2.gz FNESZTSJZSOJIB-MNOVXSKESA-N 0 1 395.750 3.206 10 0 GGAEMN CCN(CC(=O)OC(C)(C)C)C1CCN(c2ccc(Br)cn2)CC1 ZINC000192240899 565672960 /nfs/dbraw/zinc/67/29/60/565672960.db2.gz QOVVRLPOLNZNMS-UHFFFAOYSA-N 0 1 398.345 3.477 10 0 GGAEMN Cc1ccccc1CN[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280441593 565673055 /nfs/dbraw/zinc/67/30/55/565673055.db2.gz CBAHYXFSCVPKPC-LBPRGKRZSA-N 0 1 383.311 3.256 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CNCC1(C)OCCCO1 ZINC000192248066 565674187 /nfs/dbraw/zinc/67/41/87/565674187.db2.gz DKSAWAPMEPCPTK-UHFFFAOYSA-N 0 1 388.302 3.107 10 0 GGAEMN Cc1nc(C)n(C[C@@H]2CCCN(C(=O)c3c(O)cc(Cl)cc3Cl)C2)n1 ZINC000175240011 565686946 /nfs/dbraw/zinc/68/69/46/565686946.db2.gz VDNNRICOCAEHBP-GFCCVEGCSA-N 0 1 383.279 3.460 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CCO2)n[nH]1 ZINC000175300338 565691749 /nfs/dbraw/zinc/69/17/49/565691749.db2.gz JQBZLGYYDMKZAT-XPTSAGLGSA-N 0 1 384.267 3.264 10 0 GGAEMN Cc1cccc(CN[C@H](C)c2ccc(Br)c(S(N)(=O)=O)c2)c1 ZINC000280741677 565692379 /nfs/dbraw/zinc/69/23/79/565692379.db2.gz PDMPRPFAWNIONT-GFCCVEGCSA-N 0 1 383.311 3.256 10 0 GGAEMN C[C@@H]1CN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C[C@@]2(CCCOC2)O1 ZINC000330100331 565692546 /nfs/dbraw/zinc/69/25/46/565692546.db2.gz DVDQAUWWXZQLNK-DDUZABMNSA-N 0 1 390.307 3.003 10 0 GGAEMN CCC(=O)c1ccc(Cl)c(S(=O)(=O)N(C)[C@H]2CCN(CC)C[C@H]2C)c1 ZINC000280769307 565694304 /nfs/dbraw/zinc/69/43/04/565694304.db2.gz RQCVHRXOVUGYFT-CJNGLKHVSA-N 0 1 386.945 3.284 10 0 GGAEMN CC[C@H](N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccncc1 ZINC000280764571 565694621 /nfs/dbraw/zinc/69/46/21/565694621.db2.gz QYQOJJQYSWATJY-ABAIWWIYSA-N 0 1 398.326 3.293 10 0 GGAEMN C[C@@H]1CN(C[C@@H](O)COc2cc(Cl)ccc2Cl)C[C@]2(CCCOC2)O1 ZINC000330139525 565694933 /nfs/dbraw/zinc/69/49/33/565694933.db2.gz WIPNMBSZGOYPDB-SIIHOXLZSA-N 0 1 390.307 3.003 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)c2ncccc2Br)CC1 ZINC000192490769 565695801 /nfs/dbraw/zinc/69/58/01/565695801.db2.gz IFJMKZNBPZTZOT-UHFFFAOYSA-N 0 1 389.297 3.238 10 0 GGAEMN CN1CC[C@@H]2OCCN(C(=O)c3cc(Cl)c4cc(Cl)ccc4n3)[C@@H]2C1 ZINC000410844755 565698075 /nfs/dbraw/zinc/69/80/75/565698075.db2.gz CONCCVDXLSYKOW-SJORKVTESA-N 0 1 380.275 3.087 10 0 GGAEMN Cc1ccsc1CN[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280825280 565699273 /nfs/dbraw/zinc/69/92/73/565699273.db2.gz XDLYUYLBWFGBFB-JTQLQIEISA-N 0 1 389.340 3.317 10 0 GGAEMN C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ncsc2Br)C1 ZINC000411057148 565708508 /nfs/dbraw/zinc/70/85/08/565708508.db2.gz JQWLSRKFKIDQSY-ZDUSSCGKSA-N 0 1 394.338 3.500 10 0 GGAEMN Cc1cc(C(=O)N2CCN(C(=O)c3c(Cl)cccc3Cl)[C@H](C)C2)n[nH]1 ZINC000411087779 565710265 /nfs/dbraw/zinc/71/02/65/565710265.db2.gz AJFARZBAPFGJIA-LLVKDONJSA-N 0 1 381.263 3.012 10 0 GGAEMN C[C@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccc(Br)cc2)CC[N@H+]1C ZINC000281181740 565716302 /nfs/dbraw/zinc/71/63/02/565716302.db2.gz FFHQSJJEFWANSG-OSMBCOQSSA-N 0 1 380.330 3.429 10 0 GGAEMN CS(=O)(=O)C1(CN[C@H]2CCCOc3ccc(Br)cc32)CCC1 ZINC000281222691 565718688 /nfs/dbraw/zinc/71/86/88/565718688.db2.gz UDZFJVCTPZUZLA-AWEZNQCLSA-N 0 1 388.327 3.220 10 0 GGAEMN CC(C)n1cc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)cn1 ZINC000175717005 565719008 /nfs/dbraw/zinc/71/90/08/565719008.db2.gz XJDVHBLPHRXHBJ-UHFFFAOYSA-N 0 1 375.274 3.301 10 0 GGAEMN CC(C)n1cc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)cn1 ZINC000175717005 565719013 /nfs/dbraw/zinc/71/90/13/565719013.db2.gz XJDVHBLPHRXHBJ-UHFFFAOYSA-N 0 1 375.274 3.301 10 0 GGAEMN CC(C)N(CCS(=O)(=O)c1cccc(Br)c1)C1CCOCC1 ZINC000175710290 565719043 /nfs/dbraw/zinc/71/90/43/565719043.db2.gz NKLCAYCOCRIBJU-UHFFFAOYSA-N 0 1 390.343 3.112 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1cn(C)nc1C(C)C ZINC000281243781 565719696 /nfs/dbraw/zinc/71/96/96/565719696.db2.gz VIBRLBHTMDSITE-UHFFFAOYSA-N 0 1 388.287 3.115 10 0 GGAEMN CC(C)c1nc(C2(NC(=O)CSc3n[nH]c(=S)s3)CCCC2)no1 ZINC000175802728 565724964 /nfs/dbraw/zinc/72/49/64/565724964.db2.gz ZTVMTAPCUXJNIU-UHFFFAOYSA-N 0 1 385.540 3.385 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2Br)CCN1C ZINC000281418644 565729487 /nfs/dbraw/zinc/72/94/87/565729487.db2.gz IREXLIXYZYVDIC-ZYHUDNBSSA-N 0 1 395.750 3.206 10 0 GGAEMN CCN(CC(=O)NCc1cccs1)C(=O)CN[C@H](C)c1ccc(Cl)s1 ZINC000193115452 565733620 /nfs/dbraw/zinc/73/36/20/565733620.db2.gz PGWMQQDGZNGSEN-GFCCVEGCSA-N 0 1 399.969 3.279 10 0 GGAEMN Cc1nc([C@H](C)N[C@@H](C)c2nc(-c3ccc(Br)cc3)no2)n[nH]1 ZINC000411525310 565734617 /nfs/dbraw/zinc/73/46/17/565734617.db2.gz ASFBQVVVWJNURW-IUCAKERBSA-N 0 1 377.246 3.337 10 0 GGAEMN Cc1nc([C@@H](C)N[C@@H](C)c2nc(-c3ccc(Br)cc3)no2)n[nH]1 ZINC000411525308 565734881 /nfs/dbraw/zinc/73/48/81/565734881.db2.gz ASFBQVVVWJNURW-BDAKNGLRSA-N 0 1 377.246 3.337 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@H](C)c3ccnn3C)C2=O)ccc1Br ZINC000193293227 565743864 /nfs/dbraw/zinc/74/38/64/565743864.db2.gz PTEGWACMXXLTRD-CJNGLKHVSA-N 0 1 391.313 3.337 10 0 GGAEMN Brc1ccc(CN(CCc2ccccn2)CCn2ccnc2)o1 ZINC000411720724 565748151 /nfs/dbraw/zinc/74/81/51/565748151.db2.gz NOKIFJRVUGDMDQ-UHFFFAOYSA-N 0 1 375.270 3.379 10 0 GGAEMN CN1CC[C@H](NCc2ccc(S(C)(=O)=O)o2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000411747575 565749107 /nfs/dbraw/zinc/74/91/07/565749107.db2.gz LGLGREWARWBRII-DOTOQJQBSA-N 0 1 386.876 3.011 10 0 GGAEMN O=C(CCc1cnc[nH]1)N1CCC[C@@H]1c1ccc(I)cc1 ZINC000193395590 565749324 /nfs/dbraw/zinc/74/93/24/565749324.db2.gz WWXFNTBSQBIRQX-OAHLLOKOSA-N 0 1 395.244 3.311 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000281813009 565750186 /nfs/dbraw/zinc/75/01/86/565750186.db2.gz GZNOUWDIOVHPBC-BMIGLBTASA-N 0 1 393.285 3.235 10 0 GGAEMN O=S1(=O)CCC(CN2CCC(c3ccc(Br)cc3)CC2)CC1 ZINC000281927354 565755730 /nfs/dbraw/zinc/75/57/30/565755730.db2.gz DBHZRVBNPJAOPZ-UHFFFAOYSA-N 0 1 386.355 3.453 10 0 GGAEMN CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc(Cl)cc(Br)c1[O-] ZINC000176316534 565764566 /nfs/dbraw/zinc/76/45/66/565764566.db2.gz SGXSWJWYYZDPME-LLVKDONJSA-N 0 1 375.694 3.364 10 0 GGAEMN Cc1cc(C)c(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)o1 ZINC000176386494 565768551 /nfs/dbraw/zinc/76/85/51/565768551.db2.gz ASYNEXWIURBYOS-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN Cc1cc(C)c(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)o1 ZINC000176386494 565768556 /nfs/dbraw/zinc/76/85/56/565768556.db2.gz ASYNEXWIURBYOS-UHFFFAOYSA-N 0 1 375.226 3.374 10 0 GGAEMN C[C@@H]1CN(C2CCN(C(=O)/C=C/c3ccc(Br)cc3)CC2)CCO1 ZINC000193669569 565769176 /nfs/dbraw/zinc/76/91/76/565769176.db2.gz KSPIMTQUVZMJHG-NFBGWVBBSA-N 0 1 393.325 3.174 10 0 GGAEMN COC(=O)[C@H]1CSCCN(Cc2cc(Br)cc3cccnc32)C1 ZINC000412076602 565769866 /nfs/dbraw/zinc/76/98/66/565769866.db2.gz NJTLWTJHPKTHBZ-CQSZACIVSA-N 0 1 395.322 3.335 10 0 GGAEMN CC(C)N(CC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)C[C@H]1CCC(=O)N1 ZINC000412095599 565770757 /nfs/dbraw/zinc/77/07/57/565770757.db2.gz YAJRBCOGUNDIIJ-GXTWGEPZSA-N 0 1 386.323 3.160 10 0 GGAEMN C[C@H]1CN(C(=O)CSc2n[nH]c(=S)s2)C[C@H](c2ccc(F)cc2)O1 ZINC000176441703 565772695 /nfs/dbraw/zinc/77/26/95/565772695.db2.gz QYWGVDWBCGSJTJ-JOYOIKCWSA-N 0 1 385.511 3.420 10 0 GGAEMN COc1cc(Cl)c(Cl)cc1C(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000176567395 565785213 /nfs/dbraw/zinc/78/52/13/565785213.db2.gz YFCCPPYHDCTOEK-GFCCVEGCSA-N 0 1 387.307 3.327 10 0 GGAEMN O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)c1cc(Br)cc2nc[nH]c21 ZINC000282611774 565787924 /nfs/dbraw/zinc/78/79/24/565787924.db2.gz XFCGUYQZZXICKI-BDJLRTHQSA-N 0 1 396.310 3.110 10 0 GGAEMN O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)c1cc(Br)cc2nc[nH]c21 ZINC000282611782 565788417 /nfs/dbraw/zinc/78/84/17/565788417.db2.gz XFCGUYQZZXICKI-BZNIZROVSA-N 0 1 396.310 3.110 10 0 GGAEMN O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)c1cc(Br)cc2nc[nH]c21 ZINC000282611799 565788661 /nfs/dbraw/zinc/78/86/61/565788661.db2.gz XFCGUYQZZXICKI-ZBEGNZNMSA-N 0 1 396.310 3.110 10 0 GGAEMN CCS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc3ccccc32)cc1 ZINC000176636860 565790192 /nfs/dbraw/zinc/79/01/92/565790192.db2.gz GYOBBBQXSGTPAX-UHFFFAOYSA-N 0 1 375.471 3.434 10 0 GGAEMN CS(=O)(=O)Nc1ccccc1NS(=O)(=O)c1cccc2ccccc21 ZINC000176638314 565790446 /nfs/dbraw/zinc/79/04/46/565790446.db2.gz OFGBIWLQSTUVCI-UHFFFAOYSA-N 0 1 376.459 3.012 10 0 GGAEMN CS(=O)(=O)Cc1ccccc1NS(=O)(=O)c1cccc2ccccc21 ZINC000176655636 565791998 /nfs/dbraw/zinc/79/19/98/565791998.db2.gz TVDSVKKSZWHUPF-UHFFFAOYSA-N 0 1 375.471 3.185 10 0 GGAEMN CCN1CCC[C@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1 ZINC000194150283 565797143 /nfs/dbraw/zinc/79/71/43/565797143.db2.gz FGESROSODDHAGQ-VIFPVBQESA-N 0 1 378.687 3.186 10 0 GGAEMN O[C@@H]1[C@@H](CNCc2c(F)ccc(Br)c2F)CCC12CCOCC2 ZINC000282841801 565798923 /nfs/dbraw/zinc/79/89/23/565798923.db2.gz OVRIDBNWWHGLDO-BDJLRTHQSA-N 0 1 390.268 3.385 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)N[C@H]1CCCc2cn[nH]c21 ZINC000282905749 565803190 /nfs/dbraw/zinc/80/31/90/565803190.db2.gz RPAUBOQJNNOYQL-KGLIPLIRSA-N 0 1 391.269 3.373 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2c(Cl)cccc2Br)CCN1C ZINC000282964011 565805498 /nfs/dbraw/zinc/80/54/98/565805498.db2.gz KSBOMDGOCRZBKC-WDEREUQCSA-N 0 1 395.750 3.206 10 0 GGAEMN COC(=O)CCSc1ncccc1NC(=O)c1ncsc1C(F)(F)F ZINC000283007295 565805964 /nfs/dbraw/zinc/80/59/64/565805964.db2.gz DHBJASHOQFBJHN-UHFFFAOYSA-N 0 1 391.396 3.464 10 0 GGAEMN O=C(NC[C@H](CCO)c1ccccc1)c1n[nH]c2ccc(Br)cc21 ZINC000176822815 565806337 /nfs/dbraw/zinc/80/63/37/565806337.db2.gz QUKOVEHFGQAPSK-ZDUSSCGKSA-N 0 1 388.265 3.221 10 0 GGAEMN O=C(NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)c1s[n-]c(=O)c1Cl ZINC000283138124 565811019 /nfs/dbraw/zinc/81/10/19/565811019.db2.gz RVFJIDLDTGRBEZ-AGUYFDCRSA-N 0 1 377.897 3.428 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1cc(CN(C)C)ccn1 ZINC000176898927 565812321 /nfs/dbraw/zinc/81/23/21/565812321.db2.gz ZLYBVQVSSJTWKM-UHFFFAOYSA-N 0 1 378.270 3.096 10 0 GGAEMN CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1s[n-]c(=O)c1Cl ZINC000283244483 565814294 /nfs/dbraw/zinc/81/42/94/565814294.db2.gz CHKARRZYLNKHJX-CQSZACIVSA-N 0 1 379.913 3.486 10 0 GGAEMN C[C@H](NC[C@@H]1CCC2(CCOCC2)[C@H]1O)c1ncc(Br)cc1F ZINC000283367244 565817414 /nfs/dbraw/zinc/81/74/14/565817414.db2.gz NSXJXZBUPWGRBW-MKBNYLNASA-N 0 1 387.293 3.202 10 0 GGAEMN C[C@H](NC[C@H]1CCC2(CCOCC2)[C@@H]1O)c1ncc(Br)cc1F ZINC000283367239 565817457 /nfs/dbraw/zinc/81/74/57/565817457.db2.gz NSXJXZBUPWGRBW-HWWQOWPSSA-N 0 1 387.293 3.202 10 0 GGAEMN O=C(N[C@@H]1CCS(=O)(=O)c2ccccc21)c1c(O)cc(Cl)cc1Cl ZINC000176999623 565822102 /nfs/dbraw/zinc/82/21/02/565822102.db2.gz NEBQIZJYBYMYCG-GFCCVEGCSA-N 0 1 386.256 3.348 10 0 GGAEMN Cc1nc([C@@H]2CN(C(=O)Nc3c(C)cc(Br)cc3C)CCO2)n[nH]1 ZINC000177024239 565824070 /nfs/dbraw/zinc/82/40/70/565824070.db2.gz HFGCFBCKFQGUFC-ZDUSSCGKSA-N 0 1 394.273 3.098 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)Nc3c(C)cc(Br)cc3C)CCO2)n[nH]1 ZINC000177024251 565824310 /nfs/dbraw/zinc/82/43/10/565824310.db2.gz HFGCFBCKFQGUFC-CYBMUJFWSA-N 0 1 394.273 3.098 10 0 GGAEMN CCn1c(C)nnc1CSc1nc(-c2ccccc2Br)n[nH]1 ZINC000194669519 565829928 /nfs/dbraw/zinc/82/99/28/565829928.db2.gz BYAJCGPIZLKMTH-UHFFFAOYSA-N 0 1 379.287 3.446 10 0 GGAEMN COc1ccc(CN(C)C[C@H](O)COc2cccc(Br)c2)cc1O ZINC000177226149 565837370 /nfs/dbraw/zinc/83/73/70/565837370.db2.gz VQGMQJKWHPLURP-HNNXBMFYSA-N 0 1 396.281 3.035 10 0 GGAEMN C[C@@]1(c2nc(-c3nc(-c4cccc(Br)c4)n[nH]3)no2)CCCO1 ZINC000284114180 565842218 /nfs/dbraw/zinc/84/22/18/565842218.db2.gz WYAHGRDXMDVDCG-HNNXBMFYSA-N 0 1 376.214 3.310 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@H](CO)NCc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000284127760 565843374 /nfs/dbraw/zinc/84/33/74/565843374.db2.gz UHRCVENFOFEYRE-ZBFHGGJFSA-N 0 1 396.329 3.087 10 0 GGAEMN C[C@@H](NC(=O)N1CCN(C2CCOCC2)CC1)c1cccc(Br)c1 ZINC000177349145 565844108 /nfs/dbraw/zinc/84/41/08/565844108.db2.gz BHPOWQVLRXADAX-CQSZACIVSA-N 0 1 396.329 3.016 10 0 GGAEMN Cc1nsc(N2CCC(N3CCN(c4cccc(Cl)c4)CC3)CC2)n1 ZINC000413335150 565846711 /nfs/dbraw/zinc/84/67/11/565846711.db2.gz XDWPJIUGEGUYHB-UHFFFAOYSA-N 0 1 377.945 3.291 10 0 GGAEMN C[C@@H](c1ccccc1Br)N(C)C(=O)NCCCCN1CCOCC1 ZINC000195061049 565856002 /nfs/dbraw/zinc/85/60/02/565856002.db2.gz UQMSEAGWIGFFSG-HNNXBMFYSA-N 0 1 398.345 3.264 10 0 GGAEMN O=C(N[C@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCCc2[nH]ncc21 ZINC000284522493 565857394 /nfs/dbraw/zinc/85/73/94/565857394.db2.gz BYNIRFDQBGSWEB-CJNGLKHVSA-N 0 1 375.270 3.255 10 0 GGAEMN O=C(CCc1ccoc1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000177639159 565864065 /nfs/dbraw/zinc/86/40/65/565864065.db2.gz RWIMIBVCDITHRH-UHFFFAOYSA-N 0 1 375.226 3.076 10 0 GGAEMN O=C(CCc1ccoc1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000177639159 565864071 /nfs/dbraw/zinc/86/40/71/565864071.db2.gz RWIMIBVCDITHRH-UHFFFAOYSA-N 0 1 375.226 3.076 10 0 GGAEMN CCCCOC[C@@H](O)CN[C@@H](C)c1cc2c(cc1Br)OCCO2 ZINC000195212549 565866545 /nfs/dbraw/zinc/86/65/45/565866545.db2.gz WVJQAFSYJSFRGV-STQMWFEESA-N 0 1 388.302 3.049 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3ccc(Br)c(F)c3)CC2)cn1 ZINC000177711816 565869097 /nfs/dbraw/zinc/86/90/97/565869097.db2.gz ZPPFIIHDNJCDPF-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN O=C(N[C@@H](CO)CN1CCCCC1)c1sc2ccccc2c1Br ZINC000413799586 565874952 /nfs/dbraw/zinc/87/49/52/565874952.db2.gz OMZKDFQCKNKFAC-GFCCVEGCSA-N 0 1 397.338 3.240 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCCc2ccc(F)c(Br)c2)n[nH]1 ZINC000177885525 565878988 /nfs/dbraw/zinc/87/89/88/565878988.db2.gz ONIKTJWEHWRFCL-JTQLQIEISA-N 0 1 383.265 3.093 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCc2cccc(Br)c2Cl)cn1 ZINC000413877014 565879352 /nfs/dbraw/zinc/87/93/52/565879352.db2.gz BVMOLIRWMPUBSI-UHFFFAOYSA-N 0 1 382.689 3.489 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000177945932 565882297 /nfs/dbraw/zinc/88/22/97/565882297.db2.gz HHJLKWMICYYAFK-GTNSWQLSSA-N 0 1 378.270 3.093 10 0 GGAEMN O=C([C@H]1CCc2[nH]nnc2C1)N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000285053006 565885733 /nfs/dbraw/zinc/88/57/33/565885733.db2.gz JNDJWPPOOFJZNT-MEDUHNTESA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@H]1CCc2nn[nH]c2C1)N1CCC[C@@H]1c1ccc(Br)c(F)c1 ZINC000285053006 565885738 /nfs/dbraw/zinc/88/57/38/565885738.db2.gz JNDJWPPOOFJZNT-MEDUHNTESA-N 0 1 393.260 3.175 10 0 GGAEMN C[C@H](C(=O)Nc1ccccc1Br)N1CCC(c2ccn[nH]2)CC1 ZINC000195505157 565889558 /nfs/dbraw/zinc/88/95/58/565889558.db2.gz CQTQVONLMHQQBW-GFCCVEGCSA-N 0 1 377.286 3.379 10 0 GGAEMN C[C@H](Cn1cc(Br)ccc1=O)NCc1cccc(OC(C)(C)C)n1 ZINC000414105176 565895596 /nfs/dbraw/zinc/89/55/96/565895596.db2.gz PAIFXEHOUNMNAO-CYBMUJFWSA-N 0 1 394.313 3.361 10 0 GGAEMN C[C@H](NC(=O)CN[C@](C)(CO)c1ccc(Br)cc1)c1cccs1 ZINC000285248170 565897316 /nfs/dbraw/zinc/89/73/16/565897316.db2.gz AILPTYNWWDYEIO-YVEFUNNKSA-N 0 1 397.338 3.185 10 0 GGAEMN C[C@@H](NCCOCC[NH+](C)C)c1ccc(Br)cc1Br ZINC000219324655 565902300 /nfs/dbraw/zinc/90/23/00/565902300.db2.gz BXDQKTGBHKGRAE-LLVKDONJSA-N 0 1 394.151 3.440 10 0 GGAEMN C[C@H](NCC(=O)Nc1ccccc1Br)c1ccc2c(c1)OCO2 ZINC000178167595 565903359 /nfs/dbraw/zinc/90/33/59/565903359.db2.gz REBSKAXPSOPJGM-NSHDSACASA-N 0 1 377.238 3.467 10 0 GGAEMN Cc1nc([C@@H](C)S(=O)(=O)c2nc3cccc(Br)c3s2)n[nH]1 ZINC000414217185 565904344 /nfs/dbraw/zinc/90/43/44/565904344.db2.gz BSKNOMHHBJYIEM-ZCFIWIBFSA-N 0 1 387.284 3.020 10 0 GGAEMN CCN(C)C(=O)CCN1CCC[C@@H]1c1ccc(I)cc1 ZINC000178206804 565905400 /nfs/dbraw/zinc/90/54/00/565905400.db2.gz BJIPSVVLHVESPK-OAHLLOKOSA-N 0 1 386.277 3.297 10 0 GGAEMN CC(=O)Nc1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000285430110 565906542 /nfs/dbraw/zinc/90/65/42/565906542.db2.gz HMDCVAHYLAFSHF-GOSISDBHSA-N 0 1 377.282 3.405 10 0 GGAEMN CC(=O)Nc1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000285430112 565907166 /nfs/dbraw/zinc/90/71/66/565907166.db2.gz HMDCVAHYLAFSHF-SFHVURJKSA-N 0 1 377.282 3.405 10 0 GGAEMN C[C@H](N[C@@H]1CCCC[C@H]1F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000414319317 565911216 /nfs/dbraw/zinc/91/12/16/565911216.db2.gz YWKARNFHFHYOEI-ZWKOPEQDSA-N 0 1 379.295 3.028 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@@H](Oc2cccnc2)C1 ZINC000178309611 565911889 /nfs/dbraw/zinc/91/18/89/565911889.db2.gz SFYPOXYIWFRQEH-CYBMUJFWSA-N 0 1 387.237 3.014 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](Oc2cccnc2)C1 ZINC000178309621 565912110 /nfs/dbraw/zinc/91/21/10/565912110.db2.gz SFYPOXYIWFRQEH-ZDUSSCGKSA-N 0 1 387.237 3.014 10 0 GGAEMN CN(Cc1ccc([S@@](C)=O)cc1)C[C@H](O)COCc1ccc(Cl)cc1 ZINC000178427234 565918880 /nfs/dbraw/zinc/91/88/80/565918880.db2.gz KAQJGFADGFVNBV-AVRWGWEMSA-N 0 1 381.925 3.087 10 0 GGAEMN CCC(C)(C)NC(=O)c1ccc(NS(=O)(=O)CC(C)(C)OC)cc1Cl ZINC000414387749 565920286 /nfs/dbraw/zinc/92/02/86/565920286.db2.gz ZPRBMLURLCVFET-UHFFFAOYSA-N 0 1 390.933 3.425 10 0 GGAEMN C[C@@](CO)(NCc1ccc(N2CCCC2)nc1)c1ccc(Br)cc1 ZINC000285669323 565920975 /nfs/dbraw/zinc/92/09/75/565920975.db2.gz ZPYXUMQOCSVUPH-IBGZPJMESA-N 0 1 390.325 3.442 10 0 GGAEMN C[C@](CO)(NCc1ccc(N2CCCC2)nc1)c1ccc(Br)cc1 ZINC000285669328 565921144 /nfs/dbraw/zinc/92/11/44/565921144.db2.gz ZPYXUMQOCSVUPH-LJQANCHMSA-N 0 1 390.325 3.442 10 0 GGAEMN CCN(C1CCN(Cc2ccc(C(F)(F)F)c(C)c2)CC1)S(C)(=O)=O ZINC000414390487 565922562 /nfs/dbraw/zinc/92/25/62/565922562.db2.gz XUUZDQBVEUZLFP-UHFFFAOYSA-N 0 1 378.460 3.260 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2N2CCOCC2)c(Cl)c1 ZINC000414394126 565923435 /nfs/dbraw/zinc/92/34/35/565923435.db2.gz JYRQZADHXHKNKT-UHFFFAOYSA-N 0 1 384.860 3.425 10 0 GGAEMN O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)c1n[nH]c2ccc(Br)cc21 ZINC000178541487 565925339 /nfs/dbraw/zinc/92/53/39/565925339.db2.gz JBQUBBQTOUJUBW-BDJLRTHQSA-N 0 1 396.310 3.110 10 0 GGAEMN O[C@@H](CNCc1ccc(Br)c(Br)c1)C(F)(F)F ZINC000229585117 565925487 /nfs/dbraw/zinc/92/54/87/565925487.db2.gz VFGXMOFQPZEJBW-VIFPVBQESA-N 0 1 376.998 3.224 10 0 GGAEMN O=C(Cc1c[nH]c2cc(Br)ccc12)N1CCN2CCCC[C@H]2C1 ZINC000178602414 565927834 /nfs/dbraw/zinc/92/78/34/565927834.db2.gz WRSYVAOUMROOSL-HNNXBMFYSA-N 0 1 376.298 3.170 10 0 GGAEMN CN(C(=O)c1[nH]nc2ccc(Br)cc21)[C@H]1CCCc2c1cnn2C ZINC000178657904 565931359 /nfs/dbraw/zinc/93/13/59/565931359.db2.gz IBXOBLDECYHVKT-AWEZNQCLSA-N 0 1 388.269 3.209 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)c2ccc(OC(C)C)c(C)c2)c1Br ZINC000414467788 565939156 /nfs/dbraw/zinc/93/91/56/565939156.db2.gz DTHXRDOIYTWLOW-UHFFFAOYSA-N 0 1 388.287 3.377 10 0 GGAEMN CN(C)C(=O)C1(NCc2ccc(OC(F)(F)F)c(Br)c2)CC1 ZINC000414491166 565941545 /nfs/dbraw/zinc/94/15/45/565941545.db2.gz XDLNVJYMABWZOE-UHFFFAOYSA-N 0 1 381.192 3.058 10 0 GGAEMN COC(=O)[C@H]1CSCCN(Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC000414583372 565950906 /nfs/dbraw/zinc/95/09/06/565950906.db2.gz LXUQUHAEGSBFRF-GFCCVEGCSA-N 0 1 381.391 3.105 10 0 GGAEMN Cc1nc([C@@H](C)NC(=O)Cn2c(C)c(Br)c3ccccc32)n[nH]1 ZINC000286317118 565954089 /nfs/dbraw/zinc/95/40/89/565954089.db2.gz JLADNBFZKHGJCM-SECBINFHSA-N 0 1 376.258 3.016 10 0 GGAEMN COCCNCC(=O)Nc1ccc(OCc2ccccc2)c(Br)c1 ZINC000237249650 565955675 /nfs/dbraw/zinc/95/56/75/565955675.db2.gz LSWOPYDPXIMXMX-UHFFFAOYSA-N 0 1 393.281 3.203 10 0 GGAEMN CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3CN2Cc1nnc(-c2ccccc2Br)o1 ZINC000286376846 565956212 /nfs/dbraw/zinc/95/62/12/565956212.db2.gz GMFWVTHBOGRLGY-WQZURDFPSA-N 0 1 390.281 3.354 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)c2c[nH]c3cccc(Br)c23)C1 ZINC000179264971 565969455 /nfs/dbraw/zinc/96/94/55/565969455.db2.gz SBEZUENWSOECFS-ZDUSSCGKSA-N 0 1 394.313 3.017 10 0 GGAEMN C[N@@H+]1CC[C@@H](NC(=O)c2ccc(Br)c([O-])c2)[C@@H]1c1ccccc1 ZINC000179338750 565973619 /nfs/dbraw/zinc/97/36/19/565973619.db2.gz KDYYLYQZTSXTMI-WBVHZDCISA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)c([O-])c2)[C@@H]1c1ccccc1 ZINC000179338750 565973624 /nfs/dbraw/zinc/97/36/24/565973624.db2.gz KDYYLYQZTSXTMI-WBVHZDCISA-N 0 1 375.266 3.330 10 0 GGAEMN CCCC(=O)N[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000245199350 565987149 /nfs/dbraw/zinc/98/71/49/565987149.db2.gz CGQHNXFEXQSOLV-LSDHHAIUSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000245199350 565987151 /nfs/dbraw/zinc/98/71/51/565987151.db2.gz CGQHNXFEXQSOLV-LSDHHAIUSA-N 0 1 389.323 3.114 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000363138283 565992740 /nfs/dbraw/zinc/99/27/40/565992740.db2.gz SAGAZVDGEDXKTG-SNVBAGLBSA-N 0 1 381.504 3.011 10 0 GGAEMN Cc1nc(CN2CCCN(C[C@H](C)c3cccc(Br)c3)CC2)no1 ZINC000245501217 565993324 /nfs/dbraw/zinc/99/33/24/565993324.db2.gz CAOPJQCJXSZEKF-AWEZNQCLSA-N 0 1 393.329 3.452 10 0 GGAEMN O=S(=O)(c1ccc(Cl)cc1C(F)(F)F)N1CCCC[C@H]1c1nnc[nH]1 ZINC000179678820 565999698 /nfs/dbraw/zinc/99/96/98/565999698.db2.gz KPKLRMGYWAXREK-NSHDSACASA-N 0 1 394.806 3.393 10 0 GGAEMN O=S(=O)(c1c(Cl)cccc1C(F)(F)F)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000179680734 566000498 /nfs/dbraw/zinc/00/04/98/566000498.db2.gz VQPOBZSPGGVDHK-LLVKDONJSA-N 0 1 394.806 3.393 10 0 GGAEMN Cc1nnc(NC(=O)NC[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)s1 ZINC000245654202 566000590 /nfs/dbraw/zinc/00/05/90/566000590.db2.gz DCOKDLDYLREPNU-FZMZJTMJSA-N 0 1 383.880 3.454 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2ccc(F)c(Cl)c2)[C@H]1c1ccccc1 ZINC000245679118 566001671 /nfs/dbraw/zinc/00/16/71/566001671.db2.gz URGDFFSEGCLVJQ-ZWKOTPCHSA-N 0 1 382.888 3.344 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2ccc(F)c(Cl)c2)[C@H]1c1ccccc1 ZINC000245679114 566001996 /nfs/dbraw/zinc/00/19/96/566001996.db2.gz URGDFFSEGCLVJQ-QZTJIDSGSA-N 0 1 382.888 3.344 10 0 GGAEMN CCC[C@H](C(=O)Nc1nccn1Cc1ccc(Br)cc1)N(C)C ZINC000179784968 566007617 /nfs/dbraw/zinc/00/76/17/566007617.db2.gz AUBHTVDQRAFFAI-OAHLLOKOSA-N 0 1 379.302 3.363 10 0 GGAEMN CCOC(=O)c1c[nH]c(NC(=O)C2(c3ccccc3Br)CC2)n1 ZINC000415636292 566011211 /nfs/dbraw/zinc/01/12/11/566011211.db2.gz FLKOTCHRRLIGRZ-UHFFFAOYSA-N 0 1 378.226 3.019 10 0 GGAEMN O[C@]12CCCC[C@@H]1CN(Cc1cc(Br)c3c(c1)OCCO3)CC2 ZINC000179839571 566011848 /nfs/dbraw/zinc/01/18/48/566011848.db2.gz IRVVNVSYQSBMRS-KDOFPFPSSA-N 0 1 382.298 3.347 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1cccc(Br)c1 ZINC000245982204 566013410 /nfs/dbraw/zinc/01/34/10/566013410.db2.gz GWJUJLZYLAFGKL-XKQJLSEDSA-N 0 1 381.314 3.270 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2cccc(F)c2F)[C@H]1c1cccs1 ZINC000246051107 566014220 /nfs/dbraw/zinc/01/42/20/566014220.db2.gz CGLGDUZXMGOFNH-SJCJKPOMSA-N 0 1 386.489 3.388 10 0 GGAEMN COc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)cc1 ZINC000246058098 566015244 /nfs/dbraw/zinc/01/52/44/566015244.db2.gz DCHVOPQXYLWAPM-KSSFIOAISA-N 0 1 380.535 3.118 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2ccc(F)cc2F)[C@H]1c1cccs1 ZINC000246105273 566017744 /nfs/dbraw/zinc/01/77/44/566017744.db2.gz HTNOZOYCNAGHBA-SJCJKPOMSA-N 0 1 386.489 3.388 10 0 GGAEMN CO[C@@H](C)c1nc(CN2CC[C@H](C)[C@H](NC(=O)C(F)(F)F)[C@@H]2C)cs1 ZINC000287446022 566019285 /nfs/dbraw/zinc/01/92/85/566019285.db2.gz QKAVRWPYVPRTPG-ZPFDUUQYSA-N 0 1 379.448 3.128 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)CCCc2cc(Cl)sc2Cl)C[C@@H]1C ZINC000246230913 566023000 /nfs/dbraw/zinc/02/30/00/566023000.db2.gz XMAFGBWJJPYREM-RYUDHWBXSA-N 0 1 379.353 3.291 10 0 GGAEMN Cc1ccc(NC(=O)[C@H](C)N2CC[N@H+]3CCCC[C@H]3C2)c(Br)c1 ZINC000246262939 566024440 /nfs/dbraw/zinc/02/44/40/566024440.db2.gz YUDYCWNXCVQZRN-GJZGRUSLSA-N 0 1 380.330 3.255 10 0 GGAEMN Cc1ccc(NC(=O)[C@H](C)N2CCN3CCCC[C@H]3C2)c(Br)c1 ZINC000246262939 566024441 /nfs/dbraw/zinc/02/44/41/566024441.db2.gz YUDYCWNXCVQZRN-GJZGRUSLSA-N 0 1 380.330 3.255 10 0 GGAEMN Fc1cc(Br)cc(OCCN[C@@H](c2nnc[nH]2)c2ccccc2)c1 ZINC000363883640 566025739 /nfs/dbraw/zinc/02/57/39/566025739.db2.gz QCAWBLYKOCFCKQ-MRXNPFEDSA-N 0 1 391.244 3.464 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)CN1CCCC[C@H]1c1cn[nH]c1 ZINC000246299158 566025735 /nfs/dbraw/zinc/02/57/35/566025735.db2.gz BTWUTYRHWTZJTR-RDJZCZTQSA-N 0 1 380.286 3.139 10 0 GGAEMN C[C@@H](NCc1cc(F)cc(Br)c1)c1ccc(S(N)(=O)=O)cc1 ZINC000180037513 566027110 /nfs/dbraw/zinc/02/71/10/566027110.db2.gz BUUMVZMVHIHYNV-SNVBAGLBSA-N 0 1 387.274 3.086 10 0 GGAEMN CCCOc1ccc(Br)cc1CN1CCO[C@@H](c2n[nH]c(C)n2)C1 ZINC000180106868 566032537 /nfs/dbraw/zinc/03/25/37/566032537.db2.gz GPPNSNZAIQOAKT-MRXNPFEDSA-N 0 1 395.301 3.238 10 0 GGAEMN CC(C)c1n[nH]c(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)c1Br ZINC000180153550 566037651 /nfs/dbraw/zinc/03/76/51/566037651.db2.gz YHNHBAMUUQKCSO-CXAGYDPISA-N 0 1 391.313 3.471 10 0 GGAEMN O[C@H](COC[C@H]1CCCO1)CN(Cc1csc(Br)c1)C1CC1 ZINC000246728373 566038668 /nfs/dbraw/zinc/03/86/68/566038668.db2.gz OMUZSKNMLCCJLF-LSDHHAIUSA-N 0 1 390.343 3.032 10 0 GGAEMN C[C@H](CNC(=O)c1ncsc1Br)N1CCc2ccccc2C1 ZINC000287823576 566043098 /nfs/dbraw/zinc/04/30/98/566043098.db2.gz AHZFGVAQRRFRRJ-LLVKDONJSA-N 0 1 380.311 3.082 10 0 GGAEMN COc1ccc(Br)cc1CNC(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000364311506 566043489 /nfs/dbraw/zinc/04/34/89/566043489.db2.gz WTQXSYZOMBBBMS-UHFFFAOYSA-N 0 1 393.285 3.270 10 0 GGAEMN C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000246849736 566044386 /nfs/dbraw/zinc/04/43/86/566044386.db2.gz VNZIUCZQZKPEGN-JQWIXIFHSA-N 0 1 382.835 3.216 10 0 GGAEMN Cc1cnn([C@@H]2CCC[N@@H+](C[C@@H](O)COc3cccc(Br)c3)C2)c1 ZINC000246946229 566047141 /nfs/dbraw/zinc/04/71/41/566047141.db2.gz BEOQJFBOKBVMGO-IAGOWNOFSA-N 0 1 394.313 3.031 10 0 GGAEMN CC[C@H]1CN(C(=O)CCCc2ccccc2Br)CCN1C[C@H](C)O ZINC000246957027 566047235 /nfs/dbraw/zinc/04/72/35/566047235.db2.gz IQCYOADFJLSANE-RDJZCZTQSA-N 0 1 397.357 3.075 10 0 GGAEMN CC[C@@H]1CN(C(=O)CCCc2ccccc2Br)CCN1C[C@H](C)O ZINC000246956989 566047366 /nfs/dbraw/zinc/04/73/66/566047366.db2.gz IQCYOADFJLSANE-DOTOQJQBSA-N 0 1 397.357 3.075 10 0 GGAEMN C[N@H+](Cc1ccc([S@@](C)=O)cc1)C[C@@H](O)COCc1ccc(Cl)cc1 ZINC000246987028 566048408 /nfs/dbraw/zinc/04/84/08/566048408.db2.gz KAQJGFADGFVNBV-IQGLISFBSA-N 0 1 381.925 3.087 10 0 GGAEMN CN(Cc1ccc([S@@](C)=O)cc1)C[C@@H](O)COCc1ccc(Cl)cc1 ZINC000246987028 566048410 /nfs/dbraw/zinc/04/84/10/566048410.db2.gz KAQJGFADGFVNBV-IQGLISFBSA-N 0 1 381.925 3.087 10 0 GGAEMN C[N@H+](Cc1ccc([S@](C)=O)cc1)C[C@@H](O)COCc1ccc(Cl)cc1 ZINC000246987012 566049212 /nfs/dbraw/zinc/04/92/12/566049212.db2.gz KAQJGFADGFVNBV-CJAUYULYSA-N 0 1 381.925 3.087 10 0 GGAEMN CN(Cc1ccc([S@](C)=O)cc1)C[C@@H](O)COCc1ccc(Cl)cc1 ZINC000246987012 566049216 /nfs/dbraw/zinc/04/92/16/566049216.db2.gz KAQJGFADGFVNBV-CJAUYULYSA-N 0 1 381.925 3.087 10 0 GGAEMN C[C@H]1CN(C(=O)CCCc2cc(Cl)sc2Cl)[C@@H](C)CN1CCO ZINC000416285057 566051123 /nfs/dbraw/zinc/05/11/23/566051123.db2.gz BLVJEDHDLUQGOY-RYUDHWBXSA-N 0 1 379.353 3.291 10 0 GGAEMN C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000247054244 566051327 /nfs/dbraw/zinc/05/13/27/566051327.db2.gz HBDLBULIPSKRTD-PWSUYJOCSA-N 0 1 382.835 3.216 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N1CCN2CCCC[C@H]2C1 ZINC000247076839 566051590 /nfs/dbraw/zinc/05/15/90/566051590.db2.gz OOVCGKYWXVKFLX-HIFRSBDPSA-N 0 1 383.305 3.464 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc(Br)c2)CCN1CCOC ZINC000247094752 566051825 /nfs/dbraw/zinc/05/18/25/566051825.db2.gz MGBFKFHHFBUZAU-SQNIBIBYSA-N 0 1 395.341 3.122 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)[C@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000247170371 566054953 /nfs/dbraw/zinc/05/49/53/566054953.db2.gz ASAMCMNOFZEGIC-CZUORRHYSA-N 0 1 381.314 3.259 10 0 GGAEMN CCN1CCC[C@H](NC(=O)[C@H](C)CC(=O)c2cccc(Br)c2)C1 ZINC000247170346 566055401 /nfs/dbraw/zinc/05/54/01/566055401.db2.gz ASAMCMNOFZEGIC-CJNGLKHVSA-N 0 1 381.314 3.259 10 0 GGAEMN COc1cc(S(=O)(=O)N(CCN(C)C)Cc2ccc(C)o2)ccc1Cl ZINC000416377412 566059587 /nfs/dbraw/zinc/05/95/87/566059587.db2.gz ZXJJQCFIJYNMTK-UHFFFAOYSA-N 0 1 386.901 3.003 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3c(F)cccc3Br)CC2)cn1 ZINC000180479342 566066221 /nfs/dbraw/zinc/06/62/21/566066221.db2.gz JSYVSHQIBDTBDV-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN O=C(NCc1cccc(Br)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000364735050 566066953 /nfs/dbraw/zinc/06/69/53/566066953.db2.gz SKSGRGFYOVDWTB-HNNXBMFYSA-N 0 1 386.253 3.156 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)[N-]c3ccc(Cl)c(C[NH+](C)C)c3)cn21 ZINC000416422488 566067095 /nfs/dbraw/zinc/06/70/95/566067095.db2.gz MCNJBPORPARMBV-GFCCVEGCSA-N 0 1 382.917 3.296 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)[N-]c3ccc(C[NH+](C)C)c(Cl)c3)cn21 ZINC000416422777 566067245 /nfs/dbraw/zinc/06/72/45/566067245.db2.gz OPJAVHJSIWHTCT-GFCCVEGCSA-N 0 1 382.917 3.296 10 0 GGAEMN CCN(CC)CC(=O)Nc1cccc(NCc2c(Br)cnn2C)c1 ZINC000288342097 566069812 /nfs/dbraw/zinc/06/98/12/566069812.db2.gz BNILFIDXTAYQCZ-UHFFFAOYSA-N 0 1 394.317 3.075 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc2c(cc(Br)cc2F)[nH]1 ZINC000364814177 566070657 /nfs/dbraw/zinc/07/06/57/566070657.db2.gz OGFCPAGPELOFLW-SECBINFHSA-N 0 1 377.217 3.080 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@]2(O)CCCC[C@H]2C1 ZINC000248064144 566071508 /nfs/dbraw/zinc/07/15/08/566071508.db2.gz ZEDPLJCYNNPSJG-QFBILLFUSA-N 0 1 395.341 3.035 10 0 GGAEMN O[C@]12CCCC[C@H]1CN(Cc1cc3c(cc1Br)OCCO3)CC2 ZINC000248065427 566072347 /nfs/dbraw/zinc/07/23/47/566072347.db2.gz ZKEHRKSXEAXPPJ-KSSFIOAISA-N 0 1 382.298 3.347 10 0 GGAEMN CC[C@@H](C)N[C@H](CNS(=O)(=O)c1ccc(Cl)c(OC)c1)c1ccco1 ZINC000416481606 566073780 /nfs/dbraw/zinc/07/37/80/566073780.db2.gz VORKTZMMXJNUCQ-IUODEOHRSA-N 0 1 386.901 3.349 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cccc(Br)c2Cl)CCN1C[C@H](C)O ZINC000248414681 566077126 /nfs/dbraw/zinc/07/71/26/566077126.db2.gz NBONBDPONREMBL-RYUDHWBXSA-N 0 1 389.721 3.020 10 0 GGAEMN CCn1cnnc1[C@H]1CCCN(C[C@@H](O)c2ccc(F)c(Br)c2)C1 ZINC000248423726 566077174 /nfs/dbraw/zinc/07/71/74/566077174.db2.gz GTCRAKPMIDTYOW-XJKSGUPXSA-N 0 1 397.292 3.113 10 0 GGAEMN O=C(c1s[n-]c(=O)c1Cl)N1CC[C@@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000288530973 566077821 /nfs/dbraw/zinc/07/78/21/566077821.db2.gz UPJPOTZOJJHIRT-GOSISDBHSA-N 0 1 377.897 3.240 10 0 GGAEMN CCc1nc2n(n1)C[C@@H](N[C@H]1CCc3c1c(Br)ccc3F)CC2 ZINC000180621854 566078246 /nfs/dbraw/zinc/07/82/46/566078246.db2.gz QKUNKMDRXDNEOB-HZMBPMFUSA-N 0 1 379.277 3.334 10 0 GGAEMN CCc1nc2n(n1)C[C@H](N[C@@H]1CCc3c1c(Br)ccc3F)CC2 ZINC000180621803 566078281 /nfs/dbraw/zinc/07/82/81/566078281.db2.gz QKUNKMDRXDNEOB-QMTHXVAHSA-N 0 1 379.277 3.334 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCC(=O)Nc1ccc(Br)cc1 ZINC000248560296 566080966 /nfs/dbraw/zinc/08/09/66/566080966.db2.gz NBHQJGDXEAXLOP-KCXAZCMYSA-N 0 1 395.297 3.495 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C[C@H](C)O ZINC000248592050 566082850 /nfs/dbraw/zinc/08/28/50/566082850.db2.gz ZDZDKZRIQAATIF-WCQYABFASA-N 0 1 378.822 3.276 10 0 GGAEMN CC(C)n1ncc2c1C[C@@H](NCc1c(Cl)cccc1S(C)(=O)=O)CC2 ZINC000365143619 566085367 /nfs/dbraw/zinc/08/53/67/566085367.db2.gz VXGOHALHHAJLMO-AWEZNQCLSA-N 0 1 381.929 3.168 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(F)c(Cl)c1 ZINC000180736092 566085575 /nfs/dbraw/zinc/08/55/75/566085575.db2.gz ZXCPRLJPNIPHQQ-LLVKDONJSA-N 0 1 384.860 3.172 10 0 GGAEMN C[C@@H](NC(=O)NCCCN1C[C@@H](C)O[C@H](C)C1)c1cccc(Br)c1 ZINC000248877993 566091106 /nfs/dbraw/zinc/09/11/06/566091106.db2.gz OIUDCXTYNLGYMK-RBSFLKMASA-N 0 1 398.345 3.309 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)CCc2cccs2)[C@H]1c1cccs1 ZINC000248891779 566092258 /nfs/dbraw/zinc/09/22/58/566092258.db2.gz WKKQUTNFGSPHNK-YOEHRIQHSA-N 0 1 384.592 3.355 10 0 GGAEMN COc1ccc([C@H](C)NCC(=O)Nc2ccc(Br)cn2)cc1OC ZINC000180846834 566094077 /nfs/dbraw/zinc/09/40/77/566094077.db2.gz AAXRNLFXGBQMDJ-NSHDSACASA-N 0 1 394.269 3.151 10 0 GGAEMN CCS(=O)(=O)CCCCCN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000248975819 566094276 /nfs/dbraw/zinc/09/42/76/566094276.db2.gz DNPHZMMIBBUKJJ-IAGOWNOFSA-N 0 1 394.364 3.488 10 0 GGAEMN O[C@@H](CN1CCC[C@H](c2nncn2C2CC2)C1)c1ccccc1Br ZINC000180871513 566095534 /nfs/dbraw/zinc/09/55/34/566095534.db2.gz BMDQYOQWMWXIAO-GUYCJALGSA-N 0 1 391.313 3.289 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1cccc(-c2nnc[nH]2)c1 ZINC000365501679 566104987 /nfs/dbraw/zinc/10/49/87/566104987.db2.gz JRGQUXOVNKMURU-UHFFFAOYSA-N 0 1 387.237 3.424 10 0 GGAEMN C[C@@H]1CN(CCO)[C@@H](C)CN1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000416736907 566105437 /nfs/dbraw/zinc/10/54/37/566105437.db2.gz PWIKRSQJGMCKDL-WDEREUQCSA-N 0 1 379.810 3.278 10 0 GGAEMN CCc1nn(C)c(CC)c1CN[C@@](C)(CO)c1ccc(Br)cc1 ZINC000289178982 566110533 /nfs/dbraw/zinc/11/05/33/566110533.db2.gz ADGJSFUOMFXKRF-SFHVURJKSA-N 0 1 380.330 3.305 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)Nc3ccc(OC(F)F)cc3F)cn21 ZINC000416949644 566114352 /nfs/dbraw/zinc/11/43/52/566114352.db2.gz DHEJWTCWHRGIST-SECBINFHSA-N 0 1 375.372 3.322 10 0 GGAEMN C[C@H]1CCCc2nc(S(=O)(=O)Nc3ccc(Br)cc3F)cn21 ZINC000416940727 566114399 /nfs/dbraw/zinc/11/43/99/566114399.db2.gz GPRDGAQZAPGKKK-VIFPVBQESA-N 0 1 388.262 3.483 10 0 GGAEMN CCOc1c(Cl)cc(NC(=O)N2C[C@H](C)N(CCO)C[C@H]2C)cc1Cl ZINC000416995658 566118011 /nfs/dbraw/zinc/11/80/11/566118011.db2.gz LQGCBMYWCCXXJZ-NWDGAFQWSA-N 0 1 390.311 3.311 10 0 GGAEMN CC[N@H+]1CCC[C@@H](NC(=O)N2CCO[C@@H](c3ccc(Br)cc3)C2)C1 ZINC000253358396 566118318 /nfs/dbraw/zinc/11/83/18/566118318.db2.gz ORCSKBHTXUBZPH-IAGOWNOFSA-N 0 1 396.329 3.016 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000253359155 566118866 /nfs/dbraw/zinc/11/88/66/566118866.db2.gz GHUHREAHBONCCM-ZBFHGGJFSA-N 0 1 389.323 3.066 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000253359155 566118873 /nfs/dbraw/zinc/11/88/73/566118873.db2.gz GHUHREAHBONCCM-ZBFHGGJFSA-N 0 1 389.323 3.066 10 0 GGAEMN Cc1nc(C(F)(F)F)c(C[N@H+]2CCC[C@H](C[N-]C(=O)C(F)(F)F)C2)s1 ZINC000289414394 566120930 /nfs/dbraw/zinc/12/09/30/566120930.db2.gz HGDNQRIBVOQYON-SECBINFHSA-N 0 1 389.365 3.361 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)cc1OC ZINC000181208344 566125198 /nfs/dbraw/zinc/12/51/98/566125198.db2.gz ZOIYCRKMODQHRU-UHFFFAOYSA-N 0 1 376.356 3.309 10 0 GGAEMN O=C1OCC[C@@H]1CCN1CCC[C@H]1c1ccccc1I ZINC000365919034 566125827 /nfs/dbraw/zinc/12/58/27/566125827.db2.gz JDQPQTOXICAPGA-WFASDCNBSA-N 0 1 385.245 3.381 10 0 GGAEMN O=C1OCC[C@@H]1CCN1CCC[C@@H]1c1ccccc1I ZINC000365919033 566126779 /nfs/dbraw/zinc/12/67/79/566126779.db2.gz JDQPQTOXICAPGA-SWLSCSKDSA-N 0 1 385.245 3.381 10 0 GGAEMN CCCN(CCc1ccccn1)C(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261691632 566129053 /nfs/dbraw/zinc/12/90/53/566129053.db2.gz DZFLLERWXXTNSJ-IBGZPJMESA-N 0 1 390.325 3.499 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1ccc(Br)cc1 ZINC000261718311 566130878 /nfs/dbraw/zinc/13/08/78/566130878.db2.gz LTRWAYPJCACANA-GLQYFDAESA-N 0 1 381.270 3.105 10 0 GGAEMN Cc1ccc(NC(=O)C[N@@H+]2[C@@H]3CCCC[C@@H]3C[C@H]2C(=O)[O-])c(Br)c1 ZINC000261751604 566131975 /nfs/dbraw/zinc/13/19/75/566131975.db2.gz UWAFPJDWEDZSSU-WQVCFCJDSA-N 0 1 395.297 3.414 10 0 GGAEMN O=C(CCCOc1ccccc1Br)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181364183 566135774 /nfs/dbraw/zinc/13/57/74/566135774.db2.gz XLNPXZKTIVCRLK-AWEZNQCLSA-N 0 1 393.285 3.480 10 0 GGAEMN CCOc1ccc(CNC(=O)[C@](C)(N)c2ccc(Br)cc2)cc1F ZINC000261862452 566137299 /nfs/dbraw/zinc/13/72/99/566137299.db2.gz WZQLCMABAGPLSB-GOSISDBHSA-N 0 1 395.272 3.477 10 0 GGAEMN O=C(NCCOc1ncc(Cl)cc1Cl)N1CCC(c2cnc[nH]2)CC1 ZINC000366149402 566138016 /nfs/dbraw/zinc/13/80/16/566138016.db2.gz XJEUYXPHLOUHQW-UHFFFAOYSA-N 0 1 384.267 3.080 10 0 GGAEMN Cc1cc2ncc([C@H](C)N[C@@H](CO)c3cccc(Br)c3)c(C)n2n1 ZINC000181400656 566138450 /nfs/dbraw/zinc/13/84/50/566138450.db2.gz WABFKKASJFCRCW-SJCJKPOMSA-N 0 1 389.297 3.493 10 0 GGAEMN O=C(Cc1c[nH]c2cccc(Br)c12)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181395440 566138494 /nfs/dbraw/zinc/13/84/94/566138494.db2.gz ANKOPVDOCKZYHP-AWEZNQCLSA-N 0 1 388.269 3.345 10 0 GGAEMN O=C(Cc1c[nH]c2cccc(Br)c12)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181395422 566138546 /nfs/dbraw/zinc/13/85/46/566138546.db2.gz ANKOPVDOCKZYHP-CQSZACIVSA-N 0 1 388.269 3.345 10 0 GGAEMN Cc1nc([C@H]2CCCOC2)sc1C(=O)NC[C@@H](c1cccs1)N(C)C ZINC000366278852 566145156 /nfs/dbraw/zinc/14/51/56/566145156.db2.gz JQAAFYUKSFPDOQ-KBPBESRZSA-N 0 1 379.551 3.440 10 0 GGAEMN O=S(=O)(NC1(c2noc(C(F)F)n2)CCC1)c1c(Cl)ccc(F)c1F ZINC000366296683 566145679 /nfs/dbraw/zinc/14/56/79/566145679.db2.gz ORDMHTNSBLDMHT-UHFFFAOYSA-N 0 1 399.753 3.297 10 0 GGAEMN C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)nc1 ZINC000289953980 566149916 /nfs/dbraw/zinc/14/99/16/566149916.db2.gz WQGADJJXLDLLCI-CJNGLKHVSA-N 0 1 376.298 3.194 10 0 GGAEMN COC[C@H](NCC(=O)N(C)Cc1ccccc1Br)c1ccccc1 ZINC000181697306 566159142 /nfs/dbraw/zinc/15/91/42/566159142.db2.gz HMISKEZECLMPJI-SFHVURJKSA-N 0 1 391.309 3.385 10 0 GGAEMN O=C(Nc1nc(-c2ccncc2)n[nH]1)c1c[nH]c2cccc(Br)c12 ZINC000366588179 566159390 /nfs/dbraw/zinc/15/93/90/566159390.db2.gz VZZVMZLDPLKRON-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN C[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@]2(CCCOC2)O1 ZINC000366598657 566161072 /nfs/dbraw/zinc/16/10/72/566161072.db2.gz VMEMHIPDJHIRSW-SJCJKPOMSA-N 0 1 380.286 3.095 10 0 GGAEMN CC(C)S(=O)(=O)CCN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000290257694 566164412 /nfs/dbraw/zinc/16/44/12/566164412.db2.gz KIHNXWPPPNGKEV-CQSZACIVSA-N 0 1 376.316 3.076 10 0 GGAEMN CC(C)S(=O)(=O)CCN[C@H]1CCCOc2ccc(Br)cc21 ZINC000290257693 566164532 /nfs/dbraw/zinc/16/45/32/566164532.db2.gz KIHNXWPPPNGKEV-AWEZNQCLSA-N 0 1 376.316 3.076 10 0 GGAEMN CCOC[C@H]([NH2+]Cc1cnc(-c2ccc(Br)cc2)s1)C(=O)[O-] ZINC000417601250 566166652 /nfs/dbraw/zinc/16/66/52/566166652.db2.gz HSRCGZGIAXKVAC-ZDUSSCGKSA-N 0 1 385.283 3.152 10 0 GGAEMN CCOC[C@@H]([NH2+]Cc1cnc(-c2ccc(Br)cc2)s1)C(=O)[O-] ZINC000417653808 566169912 /nfs/dbraw/zinc/16/99/12/566169912.db2.gz HSRCGZGIAXKVAC-CYBMUJFWSA-N 0 1 385.283 3.152 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1CCC(=O)Nc1ccccc1Br ZINC000263038408 566170314 /nfs/dbraw/zinc/17/03/14/566170314.db2.gz CAACWKFHAWRTPR-KCXAZCMYSA-N 0 1 395.297 3.495 10 0 GGAEMN CC(C)NS(=O)(=O)CCN[C@H](C)c1cc2cc(Br)ccc2o1 ZINC000181925624 566173584 /nfs/dbraw/zinc/17/35/84/566173584.db2.gz NSBSWWVDGQFPHM-LLVKDONJSA-N 0 1 389.315 3.174 10 0 GGAEMN Fc1ccc(CN2CCC[C@H]3COCC[C@@H]32)c(I)c1 ZINC000417778739 566175873 /nfs/dbraw/zinc/17/58/73/566175873.db2.gz GENWLBXLYRBCHG-WFASDCNBSA-N 0 1 375.225 3.431 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417904583 566180812 /nfs/dbraw/zinc/18/08/12/566180812.db2.gz WBHXDCMCZXLCEC-FPMFFAJLSA-N 0 1 384.293 3.055 10 0 GGAEMN O[C@H](CNCc1ccc(F)cc1I)Cc1ccccc1 ZINC000417908017 566181530 /nfs/dbraw/zinc/18/15/30/566181530.db2.gz HVEDQFGGJSTHAM-HNNXBMFYSA-N 0 1 385.220 3.124 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CC(N[C@@H]2CCc3c2ccc(F)c3Br)C1 ZINC000263526930 566189254 /nfs/dbraw/zinc/18/92/54/566189254.db2.gz ULBKERHCADJIJV-QKFMDRJYSA-N 0 1 385.277 3.103 10 0 GGAEMN O=C([O-])C[N@@H+](CC1CC1)C1CC(Nc2noc3ccc(Br)cc32)C1 ZINC000263561090 566190075 /nfs/dbraw/zinc/19/00/75/566190075.db2.gz RNTGYHKDFJILTR-UHFFFAOYSA-N 0 1 394.269 3.330 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CC(Nc2nccc3cc(Br)ccc32)C1 ZINC000263563763 566190205 /nfs/dbraw/zinc/19/02/05/566190205.db2.gz UKXKETATLRAXMQ-UHFFFAOYSA-N 0 1 378.270 3.347 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CC(Nc2ccc(Br)c(C(F)(F)F)n2)C1 ZINC000263564478 566190667 /nfs/dbraw/zinc/19/06/67/566190667.db2.gz UYCXXWBCTQKWTE-UHFFFAOYSA-N 0 1 396.207 3.212 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@H]1CCCN(c2nnc(-c3ccccc3Cl)s2)CC1 ZINC000263550939 566190710 /nfs/dbraw/zinc/19/07/10/566190710.db2.gz KVQPXUJPGHVVST-LBPRGKRZSA-N 0 1 380.901 3.234 10 0 GGAEMN O=C(NCCc1c[nH]c2cccc(Br)c12)[C@@H]1CCCc2[nH]ncc21 ZINC000290837571 566191440 /nfs/dbraw/zinc/19/14/40/566191440.db2.gz HAEDJSLKDTYJQE-GFCCVEGCSA-N 0 1 387.281 3.432 10 0 GGAEMN COC(=O)c1cc(CN[C@H]2CCOc3c(Br)cccc32)cn1C ZINC000367317707 566195974 /nfs/dbraw/zinc/19/59/74/566195974.db2.gz MVTLOHPFWLIXKV-AWEZNQCLSA-N 0 1 379.254 3.188 10 0 GGAEMN Cc1cc(C[C@@H](C)NCc2c(Br)cncc2Br)[nH]n1 ZINC000290992033 566199536 /nfs/dbraw/zinc/19/95/36/566199536.db2.gz ZZTORVSZBCOYKB-MRVPVSSYSA-N 0 1 388.107 3.359 10 0 GGAEMN Cc1cc(C[C@@H](C)NCc2c(Br)cncc2Br)n[nH]1 ZINC000290992033 566199540 /nfs/dbraw/zinc/19/95/40/566199540.db2.gz ZZTORVSZBCOYKB-MRVPVSSYSA-N 0 1 388.107 3.359 10 0 GGAEMN O=C(NCc1noc2c1CCCC2)c1cc(Br)cc2nc[nH]c21 ZINC000291043154 566201734 /nfs/dbraw/zinc/20/17/34/566201734.db2.gz ZHFRWMDRNCETBX-UHFFFAOYSA-N 0 1 375.226 3.122 10 0 GGAEMN O=C(NC[C@H]1CCCN(C(=O)c2csc(Br)c2)C1)C(F)(F)F ZINC000291065615 566203751 /nfs/dbraw/zinc/20/37/51/566203751.db2.gz IFOWHXAYCIWIDP-MRVPVSSYSA-N 0 1 399.232 3.041 10 0 GGAEMN O=C(N[C@@H]1CCc2c1ccc(F)c2Br)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000418257019 566208342 /nfs/dbraw/zinc/20/83/42/566208342.db2.gz UGWVMVUXVDAUJV-JRPNMDOOSA-N 0 1 382.277 3.111 10 0 GGAEMN C[C@@H](NCC(=O)N1CC(=O)Nc2ccccc21)c1cccc(Br)c1 ZINC000182580818 566213714 /nfs/dbraw/zinc/21/37/14/566213714.db2.gz FLMOEZGUIZJXGY-GFCCVEGCSA-N 0 1 388.265 3.085 10 0 GGAEMN O=C(CCc1cc(F)ccc1Br)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000182584408 566213991 /nfs/dbraw/zinc/21/39/91/566213991.db2.gz FRDCZHYYXANLKM-CQSZACIVSA-N 0 1 381.249 3.393 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@@H](Cc2ccncc2)C1 ZINC000367818407 566218247 /nfs/dbraw/zinc/21/82/47/566218247.db2.gz HQMZSJFJELQBFT-ZDUSSCGKSA-N 0 1 385.265 3.425 10 0 GGAEMN CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CN1CCCC[C@H]1c1nnc[nH]1 ZINC000182726068 566221199 /nfs/dbraw/zinc/22/11/99/566221199.db2.gz IVCJOANWDZXLRT-HNNXBMFYSA-N 0 1 382.295 3.297 10 0 GGAEMN CCCn1nccc1NS(=O)(=O)c1cc(F)c(Br)cc1OC ZINC000182901085 566228729 /nfs/dbraw/zinc/22/87/29/566228729.db2.gz OJPUYHAIUUKXLV-UHFFFAOYSA-N 0 1 392.250 3.004 10 0 GGAEMN NC(=O)NC(=O)CN[C@@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 ZINC000182975884 566232491 /nfs/dbraw/zinc/23/24/91/566232491.db2.gz MAKXFTGXXBWTKE-HNNXBMFYSA-N 0 1 384.238 3.201 10 0 GGAEMN O=C(NCc1cc2cc(Br)ccc2[nH]1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000368206546 566233441 /nfs/dbraw/zinc/23/34/41/566233441.db2.gz SKRCERFTLSSMPS-GFCCVEGCSA-N 0 1 388.269 3.010 10 0 GGAEMN O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2nc3cc(Br)ccc3o2)CN1 ZINC000368505075 566240649 /nfs/dbraw/zinc/24/06/49/566240649.db2.gz UHHRCSIOCVUENL-RISCZKNCSA-N 0 1 378.270 3.081 10 0 GGAEMN COC(=O)c1cc(CN[C@H]2CCOc3ccc(Br)cc32)cn1C ZINC000368569168 566242199 /nfs/dbraw/zinc/24/21/99/566242199.db2.gz UVLBTMDGXKMREV-AWEZNQCLSA-N 0 1 379.254 3.188 10 0 GGAEMN CCc1nc([C@H]2CN(Cc3ccc(Cl)c(Br)c3)CCO2)n[nH]1 ZINC000183416128 566246721 /nfs/dbraw/zinc/24/67/21/566246721.db2.gz GTQQMQWIOJOBDW-CYBMUJFWSA-N 0 1 385.693 3.357 10 0 GGAEMN CN(C)c1ccncc1C(=O)N(C)CC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000183470201 566247765 /nfs/dbraw/zinc/24/77/65/566247765.db2.gz KILQXVVBQULSRQ-UHFFFAOYSA-N 0 1 381.263 3.165 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCO[C@H](c2ccccc2Br)C1 ZINC000183491481 566248052 /nfs/dbraw/zinc/24/80/52/566248052.db2.gz MJGFMUJXHVQLMB-KRWDZBQOSA-N 0 1 390.281 3.124 10 0 GGAEMN CCOC(=O)C[C@H](O)CN(Cc1cc(Br)ccc1F)C(C)C ZINC000599274515 566252145 /nfs/dbraw/zinc/25/21/45/566252145.db2.gz VLTFEMVZCQLCNN-AWEZNQCLSA-N 0 1 376.266 3.113 10 0 GGAEMN COc1ccc(OC)c(CNC(=O)c2n[nH]c3ccc(Br)cc32)c1 ZINC000599351824 566254280 /nfs/dbraw/zinc/25/42/80/566254280.db2.gz VNEYCLUGLKMYMX-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN CNC(=O)C[C@H](NCc1cnc2ccc(Br)cn12)c1ccccc1 ZINC000481819888 566255016 /nfs/dbraw/zinc/25/50/16/566255016.db2.gz RNYWIEKKFHIKBI-INIZCTEOSA-N 0 1 387.281 3.064 10 0 GGAEMN CNC(=O)C[C@H](NCc1cc(Br)c(O)c(OC)c1)c1ccccc1 ZINC000481826904 566255116 /nfs/dbraw/zinc/25/51/16/566255116.db2.gz WPPYKVDAIMTDDH-HNNXBMFYSA-N 0 1 393.281 3.130 10 0 GGAEMN CN(C)C(=O)c1ccc(NS(=O)(=O)Cc2ccc(Cl)c(Cl)c2)nc1 ZINC000481839711 566255375 /nfs/dbraw/zinc/25/53/75/566255375.db2.gz CXWGBQIMRBDAFK-UHFFFAOYSA-N 0 1 388.276 3.032 10 0 GGAEMN CNC(=O)C[C@H](NCc1cc(Br)c(OC)s1)c1ccccc1 ZINC000481840071 566255448 /nfs/dbraw/zinc/25/54/48/566255448.db2.gz USVWFZQVJAVBKF-AWEZNQCLSA-N 0 1 383.311 3.486 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2cccc(Br)c2[O-])[C@@H]1c1ccccc1 ZINC000534844956 566257354 /nfs/dbraw/zinc/25/73/54/566257354.db2.gz ROSYJFPJZQTSPC-CVEARBPZSA-N 0 1 375.266 3.330 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@H]2CC(=O)N(c3ccccc3Br)C2)n1 ZINC000575180058 566257483 /nfs/dbraw/zinc/25/74/83/566257483.db2.gz APBZZCMMWAFQSA-AAEUAGOBSA-N 0 1 393.285 3.399 10 0 GGAEMN COC(=O)c1cnc(CN2CCC(c3ccc(Br)cc3)CC2)cn1 ZINC000599399356 566262421 /nfs/dbraw/zinc/26/24/21/566262421.db2.gz QIIYOTPVULOFKN-UHFFFAOYSA-N 0 1 390.281 3.405 10 0 GGAEMN CNC(=O)c1ccc(NS(=O)(=O)c2cc(C)cc(C)c2OC)cc1Cl ZINC000509101723 566263299 /nfs/dbraw/zinc/26/32/99/566263299.db2.gz AQCGGMVYTJFWLF-UHFFFAOYSA-N 0 1 382.869 3.126 10 0 GGAEMN Cc1ccc2c([n-]cc(C(=O)N[C@H](C)c3ccc(Br)cn3)c2=O)[nH+]1 ZINC000481935406 566266608 /nfs/dbraw/zinc/26/66/08/566266608.db2.gz NSTZGNSTZFPVAO-SNVBAGLBSA-N 0 1 387.237 3.292 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N2C[C@H](O)C3(CC3)C2)C1=O ZINC000509142089 566266688 /nfs/dbraw/zinc/26/66/88/566266688.db2.gz UXFQFKZODIXORR-CVEARBPZSA-N 0 1 393.325 3.018 10 0 GGAEMN CCOC(=O)CC1(NCc2ccc(Br)c(F)c2F)CCOCC1 ZINC000599482804 566268911 /nfs/dbraw/zinc/26/89/11/566268911.db2.gz VWALNBXNIKJKMT-UHFFFAOYSA-N 0 1 392.240 3.319 10 0 GGAEMN O=C(NCCCc1ccc(Br)cc1F)[C@@H]1CCc2[nH]cnc2C1 ZINC000668838872 566271399 /nfs/dbraw/zinc/27/13/99/566271399.db2.gz WXBLXUAOIICKBQ-GFCCVEGCSA-N 0 1 380.261 3.165 10 0 GGAEMN C[C@@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(F)(F)F ZINC000625115330 566277866 /nfs/dbraw/zinc/27/78/66/566277866.db2.gz MKBMHUFTRYSYSD-QMMMGPOBSA-N 0 1 391.191 3.439 10 0 GGAEMN C[C@@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(F)(F)F ZINC000625115330 566277875 /nfs/dbraw/zinc/27/78/75/566277875.db2.gz MKBMHUFTRYSYSD-QMMMGPOBSA-N 0 1 391.191 3.439 10 0 GGAEMN COc1cc([C@H](C)NCc2n[nH]c(-c3ccc(Br)cc3)n2)ccn1 ZINC000556265122 566280545 /nfs/dbraw/zinc/28/05/45/566280545.db2.gz ZUHKARPYUTUCQW-NSHDSACASA-N 0 1 388.269 3.489 10 0 GGAEMN COc1cc([C@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)ccn1 ZINC000556265122 566280546 /nfs/dbraw/zinc/28/05/46/566280546.db2.gz ZUHKARPYUTUCQW-NSHDSACASA-N 0 1 388.269 3.489 10 0 GGAEMN CCOc1ccc(Br)cc1CN(C[C@@H](O)CC1(O)CCC1)C1CC1 ZINC000625136321 566281998 /nfs/dbraw/zinc/28/19/98/566281998.db2.gz KBZAKZFGKRPPKO-KRWDZBQOSA-N 0 1 398.341 3.478 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2ccc(CN(C)C)c(Br)c2)cn1 ZINC000509239337 566282339 /nfs/dbraw/zinc/28/23/39/566282339.db2.gz LSIWRKPTMSTBRC-UHFFFAOYSA-N 0 1 384.299 3.015 10 0 GGAEMN O=S(=O)(Nc1cnc(CC2CC2)nc1)c1cc(Br)ccc1F ZINC000556316196 566283987 /nfs/dbraw/zinc/28/39/87/566283987.db2.gz RWKOQPHUDCMWMA-UHFFFAOYSA-N 0 1 386.246 3.132 10 0 GGAEMN CN(CCNCc1cn(-c2ccc(Cl)cc2Cl)nn1)CC(F)(F)F ZINC000535199236 566284364 /nfs/dbraw/zinc/28/43/64/566284364.db2.gz CTANTJRXMOPILB-UHFFFAOYSA-N 0 1 382.217 3.158 10 0 GGAEMN COC(=O)[C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)[C@@H]2CCC[C@@H]21 ZINC000599654104 566284389 /nfs/dbraw/zinc/28/43/89/566284389.db2.gz LOJPKTSZPKYQBJ-XJKCOSOUSA-N 0 1 392.297 3.489 10 0 GGAEMN CCc1noc(C)c1NC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 ZINC000535164584 566284635 /nfs/dbraw/zinc/28/46/35/566284635.db2.gz BTVBNYZCHLPFPL-UHFFFAOYSA-N 0 1 376.210 3.402 10 0 GGAEMN COC(=O)[C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)[C@@H]2CCC[C@H]21 ZINC000599654103 566284933 /nfs/dbraw/zinc/28/49/33/566284933.db2.gz LOJPKTSZPKYQBJ-WOSRLPQWSA-N 0 1 392.297 3.489 10 0 GGAEMN COC(=O)[C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)[C@H]2CCC[C@@H]21 ZINC000599654102 566284980 /nfs/dbraw/zinc/28/49/80/566284980.db2.gz LOJPKTSZPKYQBJ-IOASZLSFSA-N 0 1 392.297 3.489 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cnc(CC3CC3)nc2)cc1Br ZINC000556319062 566284983 /nfs/dbraw/zinc/28/49/83/566284983.db2.gz GSFNOQPWSBOPJM-UHFFFAOYSA-N 0 1 398.282 3.001 10 0 GGAEMN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000669104384 566285854 /nfs/dbraw/zinc/28/58/54/566285854.db2.gz ZLPYHLNEJGOPGK-CYBMUJFWSA-N 0 1 388.309 3.467 10 0 GGAEMN CC(C)N1CCC[C@H](NS(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000509284738 566286757 /nfs/dbraw/zinc/28/67/57/566286757.db2.gz WXNWHQFDLZZWSU-NSHDSACASA-N 0 1 395.750 3.254 10 0 GGAEMN COC(=O)c1cccc(F)c1NS(=O)(=O)c1c(Cl)ccc(F)c1F ZINC000556347043 566287373 /nfs/dbraw/zinc/28/73/73/566287373.db2.gz OYACQOPWCYSMMJ-UHFFFAOYSA-N 0 1 379.743 3.345 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)CN(C)[C@@H]2CCSC2)CC1 ZINC000648462870 566288001 /nfs/dbraw/zinc/28/80/01/566288001.db2.gz JDEGMIRRAJRVGI-CYBMUJFWSA-N 0 1 399.354 3.000 10 0 GGAEMN COC(=O)C1C[C@@H](C)N(Cc2nc3ccc(Br)cc3[nH]2)[C@H](C)C1 ZINC000599699820 566288091 /nfs/dbraw/zinc/28/80/91/566288091.db2.gz ZJTASMJNLWTPJJ-GHMZBOCLSA-N 0 1 380.286 3.487 10 0 GGAEMN C[C@@H](c1ccc(Br)cc1)N1CCN(CCOC2CCOCC2)CC1 ZINC000625192364 566289361 /nfs/dbraw/zinc/28/93/61/566289361.db2.gz TVNWEJYHSOMHSQ-INIZCTEOSA-N 0 1 397.357 3.323 10 0 GGAEMN CC(C)N(CCN(C)C)S(=O)(=O)c1cccc(Br)c1Cl ZINC000556374806 566292542 /nfs/dbraw/zinc/29/25/42/566292542.db2.gz PRRPIDPQHHYWCP-UHFFFAOYSA-N 0 1 383.739 3.063 10 0 GGAEMN CCN([C@H]1CCN([C@@H](C)c2ccccc2)C1)S(=O)(=O)CCC(F)(F)F ZINC000556378245 566293690 /nfs/dbraw/zinc/29/36/90/566293690.db2.gz KVCNGULTNOWLKL-HOCLYGCPSA-N 0 1 378.460 3.426 10 0 GGAEMN COCC[N@H+]1CCC[C@H]1CN[C@H](C)c1ccccc1I ZINC000482241773 566295829 /nfs/dbraw/zinc/29/58/29/566295829.db2.gz JFVGFAURTGPOAA-KGLIPLIRSA-N 0 1 388.293 3.053 10 0 GGAEMN CO[C@H](CC(C)C)CS(=O)(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 ZINC000420674935 566297292 /nfs/dbraw/zinc/29/72/92/566297292.db2.gz NTQHRPKCMJEGQN-NUJGCVRESA-N 0 1 388.599 3.112 10 0 GGAEMN CO[C@H](CC(C)C)CS(=O)(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 ZINC000420674932 566297333 /nfs/dbraw/zinc/29/73/33/566297333.db2.gz NTQHRPKCMJEGQN-JFIYKMOQSA-N 0 1 388.599 3.112 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)CCN1C ZINC000420674960 566297388 /nfs/dbraw/zinc/29/73/88/566297388.db2.gz NYXXLSUPLHZLDC-PWSUYJOCSA-N 0 1 382.860 3.045 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc(C(F)(F)F)nc2C)cc1OC ZINC000509391604 566298453 /nfs/dbraw/zinc/29/84/53/566298453.db2.gz ZQSZUEHRJWUWAK-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN O=C(Cc1cscc1Br)NCCc1nc2ccc(F)cc2[nH]1 ZINC000556435166 566301228 /nfs/dbraw/zinc/30/12/28/566301228.db2.gz LUDVDYFYJGXGMQ-UHFFFAOYSA-N 0 1 382.258 3.427 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCc3ccc(Br)cc3C2)CC1 ZINC000556440770 566302016 /nfs/dbraw/zinc/30/20/16/566302016.db2.gz DJHDSGCPNXQPEJ-UHFFFAOYSA-N 0 1 378.314 3.169 10 0 GGAEMN CS[C@H]1CN(S(=O)(=O)c2ccc(C(C)(C)C)s2)C[C@H]1N1CCCC1 ZINC000445715672 566306411 /nfs/dbraw/zinc/30/64/11/566306411.db2.gz HMVGCJXRMLJZFB-KGLIPLIRSA-N 0 1 388.624 3.246 10 0 GGAEMN CS[C@@H]1CN(S(=O)(=O)c2ccc(C(C)(C)C)s2)C[C@@H]1N1CCCC1 ZINC000445715673 566306786 /nfs/dbraw/zinc/30/67/86/566306786.db2.gz HMVGCJXRMLJZFB-UONOGXRCSA-N 0 1 388.624 3.246 10 0 GGAEMN COc1cc(Br)c(CNC[C@H](O)Cc2ccc(F)cc2)cc1OC ZINC000576029971 566308983 /nfs/dbraw/zinc/30/89/83/566308983.db2.gz IJFYCZXRIOVAIP-OAHLLOKOSA-N 0 1 398.272 3.299 10 0 GGAEMN CC(C)(C)OC(=O)[C@@H]1CCCCN1C(=O)c1cccc(Br)c1O ZINC000535552414 566311840 /nfs/dbraw/zinc/31/18/40/566311840.db2.gz AHEVIPXULXRLRL-ZDUSSCGKSA-N 0 1 384.270 3.491 10 0 GGAEMN O=S(=O)(CCN[C@@H](c1cccnc1)C1CC1)c1cccc(Br)c1 ZINC000445819693 566313326 /nfs/dbraw/zinc/31/33/26/566313326.db2.gz RKWJIZQTZOGJCX-QGZVFWFLSA-N 0 1 395.322 3.359 10 0 GGAEMN Cc1ccccc1C(=O)NCC(=O)Nc1cc(Br)cc(Cl)c1O ZINC000535656078 566316661 /nfs/dbraw/zinc/31/66/61/566316661.db2.gz NWEGFJLRLNZYCU-UHFFFAOYSA-N 0 1 397.656 3.485 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC(c3ccc(Br)cc3)CC2)C1 ZINC000669653920 566317413 /nfs/dbraw/zinc/31/74/13/566317413.db2.gz HRIXHOIOBJZWGI-QGZVFWFLSA-N 0 1 380.330 3.432 10 0 GGAEMN O=C([C@@H]1CCc2cc(Br)ccc21)N1CCC(c2nc[nH]n2)CC1 ZINC000648815301 566317424 /nfs/dbraw/zinc/31/74/24/566317424.db2.gz LDUHHLPMMCXTHZ-OAHLLOKOSA-N 0 1 375.270 3.003 10 0 GGAEMN CCOC(=O)c1cccc(CNCCOc2cccc(Br)c2)n1 ZINC000600129716 566318218 /nfs/dbraw/zinc/31/82/18/566318218.db2.gz KDRPDLGDTMAHEF-UHFFFAOYSA-N 0 1 379.254 3.189 10 0 GGAEMN Cc1nn(C)c2ncc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc12 ZINC000669694588 566322882 /nfs/dbraw/zinc/32/28/82/566322882.db2.gz QFLVZVKQJDTDFX-UHFFFAOYSA-N 0 1 385.225 3.168 10 0 GGAEMN O=C(NCCC[C@@H]1CCCC[C@H]1O)c1cc(Br)cc2nc[nH]c21 ZINC000669711753 566324177 /nfs/dbraw/zinc/32/41/77/566324177.db2.gz OHJIUGQVUDZEFY-XHDPSFHLSA-N 0 1 380.286 3.387 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)c1[nH]nc2c1CCCC2 ZINC000669727474 566324333 /nfs/dbraw/zinc/32/43/33/566324333.db2.gz FSXFKDOQVNINBD-CYBMUJFWSA-N 0 1 376.254 3.305 10 0 GGAEMN O=C1CCCN1CCCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000535739982 566324936 /nfs/dbraw/zinc/32/49/36/566324936.db2.gz BQNDPEGNXFBQEX-UHFFFAOYSA-N 0 1 384.351 3.166 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@@H](CN3CCOCC3)C2)c(C)c1Br ZINC000669747008 566325859 /nfs/dbraw/zinc/32/58/59/566325859.db2.gz OOVCLUXENTUSCT-INIZCTEOSA-N 0 1 395.341 3.250 10 0 GGAEMN CN(C(=O)CCCC(=O)c1ccc(Br)cc1)[C@@H]1CN2CCC1CC2 ZINC000446041354 566326325 /nfs/dbraw/zinc/32/63/25/566326325.db2.gz IIMYSBQPHVUUCL-QGZVFWFLSA-N 0 1 393.325 3.355 10 0 GGAEMN CCCN(CC(F)(F)F)C(=O)CN[C@H](c1cccs1)C1(CO)CCC1 ZINC000625465802 566327516 /nfs/dbraw/zinc/32/75/16/566327516.db2.gz SMVBANBMNIGIAV-OAHLLOKOSA-N 0 1 378.460 3.342 10 0 GGAEMN O=C([C@@H]1CCCN(Cc2nc3cc(Br)ccc3o2)C1)N1CCCC1 ZINC000509683490 566328691 /nfs/dbraw/zinc/32/86/91/566328691.db2.gz IXIRVCJFKFYALJ-CYBMUJFWSA-N 0 1 392.297 3.425 10 0 GGAEMN CS[C@@H]1CN(C(=O)c2sc(C(F)(F)F)nc2C)C[C@H]1N1CCCC1 ZINC000462586785 566329135 /nfs/dbraw/zinc/32/91/35/566329135.db2.gz AYDKQUCCNSHTTQ-GHMZBOCLSA-N 0 1 379.473 3.122 10 0 GGAEMN OC1([C@H]2CCCCN2Cc2cc3c(cc2Br)OCCCO3)CC1 ZINC000556780445 566330330 /nfs/dbraw/zinc/33/03/30/566330330.db2.gz QEDNTPFGGHESDU-QGZVFWFLSA-N 0 1 382.298 3.490 10 0 GGAEMN COCCN1CCC[C@H](NC(=O)c2c(Cl)cc(F)cc2Br)C1 ZINC000648917499 566330646 /nfs/dbraw/zinc/33/06/46/566330646.db2.gz IIYROEGIZZXMMS-NSHDSACASA-N 0 1 393.684 3.082 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)[C@H]2CCCc3[nH]ncc32)CC1 ZINC000648957547 566333311 /nfs/dbraw/zinc/33/33/11/566333311.db2.gz BSZKWAIFDLWJHH-LBPRGKRZSA-N 0 1 390.281 3.406 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)[C@@H]2CCCc3[nH]ncc32)CC1 ZINC000648957546 566333561 /nfs/dbraw/zinc/33/35/61/566333561.db2.gz BSZKWAIFDLWJHH-GFCCVEGCSA-N 0 1 390.281 3.406 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)c2[nH]nc3c2CCC3)CC1 ZINC000648957923 566333996 /nfs/dbraw/zinc/33/39/96/566333996.db2.gz RHCUPGASOWQCCW-UHFFFAOYSA-N 0 1 376.254 3.089 10 0 GGAEMN CNC(=O)[C@@H]1CCN(Cc2csc(-c3cccc(Br)c3)n2)C1 ZINC000420970532 566334485 /nfs/dbraw/zinc/33/44/85/566334485.db2.gz GNEZKGDBOZFTCH-GFCCVEGCSA-N 0 1 380.311 3.141 10 0 GGAEMN Cc1ccc(O)c(CN[C@@H]2CCN(c3ccc(Br)c(C)c3)C2=O)n1 ZINC000462636876 566335093 /nfs/dbraw/zinc/33/50/93/566335093.db2.gz AQBYUPLDINTIMX-OAHLLOKOSA-N 0 1 390.281 3.062 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2Br)n[nH]1)[C@@H]1C[C@H]1C(F)(F)F ZINC000576343865 566337178 /nfs/dbraw/zinc/33/71/78/566337178.db2.gz FTTAYODBBFIEAY-HTQZYQBOSA-N 0 1 375.148 3.371 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)CN1[C@@H](C)CC[C@@H]1C ZINC000482850461 566337878 /nfs/dbraw/zinc/33/78/78/566337878.db2.gz NZYDRHVFAGFMOX-STQMWFEESA-N 0 1 385.302 3.286 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NC[C@@H]1C[C@H]1C1CC1 ZINC000576361543 566338449 /nfs/dbraw/zinc/33/84/49/566338449.db2.gz BQYXNJMIDYWKBB-JSGCOSHPSA-N 0 1 390.285 3.080 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NC[C@@H]1C[C@H]1C1CC1 ZINC000576361543 566338456 /nfs/dbraw/zinc/33/84/56/566338456.db2.gz BQYXNJMIDYWKBB-JSGCOSHPSA-N 0 1 390.285 3.080 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)Nc2cc(Br)ccc2F)[nH]n1 ZINC000669954192 566338891 /nfs/dbraw/zinc/33/88/91/566338891.db2.gz PQODVIQBLWLTGI-UHFFFAOYSA-N 0 1 379.193 3.356 10 0 GGAEMN Clc1ccc(-n2cc(CNCCCOC[C@H]3CCOC3)nn2)c(Cl)c1 ZINC000535942159 566340018 /nfs/dbraw/zinc/34/00/18/566340018.db2.gz HGQLFSLIMHXAHM-CYBMUJFWSA-N 0 1 385.295 3.107 10 0 GGAEMN COC(=O)c1coc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 ZINC000600474082 566340155 /nfs/dbraw/zinc/34/01/55/566340155.db2.gz WTARINMABZMHJB-AWEZNQCLSA-N 0 1 385.247 3.406 10 0 GGAEMN COC(=O)c1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)[nH]1 ZINC000600470703 566340253 /nfs/dbraw/zinc/34/02/53/566340253.db2.gz HVYSFBYRFNCRLM-HNNXBMFYSA-N 0 1 384.263 3.141 10 0 GGAEMN COC(=O)c1cc(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c[nH]1 ZINC000600470862 566340743 /nfs/dbraw/zinc/34/07/43/566340743.db2.gz JGDTUYCZKXSJJW-HNNXBMFYSA-N 0 1 384.263 3.141 10 0 GGAEMN CC1=C(C)CN(C(=O)c2[nH]nc3ccc(I)cc32)CC1 ZINC000482896816 566340776 /nfs/dbraw/zinc/34/07/76/566340776.db2.gz IDDAQXLLXGCLEQ-UHFFFAOYSA-N 0 1 381.217 3.350 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)CN1[C@@H](C)CC[C@@H]1C ZINC000482957800 566344269 /nfs/dbraw/zinc/34/42/69/566344269.db2.gz IWFSTYFXCOZHNJ-STQMWFEESA-N 0 1 389.359 3.358 10 0 GGAEMN C[C@@]1(CNC(=O)c2cc(Br)cc3nc[nH]c32)CCO[C@H]1C1CC1 ZINC000556918784 566344903 /nfs/dbraw/zinc/34/49/03/566344903.db2.gz LJDGTYOLBJIBIH-RDJZCZTQSA-N 0 1 378.270 3.260 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000576434941 566345392 /nfs/dbraw/zinc/34/53/92/566345392.db2.gz GAXSPSRFFGYOLD-HNNXBMFYSA-N 0 1 381.567 3.147 10 0 GGAEMN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1cc(Br)ccc1F ZINC000556921337 566345427 /nfs/dbraw/zinc/34/54/27/566345427.db2.gz OEGRGWBIBLDXAW-AAEUAGOBSA-N 0 1 393.322 3.053 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000576434730 566345626 /nfs/dbraw/zinc/34/56/26/566345626.db2.gz LIUWQMLULBOONL-GFCCVEGCSA-N 0 1 399.504 3.013 10 0 GGAEMN COC1CCN(CCNC(=O)c2c(Cl)cc(F)cc2Br)CC1 ZINC000649143471 566346903 /nfs/dbraw/zinc/34/69/03/566346903.db2.gz UIYPNDXADDQDIC-UHFFFAOYSA-N 0 1 393.684 3.082 10 0 GGAEMN CC1(C)C[C@@H](SCC(=O)Nc2cccc(CN3CCSCC3)c2)CO1 ZINC000600567568 566347473 /nfs/dbraw/zinc/34/74/73/566347473.db2.gz BMDCHTSFEKXBHB-QGZVFWFLSA-N 0 1 380.579 3.475 10 0 GGAEMN CN(C)[C@H](CNC(=O)NC[C@@H]1CSc2ccccc2O1)c1cccs1 ZINC000576460804 566348744 /nfs/dbraw/zinc/34/87/44/566348744.db2.gz FBOZMFLDWFPMNC-ZIAGYGMSSA-N 0 1 377.535 3.203 10 0 GGAEMN CC[C@H](Cn1cncn1)NCc1ccc(Cl)cc1I ZINC000576484967 566349346 /nfs/dbraw/zinc/34/93/46/566349346.db2.gz RMANAVQKAUNRCL-GFCCVEGCSA-N 0 1 390.656 3.105 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)[C@H](C)Cc1cnc[nH]1 ZINC000576478397 566349786 /nfs/dbraw/zinc/34/97/86/566349786.db2.gz YEWLPOIOZGCZBY-LLVKDONJSA-N 0 1 382.258 3.015 10 0 GGAEMN CCCOc1ccc(Br)cc1CN[C@@H]1CC(=O)N([C@H]2C[C@@H]2C)C1 ZINC000462743975 566349643 /nfs/dbraw/zinc/34/96/43/566349643.db2.gz FQAOWVBKPIGNIH-MAZHCROVSA-N 0 1 381.314 3.337 10 0 GGAEMN CCCOc1ccc(Br)cc1CN[C@@H]1CC(=O)N([C@@H]2C[C@@H]2C)C1 ZINC000462743969 566349814 /nfs/dbraw/zinc/34/98/14/566349814.db2.gz FQAOWVBKPIGNIH-APHBMKBZSA-N 0 1 381.314 3.337 10 0 GGAEMN C[C@H](C1CC1)n1nccc1NS(=O)(=O)c1cc(F)ccc1OC(F)F ZINC000421147431 566350174 /nfs/dbraw/zinc/35/01/74/566350174.db2.gz BTCZMSQFVGONQU-SECBINFHSA-N 0 1 375.372 3.395 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)[C@@H]1O ZINC000576518155 566353509 /nfs/dbraw/zinc/35/35/09/566353509.db2.gz VDFSBRQLQFJHHZ-VMGRFDJRSA-N 0 1 383.897 3.004 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@@H](NCc2ccccc2Br)C1 ZINC000509988511 566353621 /nfs/dbraw/zinc/35/36/21/566353621.db2.gz GIBOGSGLQDLGEI-MRXNPFEDSA-N 0 1 389.293 3.219 10 0 GGAEMN Cc1ccncc1CN(C)C[C@@H](O)COc1cc(F)cc(Br)c1 ZINC000483026503 566354072 /nfs/dbraw/zinc/35/40/72/566354072.db2.gz LOFYIBPCOWFQQE-MRXNPFEDSA-N 0 1 383.261 3.163 10 0 GGAEMN Cn1cc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C(F)F)n1 ZINC000462796978 566355009 /nfs/dbraw/zinc/35/50/09/566355009.db2.gz AHOOCJQZYASZFH-UHFFFAOYSA-N 0 1 397.227 3.195 10 0 GGAEMN Cn1cc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C(F)F)n1 ZINC000462796978 566355016 /nfs/dbraw/zinc/35/50/16/566355016.db2.gz AHOOCJQZYASZFH-UHFFFAOYSA-N 0 1 397.227 3.195 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2cccc(C3CCOCC3)c2)cs1 ZINC000600661804 566355888 /nfs/dbraw/zinc/35/58/88/566355888.db2.gz ABLBRAIVLDRSBM-UHFFFAOYSA-N 0 1 381.475 3.230 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2ccc(I)cc2)[C@@H]2CCC[C@@H]21 ZINC000600675505 566357244 /nfs/dbraw/zinc/35/72/44/566357244.db2.gz PUXYYVWHDVSTPJ-RBSFLKMASA-N 0 1 385.245 3.366 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2ccc(I)cc2)[C@@H]2CCC[C@H]21 ZINC000600675506 566358994 /nfs/dbraw/zinc/35/89/94/566358994.db2.gz PUXYYVWHDVSTPJ-RRFJBIMHSA-N 0 1 385.245 3.366 10 0 GGAEMN CC(C)n1ccc(CN[C@@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC000625793970 566359441 /nfs/dbraw/zinc/35/94/41/566359441.db2.gz AOGDGBLJMKFGAR-SFHVURJKSA-N 0 1 378.314 3.236 10 0 GGAEMN CC(C)n1ccc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC000625793969 566359905 /nfs/dbraw/zinc/35/99/05/566359905.db2.gz AOGDGBLJMKFGAR-GOSISDBHSA-N 0 1 378.314 3.236 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(C)=O)c(Cl)c2)cc1F ZINC000446623223 566359986 /nfs/dbraw/zinc/35/99/86/566359986.db2.gz IBQQNFLSCRWJHI-UHFFFAOYSA-N 0 1 385.800 3.269 10 0 GGAEMN CCc1nc(C)c(CNC(=O)c2c[nH]c3ccc(Br)cc3c2=O)o1 ZINC000557081452 566360599 /nfs/dbraw/zinc/36/05/99/566360599.db2.gz QVHQNLMCPYSUHW-UHFFFAOYSA-N 0 1 390.237 3.079 10 0 GGAEMN CCn1cc(Br)cc1C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000536264828 566361612 /nfs/dbraw/zinc/36/16/12/566361612.db2.gz QJKLVAIUMPBMPH-RDJZCZTQSA-N 0 1 376.298 3.446 10 0 GGAEMN Cc1cc(Br)cn2c(CNCc3c4c(nn3C)CCCC4)cnc12 ZINC000462868441 566362585 /nfs/dbraw/zinc/36/25/85/566362585.db2.gz AGEHIQMZQQOZFR-UHFFFAOYSA-N 0 1 388.313 3.307 10 0 GGAEMN Cn1nc2c(c1CNCc1cccc(I)c1)CCCC2 ZINC000462877475 566362802 /nfs/dbraw/zinc/36/28/02/566362802.db2.gz NQJXMWHEDALRAB-UHFFFAOYSA-N 0 1 381.261 3.193 10 0 GGAEMN CC[C@@H]1CN(CCOc2cc(F)cc(Br)c2)C[C@@]2(CCOC2)O1 ZINC000483200885 566363835 /nfs/dbraw/zinc/36/38/35/566363835.db2.gz QRSCVPKQLBGORL-NVXWUHKLSA-N 0 1 388.277 3.237 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1csc(Br)c1)C1CC1 ZINC000576624993 566364640 /nfs/dbraw/zinc/36/46/40/566364640.db2.gz SYWKXBWWNMFFPL-UHFFFAOYSA-N 0 1 395.388 3.147 10 0 GGAEMN O=C(Nc1cnc(CC2CC2)nc1)c1cc(=O)c2cc(Br)ccc2[nH]1 ZINC000557126087 566365437 /nfs/dbraw/zinc/36/54/37/566365437.db2.gz RNZGHRIMKZVYEY-UHFFFAOYSA-N 0 1 399.248 3.285 10 0 GGAEMN Cc1c(Cl)c(CNC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)nn1C ZINC000421337886 566366854 /nfs/dbraw/zinc/36/68/54/566366854.db2.gz CPYXGBNSQGWCLS-ZDUSSCGKSA-N 0 1 375.822 3.342 10 0 GGAEMN COC(=O)c1cc(CN[C@@H]2CCOc3c(Br)cccc32)n(C)c1C ZINC000462904353 566367206 /nfs/dbraw/zinc/36/72/06/566367206.db2.gz VTXOEGKLQANJRZ-MRXNPFEDSA-N 0 1 393.281 3.496 10 0 GGAEMN COC(=O)c1ccc(CS(=O)(=O)Nc2cc(Cl)c(Cl)cn2)cc1 ZINC000446815990 566367586 /nfs/dbraw/zinc/36/75/86/566367586.db2.gz BGHUBGVJZARUTD-UHFFFAOYSA-N 0 1 375.233 3.117 10 0 GGAEMN C[C@@H]1OCC[C@H]1N(CCO)Cc1cc(Br)ccc1OC(F)F ZINC000483269255 566369998 /nfs/dbraw/zinc/36/99/98/566369998.db2.gz RHCPCFKSLDWXRF-GXFFZTMASA-N 0 1 380.229 3.022 10 0 GGAEMN Cc1nc(C)c([C@H](C)N(C)Cc2ccc(S(=O)(=O)NC3CC3)cc2)s1 ZINC000649522196 566371188 /nfs/dbraw/zinc/37/11/88/566371188.db2.gz NRXWAHKMVALPLE-ZDUSSCGKSA-N 0 1 379.551 3.394 10 0 GGAEMN C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281405 566371829 /nfs/dbraw/zinc/37/18/29/566371829.db2.gz MUQRXHCUAPQFRH-GXFFZTMASA-N 0 1 380.229 3.022 10 0 GGAEMN C[C@@H]1OCC[C@H]1N(CCO)Cc1cccc(Br)c1OC(F)F ZINC000483281405 566371831 /nfs/dbraw/zinc/37/18/31/566371831.db2.gz MUQRXHCUAPQFRH-GXFFZTMASA-N 0 1 380.229 3.022 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)c1 ZINC000625992923 566372673 /nfs/dbraw/zinc/37/26/73/566372673.db2.gz YPXNJQMFVLGWGQ-FHLIZLRMSA-N 0 1 386.293 3.430 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2cccc(F)c2Cl)C1 ZINC000557197763 566372875 /nfs/dbraw/zinc/37/28/75/566372875.db2.gz SWUDHVSFIIHNPK-HNNXBMFYSA-N 0 1 388.936 3.185 10 0 GGAEMN CN(C)C[C@H](NCC(=O)N(C)c1nccs1)c1ccc(Cl)c(Cl)c1 ZINC000625983723 566373149 /nfs/dbraw/zinc/37/31/49/566373149.db2.gz YVUOEUVXPWUMFN-AWEZNQCLSA-N 0 1 387.336 3.305 10 0 GGAEMN Cc1n[nH]c(C)c1NC(=O)CN[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000625983662 566373257 /nfs/dbraw/zinc/37/32/57/566373257.db2.gz XBXQOWLUHKFPST-HNNXBMFYSA-N 0 1 384.311 3.164 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@@H](O)COc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000625995799 566373707 /nfs/dbraw/zinc/37/37/07/566373707.db2.gz WAHOXKZZPZAVBB-BZNIZROVSA-N 0 1 384.263 3.066 10 0 GGAEMN Cc1cc(Br)ccc1[C@H]1CCCN1CCN1C(=O)NC(C)(C)C1=O ZINC000626009548 566374285 /nfs/dbraw/zinc/37/42/85/566374285.db2.gz LQFCCAYICMLWDG-OAHLLOKOSA-N 0 1 394.313 3.225 10 0 GGAEMN CSc1ccc(OC[C@@H](O)CNCc2cn3cc(Cl)ccc3n2)cc1 ZINC000576749896 566374616 /nfs/dbraw/zinc/37/46/16/566374616.db2.gz ZJPIROOBSIWTSJ-HNNXBMFYSA-N 0 1 377.897 3.239 10 0 GGAEMN Cc1cc(Br)ccc1[C@@H]1CCCN1CCN1C(=O)NC(C)(C)C1=O ZINC000626009547 566374833 /nfs/dbraw/zinc/37/48/33/566374833.db2.gz LQFCCAYICMLWDG-HNNXBMFYSA-N 0 1 394.313 3.225 10 0 GGAEMN C[C@@H]1[C@H](C(F)(F)F)OCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000626018303 566376876 /nfs/dbraw/zinc/37/68/76/566376876.db2.gz AKICANLIOQMPDM-AMIZOPFISA-N 0 1 378.192 3.477 10 0 GGAEMN CC(C)c1nc(C[S@](=O)Cc2ccc(Br)c(F)c2F)n[nH]1 ZINC000600928552 566378223 /nfs/dbraw/zinc/37/82/23/566378223.db2.gz QYOBYEAOGJNSMR-OAQYLSRUSA-N 0 1 378.242 3.418 10 0 GGAEMN Cc1ccc(O)c(CN[C@@H](C)c2ccc(Br)cc2OCCCO)n1 ZINC000463035262 566378782 /nfs/dbraw/zinc/37/87/82/566378782.db2.gz ORWJBQWZEVEGSO-ZDUSSCGKSA-N 0 1 395.297 3.470 10 0 GGAEMN C[C@H]1C[C@@H](c2ccc(Br)cc2)CN1CC(=O)NCc1cccnc1 ZINC000626041093 566378968 /nfs/dbraw/zinc/37/89/68/566378968.db2.gz QNEYNGDUROGBCV-WMLDXEAASA-N 0 1 388.309 3.338 10 0 GGAEMN C[C@H](C(=O)Nc1ncccn1)N1C[C@H](c2ccc(Br)cc2)C[C@H]1C ZINC000626040950 566379109 /nfs/dbraw/zinc/37/91/09/566379109.db2.gz OMHOUAFAETVKPQ-UMVBOHGHSA-N 0 1 389.297 3.444 10 0 GGAEMN Cc1cc(NC(=O)[C@H](C)N2CCN(CCCF)CC2)ccc1Br ZINC000626071264 566382392 /nfs/dbraw/zinc/38/23/92/566382392.db2.gz WTJWHPCRIPDJJC-AWEZNQCLSA-N 0 1 386.309 3.062 10 0 GGAEMN Cc1cc(NC(=O)[C@@H](C)N2CCN(CCCF)CC2)ccc1Br ZINC000626071265 566382711 /nfs/dbraw/zinc/38/27/11/566382711.db2.gz WTJWHPCRIPDJJC-CQSZACIVSA-N 0 1 386.309 3.062 10 0 GGAEMN FCCCN1CCN(CCOc2ccc(Cl)cc2Br)CC1 ZINC000626073737 566382768 /nfs/dbraw/zinc/38/27/68/566382768.db2.gz YQYQQQGNAJRHQB-UHFFFAOYSA-N 0 1 379.701 3.459 10 0 GGAEMN CCCOc1ccc(Br)cc1C[S@](=O)Cc1n[nH]c(CC)n1 ZINC000447103307 566386449 /nfs/dbraw/zinc/38/64/49/566386449.db2.gz WAQBUWDPZQSRMM-QFIPXVFZSA-N 0 1 386.315 3.367 10 0 GGAEMN CCNC(=O)c1ccc(=N[C@@H](CCOC)c2ccc(Cl)c(Cl)c2)[nH]n1 ZINC000557426145 566386471 /nfs/dbraw/zinc/38/64/71/566386471.db2.gz SUTCCDZNTAJCFB-AWEZNQCLSA-N 0 1 383.279 3.145 10 0 GGAEMN CC(=O)c1[nH]c(CCN2CCc3cc(F)cc(Br)c3C2)nc1C ZINC000626132404 566387697 /nfs/dbraw/zinc/38/76/97/566387697.db2.gz HHQXGSWVXRDVHM-UHFFFAOYSA-N 0 1 380.261 3.423 10 0 GGAEMN CC[C@](NS(=O)(=O)c1c(F)cccc1Cl)(C(=O)OC)c1ccccc1 ZINC000510504353 566389846 /nfs/dbraw/zinc/38/98/46/566389846.db2.gz YJQVJKPRFKCHEZ-QGZVFWFLSA-N 0 1 385.844 3.236 10 0 GGAEMN CSCc1cc(F)ccc1CNCc1ccc(Cl)c(S(N)(=O)=O)c1 ZINC000601108122 566390227 /nfs/dbraw/zinc/39/02/27/566390227.db2.gz CDXVTRNUDGWWGM-UHFFFAOYSA-N 0 1 388.917 3.279 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1C[C@H](c2ccccc2)[C@](F)(CO)C1 ZINC000576938873 566391809 /nfs/dbraw/zinc/39/18/09/566391809.db2.gz JRBCJZOXIAARKO-RDTXWAMCSA-N 0 1 394.240 3.095 10 0 GGAEMN CC[C@@H](c1ccc(Br)cc1)N1CCC[C@H](CS(=O)(=O)NC)C1 ZINC000626167820 566392132 /nfs/dbraw/zinc/39/21/32/566392132.db2.gz DEIQRTOVHOREKZ-BBRMVZONSA-N 0 1 389.359 3.161 10 0 GGAEMN Ic1cnc(CN[C@H](C2CCC2)[C@H]2CCCO2)s1 ZINC000601156688 566393723 /nfs/dbraw/zinc/39/37/23/566393723.db2.gz WMOBQKPGBGHMRM-ZWNOBZJWSA-N 0 1 378.279 3.185 10 0 GGAEMN O=C(NCCc1ccccc1)c1n[nH]c2ccc(I)cc21 ZINC000463242564 566394503 /nfs/dbraw/zinc/39/45/03/566394503.db2.gz JPLFBROZLPDHGJ-UHFFFAOYSA-N 0 1 391.212 3.140 10 0 GGAEMN O=C(NCc1ccc(F)cc1)c1n[nH]c2ccc(I)cc21 ZINC000463228597 566395234 /nfs/dbraw/zinc/39/52/34/566395234.db2.gz VCQCBFFHCJBWMU-UHFFFAOYSA-N 0 1 395.175 3.237 10 0 GGAEMN O=C(c1cc2cc(Br)ccc2s1)N1CCC[C@@H](c2nn[nH]n2)C1 ZINC000626237782 566396043 /nfs/dbraw/zinc/39/60/43/566396043.db2.gz HBFXIIGVVAIYNZ-SECBINFHSA-N 0 1 392.282 3.197 10 0 GGAEMN CC(C)(C)[C@@H](O)C[C@@H](CO)NCc1cc(Br)ccc1OC(F)F ZINC000576997927 566396414 /nfs/dbraw/zinc/39/64/14/566396414.db2.gz AHNZSKDPLVIWMR-JSGCOSHPSA-N 0 1 396.272 3.298 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1NCc1n[nH]c(C2CCOCC2)n1 ZINC000601222588 566396927 /nfs/dbraw/zinc/39/69/27/566396927.db2.gz NZYPWNPZQAHSHN-UHFFFAOYSA-N 0 1 385.251 3.404 10 0 GGAEMN COc1ccc(Cl)c(S(=O)(=O)Nc2ccc3ccc(=O)n(C)c3c2)c1 ZINC000447266927 566399856 /nfs/dbraw/zinc/39/98/56/566399856.db2.gz ZAIXPGMLEIZEBD-UHFFFAOYSA-N 0 1 378.837 3.001 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C[C@@H]1C ZINC000626314995 566400832 /nfs/dbraw/zinc/40/08/32/566400832.db2.gz XPIHDWVRJVOPNU-WJPHHUGGSA-N 0 1 377.326 3.276 10 0 GGAEMN CC(C)C[C@H](N)c1noc(-c2ccc(Br)cc2-n2cncn2)n1 ZINC000577063278 566401667 /nfs/dbraw/zinc/40/16/67/566401667.db2.gz DYJWCXZWSFDMHY-LBPRGKRZSA-N 0 1 377.246 3.126 10 0 GGAEMN OC[C@@]1(c2ccccc2)CCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000463361883 566403789 /nfs/dbraw/zinc/40/37/89/566403789.db2.gz OGZZOFZJPIINBD-LJQANCHMSA-N 0 1 386.293 3.461 10 0 GGAEMN C[C@@H](NCCS(=O)(=O)NC[C@H]1CCCCO1)c1cc(Cl)cc(Cl)c1 ZINC000536866477 566406815 /nfs/dbraw/zinc/40/68/15/566406815.db2.gz RYEPYCUTUAFIMM-MLGOLLRUSA-N 0 1 395.352 3.133 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@H](N[C@@H]2CCCOc3c(Br)cccc32)CC1=O ZINC000536875320 566407198 /nfs/dbraw/zinc/40/71/98/566407198.db2.gz IBCFCRAGNPCZAW-BHTHQVBYSA-N 0 1 379.298 3.262 10 0 GGAEMN C[C@@H](CNC(=O)C(=O)c1ccc(Br)cc1)N(C)Cc1ccccc1 ZINC000510715748 566407281 /nfs/dbraw/zinc/40/72/81/566407281.db2.gz MZDQIHRUPOFZPS-AWEZNQCLSA-N 0 1 389.293 3.269 10 0 GGAEMN CN(CCc1cccc(Br)c1)CC(=O)N1CCO[C@@H]2CCCC[C@H]21 ZINC000463413090 566408288 /nfs/dbraw/zinc/40/82/88/566408288.db2.gz JPDIPYIPINSUPA-QZTJIDSGSA-N 0 1 395.341 3.093 10 0 GGAEMN CN(CCc1cccc(Br)c1)CC(=O)N1CCO[C@H]2CCCC[C@@H]21 ZINC000463413092 566408666 /nfs/dbraw/zinc/40/86/66/566408666.db2.gz JPDIPYIPINSUPA-ROUUACIJSA-N 0 1 395.341 3.093 10 0 GGAEMN CC(C)(C)n1nnnc1CSc1nc(-c2ccccc2Br)n[nH]1 ZINC000463414327 566409118 /nfs/dbraw/zinc/40/91/18/566409118.db2.gz ZHILJKXNVRJINU-UHFFFAOYSA-N 0 1 394.302 3.268 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCC2CCN(Cc3ccccc3Cl)CC2)o1 ZINC000536896282 566409287 /nfs/dbraw/zinc/40/92/87/566409287.db2.gz JSPDXJGEOWCHCQ-UHFFFAOYSA-N 0 1 382.913 3.432 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SCc2nnnn2C(C)(C)C)n1 ZINC000463417774 566409525 /nfs/dbraw/zinc/40/95/25/566409525.db2.gz ZTSAGSSJEYEGEQ-UHFFFAOYSA-N 0 1 379.877 3.168 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2cc(F)c(F)cc2I)o1 ZINC000536899277 566410196 /nfs/dbraw/zinc/41/01/96/566410196.db2.gz CLUJIOIQXJSDPF-UHFFFAOYSA-N 0 1 399.156 3.272 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(I)cc21)c1cccnc1 ZINC000463438496 566410610 /nfs/dbraw/zinc/41/06/10/566410610.db2.gz XHLSFSRNZZFVFT-VIFPVBQESA-N 0 1 392.200 3.054 10 0 GGAEMN C[C@H](NC(=O)c1n[nH]c2ccc(I)cc21)c1ccccn1 ZINC000463456463 566412157 /nfs/dbraw/zinc/41/21/57/566412157.db2.gz RKUOVHPSMLQCEY-VIFPVBQESA-N 0 1 392.200 3.054 10 0 GGAEMN O=C(NCCc1ccc2c[nH]nc2c1)c1n[nH]c2ccc(Br)cc21 ZINC000671286655 566414785 /nfs/dbraw/zinc/41/47/85/566414785.db2.gz WNNOGLZIPUNEGU-UHFFFAOYSA-N 0 1 384.237 3.174 10 0 GGAEMN C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1c(F)cncc1F ZINC000557784006 566418966 /nfs/dbraw/zinc/41/89/66/566418966.db2.gz JXWPXDQREWVQNT-ZETCQYMHSA-N 0 1 381.180 3.490 10 0 GGAEMN Cn1cnc(=NC(=O)N2CCC[C@@H]2c2ccc(Br)cc2Cl)[nH]1 ZINC000626571518 566425203 /nfs/dbraw/zinc/42/52/03/566425203.db2.gz OKUYHAYXHQJJDL-GFCCVEGCSA-N 0 1 384.665 3.022 10 0 GGAEMN Cc1cc(Br)cc2c1CN(C(=O)CN(C)[C@H]1CCSC1)CC2 ZINC000537170295 566425913 /nfs/dbraw/zinc/42/59/13/566425913.db2.gz KBYUNRYLIBFPGW-HNNXBMFYSA-N 0 1 383.355 3.080 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)Cc3ccccc3Br)[nH]c21 ZINC000557843682 566426767 /nfs/dbraw/zinc/42/67/67/566426767.db2.gz SUDFOUPKEKSEGU-UHFFFAOYSA-N 0 1 394.294 3.253 10 0 GGAEMN Cn1cc([C@@H](NCC(=O)Nc2ccc(Br)cc2)C(C)(C)C)cn1 ZINC000537173719 566427127 /nfs/dbraw/zinc/42/71/27/566427127.db2.gz FQGXBDZTASMEEF-MRXNPFEDSA-N 0 1 379.302 3.498 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1Cc1ccc(OC(F)F)c(Br)c1 ZINC000537165102 566427338 /nfs/dbraw/zinc/42/73/38/566427338.db2.gz HZQGGWGCZZZQGS-LLVKDONJSA-N 0 1 377.229 3.280 10 0 GGAEMN Brc1ccc2c(c1)[C@@H](NCc1cccc(N3CCOCC3)n1)CC2 ZINC000511012254 566427684 /nfs/dbraw/zinc/42/76/84/566427684.db2.gz OCYSJJLVGNOCCQ-SFHVURJKSA-N 0 1 388.309 3.458 10 0 GGAEMN C[C@@H]1CN(C)[C@H](C)[C@H](C)N1C(=O)Cc1noc2ccc(Br)cc21 ZINC000650155726 566428002 /nfs/dbraw/zinc/42/80/02/566428002.db2.gz FSOVVZWTKCYMTA-UTUOFQBUSA-N 0 1 380.286 3.072 10 0 GGAEMN C[C@@H]1CN(C)[C@H](C)[C@H](C)N1C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000650150930 566428254 /nfs/dbraw/zinc/42/82/54/566428254.db2.gz BSASVELCFZVWBO-UTUOFQBUSA-N 0 1 392.297 3.256 10 0 GGAEMN CC(C)[N@@H+](C)CC1CCN(C(=O)N=c2nc(-c3ccsc3)[n-]s2)CC1 ZINC000577361781 566429285 /nfs/dbraw/zinc/42/92/85/566429285.db2.gz MAUIGOHFBANNDA-UHFFFAOYSA-N 0 1 379.555 3.273 10 0 GGAEMN COC1(CS(=O)(=O)Nc2ccccc2SCC(F)(F)F)CCOCC1 ZINC000650159042 566429873 /nfs/dbraw/zinc/42/98/73/566429873.db2.gz MJDOXJHDMJWDMZ-UHFFFAOYSA-N 0 1 399.456 3.278 10 0 GGAEMN COC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC(F)F)c(F)c1 ZINC000447784815 566430755 /nfs/dbraw/zinc/43/07/55/566430755.db2.gz FXJCCXOKCBPQDR-UHFFFAOYSA-N 0 1 375.324 3.015 10 0 GGAEMN CCOC(=O)COc1cccc(NS(=O)(=O)c2cccc(C)c2Cl)c1 ZINC000537196946 566430836 /nfs/dbraw/zinc/43/08/36/566430836.db2.gz ABKRPQIYNXTUMU-UHFFFAOYSA-N 0 1 383.853 3.391 10 0 GGAEMN C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H](S(=O)(=O)N(C)C)C1 ZINC000511059529 566433189 /nfs/dbraw/zinc/43/31/89/566433189.db2.gz MWROXYBSUAUXLV-SWLSCSKDSA-N 0 1 380.432 3.002 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1CC[S@@](=O)c1cc(Cl)ccc1Cl ZINC000577422355 566433571 /nfs/dbraw/zinc/43/35/71/566433571.db2.gz XQCNPXUXAANQBO-JBEBIEQOSA-N 0 1 391.364 3.482 10 0 GGAEMN CC1(C)CCCN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000463819730 566436229 /nfs/dbraw/zinc/43/62/29/566436229.db2.gz LARBDRUGTSSUQA-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN CN1CC2(C1)CCN(C(=O)c1c(F)ccc(C(F)(F)F)c1Br)C2 ZINC000626670249 566440397 /nfs/dbraw/zinc/44/03/97/566440397.db2.gz HULJQMJCSIOIMW-UHFFFAOYSA-N 0 1 395.194 3.385 10 0 GGAEMN CSc1ccc(S(=O)(=O)N2CCCC[C@@H]2c2n[nH]c(C)n2)cc1Cl ZINC000511151761 566442306 /nfs/dbraw/zinc/44/23/06/566442306.db2.gz PEHGXTVGCPNEJM-CYBMUJFWSA-N 0 1 386.930 3.404 10 0 GGAEMN C[C@@H]1CO[C@@H](C(F)(F)F)CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000671714485 566444591 /nfs/dbraw/zinc/44/45/91/566444591.db2.gz WSEKPBWHHGIFOT-PRHODGIISA-N 0 1 378.192 3.477 10 0 GGAEMN CN(C(=O)c1c(Br)cccc1Br)[C@@H]1CCCN(C)C1 ZINC000464053197 566445024 /nfs/dbraw/zinc/44/50/24/566445024.db2.gz LRMICUXBILKICJ-SNVBAGLBSA-N 0 1 390.119 3.378 10 0 GGAEMN C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc(I)cc32)[C@H]1C ZINC000464074500 566446245 /nfs/dbraw/zinc/44/62/45/566446245.db2.gz VCIKICWIRRBRQB-ZJUUUORDSA-N 0 1 383.233 3.428 10 0 GGAEMN O=C(NCCc1ccc(Br)cc1Cl)N[C@@H]1CCc2nc[nH]c2C1 ZINC000577581489 566446945 /nfs/dbraw/zinc/44/69/45/566446945.db2.gz ZQUNRWFRHRITCM-GFCCVEGCSA-N 0 1 397.704 3.225 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000484699267 566447608 /nfs/dbraw/zinc/44/76/08/566447608.db2.gz ZPQXEQAQUUVCED-YOEHRIQHSA-N 0 1 393.325 3.173 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@H](NCc2cn[nH]c2)C1=O ZINC000671730073 566447671 /nfs/dbraw/zinc/44/76/71/566447671.db2.gz JXALTVMLYGOSRY-HNNXBMFYSA-N 0 1 377.286 3.074 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000484699265 566447655 /nfs/dbraw/zinc/44/76/55/566447655.db2.gz ZPQXEQAQUUVCED-RHSMWYFYSA-N 0 1 393.325 3.173 10 0 GGAEMN COC(=O)c1cc(Br)cc(NC(=O)[C@@H]2C[C@H]2c2cnc[nH]2)c1C ZINC000602162419 566449964 /nfs/dbraw/zinc/44/99/64/566449964.db2.gz BGHYFKVRSHWVJJ-VXGBXAGGSA-N 0 1 378.226 3.009 10 0 GGAEMN CN(Cc1cnc[nH]1)S(=O)(=O)c1ccc(Br)cc1C(F)(F)F ZINC000577747098 566460618 /nfs/dbraw/zinc/46/06/18/566460618.db2.gz RHZNMYIGVPRZRF-UHFFFAOYSA-N 0 1 398.204 3.012 10 0 GGAEMN CCn1c(CNC(=O)[C@H](C)Cc2cnc[nH]2)nc2cc(Br)ccc21 ZINC000577767228 566463120 /nfs/dbraw/zinc/46/31/20/566463120.db2.gz WAPDQYZFEZJTJZ-LLVKDONJSA-N 0 1 390.285 3.037 10 0 GGAEMN O=S(=O)(Nc1ccc2c(c1)CCO2)c1cc(Br)c(F)cc1F ZINC000485003252 566467742 /nfs/dbraw/zinc/46/77/42/566467742.db2.gz CZDORCDWOHBXLA-UHFFFAOYSA-N 0 1 390.205 3.463 10 0 GGAEMN C[C@](CO)(NCC(=O)Nc1cccc(F)c1)c1ccc(Br)cc1 ZINC000511547239 566469857 /nfs/dbraw/zinc/46/98/57/566469857.db2.gz SVKMWFAIOCQCNW-QGZVFWFLSA-N 0 1 381.245 3.024 10 0 GGAEMN COc1cc2c(cc1OC)CCN(Cc1c(Br)c(C)nn1C)CC2 ZINC000448335391 566469891 /nfs/dbraw/zinc/46/98/91/566469891.db2.gz RDGQOAYMEZSVFW-UHFFFAOYSA-N 0 1 394.313 3.109 10 0 GGAEMN Cc1ccsc1[C@H](CO)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000537785274 566470810 /nfs/dbraw/zinc/47/08/10/566470810.db2.gz WXRNVAYNRZVPIH-LBPRGKRZSA-N 0 1 380.267 3.159 10 0 GGAEMN Cc1ccc(NC(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000511565594 566471344 /nfs/dbraw/zinc/47/13/44/566471344.db2.gz KJGLHHZZJDJZAV-SFHVURJKSA-N 0 1 377.282 3.193 10 0 GGAEMN Cc1nnc(SCC(=O)N2CC(C)(C)c3cc(Br)ccc32)[nH]1 ZINC000672190862 566472056 /nfs/dbraw/zinc/47/20/56/566472056.db2.gz CSDSNLKHIGKBMO-UHFFFAOYSA-N 0 1 381.299 3.292 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2CC(C)(C)c3cc(Br)ccc32)n1 ZINC000672190862 566472058 /nfs/dbraw/zinc/47/20/58/566472058.db2.gz CSDSNLKHIGKBMO-UHFFFAOYSA-N 0 1 381.299 3.292 10 0 GGAEMN CCN(C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)c1ccccc1 ZINC000511558989 566472120 /nfs/dbraw/zinc/47/21/20/566472120.db2.gz ANXCBRDPZIACFH-IBGZPJMESA-N 0 1 391.309 3.299 10 0 GGAEMN C[C@](CO)(NCC(=O)N(C1CC1)C1CCCC1)c1ccc(Br)cc1 ZINC000511581119 566473000 /nfs/dbraw/zinc/47/30/00/566473000.db2.gz ZCYZYORMULEGIS-LJQANCHMSA-N 0 1 395.341 3.180 10 0 GGAEMN CN(CC1CCCCC1)C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511584815 566473027 /nfs/dbraw/zinc/47/30/27/566473027.db2.gz JSSHDHLHXBRZPG-LJQANCHMSA-N 0 1 397.357 3.285 10 0 GGAEMN C[C@@](CO)(NCC(=O)NC1CCCCCC1)c1ccc(Br)cc1 ZINC000511593264 566475401 /nfs/dbraw/zinc/47/54/01/566475401.db2.gz LDQMQCFRCQHAEV-SFHVURJKSA-N 0 1 383.330 3.085 10 0 GGAEMN CC[C@@H]1CCCCN1C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511604416 566475811 /nfs/dbraw/zinc/47/58/11/566475811.db2.gz LRGVUPWTIWGGHA-SJLPKXTDSA-N 0 1 383.330 3.037 10 0 GGAEMN COC(=O)C1(CN(C)CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000448523924 566476345 /nfs/dbraw/zinc/47/63/45/566476345.db2.gz CBGMEFGCUXIIAO-UHFFFAOYSA-N 0 1 378.778 3.182 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(N3C[C@@H](C)O[C@@H](C)C3)nc2)c(C)s1 ZINC000577927882 566476292 /nfs/dbraw/zinc/47/62/92/566476292.db2.gz HPHZOOGRKHATHJ-TXEJJXNPSA-N 0 1 381.523 3.174 10 0 GGAEMN CC(C)C[C@H](C)N(C)C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511628184 566476976 /nfs/dbraw/zinc/47/69/76/566476976.db2.gz XWCWHQSMZQJSNR-KBXCAEBGSA-N 0 1 385.346 3.139 10 0 GGAEMN C[C@@H](C1CC1)N(C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)C1CC1 ZINC000511621604 566477618 /nfs/dbraw/zinc/47/76/18/566477618.db2.gz GGCZGCYYNKGEIN-DJJJIMSYSA-N 0 1 395.341 3.036 10 0 GGAEMN NC(=O)c1c(F)cc(Br)cc1NCCc1ccc2cn[nH]c2c1 ZINC000672294781 566479394 /nfs/dbraw/zinc/47/93/94/566479394.db2.gz PRAJNICUDGQOTN-UHFFFAOYSA-N 0 1 377.217 3.218 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)N2CCC(N3CCOC[C@@H]3C)CC2)c1 ZINC000627427419 566481393 /nfs/dbraw/zinc/48/13/93/566481393.db2.gz DTNZRYOAORFJQM-ZDUSSCGKSA-N 0 1 399.304 3.222 10 0 GGAEMN CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc3c2OCCC3)cc1Cl ZINC000464534857 566483178 /nfs/dbraw/zinc/48/31/78/566483178.db2.gz BMGOVTRBAWZGHN-UHFFFAOYSA-N 0 1 380.853 3.424 10 0 GGAEMN CC[C@@H]1CN(C)CCCN1S(=O)(=O)c1cccc(Br)c1Cl ZINC000577987413 566483240 /nfs/dbraw/zinc/48/32/40/566483240.db2.gz GMYDEWLQGCKXPK-LLVKDONJSA-N 0 1 395.750 3.207 10 0 GGAEMN CCN1CCN(CC(=O)Nc2ccc(Br)c3ccccc23)CC1 ZINC000537994131 566484253 /nfs/dbraw/zinc/48/42/53/566484253.db2.gz AIYGGOXQCDQSPL-UHFFFAOYSA-N 0 1 376.298 3.178 10 0 GGAEMN O=C(N[C@H]1COc2ccc(F)cc2C1)c1cc(Br)cc2nc[nH]c21 ZINC000558578978 566488993 /nfs/dbraw/zinc/48/89/93/566488993.db2.gz LDIKIEGLWRAQRF-GFCCVEGCSA-N 0 1 390.212 3.198 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000538057663 566490238 /nfs/dbraw/zinc/49/02/38/566490238.db2.gz YETCMKARSWMMPN-WHCBVINPSA-N 0 1 392.297 3.485 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000538057664 566490836 /nfs/dbraw/zinc/49/08/36/566490836.db2.gz YETCMKARSWMMPN-YLVFBTJISA-N 0 1 392.297 3.485 10 0 GGAEMN Cn1ncc(Cl)c1S(=O)(=O)Nc1ccc(Oc2ccccc2F)nc1 ZINC000485398751 566495591 /nfs/dbraw/zinc/49/55/91/566495591.db2.gz MDOLTPMWPQLGQJ-UHFFFAOYSA-N 0 1 382.804 3.201 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Cl)c(Br)cc2F)CC1 ZINC000448793557 566498199 /nfs/dbraw/zinc/49/81/99/566498199.db2.gz LQWXKCQVSDFAGW-UHFFFAOYSA-N 0 1 393.684 3.036 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@H]2CC(=O)N(c3cccc(Br)c3)C2)n1 ZINC000578192448 566499770 /nfs/dbraw/zinc/49/97/70/566499770.db2.gz QNMVGULLNDFZGS-SMDDNHRTSA-N 0 1 393.285 3.399 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1C[C@H]1C(F)(F)F ZINC000448815997 566499871 /nfs/dbraw/zinc/49/98/71/566499871.db2.gz KUXUUSMVQASKAS-RKDXNWHRSA-N 0 1 375.148 3.371 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@@H]2CC(=O)N(c3cccc(Br)c3)C2)n1 ZINC000578192445 566500773 /nfs/dbraw/zinc/50/07/73/566500773.db2.gz QNMVGULLNDFZGS-BXUZGUMPSA-N 0 1 393.285 3.399 10 0 GGAEMN COCCN1CCCN(C(=O)c2ccc(Br)c(OC(C)C)c2)CC1 ZINC000651178798 566500823 /nfs/dbraw/zinc/50/08/23/566500823.db2.gz ZQFWGRQRFICGKS-UHFFFAOYSA-N 0 1 399.329 3.031 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)N1CCNC[C@H]1c1ccccc1 ZINC000423989410 566500939 /nfs/dbraw/zinc/50/09/39/566500939.db2.gz BNYRVHDFJDMPLO-KRWDZBQOSA-N 0 1 389.293 3.173 10 0 GGAEMN CC1(C)SC[C@@H]1Nc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cn1 ZINC000558764607 566504903 /nfs/dbraw/zinc/50/49/03/566504903.db2.gz SQYXWJUBYLSVTQ-AWEZNQCLSA-N 0 1 385.461 3.467 10 0 GGAEMN CCCc1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)no1 ZINC000448873417 566507241 /nfs/dbraw/zinc/50/72/41/566507241.db2.gz KMXLMAIPXRCGFQ-UHFFFAOYSA-N 0 1 390.241 3.105 10 0 GGAEMN CCCc1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)no1 ZINC000448873417 566507246 /nfs/dbraw/zinc/50/72/46/566507246.db2.gz KMXLMAIPXRCGFQ-UHFFFAOYSA-N 0 1 390.241 3.105 10 0 GGAEMN CC(C)[C@H]1CCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000538371114 566510168 /nfs/dbraw/zinc/51/01/68/566510168.db2.gz YVXCBOVUILFZKF-CYBMUJFWSA-N 0 1 378.274 3.174 10 0 GGAEMN CC(C)[C@H]1CCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000538371114 566510174 /nfs/dbraw/zinc/51/01/74/566510174.db2.gz YVXCBOVUILFZKF-CYBMUJFWSA-N 0 1 378.274 3.174 10 0 GGAEMN COCc1cnc(CN[C@@H]2CCN(c3ccc(Br)cc3)C2)s1 ZINC000538393164 566510552 /nfs/dbraw/zinc/51/05/52/566510552.db2.gz NSJGHLJQMSCXMA-CYBMUJFWSA-N 0 1 382.327 3.421 10 0 GGAEMN C[C@H](CNCc1cnc(-c2ccc(Br)cc2)s1)S(C)(=O)=O ZINC000538428379 566512093 /nfs/dbraw/zinc/51/20/93/566512093.db2.gz PIBABQGPWYJEFW-SNVBAGLBSA-N 0 1 389.340 3.095 10 0 GGAEMN CCN(CC)[C@H](C)CNC(=O)Nc1cccc(Cl)c1S(=O)(=O)C(C)C ZINC000578334486 566512840 /nfs/dbraw/zinc/51/28/40/566512840.db2.gz PPXNAWXXIAKITB-CYBMUJFWSA-N 0 1 389.949 3.374 10 0 GGAEMN CC(C)n1cncc1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000424137205 566514454 /nfs/dbraw/zinc/51/44/54/566514454.db2.gz APDACULVUGFUBM-UHFFFAOYSA-N 0 1 393.329 3.353 10 0 GGAEMN C[C@@H]1CN(c2ncc(Br)c3ccc(F)cc32)C[C@H](C)N1CCO ZINC000651355216 566516875 /nfs/dbraw/zinc/51/68/75/566516875.db2.gz JOSIYWXPECBIDQ-TXEJJXNPSA-N 0 1 382.277 3.028 10 0 GGAEMN CC(C)n1cncc1CN[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000424190867 566517624 /nfs/dbraw/zinc/51/76/24/566517624.db2.gz MYKJHPKNGZXDNT-INIZCTEOSA-N 0 1 377.286 3.122 10 0 GGAEMN CN1CC[C@@H](CNCc2csc(COc3ccc(Cl)cc3)n2)CC1=O ZINC000424183221 566517918 /nfs/dbraw/zinc/51/79/18/566517918.db2.gz AXUCAUHFFFPBEW-CYBMUJFWSA-N 0 1 379.913 3.334 10 0 GGAEMN CN(C)C(=O)C1CCN(Cc2ccnc3c(Br)cccc23)CC1 ZINC000449010165 566519599 /nfs/dbraw/zinc/51/95/99/566519599.db2.gz YJXMYKDZTOKVMF-UHFFFAOYSA-N 0 1 376.298 3.298 10 0 GGAEMN CCN(CC)CCN(Cc1cccs1)Cc1cccc(S(C)(=O)=O)c1 ZINC000449008545 566519932 /nfs/dbraw/zinc/51/99/32/566519932.db2.gz QOEBPSOTZDINIY-UHFFFAOYSA-N 0 1 380.579 3.496 10 0 GGAEMN CCc1nocc1CN(C)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000512191135 566520526 /nfs/dbraw/zinc/52/05/26/566520526.db2.gz HKJQNMKPOCSUMD-UHFFFAOYSA-N 0 1 390.237 3.113 10 0 GGAEMN CCOC(=O)c1sc([C@@H](C)NC(=O)c2sccc2CN(C)C)nc1C ZINC000465139989 566520986 /nfs/dbraw/zinc/52/09/86/566520986.db2.gz MIJCJJRBXYJAAE-LLVKDONJSA-N 0 1 381.523 3.242 10 0 GGAEMN CS(=O)(=O)c1cccc(CNCc2cc(Cl)c3c(c2)OCCCO3)c1 ZINC000449068300 566526128 /nfs/dbraw/zinc/52/61/28/566526128.db2.gz RSOFPSMCQQZVLR-UHFFFAOYSA-N 0 1 381.881 3.195 10 0 GGAEMN CC[C@@H]1C[C@@H](C)CN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000465291599 566527230 /nfs/dbraw/zinc/52/72/30/566527230.db2.gz WJQYOPASDXMVRZ-MWLCHTKSSA-N 0 1 383.233 3.428 10 0 GGAEMN O[C@@H](CNCc1cc(Cl)sc1Cl)COc1ccc2c(c1)OCO2 ZINC000449096200 566527340 /nfs/dbraw/zinc/52/73/40/566527340.db2.gz FOEMZJLUDNPRFI-JTQLQIEISA-N 0 1 376.261 3.313 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2ccc(Br)cc2OC)[C@@H]1n1cccn1 ZINC000578502966 566528698 /nfs/dbraw/zinc/52/86/98/566528698.db2.gz YMGNTYMEOLSHDI-UAGQMJEPSA-N 0 1 380.286 3.163 10 0 GGAEMN C[C@H]1C[C@H](NC(=O)c2ncsc2Br)CN1Cc1ccccc1 ZINC000673230551 566529033 /nfs/dbraw/zinc/52/90/33/566529033.db2.gz VJDMUGINMXUMGA-AAEUAGOBSA-N 0 1 380.311 3.298 10 0 GGAEMN C[C@H]1C[C@@H](NC(=O)c2ncsc2Br)CN1Cc1ccccc1 ZINC000673230553 566530011 /nfs/dbraw/zinc/53/00/11/566530011.db2.gz VJDMUGINMXUMGA-WCQYABFASA-N 0 1 380.311 3.298 10 0 GGAEMN COc1ccc(CN2CCC[C@H](C(=O)N3CCCC3)C2)cc1Br ZINC000538729000 566531444 /nfs/dbraw/zinc/53/14/44/566531444.db2.gz KKEGXSVZNWOGOR-HNNXBMFYSA-N 0 1 381.314 3.292 10 0 GGAEMN Cc1ccc2nc(CN[C@@H](C(N)=O)c3ccc(Br)cc3F)[nH]c2c1 ZINC000465407263 566531443 /nfs/dbraw/zinc/53/14/43/566531443.db2.gz SFKNTLWFCBZKIQ-MRXNPFEDSA-N 0 1 391.244 3.089 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)cc3)c[nH]2)C[C@@H]1C(=O)[O-] ZINC000578532614 566531805 /nfs/dbraw/zinc/53/18/05/566531805.db2.gz WBEGGBKWWLLIQX-RISCZKNCSA-N 0 1 378.270 3.382 10 0 GGAEMN C[C@H]1CCC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)[C@@H]1C(=O)[O-] ZINC000424417938 566534133 /nfs/dbraw/zinc/53/41/33/566534133.db2.gz MPTBMNMDEFIZHV-NHYWBVRUSA-N 0 1 384.270 3.296 10 0 GGAEMN O=C(c1cccc(Br)c1O)N1CCC(C(=O)N2CCCCC2)CC1 ZINC000538751991 566533895 /nfs/dbraw/zinc/53/38/95/566533895.db2.gz ALUWNNHYKDFSGI-UHFFFAOYSA-N 0 1 395.297 3.019 10 0 GGAEMN C[C@@H]1CCC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)[C@H]1C(=O)[O-] ZINC000424417937 566534751 /nfs/dbraw/zinc/53/47/51/566534751.db2.gz MPTBMNMDEFIZHV-IAQYHMDHSA-N 0 1 384.270 3.296 10 0 GGAEMN CNC(=O)CCCN(C)Cc1cc(Br)c(C)cc1Br ZINC000628185212 566537292 /nfs/dbraw/zinc/53/72/92/566537292.db2.gz PUKIKROSLIMWOI-UHFFFAOYSA-N 0 1 392.135 3.478 10 0 GGAEMN Cc1nc(C)c(CNCCC(=O)N(C)Cc2ccccc2Br)o1 ZINC000628214725 566540264 /nfs/dbraw/zinc/54/02/64/566540264.db2.gz KXKXWANIOROCND-UHFFFAOYSA-N 0 1 380.286 3.192 10 0 GGAEMN O=C(Nc1ccccc1CN1CCC(O)CC1)c1nscc1Br ZINC000651605779 566540460 /nfs/dbraw/zinc/54/04/60/566540460.db2.gz UFFISTNWCXQDAS-UHFFFAOYSA-N 0 1 396.310 3.115 10 0 GGAEMN O=C1[C@@H](NCc2cc(F)cc(Br)c2)CCCN1c1cccnc1 ZINC000449241567 566540553 /nfs/dbraw/zinc/54/05/53/566540553.db2.gz SYLBGIDEGRQSHR-INIZCTEOSA-N 0 1 378.245 3.268 10 0 GGAEMN CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1cccc(Cl)c1 ZINC000673570199 566543965 /nfs/dbraw/zinc/54/39/65/566543965.db2.gz PGKMKECUFJVEHF-IBGZPJMESA-N 0 1 378.925 3.376 10 0 GGAEMN O=C(CCCCc1cn[nH]n1)NCC/C=C\c1ccc(Br)cc1 ZINC000628335850 566547639 /nfs/dbraw/zinc/54/76/39/566547639.db2.gz VAGVOROWEJHFKE-HYXAFXHYSA-N 0 1 377.286 3.500 10 0 GGAEMN CN(C(=O)c1cc(F)c(Br)c(Cl)c1)[C@@H]1CN2CCC1CC2 ZINC000512679111 566548702 /nfs/dbraw/zinc/54/87/02/566548702.db2.gz VGKSILLWWFFIMH-CYBMUJFWSA-N 0 1 375.669 3.408 10 0 GGAEMN C[C@H](N[C@@H]1CCc2c1ccc(F)c2Br)C1(S(C)(=O)=O)CC1 ZINC000449322028 566548857 /nfs/dbraw/zinc/54/88/57/566548857.db2.gz NXGZVMZRFAKUNX-TVQRCGJNSA-N 0 1 376.291 3.131 10 0 GGAEMN O=C(N[C@@H](c1cccc(F)c1)c1cccc(Br)c1)c1ncn[nH]1 ZINC000512683974 566550307 /nfs/dbraw/zinc/55/03/07/566550307.db2.gz AMRLGBGOGAPASK-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN O=C(N[C@@H](c1cccc(F)c1)c1cccc(Br)c1)c1nc[nH]n1 ZINC000512683974 566550317 /nfs/dbraw/zinc/55/03/17/566550317.db2.gz AMRLGBGOGAPASK-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)CN1CCOC[C@@H]1CC1CCC1 ZINC000559465228 566550431 /nfs/dbraw/zinc/55/04/31/566550431.db2.gz IOMXCBUQZILDEW-IRXDYDNUSA-N 0 1 384.314 3.080 10 0 GGAEMN Cc1nnc(SCCC(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)[nH]1 ZINC000673645365 566551087 /nfs/dbraw/zinc/55/10/87/566551087.db2.gz APYUUGUCESUFNL-IUCAKERBSA-N 0 1 390.353 3.185 10 0 GGAEMN C[C@](CO)(NCC1=Cc2cc(Br)ccc2OC1)c1cccc(O)c1 ZINC000628373943 566552669 /nfs/dbraw/zinc/55/26/69/566552669.db2.gz OOMGEWWDJINWHM-LJQANCHMSA-N 0 1 390.277 3.428 10 0 GGAEMN C[C@@H](CN[C@H](C)c1ncc(Br)cn1)c1ccc(S(C)(=O)=O)cc1 ZINC000449340228 566552806 /nfs/dbraw/zinc/55/28/06/566552806.db2.gz NHKZXOIXRAYFSU-NWDGAFQWSA-N 0 1 398.326 3.097 10 0 GGAEMN C[C@H](CN[C@@H](C)c1ncc(Br)cn1)c1ccc(S(C)(=O)=O)cc1 ZINC000449340227 566552925 /nfs/dbraw/zinc/55/29/25/566552925.db2.gz NHKZXOIXRAYFSU-NEPJUHHUSA-N 0 1 398.326 3.097 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2cccc(Br)c2F)c2ccccc21 ZINC000449358868 566553110 /nfs/dbraw/zinc/55/31/10/566553110.db2.gz PAAAIIOWYVATFG-LBPRGKRZSA-N 0 1 384.270 3.249 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2ccc(F)cc2Br)c2ccccc21 ZINC000449356011 566553167 /nfs/dbraw/zinc/55/31/67/566553167.db2.gz FHJOXYOXQBSTCY-GFCCVEGCSA-N 0 1 384.270 3.249 10 0 GGAEMN CCCN1C(=O)N=NC1SCc1nc2ccc(Br)cc2n1C ZINC000486057941 566553424 /nfs/dbraw/zinc/55/34/24/566553424.db2.gz ZLDJHAGGKPMTQH-UHFFFAOYSA-N 0 1 382.287 3.335 10 0 GGAEMN CN(C)[C@@H](CNC(=O)CN(C)c1ccc(Cl)cn1)c1ccc(Cl)cc1 ZINC000673749435 566554556 /nfs/dbraw/zinc/55/45/56/566554556.db2.gz NTUGQWMFMCCAPO-INIZCTEOSA-N 0 1 381.307 3.244 10 0 GGAEMN Cn1ccnc1CN1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449389925 566556144 /nfs/dbraw/zinc/55/61/44/566556144.db2.gz FCKOCBFJJSCGHT-CQSZACIVSA-N 0 1 381.261 3.089 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc[nH]c1C1CC1 ZINC000559563419 566556950 /nfs/dbraw/zinc/55/69/50/566556950.db2.gz LMSFMKLJAORBIO-UHFFFAOYSA-N 0 1 386.253 3.370 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc[nH]c1C1CC1 ZINC000559563419 566556954 /nfs/dbraw/zinc/55/69/54/566556954.db2.gz LMSFMKLJAORBIO-UHFFFAOYSA-N 0 1 386.253 3.370 10 0 GGAEMN COC(=O)c1cc(Cl)ccc1S(=O)(=O)Nc1ccc2c(c1)CCCO2 ZINC000512785727 566557434 /nfs/dbraw/zinc/55/74/34/566557434.db2.gz NSFCYFNKAICTSX-UHFFFAOYSA-N 0 1 381.837 3.252 10 0 GGAEMN CCOc1cc(CN2C[C@@H]3CCC[C@]3(CO)C2)cc(Br)c1OC ZINC000628461351 566557875 /nfs/dbraw/zinc/55/78/75/566557875.db2.gz VYPQCXVWMAUYFO-KBXCAEBGSA-N 0 1 384.314 3.451 10 0 GGAEMN CSc1cc(Br)ccc1CN[C@H](C)C1(S(C)(=O)=O)CC1 ZINC000512880745 566565634 /nfs/dbraw/zinc/56/56/34/566565634.db2.gz XEYRFOBZMNEILI-SNVBAGLBSA-N 0 1 378.357 3.226 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1CC[C@H](CO)[C@H]1CC ZINC000449425255 566560463 /nfs/dbraw/zinc/56/04/63/566560463.db2.gz PVQKAFRQQSVRJI-RHSMWYFYSA-N 0 1 386.330 3.457 10 0 GGAEMN CCOc1c(Br)cc(CNC2(CF)CCOCC2)cc1OC ZINC000449447120 566562143 /nfs/dbraw/zinc/56/21/43/566562143.db2.gz XCHQVMGWPLIUIV-UHFFFAOYSA-N 0 1 376.266 3.465 10 0 GGAEMN COc1ccc(Cl)cc1[C@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000578891064 566562198 /nfs/dbraw/zinc/56/21/98/566562198.db2.gz DENTUFAKGZFPTB-JSGCOSHPSA-N 0 1 381.881 3.234 10 0 GGAEMN CCOc1cc(CNC2(CF)CCOCC2)cc(Br)c1OC ZINC000449446919 566562245 /nfs/dbraw/zinc/56/22/45/566562245.db2.gz VRCCBKFNBZCGER-UHFFFAOYSA-N 0 1 376.266 3.465 10 0 GGAEMN O=C1[C@@H](NCc2ccc(Cl)c(C(F)(F)F)c2)CCN1C1CCOCC1 ZINC000673886217 566563493 /nfs/dbraw/zinc/56/34/93/566563493.db2.gz TYOUCWXUZIXGPB-HNNXBMFYSA-N 0 1 376.806 3.228 10 0 GGAEMN C[C@@H](NCc1ccc(OC(F)F)c(Br)c1)C1(S(C)(=O)=O)CC1 ZINC000512860743 566564020 /nfs/dbraw/zinc/56/40/20/566564020.db2.gz KGGLUICLDAPAIL-SECBINFHSA-N 0 1 398.269 3.106 10 0 GGAEMN C[S@@](=O)c1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000512869063 566564269 /nfs/dbraw/zinc/56/42/69/566564269.db2.gz MTRPOQJRROSOHO-VGOFRKELSA-N 0 1 382.323 3.184 10 0 GGAEMN C[S@@](=O)c1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000512869061 566564325 /nfs/dbraw/zinc/56/43/25/566564325.db2.gz MTRPOQJRROSOHO-HTAPYJJXSA-N 0 1 382.323 3.184 10 0 GGAEMN COCCOc1cccc(CN[C@](C)(CO)c2ccc(Br)cc2)c1 ZINC000512858327 566564936 /nfs/dbraw/zinc/56/49/36/566564936.db2.gz WHPCODCFEPQFCU-LJQANCHMSA-N 0 1 394.309 3.472 10 0 GGAEMN CSc1cc(Br)ccc1CN[C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000512880744 566566552 /nfs/dbraw/zinc/56/65/52/566566552.db2.gz XEYRFOBZMNEILI-JTQLQIEISA-N 0 1 378.357 3.226 10 0 GGAEMN COc1ncc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cc1Br ZINC000424747416 566566039 /nfs/dbraw/zinc/56/60/39/566566039.db2.gz GDIVJOZRFMYUJX-JKSUJKDBSA-N 0 1 390.281 3.028 10 0 GGAEMN CCN(C)c1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cn1 ZINC000512890376 566566229 /nfs/dbraw/zinc/56/62/29/566566229.db2.gz JUFMQFJWVJLPRE-SFHVURJKSA-N 0 1 378.314 3.298 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)Cc2noc3ccc(Br)cc32)C[C@H]1C ZINC000424747238 566566369 /nfs/dbraw/zinc/56/63/69/566566369.db2.gz MRDJLSUNGUPJEB-VXGBXAGGSA-N 0 1 380.286 3.074 10 0 GGAEMN COCCOc1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000512873947 566566646 /nfs/dbraw/zinc/56/66/46/566566646.db2.gz HWZACZKXYKVSBY-IBGZPJMESA-N 0 1 394.309 3.472 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)Cc2noc3ccc(Br)cc32)C[C@@H]1C ZINC000424747237 566566874 /nfs/dbraw/zinc/56/68/74/566566874.db2.gz MRDJLSUNGUPJEB-RYUDHWBXSA-N 0 1 380.286 3.074 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@](O)(C(F)F)C1 ZINC000449474423 566567998 /nfs/dbraw/zinc/56/79/98/566567998.db2.gz RVGOLQLLAFEUCU-INIZCTEOSA-N 0 1 386.240 3.145 10 0 GGAEMN O=C(NCc1c[nH]nn1)c1cccc(Sc2cccc(Br)c2)n1 ZINC000673951668 566568986 /nfs/dbraw/zinc/56/89/86/566568986.db2.gz QPARXPZMDHERMO-UHFFFAOYSA-N 0 1 390.266 3.043 10 0 GGAEMN COc1ccc([C@H](C)[C@@H](C)NCc2nn(C)cc2Br)cc1OC ZINC000449484759 566569841 /nfs/dbraw/zinc/56/98/41/566569841.db2.gz NMMSIOMIHVUYPS-VXGBXAGGSA-N 0 1 382.302 3.482 10 0 GGAEMN CCC[C@H](C)[C@@H](CO)NCc1ncc(Br)cc1Br ZINC000651893941 566572920 /nfs/dbraw/zinc/57/29/20/566572920.db2.gz LUMSEASQTGWXCA-TVQRCGJNSA-N 0 1 380.124 3.493 10 0 GGAEMN CCN1C[C@H](NCc2cnc(-c3ccc(Br)cc3)s2)CC1=O ZINC000449524051 566573511 /nfs/dbraw/zinc/57/35/11/566573511.db2.gz ZNGVUDAWGLACES-CYBMUJFWSA-N 0 1 380.311 3.283 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CNCc1cc(Cl)ccc1Br ZINC000513021679 566574339 /nfs/dbraw/zinc/57/43/39/566574339.db2.gz IBPHEJKHPYXCGT-ZDUSSCGKSA-N 0 1 395.750 3.006 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc(C(F)(F)F)ccc1Cl ZINC000513028136 566574470 /nfs/dbraw/zinc/57/44/70/566574470.db2.gz VRUFQAJOTWTKGZ-CYBMUJFWSA-N 0 1 384.851 3.263 10 0 GGAEMN COC[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccc(F)cc1 ZINC000539377162 566577089 /nfs/dbraw/zinc/57/70/89/566577089.db2.gz OVTUYJFGHUMKMK-SJLPKXTDSA-N 0 1 398.272 3.305 10 0 GGAEMN COC[C@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccc(F)cc1 ZINC000539377160 566577482 /nfs/dbraw/zinc/57/74/82/566577482.db2.gz OVTUYJFGHUMKMK-AEFFLSMTSA-N 0 1 398.272 3.305 10 0 GGAEMN CSCCN[C@@H](CNS(=O)(=O)c1ccc(C)cc1C)c1ccccc1 ZINC000539357029 566577497 /nfs/dbraw/zinc/57/74/97/566577497.db2.gz QAGCMTVAKSJUTE-SFHVURJKSA-N 0 1 378.563 3.276 10 0 GGAEMN COCc1cnc(CNC[C@H](CO)Cc2ccc(C)c(Br)c2)s1 ZINC000449599446 566580819 /nfs/dbraw/zinc/58/08/19/566580819.db2.gz KWHXAARILYSCQY-CQSZACIVSA-N 0 1 399.354 3.301 10 0 GGAEMN COC(=O)[C@H](NS(=O)(=O)c1c(F)cccc1Cl)c1ccc(F)c(C)c1 ZINC000466526031 566582629 /nfs/dbraw/zinc/58/26/29/566582629.db2.gz HQSRHYKUIIHQKN-CQSZACIVSA-N 0 1 389.807 3.119 10 0 GGAEMN COC(=O)C[C@](C)(NCc1ccc(OC)nc1)c1ccc(Br)cc1 ZINC000513134215 566582699 /nfs/dbraw/zinc/58/26/99/566582699.db2.gz VAORTDAVJACENE-SFHVURJKSA-N 0 1 393.281 3.421 10 0 GGAEMN Cn1cc(I)c(CN[C@@H]2CC[C@@H](c3ccccc3)C2)n1 ZINC000449604878 566583464 /nfs/dbraw/zinc/58/34/64/566583464.db2.gz LTDCFDQHUOXTHW-ZIAGYGMSSA-N 0 1 381.261 3.451 10 0 GGAEMN O=C(NC[C@@H]1CN(c2ccc(Cl)cc2)CCO1)c1ccc(O)c(Cl)c1 ZINC000628745734 566584227 /nfs/dbraw/zinc/58/42/27/566584227.db2.gz ZJTWATVMAVRXBA-OAHLLOKOSA-N 0 1 381.259 3.334 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2ccc(C(N)=O)c(Cl)c2)c2ccccc2n1C ZINC000560008062 566584710 /nfs/dbraw/zinc/58/47/10/566584710.db2.gz ZVMQECLNWWPYOQ-UHFFFAOYSA-N 0 1 377.853 3.040 10 0 GGAEMN Cn1c(=O)ccc2c1CCC[C@@H]2NCc1cc2c(cc1Br)OCO2 ZINC000652044374 566585771 /nfs/dbraw/zinc/58/57/71/566585771.db2.gz LIQKMUFPWRPEFM-AWEZNQCLSA-N 0 1 391.265 3.044 10 0 GGAEMN CCc1[nH]nc(C(=O)N2CCC[C@]3(C2)OCc2ccccc23)c1Br ZINC000579184443 566587068 /nfs/dbraw/zinc/58/70/68/566587068.db2.gz CMBMNFZSWGZPBJ-GOSISDBHSA-N 0 1 390.281 3.396 10 0 GGAEMN COc1ccc(CN[C@H]2CCCc3c2ccc(=O)n3C)c(Br)c1 ZINC000652049545 566587775 /nfs/dbraw/zinc/58/77/75/566587775.db2.gz JKTKSFWYRBVGSZ-INIZCTEOSA-N 0 1 377.282 3.324 10 0 GGAEMN C[C@H](CN1CCCCC1)NS(=O)(=O)c1cccc(Br)c1Cl ZINC000560039440 566589816 /nfs/dbraw/zinc/58/98/16/566589816.db2.gz WSDASCMYHPABSG-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN CCC[C@@H]1CN(C(=O)Nc2cc(Cl)c(Cl)cn2)CCN1CCOC ZINC000466676953 566590072 /nfs/dbraw/zinc/59/00/72/566590072.db2.gz HTNPOBXTCNWVOJ-GFCCVEGCSA-N 0 1 375.300 3.353 10 0 GGAEMN CCC[C@H]1CN(C(=O)Nc2cc(Cl)c(Cl)cn2)CCN1CCOC ZINC000466676954 566590349 /nfs/dbraw/zinc/59/03/49/566590349.db2.gz HTNPOBXTCNWVOJ-LBPRGKRZSA-N 0 1 375.300 3.353 10 0 GGAEMN COCC(C)(C)N1CCN(C(=O)c2c[nH]c3cccc(Br)c23)CC1 ZINC000424992805 566593607 /nfs/dbraw/zinc/59/36/07/566593607.db2.gz SUMKDDJXOTVNSB-UHFFFAOYSA-N 0 1 394.313 3.113 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CN1CCCCCC1=O)c1ccc(Cl)c(Cl)c1 ZINC000628968677 566600066 /nfs/dbraw/zinc/60/00/66/566600066.db2.gz MIGCPFJQLWCOER-MRXNPFEDSA-N 0 1 386.323 3.115 10 0 GGAEMN CON1CCC(CC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000628969333 566600179 /nfs/dbraw/zinc/60/01/79/566600179.db2.gz RNLXDNXZSLYIKL-KRWDZBQOSA-N 0 1 388.339 3.376 10 0 GGAEMN O=C(NC1CCN(Cc2ccncc2)CC1)c1ccsc1Br ZINC000449785309 566600281 /nfs/dbraw/zinc/60/02/81/566600281.db2.gz FNASTNZKXPNTEW-UHFFFAOYSA-N 0 1 380.311 3.300 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CNC(=O)CC(C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968393 566600332 /nfs/dbraw/zinc/60/03/32/566600332.db2.gz HOPKUSLMQYURFY-OAHLLOKOSA-N 0 1 388.339 3.265 10 0 GGAEMN O[C@]1(CCN[C@H](c2ccc(Br)o2)c2ccc(F)cc2)CCOC1 ZINC000652262079 566600442 /nfs/dbraw/zinc/60/04/42/566600442.db2.gz PBXHKSVGRLQQPX-DLBZAZTESA-N 0 1 384.245 3.402 10 0 GGAEMN C[C@H](OC[C@H]1CCCO1)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968879 566600398 /nfs/dbraw/zinc/60/03/98/566600398.db2.gz UXDDTUGOKUNDJF-QEORTHHSSA-N 0 1 389.323 3.296 10 0 GGAEMN C[C@H](Cc1cnn(C)c1)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968045 566600410 /nfs/dbraw/zinc/60/04/10/566600410.db2.gz AHGUSGUOTDNNDD-SJKOYZFVSA-N 0 1 383.323 3.325 10 0 GGAEMN C[C@H](OC[C@H]1CCCO1)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968877 566600432 /nfs/dbraw/zinc/60/04/32/566600432.db2.gz UXDDTUGOKUNDJF-DXCKQFNASA-N 0 1 389.323 3.296 10 0 GGAEMN CCOCCO[C@@H](C)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968609 566600548 /nfs/dbraw/zinc/60/05/48/566600548.db2.gz KYWVNFAJOYOPCV-BLLLJJGKSA-N 0 1 377.312 3.154 10 0 GGAEMN CCOCCO[C@@H](C)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968614 566600739 /nfs/dbraw/zinc/60/07/39/566600739.db2.gz KYWVNFAJOYOPCV-LRDDRELGSA-N 0 1 377.312 3.154 10 0 GGAEMN Cc1nccc(CCC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)n1 ZINC000628969241 566600869 /nfs/dbraw/zinc/60/08/69/566600869.db2.gz PQXBVSUCZHUEBF-QGZVFWFLSA-N 0 1 381.307 3.444 10 0 GGAEMN CC(=O)NCCCCCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968806 566601150 /nfs/dbraw/zinc/60/11/50/566601150.db2.gz QAZBBJYYOPGRGN-QGZVFWFLSA-N 0 1 388.339 3.409 10 0 GGAEMN CC(C)NC(=O)CCCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968888 566601199 /nfs/dbraw/zinc/60/11/99/566601199.db2.gz VIWTZIDISFJHDH-MRXNPFEDSA-N 0 1 388.339 3.407 10 0 GGAEMN C[C@@H]1CN(CCO)CCN1Cc1csc(-c2cccc(Br)c2)n1 ZINC000449785885 566601380 /nfs/dbraw/zinc/60/13/80/566601380.db2.gz JRINYMFDFNIXLX-CYBMUJFWSA-N 0 1 396.354 3.071 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2cc(Br)c(F)cc2Cl)c1 ZINC000674646742 566601384 /nfs/dbraw/zinc/60/13/84/566601384.db2.gz OKUOUHLKUKKRQP-UHFFFAOYSA-N 0 1 382.642 3.259 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1nc2cc(Br)ccc2[nH]1 ZINC000560174234 566604091 /nfs/dbraw/zinc/60/40/91/566604091.db2.gz JTEFYTGZJVSNTQ-CYBMUJFWSA-N 0 1 379.302 3.206 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000560174234 566604102 /nfs/dbraw/zinc/60/41/02/566604102.db2.gz JTEFYTGZJVSNTQ-CYBMUJFWSA-N 0 1 379.302 3.206 10 0 GGAEMN Cc1cnc(CCCC(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)o1 ZINC000449813923 566604127 /nfs/dbraw/zinc/60/41/27/566604127.db2.gz ZOOKVNDRKIGQOY-UHFFFAOYSA-N 0 1 390.241 3.492 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1nc2cc(Br)ccc2[nH]1 ZINC000560174236 566604498 /nfs/dbraw/zinc/60/44/98/566604498.db2.gz JTEFYTGZJVSNTQ-ZDUSSCGKSA-N 0 1 379.302 3.206 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000560174236 566604522 /nfs/dbraw/zinc/60/45/22/566604522.db2.gz JTEFYTGZJVSNTQ-ZDUSSCGKSA-N 0 1 379.302 3.206 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@@H](CCF)C1 ZINC000629020431 566605738 /nfs/dbraw/zinc/60/57/38/566605738.db2.gz TXKQYRUVPPDFAI-LBPRGKRZSA-N 0 1 382.233 3.040 10 0 GGAEMN O=C(NCc1c[nH]nn1)[C@@H](Oc1ccccc1Br)c1ccccc1 ZINC000674755517 566605919 /nfs/dbraw/zinc/60/59/19/566605919.db2.gz SMTXFNFULDDGPA-INIZCTEOSA-N 0 1 387.237 3.004 10 0 GGAEMN Cc1c(C2CC2)nc2ccc(Br)cc2c1C(=O)NCc1c[nH]nn1 ZINC000674755617 566606447 /nfs/dbraw/zinc/60/64/47/566606447.db2.gz WZOSZGLOFKYUBZ-UHFFFAOYSA-N 0 1 386.253 3.231 10 0 GGAEMN O=C(NCc1c[nH]nn1)Nc1ccc(Oc2cccc(Br)c2)nc1 ZINC000674757906 566606954 /nfs/dbraw/zinc/60/69/54/566606954.db2.gz WSLOQMVOOXUJHH-UHFFFAOYSA-N 0 1 389.213 3.076 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(C)c(Br)c3)[nH]c2c1 ZINC000466921056 566609132 /nfs/dbraw/zinc/60/91/32/566609132.db2.gz VKLACNDSSIWNKC-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN CN(C)C[C@H]1CCCN1S(=O)(=O)c1ccc2ccccc2c1Br ZINC000425170746 566609312 /nfs/dbraw/zinc/60/93/12/566609312.db2.gz SYQIPYOXHFOSAJ-CQSZACIVSA-N 0 1 397.338 3.317 10 0 GGAEMN COC(=O)c1ccc(CN2CCC(c3ncc[nH]3)CC2)c(Br)c1 ZINC000560261279 566611108 /nfs/dbraw/zinc/61/11/08/566611108.db2.gz UBMHHGXTZGFCMJ-UHFFFAOYSA-N 0 1 378.270 3.338 10 0 GGAEMN O=C(c1cccc(Br)c1O)N(C[C@@H]1CCCO1)[C@H]1CCSC1 ZINC000539889256 566611840 /nfs/dbraw/zinc/61/18/40/566611840.db2.gz DJQGKHLKHBHCMI-RYUDHWBXSA-N 0 1 386.311 3.281 10 0 GGAEMN O=C(c1cccc(Br)c1O)N(C[C@@H]1CCCO1)[C@@H]1CCSC1 ZINC000539889254 566611862 /nfs/dbraw/zinc/61/18/62/566611862.db2.gz DJQGKHLKHBHCMI-NEPJUHHUSA-N 0 1 386.311 3.281 10 0 GGAEMN Cc1c2cc(Br)ccc2oc1C(=O)NC1(c2nn[nH]n2)CCCC1 ZINC000605529874 566612648 /nfs/dbraw/zinc/61/26/48/566612648.db2.gz BTTQYEUEVWMXIG-UHFFFAOYSA-N 0 1 390.241 3.216 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](CCC[C@H]2CCOC2)C[C@H]1c1ccc(Br)cc1 ZINC000652506454 566614179 /nfs/dbraw/zinc/61/41/79/566614179.db2.gz SZZRYNLGYOVMAB-RRQGHBQHSA-N 0 1 382.298 3.366 10 0 GGAEMN O=C([O-])C[N@@H+](Cc1cc2c(cc1Br)OCCO2)C1CCCCC1 ZINC000652482529 566614258 /nfs/dbraw/zinc/61/42/58/566614258.db2.gz GZKNLRGROKUTKL-UHFFFAOYSA-N 0 1 384.270 3.440 10 0 GGAEMN O=C(c1cc(Br)c(F)cc1[O-])N1CCC[N@H+](C2CCCC2)CC1 ZINC000449914361 566614685 /nfs/dbraw/zinc/61/46/85/566614685.db2.gz QBDGNEFOADJHHR-UHFFFAOYSA-N 0 1 385.277 3.384 10 0 GGAEMN CC(C)c1nc([C@H](C)NC(=O)NCCc2ccccc2Br)n[nH]1 ZINC000560294030 566615350 /nfs/dbraw/zinc/61/53/50/566615350.db2.gz FKVLSMIXSBPQLS-NSHDSACASA-N 0 1 380.290 3.294 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1F)N[C@@H]1CCc2nc[nH]c2C1 ZINC000560344737 566616482 /nfs/dbraw/zinc/61/64/82/566616482.db2.gz GWNYQFLVKLYYOB-GFCCVEGCSA-N 0 1 398.301 3.218 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@H]1C1CC1 ZINC000652515221 566616733 /nfs/dbraw/zinc/61/67/33/566616733.db2.gz UDSYOLWXFFIUHW-WDEREUQCSA-N 0 1 398.282 3.103 10 0 GGAEMN NS(=O)(=O)C[C@@H]1CCCN1Cc1cccc(Oc2ccc(Cl)cc2)c1 ZINC000674908989 566618281 /nfs/dbraw/zinc/61/82/81/566618281.db2.gz VONBKAFUYLAGIE-INIZCTEOSA-N 0 1 380.897 3.385 10 0 GGAEMN Cc1cc(C2(C(=O)NCCc3nc[nH]n3)CCCCC2)ccc1Br ZINC000449956589 566619470 /nfs/dbraw/zinc/61/94/70/566619470.db2.gz AHDAUGPXJDXRCI-UHFFFAOYSA-N 0 1 391.313 3.436 10 0 GGAEMN Cc1c(Br)ccc(C(=O)Nc2ccn(-c3ccncc3)n2)c1F ZINC000579552619 566619391 /nfs/dbraw/zinc/61/93/91/566619391.db2.gz OQKJNZUNKHRWRY-UHFFFAOYSA-N 0 1 375.201 3.152 10 0 GGAEMN C[C@@H]1CN(CCCOc2cccc(I)c2)[C@H](C)CO1 ZINC000513716720 566620017 /nfs/dbraw/zinc/62/00/17/566620017.db2.gz HEHWCOAKLZPJLE-CHWSQXEVSA-N 0 1 375.250 3.169 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCc2ccc(O)cc2CC1 ZINC000605887515 566620083 /nfs/dbraw/zinc/62/00/83/566620083.db2.gz ZAFQEAKMBJYULN-UHFFFAOYSA-N 0 1 386.249 3.272 10 0 GGAEMN CNS(=O)(=O)CCCN(Cc1ccccc1Br)C1CCCC1 ZINC000486789648 566622295 /nfs/dbraw/zinc/62/22/95/566622295.db2.gz BBSATSZTHXKHOO-UHFFFAOYSA-N 0 1 389.359 3.133 10 0 GGAEMN O=C(Nc1ccn(-c2ccncc2)n1)c1c[nH]c2cccc(Br)c12 ZINC000486805646 566623422 /nfs/dbraw/zinc/62/34/22/566623422.db2.gz QPRQJHHWSIGRNB-UHFFFAOYSA-N 0 1 382.221 3.185 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC(C2(O)CC2)CC1 ZINC000652666778 566623933 /nfs/dbraw/zinc/62/39/33/566623933.db2.gz SRZOTUAMSIZLEU-UHFFFAOYSA-N 0 1 390.281 3.216 10 0 GGAEMN CO[C@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CC[C@H]1C ZINC000467078381 566624041 /nfs/dbraw/zinc/62/40/41/566624041.db2.gz HACLZOJRXCFLAG-BZNIZROVSA-N 0 1 378.270 3.336 10 0 GGAEMN Cc1nc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)c(Br)s1 ZINC000579603389 566624497 /nfs/dbraw/zinc/62/44/97/566624497.db2.gz TWVHDHLJLADBNI-JSGCOSHPSA-N 0 1 380.311 3.389 10 0 GGAEMN CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000467109746 566625160 /nfs/dbraw/zinc/62/51/60/566625160.db2.gz IBCDZGXTEKYFRJ-SNVBAGLBSA-N 0 1 381.263 3.234 10 0 GGAEMN COCc1cnc(CNC[C@@H](c2cccc(Cl)c2)N2CCOCC2)s1 ZINC000540069391 566625951 /nfs/dbraw/zinc/62/59/51/566625951.db2.gz QIIVZTLCHVZMKJ-KRWDZBQOSA-N 0 1 381.929 3.106 10 0 GGAEMN Cc1nnc(SCC(=O)N2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)[nH]1 ZINC000629247256 566626576 /nfs/dbraw/zinc/62/65/76/566626576.db2.gz OYHGJPWCPAQFQL-GXFFZTMASA-N 0 1 395.326 3.372 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)n1 ZINC000629247256 566626580 /nfs/dbraw/zinc/62/65/80/566626580.db2.gz OYHGJPWCPAQFQL-GXFFZTMASA-N 0 1 395.326 3.372 10 0 GGAEMN O=C(N[C@@H](C1CC1)C1CCOCC1)c1n[nH]c2ccc(Br)cc21 ZINC000652769584 566626685 /nfs/dbraw/zinc/62/66/85/566626685.db2.gz KEARRCXFEHJVBZ-HNNXBMFYSA-N 0 1 378.270 3.260 10 0 GGAEMN O=C(N[C@@H](C1CC1)C1CCOCC1)c1cc(Br)cc2nc[nH]c21 ZINC000652768401 566627760 /nfs/dbraw/zinc/62/77/60/566627760.db2.gz HPZNTZYVXAMVSI-HNNXBMFYSA-N 0 1 378.270 3.260 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000579657985 566627913 /nfs/dbraw/zinc/62/79/13/566627913.db2.gz RPUKVLHPCBLJIP-ZYHUDNBSSA-N 0 1 393.285 3.099 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCC[C@@H]1c1ccc(Br)cn1 ZINC000560481925 566630070 /nfs/dbraw/zinc/63/00/70/566630070.db2.gz YCYXQHIROBSLND-BLLLJJGKSA-N 0 1 375.270 3.351 10 0 GGAEMN CCn1c(-c2cccc(Br)c2)nnc1N1CCN(C2CC2)CC1 ZINC000579688099 566630193 /nfs/dbraw/zinc/63/01/93/566630193.db2.gz XDJDJZLRIOYRPW-UHFFFAOYSA-N 0 1 376.302 3.012 10 0 GGAEMN CN(C)C[C@@H](N[C@@H](Cc1ccccc1)C(N)=O)c1ccc(Cl)c(Cl)c1 ZINC000629264480 566630654 /nfs/dbraw/zinc/63/06/54/566630654.db2.gz PCMLSZNNOWFQBJ-ZWKOTPCHSA-N 0 1 380.319 3.282 10 0 GGAEMN CCN(C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1)[C@H]1CCCOC1 ZINC000652816477 566630795 /nfs/dbraw/zinc/63/07/95/566630795.db2.gz CYGQHIPRUOPFLG-AWEZNQCLSA-N 0 1 378.270 3.480 10 0 GGAEMN CN(C)C[C@H](N[C@H](Cc1ccccc1)C(N)=O)c1ccc(Cl)c(Cl)c1 ZINC000629264475 566631154 /nfs/dbraw/zinc/63/11/54/566631154.db2.gz PCMLSZNNOWFQBJ-MSOLQXFVSA-N 0 1 380.319 3.282 10 0 GGAEMN COc1cc(Br)c(NC(=O)[C@@H]2CCCc3[nH]ncc32)cc1OC ZINC000467184353 566631369 /nfs/dbraw/zinc/63/13/69/566631369.db2.gz ZJTRAYYIOOTNDR-SECBINFHSA-N 0 1 380.242 3.248 10 0 GGAEMN C[C@H](CC(=O)N1CCC(c2n[nH]c(=O)o2)CC1)c1ccc(Br)cc1 ZINC000425328172 566631387 /nfs/dbraw/zinc/63/13/87/566631387.db2.gz WUWIVAMYISZSMO-LLVKDONJSA-N 0 1 394.269 3.438 10 0 GGAEMN CS(=O)(=O)N1CC[C@@H](CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000513883002 566632324 /nfs/dbraw/zinc/63/23/24/566632324.db2.gz UPKHKPDTHGAUMQ-BLLLJJGKSA-N 0 1 377.337 3.412 10 0 GGAEMN COC(=O)c1cccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)c1 ZINC000467209891 566633842 /nfs/dbraw/zinc/63/38/42/566633842.db2.gz ZKSRSMLYTOERFF-UHFFFAOYSA-N 0 1 388.221 3.042 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1ccccc1OCc1cscn1)C1CC1 ZINC000629288366 566634633 /nfs/dbraw/zinc/63/46/33/566634633.db2.gz HHJHXIQTBBCSMN-QGZVFWFLSA-N 0 1 382.507 3.279 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1ccc(C)cc1OCC(F)(F)F)C1CC1 ZINC000629286975 566634818 /nfs/dbraw/zinc/63/48/18/566634818.db2.gz DZBICHHCJDJFBZ-OAHLLOKOSA-N 0 1 381.416 3.493 10 0 GGAEMN CN(C)c1nc2ccc(NC(=O)Cc3ccc(Br)cc3O)cc2[nH]1 ZINC000579737875 566634913 /nfs/dbraw/zinc/63/49/13/566634913.db2.gz SSRVATFIEZKYMX-UHFFFAOYSA-N 0 1 389.253 3.278 10 0 GGAEMN CO[C@@H](Cc1ccc(F)cc1)CS(=O)(=O)Nc1cc(F)c(F)c(F)c1 ZINC000629289741 566637153 /nfs/dbraw/zinc/63/71/53/566637153.db2.gz OENIIQFSTIVGFA-ZDUSSCGKSA-N 0 1 377.359 3.242 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ncc(Cc3ccc(F)cc3)s2)[nH]1 ZINC000467291901 566637693 /nfs/dbraw/zinc/63/76/93/566637693.db2.gz QFUCKBKKRRCMLW-UHFFFAOYSA-N 0 1 377.470 3.420 10 0 GGAEMN CC(=O)Nc1ccc(Br)cc1NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000467264233 566637817 /nfs/dbraw/zinc/63/78/17/566637817.db2.gz KIZILJBNRFKPPY-LLVKDONJSA-N 0 1 377.242 3.189 10 0 GGAEMN CN(C)S(=O)(=O)c1ccc(CN2CCC[C@H]2Cc2ccc(F)cc2)s1 ZINC000425399680 566638470 /nfs/dbraw/zinc/63/84/70/566638470.db2.gz BMFCKSUAKYAGHV-INIZCTEOSA-N 0 1 382.526 3.345 10 0 GGAEMN CO[C@H](Cc1ccc(F)cc1)CS(=O)(=O)Nc1cc(F)cc(F)c1F ZINC000629303291 566638791 /nfs/dbraw/zinc/63/87/91/566638791.db2.gz HRBJPWWDFAIVFL-CYBMUJFWSA-N 0 1 377.359 3.242 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)N=c2[n-]nc(C3CC3)s2)[C@@H]1c1cccs1 ZINC000579784707 566638799 /nfs/dbraw/zinc/63/87/99/566638799.db2.gz PPRKHYZPRALVRY-TZMCWYRMSA-N 0 1 377.539 3.104 10 0 GGAEMN COc1ccc(CCCN(C)Cc2ccc(S(=O)(=O)N(C)C)s2)cc1 ZINC000425405638 566640529 /nfs/dbraw/zinc/64/05/29/566640529.db2.gz LNFGHHODDRLMGI-UHFFFAOYSA-N 0 1 382.551 3.072 10 0 GGAEMN CCN1CCN(CC(=O)N[C@H](c2cccs2)c2ccc(Cl)cc2)CC1 ZINC000514074302 566641062 /nfs/dbraw/zinc/64/10/62/566641062.db2.gz LXCNVJWZNCGAMF-IBGZPJMESA-N 0 1 377.941 3.245 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@@H](c2nc(C)n[nH]2)C1 ZINC000514092476 566641395 /nfs/dbraw/zinc/64/13/95/566641395.db2.gz AHRYPXYBOKEUCH-GFCCVEGCSA-N 0 1 393.285 3.042 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@@H](c2nnc(C)[nH]2)C1 ZINC000514092476 566641402 /nfs/dbraw/zinc/64/14/02/566641402.db2.gz AHRYPXYBOKEUCH-GFCCVEGCSA-N 0 1 393.285 3.042 10 0 GGAEMN CC[C@H](Cc1cccc(Br)c1)C(=O)NC1(c2nn[nH]n2)CCCC1 ZINC000467323712 566642187 /nfs/dbraw/zinc/64/21/87/566642187.db2.gz SXNSVMYMTQIRJC-CYBMUJFWSA-N 0 1 392.301 3.117 10 0 GGAEMN O=C(c1cc(Br)c(F)cc1[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000450190684 566642508 /nfs/dbraw/zinc/64/25/08/566642508.db2.gz VLCPGYKKZRKVSN-ZBEGNZNMSA-N 0 1 397.288 3.383 10 0 GGAEMN O=C(c1cc(Br)c(F)cc1[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000450190683 566642555 /nfs/dbraw/zinc/64/25/55/566642555.db2.gz VLCPGYKKZRKVSN-MEDUHNTESA-N 0 1 397.288 3.383 10 0 GGAEMN CN(CCN1CCOCC1)Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000514105548 566643681 /nfs/dbraw/zinc/64/36/81/566643681.db2.gz RZSNXWWHZPOBAZ-UHFFFAOYSA-N 0 1 396.354 3.337 10 0 GGAEMN COCc1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)cc1OC ZINC000629329091 566644827 /nfs/dbraw/zinc/64/48/27/566644827.db2.gz FBVZZYJWZZSKSB-UHFFFAOYSA-N 0 1 376.356 3.056 10 0 GGAEMN Cc1c2cc(Br)cc(C)c2oc1C(=O)NCCCc1nc[nH]n1 ZINC000653027928 566646703 /nfs/dbraw/zinc/64/67/03/566646703.db2.gz ICOPETXECRPNAK-UHFFFAOYSA-N 0 1 377.242 3.293 10 0 GGAEMN CCOC(=O)c1sc2ccsc2c1CNC(=O)CN(C)[C@H]1CCSC1 ZINC000487093679 566648160 /nfs/dbraw/zinc/64/81/60/566648160.db2.gz NSMFLVXOMMJAPJ-NSHDSACASA-N 0 1 398.575 3.193 10 0 GGAEMN COC(=O)c1cnc([C@H](C)NCCCc2nc(-c3cccs3)no2)s1 ZINC000425483297 566648733 /nfs/dbraw/zinc/64/87/33/566648733.db2.gz HWPJHBXGXUZCKM-JTQLQIEISA-N 0 1 378.479 3.325 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1cccnc1C(F)(F)F)c1ccc(F)cc1 ZINC000629351309 566649656 /nfs/dbraw/zinc/64/96/56/566649656.db2.gz KNSYMOLOVXYWPV-ZDUSSCGKSA-N 0 1 378.347 3.369 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)[C@@H]2CCC[C@H]21 ZINC000629371507 566652065 /nfs/dbraw/zinc/65/20/65/566652065.db2.gz ABNBDBWPUOUOAQ-BCUIYNNISA-N 0 1 388.291 3.308 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCO3)[C@@H]2CCC[C@@H]21 ZINC000629373088 566652853 /nfs/dbraw/zinc/65/28/53/566652853.db2.gz JXJFQNFRJXKPMX-YRGRVCCFSA-N 0 1 382.254 3.253 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(c(Br)c2)OCO3)[C@@H]2CCC[C@@H]21 ZINC000629372007 566653174 /nfs/dbraw/zinc/65/31/74/566653174.db2.gz AQSBGOSIEFTBSE-YRGRVCCFSA-N 0 1 382.254 3.253 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(c(Br)c2)OCO3)[C@H]2CCC[C@@H]21 ZINC000629371995 566653224 /nfs/dbraw/zinc/65/32/24/566653224.db2.gz AQSBGOSIEFTBSE-BZPMIXESSA-N 0 1 382.254 3.253 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)[C@@H]2CCC[C@H]21 ZINC000629372743 566653390 /nfs/dbraw/zinc/65/33/90/566653390.db2.gz GSINYRHNFMCHGX-TTZDDIAXSA-N 0 1 388.291 3.308 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2csc(Br)c2)CC1 ZINC000629418570 566654201 /nfs/dbraw/zinc/65/42/01/566654201.db2.gz ZZJITZVHDNVJRC-UHFFFAOYSA-N 0 1 387.343 3.228 10 0 GGAEMN Cc1c(C(=O)Nc2cc(Br)cc(Cl)c2O)nn2c1OCCC2 ZINC000450295040 566654752 /nfs/dbraw/zinc/65/47/52/566654752.db2.gz UNKLUUGJNXPDFG-UHFFFAOYSA-N 0 1 386.633 3.348 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cccc(Br)c2C)CC1 ZINC000629418753 566654721 /nfs/dbraw/zinc/65/47/21/566654721.db2.gz UDMSSHMDRTVSPV-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(Br)ccc2C)CC1 ZINC000629418013 566654734 /nfs/dbraw/zinc/65/47/34/566654734.db2.gz LTXWYDQMUOBEJI-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(F)ccc2Br)CC1 ZINC000629420263 566655036 /nfs/dbraw/zinc/65/50/36/566655036.db2.gz RRRAUQHTLUDQCO-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN COCc1cnc(CN[C@@H]2CCN(c3cccc(Br)c3)C2)s1 ZINC000487199887 566655247 /nfs/dbraw/zinc/65/52/47/566655247.db2.gz JAVKJBJYDUUPAH-CYBMUJFWSA-N 0 1 382.327 3.421 10 0 GGAEMN Cn1ncc(Br)c1CNCCOc1ccc(Br)cc1 ZINC000487280268 566661055 /nfs/dbraw/zinc/66/10/55/566661055.db2.gz PNPZWVQAHZMQKJ-UHFFFAOYSA-N 0 1 389.091 3.114 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCCc2nc3cc(Cl)ccc3s2)n[nH]1 ZINC000487313599 566663350 /nfs/dbraw/zinc/66/33/50/566663350.db2.gz ZXFDMMDIURMUOF-JTQLQIEISA-N 0 1 377.901 3.454 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000629587880 566668842 /nfs/dbraw/zinc/66/88/42/566668842.db2.gz XBHAGOPPFWEELM-SECBINFHSA-N 0 1 398.212 3.275 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@@H](O)COc1c(Cl)cccc1Cl ZINC000629587317 566669169 /nfs/dbraw/zinc/66/91/69/566669169.db2.gz HTOSXZGNXKWENO-SECBINFHSA-N 0 1 398.212 3.275 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@H](O)COc1ccc(Cl)cc1Cl ZINC000629586709 566669362 /nfs/dbraw/zinc/66/93/62/566669362.db2.gz CIPGDAZSCMYKET-JTQLQIEISA-N 0 1 398.212 3.275 10 0 GGAEMN O=C(NCc1ccc(O)c(Br)c1)Nc1cnn(-c2ccncc2)c1 ZINC000675891387 566669459 /nfs/dbraw/zinc/66/94/59/566669459.db2.gz HQBHRQUNWIPQGA-UHFFFAOYSA-N 0 1 388.225 3.057 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000629587881 566669671 /nfs/dbraw/zinc/66/96/71/566669671.db2.gz XBHAGOPPFWEELM-VIFPVBQESA-N 0 1 398.212 3.275 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1cccs1 ZINC000653481085 566670728 /nfs/dbraw/zinc/67/07/28/566670728.db2.gz ZKNWIWRVTKKNKL-SCRDCRAPSA-N 0 1 379.448 3.150 10 0 GGAEMN O[C@H](CNCc1cc(F)c(Br)cc1F)COCc1cccs1 ZINC000629598301 566670769 /nfs/dbraw/zinc/67/07/69/566670769.db2.gz VYZMUYMTHDSGDD-LLVKDONJSA-N 0 1 392.265 3.456 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H](C[C@H]1CCCO1)C(F)(F)F)c1cccs1 ZINC000653481086 566671008 /nfs/dbraw/zinc/67/10/08/566671008.db2.gz ZKNWIWRVTKKNKL-YRGRVCCFSA-N 0 1 379.448 3.150 10 0 GGAEMN CN(CC1(c2ccc(Br)cc2)CC1)C(=O)N[C@@H]1CCCN(C)C1 ZINC000607409310 566671034 /nfs/dbraw/zinc/67/10/34/566671034.db2.gz AFNUUABPJBYRFG-MRXNPFEDSA-N 0 1 380.330 3.216 10 0 GGAEMN CCC(CC)(CC(=O)OC)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000487409762 566671319 /nfs/dbraw/zinc/67/13/19/566671319.db2.gz FMEAOFZHIJGQLR-UHFFFAOYSA-N 0 1 382.258 3.177 10 0 GGAEMN COc1ncc(Br)cc1CNCCC(=O)Nc1cccc(F)c1C ZINC000629593307 566671394 /nfs/dbraw/zinc/67/13/94/566671394.db2.gz LIWWJFKKOWRROQ-UHFFFAOYSA-N 0 1 396.260 3.419 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCC[C@@H]1C1CC1 ZINC000607415637 566671662 /nfs/dbraw/zinc/67/16/62/566671662.db2.gz KYDMUMVWABSZGL-CQSZACIVSA-N 0 1 390.285 3.318 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCC[C@@H]1C1CC1 ZINC000607415637 566671666 /nfs/dbraw/zinc/67/16/66/566671666.db2.gz KYDMUMVWABSZGL-CQSZACIVSA-N 0 1 390.285 3.318 10 0 GGAEMN C[C@H]1C[C@H](C)N(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000607415073 566671860 /nfs/dbraw/zinc/67/18/60/566671860.db2.gz ADMBYAVONXEMQS-QWRGUYRKSA-N 0 1 378.274 3.174 10 0 GGAEMN C[C@H]1C[C@H](C)N(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000607415073 566671866 /nfs/dbraw/zinc/67/18/66/566671866.db2.gz ADMBYAVONXEMQS-QWRGUYRKSA-N 0 1 378.274 3.174 10 0 GGAEMN COc1cc(C)nc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000540792915 566672158 /nfs/dbraw/zinc/67/21/58/566672158.db2.gz LLJAIESYSIIEKT-UHFFFAOYSA-N 0 1 388.269 3.236 10 0 GGAEMN COc1cc(C)nc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000540792915 566672166 /nfs/dbraw/zinc/67/21/66/566672166.db2.gz LLJAIESYSIIEKT-UHFFFAOYSA-N 0 1 388.269 3.236 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CC(Cc3ccccc3Br)C2)cn1 ZINC000629602268 566672547 /nfs/dbraw/zinc/67/25/47/566672547.db2.gz IILTVHHACKDXPO-UHFFFAOYSA-N 0 1 388.309 3.220 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCc3c(F)cc(Br)cc3C2)n[nH]1 ZINC000676051145 566673314 /nfs/dbraw/zinc/67/33/14/566673314.db2.gz MXKKAHQMQKKRGC-JTQLQIEISA-N 0 1 395.276 3.319 10 0 GGAEMN C[C@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccco1 ZINC000607641239 566677379 /nfs/dbraw/zinc/67/73/79/566677379.db2.gz VIQBMJHWRQRTPG-JTQLQIEISA-N 0 1 375.226 3.247 10 0 GGAEMN C[C@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccco1 ZINC000607641239 566677386 /nfs/dbraw/zinc/67/73/86/566677386.db2.gz VIQBMJHWRQRTPG-JTQLQIEISA-N 0 1 375.226 3.247 10 0 GGAEMN CCO[C@H]1C[C@@H](NC(=O)c2n[nH]c3ccc(Br)cc32)C12CCC2 ZINC000607683072 566677468 /nfs/dbraw/zinc/67/74/68/566677468.db2.gz RMADLZRTVVZENZ-KGLIPLIRSA-N 0 1 378.270 3.403 10 0 GGAEMN C[C@@H]1C[C@H](CO)CCN1C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000629678055 566677881 /nfs/dbraw/zinc/67/78/81/566677881.db2.gz AEQNTXSVRZLTBZ-VXGBXAGGSA-N 0 1 378.270 3.072 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC[C@H](C)Oc2ccc(Br)cc2)n[nH]1 ZINC000487556928 566679364 /nfs/dbraw/zinc/67/93/64/566679364.db2.gz JPCYQUMAAGLHGH-YPMHNXCESA-N 0 1 395.301 3.178 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC[C@@H](C)Oc2ccc(Br)cc2)n[nH]1 ZINC000487556927 566679660 /nfs/dbraw/zinc/67/96/60/566679660.db2.gz JPCYQUMAAGLHGH-WCQYABFASA-N 0 1 395.301 3.178 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC[C@H](C)Oc2cccc(Br)c2)n[nH]1 ZINC000487546035 566679701 /nfs/dbraw/zinc/67/97/01/566679701.db2.gz ZTZJYOVKYYNOBR-AAEUAGOBSA-N 0 1 395.301 3.178 10 0 GGAEMN C[C@@H](CNCc1c(Br)cnn1C)c1nc(-c2ccccc2)no1 ZINC000487549871 566679779 /nfs/dbraw/zinc/67/97/79/566679779.db2.gz JCYOPBOZNLQRBE-NSHDSACASA-N 0 1 376.258 3.126 10 0 GGAEMN C[C@H](CNCc1c(Br)cnn1C)c1nc(-c2ccccc2)no1 ZINC000487549869 566679946 /nfs/dbraw/zinc/67/99/46/566679946.db2.gz JCYOPBOZNLQRBE-LLVKDONJSA-N 0 1 376.258 3.126 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NC[C@@H](C)Oc2ccc(Br)cc2)n[nH]1 ZINC000487556926 566680211 /nfs/dbraw/zinc/68/02/11/566680211.db2.gz JPCYQUMAAGLHGH-DGCLKSJQSA-N 0 1 395.301 3.178 10 0 GGAEMN Cc1ccc(OC[C@@H](O)CN[C@H](CCO)c2ccccc2Br)cc1 ZINC000514963272 566680913 /nfs/dbraw/zinc/68/09/13/566680913.db2.gz NKNGRDHFKJEMRE-HNAYVOBHSA-N 0 1 394.309 3.211 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCc2cc(F)cc(Br)c2C1 ZINC000629740669 566681090 /nfs/dbraw/zinc/68/10/90/566681090.db2.gz JRULVWKILXZIPJ-GFCCVEGCSA-N 0 1 378.245 3.316 10 0 GGAEMN Cc1ccc(OC[C@H](O)CN[C@H](CCO)c2ccccc2Br)cc1 ZINC000514963271 566681053 /nfs/dbraw/zinc/68/10/53/566681053.db2.gz NKNGRDHFKJEMRE-DNVCBOLYSA-N 0 1 394.309 3.211 10 0 GGAEMN COc1ccccc1[C@@H](CNCc1c(Br)cnn1C)OC(C)C ZINC000487575748 566681660 /nfs/dbraw/zinc/68/16/60/566681660.db2.gz VCGUZYSDIGLUGJ-QGZVFWFLSA-N 0 1 382.302 3.447 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCc3cc(F)cc(Br)c3C2)cn1 ZINC000629739729 566681920 /nfs/dbraw/zinc/68/19/20/566681920.db2.gz HSFBMNKKMWSLHB-UHFFFAOYSA-N 0 1 392.272 3.243 10 0 GGAEMN Cn1ncc(Br)c1CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 ZINC000487575651 566682021 /nfs/dbraw/zinc/68/20/21/566682021.db2.gz RBWHJRLEKZIUNB-SNVBAGLBSA-N 0 1 387.684 3.344 10 0 GGAEMN OC[C@H](CNCc1nc(-c2cccc(Br)c2)c[nH]1)c1cccnc1 ZINC000514943900 566682114 /nfs/dbraw/zinc/68/21/14/566682114.db2.gz CQDWHTGHECUNGL-HNNXBMFYSA-N 0 1 387.281 3.100 10 0 GGAEMN O=C(COc1ccc(Cl)cc1Cl)N1CCN(C[C@H]2CCSC2)CC1 ZINC000425989265 566685628 /nfs/dbraw/zinc/68/56/28/566685628.db2.gz JPMLNVAHBCQCKV-CYBMUJFWSA-N 0 1 389.348 3.270 10 0 GGAEMN CCN(CCNC(=O)N1CCO[C@@H](c2cccs2)C1)CCC(F)(F)F ZINC000425988980 566686400 /nfs/dbraw/zinc/68/64/00/566686400.db2.gz QCHVSIUABBXQAX-CYBMUJFWSA-N 0 1 379.448 3.105 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1ccc(I)cc1F ZINC000450587610 566687898 /nfs/dbraw/zinc/68/78/98/566687898.db2.gz DOELZQCLHSSCJI-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1ccc(I)cc1F ZINC000450587610 566687906 /nfs/dbraw/zinc/68/79/06/566687906.db2.gz DOELZQCLHSSCJI-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=c1c2c([n-]n1-c1ccc(Br)cn1)CC[N@H+](Cc1ccccc1)C2 ZINC000629942605 566695620 /nfs/dbraw/zinc/69/56/20/566695620.db2.gz DJUBVNAYXGVMQR-HNNXBMFYSA-N 0 1 385.265 3.069 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2c(Cl)ccc(C)c2Cl)cn1 ZINC000541083504 566695810 /nfs/dbraw/zinc/69/58/10/566695810.db2.gz RWYHROURAYUZNC-UHFFFAOYSA-N 0 1 375.233 3.284 10 0 GGAEMN COC(=O)c1cc(F)cc(S(=O)(=O)Nc2ccc(C(C)=O)c(Cl)c2)c1 ZINC000541165152 566701704 /nfs/dbraw/zinc/70/17/04/566701704.db2.gz PNHMSHVZKCANEL-UHFFFAOYSA-N 0 1 385.800 3.269 10 0 GGAEMN CC(C)(C)[C@@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CCO1 ZINC000468532874 566707913 /nfs/dbraw/zinc/70/79/13/566707913.db2.gz YCEFQBQEBGPPLO-HNNXBMFYSA-N 0 1 393.281 3.178 10 0 GGAEMN CCOC(=O)[C@H]1CCCN1[C@H](C)CC(=O)Nc1cccc(Br)c1 ZINC000468534908 566708124 /nfs/dbraw/zinc/70/81/24/566708124.db2.gz FHALZGLBLRHTRP-IUODEOHRSA-N 0 1 383.286 3.194 10 0 GGAEMN CC(C)(C)[C@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CCO1 ZINC000468532875 566708313 /nfs/dbraw/zinc/70/83/13/566708313.db2.gz YCEFQBQEBGPPLO-OAHLLOKOSA-N 0 1 393.281 3.178 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(-c3ccc(Br)cc3)o2)CCN1CCO ZINC000426496278 566715529 /nfs/dbraw/zinc/71/55/29/566715529.db2.gz ODIVUPCPTYIHCI-CQSZACIVSA-N 0 1 379.298 3.208 10 0 GGAEMN Cc1cc(NC(=O)CCN2CCC[C@H]2c2ccc(Br)s2)no1 ZINC000541319029 566715656 /nfs/dbraw/zinc/71/56/56/566715656.db2.gz GTPNAWGVLIWION-NSHDSACASA-N 0 1 384.299 3.395 10 0 GGAEMN COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](C2N=NC(=O)O2)C1 ZINC000450896728 566717495 /nfs/dbraw/zinc/71/74/95/566717495.db2.gz OBRKBXWTIKZPBI-ZANVPECISA-N 0 1 386.235 3.176 10 0 GGAEMN COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](c2n[nH]c(=O)o2)C1 ZINC000450896728 566717497 /nfs/dbraw/zinc/71/74/97/566717497.db2.gz OBRKBXWTIKZPBI-ZANVPECISA-N 0 1 386.235 3.176 10 0 GGAEMN CN(C)C[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000515516197 566717945 /nfs/dbraw/zinc/71/79/45/566717945.db2.gz RXSRMZKDXMLQJP-AWEZNQCLSA-N 0 1 387.332 3.445 10 0 GGAEMN CN(C)C[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000515516198 566718052 /nfs/dbraw/zinc/71/80/52/566718052.db2.gz RXSRMZKDXMLQJP-CQSZACIVSA-N 0 1 387.332 3.445 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2cc(Cl)ccc2F)C1 ZINC000468656356 566718316 /nfs/dbraw/zinc/71/83/16/566718316.db2.gz VHPBIKQXQIUCCM-MRXNPFEDSA-N 0 1 388.936 3.185 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2ccc(F)c(Cl)c2)C1 ZINC000468650371 566718861 /nfs/dbraw/zinc/71/88/61/566718861.db2.gz UGMNLYFWXAIGGJ-OAHLLOKOSA-N 0 1 388.936 3.185 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2cc(Cl)ccc2F)C1 ZINC000468656355 566719118 /nfs/dbraw/zinc/71/91/18/566719118.db2.gz VHPBIKQXQIUCCM-INIZCTEOSA-N 0 1 388.936 3.185 10 0 GGAEMN COC(=O)c1cn(C2CCN(CCc3cc(Cl)ccc3Cl)CC2)nn1 ZINC000488329770 566721345 /nfs/dbraw/zinc/72/13/45/566721345.db2.gz PBCNMPMMHXOSQW-UHFFFAOYSA-N 0 1 383.279 3.251 10 0 GGAEMN COCCN(Cc1cc(Br)cc(Br)c1)[C@H]1CCOC1 ZINC000580800343 566724355 /nfs/dbraw/zinc/72/43/55/566724355.db2.gz GAHFVIADJNZDMP-AWEZNQCLSA-N 0 1 393.119 3.449 10 0 GGAEMN O=C(CC1CC(F)(F)C1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000580814437 566724429 /nfs/dbraw/zinc/72/44/29/566724429.db2.gz RVRYCPTXLRIPOJ-UHFFFAOYSA-N 0 1 385.212 3.286 10 0 GGAEMN O=C(CC1CC(F)(F)C1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000580814437 566724433 /nfs/dbraw/zinc/72/44/33/566724433.db2.gz RVRYCPTXLRIPOJ-UHFFFAOYSA-N 0 1 385.212 3.286 10 0 GGAEMN COc1ccc(C[NH2+][C@H](C(=O)[O-])c2ccc(C)cc2)c(Br)c1O ZINC000426682274 566724407 /nfs/dbraw/zinc/72/44/07/566724407.db2.gz HEKXNPNCKWEKRT-HNNXBMFYSA-N 0 1 380.238 3.387 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccsc1 ZINC000654288922 566726146 /nfs/dbraw/zinc/72/61/46/566726146.db2.gz VTFITEPHIPUSEN-BFHYXJOUSA-N 0 1 379.448 3.150 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)NCc2ccc(Br)cc2OC)C[C@@H]1C ZINC000488495750 566730260 /nfs/dbraw/zinc/73/02/60/566730260.db2.gz JCUIOIOZWKKPCN-STQMWFEESA-N 0 1 384.318 3.082 10 0 GGAEMN COC(=O)C[C@@](C)(NCc1cn(C)nc1C)c1ccc(Br)cc1 ZINC000450987706 566731122 /nfs/dbraw/zinc/73/11/22/566731122.db2.gz MGTLMVSOWIFMCI-QGZVFWFLSA-N 0 1 380.286 3.059 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN(C2CCC2)CC1 ZINC000468803811 566731765 /nfs/dbraw/zinc/73/17/65/566731765.db2.gz BZFJHBOVSCNTRX-ZDUSSCGKSA-N 0 1 396.329 3.398 10 0 GGAEMN O=C(NCCN1CCCOCC1)c1ccc2scc(Br)c2c1 ZINC000451003389 566731865 /nfs/dbraw/zinc/73/18/65/566731865.db2.gz LHIHQMVQHPZOOZ-UHFFFAOYSA-N 0 1 383.311 3.116 10 0 GGAEMN O=C([O-])[C@]1([NH2+]Cc2ncc(Br)cc2F)CCc2c1cccc2F ZINC000630455928 566732295 /nfs/dbraw/zinc/73/22/95/566732295.db2.gz JHRRKRQSWFSRFH-INIZCTEOSA-N 0 1 383.192 3.138 10 0 GGAEMN OC[C@H](CNCc1cn(-c2cccc(Cl)c2Cl)nn1)c1ccccc1 ZINC000677244456 566734839 /nfs/dbraw/zinc/73/48/39/566734839.db2.gz AGPNHLZFHRJUBM-AWEZNQCLSA-N 0 1 377.275 3.440 10 0 GGAEMN CN(C)c1ncc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)c(F)c2)s1 ZINC000677245353 566735003 /nfs/dbraw/zinc/73/50/03/566735003.db2.gz GWIPTKHNFRJBTC-GOEBONIOSA-N 0 1 382.892 3.063 10 0 GGAEMN O=C([O-])[C@@H]([NH2+]Cc1ccc(-c2ccc(Br)cc2)o1)[C@@H]1CCCO1 ZINC000630470109 566735288 /nfs/dbraw/zinc/73/52/88/566735288.db2.gz RWVWXERHYKXNAU-HOTGVXAUSA-N 0 1 380.238 3.431 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N2CCOc3cccc(Br)c3C2)n[nH]1 ZINC000654497571 566736947 /nfs/dbraw/zinc/73/69/47/566736947.db2.gz NYNPERUUYGXRMH-NSHDSACASA-N 0 1 393.285 3.016 10 0 GGAEMN COc1cnc(NS(=O)(=O)c2sc(C)cc2C)c(Br)c1 ZINC000451026318 566737674 /nfs/dbraw/zinc/73/76/74/566737674.db2.gz MOAPVQAQWKEGRJ-UHFFFAOYSA-N 0 1 377.285 3.332 10 0 GGAEMN C[C@](CO)(NCC[S@](=O)c1cc(Cl)ccc1Cl)c1cccc(O)c1 ZINC000451029854 566738863 /nfs/dbraw/zinc/73/88/63/566738863.db2.gz HXVPQHAYANHMCA-OSPHWJPCSA-N 0 1 388.316 3.304 10 0 GGAEMN CCc1[nH]nc(C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)c1Br ZINC000468868065 566738882 /nfs/dbraw/zinc/73/88/82/566738882.db2.gz GNWYKPYUFMSMHA-CYBMUJFWSA-N 0 1 393.285 3.372 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@H](C(C)(C)C)[C@@H](O)C1)c1ccc(Br)cc1 ZINC000541625273 566739968 /nfs/dbraw/zinc/73/99/68/566739968.db2.gz NRJTUUMWRRUGBV-JQFCIGGWSA-N 0 1 397.357 3.355 10 0 GGAEMN CCN1CCC[C@H](NC(=O)CSc2nc(C)nc3sc(C)c(C)c32)C1 ZINC000515977264 566740459 /nfs/dbraw/zinc/74/04/59/566740459.db2.gz LRJIFLCZUYNBFS-AWEZNQCLSA-N 0 1 378.567 3.309 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)c1ccccc1I ZINC000608901090 566742039 /nfs/dbraw/zinc/74/20/39/566742039.db2.gz UMBUGRSGIGTQKJ-UHFFFAOYSA-N 0 1 390.184 3.124 10 0 GGAEMN C[C@@H]1[C@@H](CO)CCN1CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000488718199 566742593 /nfs/dbraw/zinc/74/25/93/566742593.db2.gz LXIAZFIBOQZQIN-NXEZZACHSA-N 0 1 395.219 3.109 10 0 GGAEMN CC(C)c1noc([C@H](C)n2cc([C@@H](N)c3ccc(Br)cc3)nn2)n1 ZINC000630599368 566742874 /nfs/dbraw/zinc/74/28/74/566742874.db2.gz JXXFDWLVAFGRIE-HZMBPMFUSA-N 0 1 391.273 3.204 10 0 GGAEMN C[C@H]1[C@H](CO)CCN1CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000488718200 566743330 /nfs/dbraw/zinc/74/33/30/566743330.db2.gz LXIAZFIBOQZQIN-UWVGGRQHSA-N 0 1 395.219 3.109 10 0 GGAEMN CN(C)C[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)ccc1OCC1CCC1 ZINC000468925508 566744427 /nfs/dbraw/zinc/74/44/27/566744427.db2.gz IBBHUJZFXXFULK-INIZCTEOSA-N 0 1 386.945 3.234 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN(C(C)C)CC1 ZINC000468923736 566744515 /nfs/dbraw/zinc/74/45/15/566744515.db2.gz HSWAUTWWZQBDJF-ZDUSSCGKSA-N 0 1 384.318 3.254 10 0 GGAEMN CC(C)(C)n1ccc(C(=O)Nc2nc(-c3ccc(Br)cc3)n[nH]2)n1 ZINC000654636261 566746759 /nfs/dbraw/zinc/74/67/59/566746759.db2.gz NLFNBPCVQVJYPI-UHFFFAOYSA-N 0 1 389.257 3.438 10 0 GGAEMN OC1([C@@H]2CCCCN2Cc2nc(-c3cccc(Br)c3)no2)CC1 ZINC000581117200 566750781 /nfs/dbraw/zinc/75/07/81/566750781.db2.gz MSRXQUPTRBDXNC-AWEZNQCLSA-N 0 1 378.270 3.379 10 0 GGAEMN CN(C)[C@H](CNC(=O)c1c(F)cncc1Br)c1ccc(F)cc1 ZINC000630783743 566751149 /nfs/dbraw/zinc/75/11/49/566751149.db2.gz NWMGHSHPDRAGHC-CQSZACIVSA-N 0 1 384.224 3.155 10 0 GGAEMN CC(C)c1nc(C[S@@](=O)Cc2c(F)ccc(Br)c2F)n[nH]1 ZINC000427150693 566751428 /nfs/dbraw/zinc/75/14/28/566751428.db2.gz RRZGUBBSALJQJZ-NRFANRHFSA-N 0 1 378.242 3.418 10 0 GGAEMN CC(C)c1nc(C[S@](=O)Cc2c(F)ccc(Br)c2F)n[nH]1 ZINC000427150694 566752072 /nfs/dbraw/zinc/75/20/72/566752072.db2.gz RRZGUBBSALJQJZ-OAQYLSRUSA-N 0 1 378.242 3.418 10 0 GGAEMN Cc1cccc(S(=O)(=O)Nc2cnn(C)c2C(F)F)c1Br ZINC000677552129 566753579 /nfs/dbraw/zinc/75/35/79/566753579.db2.gz QMWORFPYNFBSHL-UHFFFAOYSA-N 0 1 380.214 3.229 10 0 GGAEMN CCN1CCN(CC(=O)Nc2cccc(Cl)c2SCC(F)F)CC1 ZINC000469027293 566754302 /nfs/dbraw/zinc/75/43/02/566754302.db2.gz SNASEBPDOWEDSC-UHFFFAOYSA-N 0 1 377.888 3.273 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ncc(Br)cc2C)ccc1F ZINC000469025153 566754590 /nfs/dbraw/zinc/75/45/90/566754590.db2.gz PQNPIFAHVGACDG-UHFFFAOYSA-N 0 1 375.219 3.101 10 0 GGAEMN Cc1cc(NC(=O)CSc2nnc(C)[nH]2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000561984642 566755008 /nfs/dbraw/zinc/75/50/08/566755008.db2.gz FWSYFWYMNQCMLM-UHFFFAOYSA-N 0 1 397.291 3.067 10 0 GGAEMN Cc1n[nH]c(SCC(=O)Nc2cc(C)n(-c3ccc(Cl)c(Cl)c3)n2)n1 ZINC000561984642 566755012 /nfs/dbraw/zinc/75/50/12/566755012.db2.gz FWSYFWYMNQCMLM-UHFFFAOYSA-N 0 1 397.291 3.067 10 0 GGAEMN Cc1cnc(CCN2CCN(c3ccc(Br)cn3)CC2)c(C)c1 ZINC000516283492 566756022 /nfs/dbraw/zinc/75/60/22/566756022.db2.gz YGFOJMTWRYNUKS-UHFFFAOYSA-N 0 1 375.314 3.221 10 0 GGAEMN Cc1ccc([C@@H](CNC(=O)c2cc[nH]c(=O)c2Br)N2CCCC2)o1 ZINC000469041664 566756145 /nfs/dbraw/zinc/75/61/45/566756145.db2.gz UDBQPDNFJWDWOW-CYBMUJFWSA-N 0 1 394.269 3.018 10 0 GGAEMN CCN(CC)[C@H](CNC(=O)c1c(F)cncc1Br)c1ccco1 ZINC000630839986 566756231 /nfs/dbraw/zinc/75/62/31/566756231.db2.gz MYOONNAVHZXBPH-CYBMUJFWSA-N 0 1 384.249 3.389 10 0 GGAEMN CCCCc1cnc(NS(=O)(=O)c2ccc(C(=O)OC)c(Cl)c2)nc1 ZINC000451097639 566757208 /nfs/dbraw/zinc/75/72/08/566757208.db2.gz DXHDPJNSNZMEIP-UHFFFAOYSA-N 0 1 383.857 3.060 10 0 GGAEMN CC(C)[C@H](NS(=O)(=O)c1ccc(Br)c(F)c1)C(F)(F)F ZINC000469055107 566757894 /nfs/dbraw/zinc/75/78/94/566757894.db2.gz WDHPIGQACLSJDE-JTQLQIEISA-N 0 1 378.185 3.453 10 0 GGAEMN CN(C)c1ncc(Br)cc1C(=O)Nc1nc2ccc(F)cc2[nH]1 ZINC000488937664 566758779 /nfs/dbraw/zinc/75/87/79/566758779.db2.gz MGNCQPMKNXHYKA-UHFFFAOYSA-N 0 1 378.205 3.178 10 0 GGAEMN COc1cc(Br)ccc1CNc1ccc(N2CCN(C)CC2)nc1 ZINC000541923269 566759080 /nfs/dbraw/zinc/75/90/80/566759080.db2.gz NZJMWSFQIYNSNH-UHFFFAOYSA-N 0 1 391.313 3.217 10 0 GGAEMN CO[C@@H](C(=O)N1CCC(c2cnc[nH]2)CC1)c1ccccc1Br ZINC000654873169 566759173 /nfs/dbraw/zinc/75/91/73/566759173.db2.gz APXWQPLTPHGEOX-MRXNPFEDSA-N 0 1 378.270 3.266 10 0 GGAEMN C[C@H](N[C@@H]1CCCN(S(=O)(=O)N(C)C)C1)c1cc(F)c(Cl)cc1Cl ZINC000562056005 566760897 /nfs/dbraw/zinc/76/08/97/566760897.db2.gz OEJPUORQZLTNHD-WDEREUQCSA-N 0 1 398.331 3.054 10 0 GGAEMN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@H](C(F)F)C1 ZINC000677729196 566761306 /nfs/dbraw/zinc/76/13/06/566761306.db2.gz AIVRILYPIHWSRY-YPMHNXCESA-N 0 1 375.257 3.383 10 0 GGAEMN CC(=O)N(C)c1ccccc1NS(=O)(=O)c1ccc2nc(C)sc2c1 ZINC000427268822 566762218 /nfs/dbraw/zinc/76/22/18/566762218.db2.gz DFPYEOGIYSABPU-UHFFFAOYSA-N 0 1 375.475 3.388 10 0 GGAEMN C[C@H](NC(=O)c1ccco1)C(=O)Nc1cc(Br)cc(Cl)c1O ZINC000677802894 566763729 /nfs/dbraw/zinc/76/37/29/566763729.db2.gz VWUCOCQSBNADTR-ZETCQYMHSA-N 0 1 387.617 3.158 10 0 GGAEMN Cn1ccc(-c2cc(C(=O)N3CCc4sc(Br)cc4C3)n[nH]2)c1 ZINC000654930195 566763760 /nfs/dbraw/zinc/76/37/60/566763760.db2.gz JDHBTTGPXWFZHV-UHFFFAOYSA-N 0 1 391.294 3.438 10 0 GGAEMN CCCn1nccc1NS(=O)(=O)c1cc(Br)cc2cccnc21 ZINC000581271218 566764346 /nfs/dbraw/zinc/76/43/46/566764346.db2.gz AMNOFVVJXJPAEP-UHFFFAOYSA-N 0 1 395.282 3.405 10 0 GGAEMN O=S(=O)(C[C@H]1CCCC1(F)F)NC[C@H]1CCCN(Cc2cccs2)C1 ZINC000451136533 566764954 /nfs/dbraw/zinc/76/49/54/566764954.db2.gz QOTQSIUXFSBYTL-HUUCEWRRSA-N 0 1 392.537 3.315 10 0 GGAEMN CCOC(=O)c1cc(COC)cc(NS(=O)(=O)c2cc(C)sc2C)c1 ZINC000427320930 566765883 /nfs/dbraw/zinc/76/58/83/566765883.db2.gz NRWONIQUUXBOPC-UHFFFAOYSA-N 0 1 383.491 3.489 10 0 GGAEMN O=C1[C@H](Sc2nc(-c3ccc(Br)cc3)n[nH]2)CCN1C1CCC1 ZINC000631005046 566770233 /nfs/dbraw/zinc/77/02/33/566770233.db2.gz MOBJFLZEWSYPNS-CYBMUJFWSA-N 0 1 393.310 3.480 10 0 GGAEMN Brc1ccn2cc(CN[C@@H](c3nnc[nH]3)c3ccccc3)nc2c1 ZINC000562212340 566770633 /nfs/dbraw/zinc/77/06/33/566770633.db2.gz OATRNKOBYWREDC-MRXNPFEDSA-N 0 1 383.253 3.094 10 0 GGAEMN O=C(c1ccoc1)N1CCC(NCc2ncc(Br)cc2Cl)CC1 ZINC000631038972 566772029 /nfs/dbraw/zinc/77/20/29/566772029.db2.gz PXLQPWIJFWQNRB-UHFFFAOYSA-N 0 1 398.688 3.485 10 0 GGAEMN C[C@@H](NCC(=O)Nc1nc2c(s1)CCCC2)c1ccc([S@](C)=O)cc1 ZINC000542053773 566772592 /nfs/dbraw/zinc/77/25/92/566772592.db2.gz RGTXQWWAIMAYCB-YDBLSZJJSA-N 0 1 377.535 3.049 10 0 GGAEMN COc1ccc(CN2CCC[C@@H](c3ccnc(N)n3)C2)c(Br)c1 ZINC000581396729 566773087 /nfs/dbraw/zinc/77/30/87/566773087.db2.gz QZTWWRXEMJAXNU-CYBMUJFWSA-N 0 1 377.286 3.040 10 0 GGAEMN Cc1noc(CN2CC[C@H](Cc3cccc(I)c3)C2)n1 ZINC000451185008 566773483 /nfs/dbraw/zinc/77/34/83/566773483.db2.gz BVWTZLYPJMDRLF-CYBMUJFWSA-N 0 1 383.233 3.047 10 0 GGAEMN C[C@@H](c1nncn1C)N1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000451186147 566773540 /nfs/dbraw/zinc/77/35/40/566773540.db2.gz DMHXUTCBTOCTKG-JSGCOSHPSA-N 0 1 396.276 3.045 10 0 GGAEMN CC(C)N(CC(=O)N1CCOC[C@H]1C1CC1)Cc1cccc(Br)c1 ZINC000677980582 566773639 /nfs/dbraw/zinc/77/36/39/566773639.db2.gz GEHSTSNYPQYJBX-SFHVURJKSA-N 0 1 395.341 3.297 10 0 GGAEMN COc1cncc(CNCc2cc(Br)c3c(c2)OCCO3)c1C ZINC000631053139 566773658 /nfs/dbraw/zinc/77/36/58/566773658.db2.gz BLQIPCSFVGVGIX-UHFFFAOYSA-N 0 1 379.254 3.222 10 0 GGAEMN Clc1cc(Br)cnc1CN[C@@H]1CCCN(c2ncccn2)C1 ZINC000631044389 566774548 /nfs/dbraw/zinc/77/45/48/566774548.db2.gz QCSXJDNMGXWYCS-GFCCVEGCSA-N 0 1 382.693 3.046 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(C)=O)c(Cl)c2)c(C)c1 ZINC000542092642 566774746 /nfs/dbraw/zinc/77/47/46/566774746.db2.gz DUAJMNOJYMKBFD-UHFFFAOYSA-N 0 1 381.837 3.438 10 0 GGAEMN Ic1cccc(C[C@H]2CCN(Cc3ncccn3)C2)c1 ZINC000451197272 566774849 /nfs/dbraw/zinc/77/48/49/566774849.db2.gz YBSWJUJOCMUEPL-CQSZACIVSA-N 0 1 379.245 3.146 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NC(=O)c2[nH]nc3ccc(Br)cc32)n[nH]1 ZINC000489220815 566774885 /nfs/dbraw/zinc/77/48/85/566774885.db2.gz PYJJTICAQKPUCV-BDAKNGLRSA-N 0 1 391.273 3.448 10 0 GGAEMN Ic1cccc(C[C@@H]2CCN(Cc3ncccn3)C2)c1 ZINC000451197271 566774974 /nfs/dbraw/zinc/77/49/74/566774974.db2.gz YBSWJUJOCMUEPL-AWEZNQCLSA-N 0 1 379.245 3.146 10 0 GGAEMN C[C@@H](C(=O)N(CCO)Cc1cc(Br)cs1)N1CCCCCC1 ZINC000427555783 566778242 /nfs/dbraw/zinc/77/82/42/566778242.db2.gz LWFSIFUPRDLTHM-ZDUSSCGKSA-N 0 1 389.359 3.096 10 0 GGAEMN CCN1C(=O)N=NC1C1CCN(Cc2cccc(Br)c2C)CC1 ZINC000678053635 566778095 /nfs/dbraw/zinc/77/80/95/566778095.db2.gz OGBSEVBGIKAQIC-UHFFFAOYSA-N 0 1 379.302 3.454 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)CC2CC(F)(F)C2)[C@@H]1c1cccs1 ZINC000451243502 566781193 /nfs/dbraw/zinc/78/11/93/566781193.db2.gz PLDSDHWYJKDIHR-DZGCQCFKSA-N 0 1 378.510 3.096 10 0 GGAEMN Cc1ccccc1[C@@H](N)C(=O)Nc1ccc(CN(C)C)c(Br)c1 ZINC000581487656 566781341 /nfs/dbraw/zinc/78/13/41/566781341.db2.gz ZKVHMEPQGLPMHF-QGZVFWFLSA-N 0 1 376.298 3.458 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)CC2CC(F)(F)C2)[C@@H]1c1cccs1 ZINC000451243504 566782351 /nfs/dbraw/zinc/78/23/51/566782351.db2.gz PLDSDHWYJKDIHR-UKRRQHHQSA-N 0 1 378.510 3.096 10 0 GGAEMN CC[C@@H]1CN(C)CCN1C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000655143143 566782506 /nfs/dbraw/zinc/78/25/06/566782506.db2.gz NCDAWLHFWPIXNI-UKRRQHHQSA-N 0 1 382.302 3.008 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)n[nH]1 ZINC000469339770 566782766 /nfs/dbraw/zinc/78/27/66/566782766.db2.gz NJLWLBMAXCAMEI-VHSXEESVSA-N 0 1 396.289 3.260 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@@H](Cc1ccc(F)cc1)C(N)=O ZINC000469337814 566783318 /nfs/dbraw/zinc/78/33/18/566783318.db2.gz MSTCNOFQKQRWNA-BZNIZROVSA-N 0 1 395.272 3.344 10 0 GGAEMN C[C@@H](Cc1ccccc1Br)NC(=O)c1ccc(CN(C)C)nc1 ZINC000516789942 566783429 /nfs/dbraw/zinc/78/34/29/566783429.db2.gz JTJMFKLAGAJCIR-ZDUSSCGKSA-N 0 1 376.298 3.267 10 0 GGAEMN COCCc1ncc(CN[C@](C)(CO)c2ccc(Br)cc2)s1 ZINC000631132915 566784180 /nfs/dbraw/zinc/78/41/80/566784180.db2.gz CFEVCEADUNALFN-MRXNPFEDSA-N 0 1 385.327 3.092 10 0 GGAEMN CN1CCC[C@@H](NCc2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc21 ZINC000631154351 566785317 /nfs/dbraw/zinc/78/53/17/566785317.db2.gz WCPQUJZZQIQNHT-MRXNPFEDSA-N 0 1 379.913 3.048 10 0 GGAEMN Cc1nnsc1CNC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000562366527 566785383 /nfs/dbraw/zinc/78/53/83/566785383.db2.gz KDJXRKIVLGUGDY-CYBMUJFWSA-N 0 1 376.873 3.423 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3cc(Br)cn3C)cccc21 ZINC000469366245 566785934 /nfs/dbraw/zinc/78/59/34/566785934.db2.gz YRUNRHLAOQYQKM-CQSZACIVSA-N 0 1 378.270 3.425 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3cncc(Br)c3)cccc21 ZINC000469364893 566786026 /nfs/dbraw/zinc/78/60/26/566786026.db2.gz RGEUGCZHERCLAV-HNNXBMFYSA-N 0 1 376.254 3.482 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3cc(Br)cn3C)cccc21 ZINC000469366244 566786037 /nfs/dbraw/zinc/78/60/37/566786037.db2.gz YRUNRHLAOQYQKM-AWEZNQCLSA-N 0 1 378.270 3.425 10 0 GGAEMN O=S1(=O)C[C@H](CNCc2ccc(C(F)(F)F)s2)Oc2ccccc21 ZINC000581548185 566786145 /nfs/dbraw/zinc/78/61/45/566786145.db2.gz WMGKUNJQWBLYHH-JTQLQIEISA-N 0 1 377.409 3.091 10 0 GGAEMN CC(C)(CNCc1ncc(Br)cc1Cl)[C@]1(O)CCCOC1 ZINC000631176391 566786837 /nfs/dbraw/zinc/78/68/37/566786837.db2.gz CDLVLDWBTLBBKW-HNNXBMFYSA-N 0 1 377.710 3.155 10 0 GGAEMN O=C(N[C@@H](C1CC1)[C@@H]1CCCCO1)c1cc(Br)cc2nc[nH]c21 ZINC000655221113 566787197 /nfs/dbraw/zinc/78/71/97/566787197.db2.gz DPOBXWXORRPYHG-GJZGRUSLSA-N 0 1 378.270 3.403 10 0 GGAEMN O=C(CCOc1cccc(Cl)c1Cl)NCc1n[nH]c([C@H]2CCCO2)n1 ZINC000655235638 566789418 /nfs/dbraw/zinc/78/94/18/566789418.db2.gz KOFCRNHADAIKKT-GFCCVEGCSA-N 0 1 385.251 3.048 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H](OC2CCC2)C1 ZINC000655279311 566792248 /nfs/dbraw/zinc/79/22/48/566792248.db2.gz GWJYTFYFCGYNKO-CYBMUJFWSA-N 0 1 378.270 3.499 10 0 GGAEMN C[C@H](Cc1ccc(F)cc1Br)NCc1nnc(C2CCOCC2)[nH]1 ZINC000631214747 566792381 /nfs/dbraw/zinc/79/23/81/566792381.db2.gz XNEMQNHWKMEGNL-LLVKDONJSA-N 0 1 397.292 3.321 10 0 GGAEMN O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)c1n[nH]c2ccc(Cl)cc21 ZINC000489506299 566792997 /nfs/dbraw/zinc/79/29/97/566792997.db2.gz APZUNXBEDXAKPG-UHFFFAOYSA-N 0 1 398.271 3.073 10 0 GGAEMN COc1ccc(OCc2nc(CNCC[C@@H](O)C(F)(F)F)cs2)cc1 ZINC000581634937 566794759 /nfs/dbraw/zinc/79/47/59/566794759.db2.gz LZLRHHBXADSHOY-CQSZACIVSA-N 0 1 376.400 3.134 10 0 GGAEMN Cc1nc2ccc(S(=O)(=O)N(CCN(C)C)C3CCCCC3)cc2s1 ZINC000489586984 566798040 /nfs/dbraw/zinc/79/80/40/566798040.db2.gz QCFLSTNDHDOCQC-UHFFFAOYSA-N 0 1 381.567 3.490 10 0 GGAEMN Cc1cnc(CCN(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2O)s1 ZINC000451334240 566799541 /nfs/dbraw/zinc/79/95/41/566799541.db2.gz BLGYSKOIQHRAIV-UHFFFAOYSA-N 0 1 380.413 3.039 10 0 GGAEMN Brc1ccc(CN2CC[C@H](Nc3ncccn3)C2)c2ncccc12 ZINC000581727267 566802037 /nfs/dbraw/zinc/80/20/37/566802037.db2.gz WFXYEJPTFKNJQJ-AWEZNQCLSA-N 0 1 384.281 3.474 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2c(F)cccc2Cl)[C@H]1c1ccccc1 ZINC000451351233 566802534 /nfs/dbraw/zinc/80/25/34/566802534.db2.gz INDATWUIHHEXOA-ZWKOTPCHSA-N 0 1 382.888 3.344 10 0 GGAEMN C[C@](N)(C(=O)N1CCOc2cccc(Br)c2C1)c1ccccc1 ZINC000655503027 566804934 /nfs/dbraw/zinc/80/49/34/566804934.db2.gz BBHRXXKCIJPUSU-GOSISDBHSA-N 0 1 375.266 3.044 10 0 GGAEMN O=C([C@@H]1NCCc2ccccc21)N1CCOc2cccc(Br)c2C1 ZINC000655504107 566806457 /nfs/dbraw/zinc/80/64/57/566806457.db2.gz MOQQNQDPCIUKCO-GOSISDBHSA-N 0 1 387.277 3.057 10 0 GGAEMN Cc1ncc([C@@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)s1 ZINC000678608095 566807153 /nfs/dbraw/zinc/80/71/53/566807153.db2.gz XUUTXMMXNYOYAX-CQSZACIVSA-N 0 1 379.551 3.228 10 0 GGAEMN CN1CCN(CCOc2ccc(NC(=O)c3cscc3Cl)cc2)CC1 ZINC000631556221 566809721 /nfs/dbraw/zinc/80/97/21/566809721.db2.gz YQOKTGXYBCWBDR-UHFFFAOYSA-N 0 1 379.913 3.280 10 0 GGAEMN CC(C)(C)OC(=O)CSCC(=O)Nc1nc(-c2ccccc2Cl)n[nH]1 ZINC000610158588 566812536 /nfs/dbraw/zinc/81/25/36/566812536.db2.gz ZRXHRDXBESESNU-UHFFFAOYSA-N 0 1 382.873 3.139 10 0 GGAEMN CN(C(=O)CSCc1ccc(Br)cc1F)[C@@H]1CCCN(C)C1 ZINC000610187850 566813550 /nfs/dbraw/zinc/81/35/50/566813550.db2.gz OWCDAXNPCMNUJR-CQSZACIVSA-N 0 1 389.334 3.374 10 0 GGAEMN CSCC[C@H](N[C@H]1CCCc2ncc(C(F)(F)F)cc21)C(=O)N(C)C ZINC000489859412 566814211 /nfs/dbraw/zinc/81/42/11/566814211.db2.gz MSKOXXCXXHJAEJ-GJZGRUSLSA-N 0 1 375.460 3.277 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2ncc(-c3ccccc3Br)o2)C1 ZINC000517241424 566814768 /nfs/dbraw/zinc/81/47/68/566814768.db2.gz NGQRFAFBLPFBEN-NEPJUHHUSA-N 0 1 395.253 3.168 10 0 GGAEMN O=C(c1ccc2cncc(Br)c2n1)N1CCC(c2cnc[nH]2)CC1 ZINC000631672555 566814825 /nfs/dbraw/zinc/81/48/25/566814825.db2.gz BNDAHZMOGNSJNJ-UHFFFAOYSA-N 0 1 386.253 3.135 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451415702 566816149 /nfs/dbraw/zinc/81/61/49/566816149.db2.gz FTGRPVHAUBZMDI-ZACQAIPSSA-N 0 1 382.298 3.361 10 0 GGAEMN C[C@@H](NCc1n[nH]c(C2CCOCC2)n1)c1ccc(Br)c(F)c1 ZINC000631691821 566816735 /nfs/dbraw/zinc/81/67/35/566816735.db2.gz BSTOEHICMQFWEQ-SNVBAGLBSA-N 0 1 383.265 3.451 10 0 GGAEMN O=C(COc1c(Cl)cccc1Cl)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000542672705 566816995 /nfs/dbraw/zinc/81/69/95/566816995.db2.gz XIWFLKZTAACGEA-OAHLLOKOSA-N 0 1 377.231 3.396 10 0 GGAEMN Cc1c([C@H](C)NCC[C@@H](O)C(F)F)nnn1-c1cccc(Br)c1 ZINC000631695589 566817996 /nfs/dbraw/zinc/81/79/96/566817996.db2.gz AILLPIFDGANJHH-TVQRCGJNSA-N 0 1 389.244 3.005 10 0 GGAEMN Cc1c([C@H](C)NCC[C@H](O)C(F)F)nnn1-c1cccc(Br)c1 ZINC000631695590 566818474 /nfs/dbraw/zinc/81/84/74/566818474.db2.gz AILLPIFDGANJHH-ZANVPECISA-N 0 1 389.244 3.005 10 0 GGAEMN Brc1ccc2c(c1)CC[C@H]2NCc1n[nH]c(C2CCOCC2)n1 ZINC000631694421 566818798 /nfs/dbraw/zinc/81/87/98/566818798.db2.gz BJRVUPXRQSJBHS-OAHLLOKOSA-N 0 1 377.286 3.238 10 0 GGAEMN Cc1cc(OC[C@@H](O)CN2CC[C@](O)(C(F)F)C2)c(C(C)C)cc1Cl ZINC000451440420 566819446 /nfs/dbraw/zinc/81/94/46/566819446.db2.gz PTIQFYSHBKHQGI-SCLBCKFNSA-N 0 1 377.859 3.213 10 0 GGAEMN Cc1nc2cc(Br)cc(NC(=O)N3C[C@H]4CCC[C@@H](C3)N4)c2o1 ZINC000562758803 566819796 /nfs/dbraw/zinc/81/97/96/566819796.db2.gz NJLNWCSIBZBMNL-TXEJJXNPSA-N 0 1 379.258 3.257 10 0 GGAEMN O=S(=O)(c1cc(C(F)(F)F)ccc1O)N1CC[C@@H](CC(F)(F)F)C1 ZINC000451454095 566820193 /nfs/dbraw/zinc/82/01/93/566820193.db2.gz AWKOXGBUYMXFMV-QMMMGPOBSA-N 0 1 377.306 3.374 10 0 GGAEMN CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(Cc2nc3c(s2)CCC3)C1 ZINC000678838733 566821021 /nfs/dbraw/zinc/82/10/21/566821021.db2.gz XKCZWTHTSLRTGC-LBPRGKRZSA-N 0 1 375.460 3.255 10 0 GGAEMN C[C@H](N[C@@H]1COCC[C@H]1O)c1ccc(Br)cc1Br ZINC000631748978 566821341 /nfs/dbraw/zinc/82/13/41/566821341.db2.gz GRKFFUGUNBSSLI-ZEGGKSINSA-N 0 1 379.092 3.012 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC[C@@H]1C1CC1 ZINC000610292242 566821313 /nfs/dbraw/zinc/82/13/13/566821313.db2.gz YKXCPQBDOYSKDL-CYBMUJFWSA-N 0 1 381.217 3.182 10 0 GGAEMN C[C@@H](N[C@@H]1COCC[C@H]1O)c1ccc(Br)cc1Br ZINC000631748977 566822419 /nfs/dbraw/zinc/82/24/19/566822419.db2.gz GRKFFUGUNBSSLI-BZHVJNSISA-N 0 1 379.092 3.012 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)n[nH]1 ZINC000655617511 566822589 /nfs/dbraw/zinc/82/25/89/566822589.db2.gz PJBIOVWWWISVQI-JTQLQIEISA-N 0 1 384.267 3.342 10 0 GGAEMN Cc1nc(CN2CCN(CCSc3cc(Cl)ccc3Cl)CC2)n[nH]1 ZINC000678888521 566824306 /nfs/dbraw/zinc/82/43/06/566824306.db2.gz KGNUDWMTITZUHK-UHFFFAOYSA-N 0 1 386.352 3.330 10 0 GGAEMN COc1cccc(F)c1[C@@H](C)N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000428229203 566825331 /nfs/dbraw/zinc/82/53/31/566825331.db2.gz NTUPNLXQQKQYMF-NWDGAFQWSA-N 0 1 383.261 3.498 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CC2(C1)CCCC2 ZINC000428308238 566830018 /nfs/dbraw/zinc/83/00/18/566830018.db2.gz YPNMYMYSWGMRTF-UHFFFAOYSA-N 0 1 381.217 3.184 10 0 GGAEMN O=S(=O)(N[C@H](C[C@H]1CCCO1)C(F)(F)F)c1ccc(F)cc1Cl ZINC000655661836 566830581 /nfs/dbraw/zinc/83/05/81/566830581.db2.gz JHQAWNUIGOOZLB-BXKDBHETSA-N 0 1 375.771 3.257 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1cc(F)cc(Cl)c1 ZINC000655662604 566830596 /nfs/dbraw/zinc/83/05/96/566830596.db2.gz UAFFUGXIENNROD-JQWIXIFHSA-N 0 1 375.771 3.257 10 0 GGAEMN O=S(=O)(N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccc(Cl)c(F)c1 ZINC000655662580 566830633 /nfs/dbraw/zinc/83/06/33/566830633.db2.gz SWBFECVKSMUDCB-QPUJVOFHSA-N 0 1 375.771 3.257 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccc(F)cc1Cl ZINC000655661837 566830675 /nfs/dbraw/zinc/83/06/75/566830675.db2.gz JHQAWNUIGOOZLB-CABZTGNLSA-N 0 1 375.771 3.257 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1ccc(F)cc1Cl ZINC000655661839 566830943 /nfs/dbraw/zinc/83/09/43/566830943.db2.gz JHQAWNUIGOOZLB-SKDRFNHKSA-N 0 1 375.771 3.257 10 0 GGAEMN C[C@@H](C(=O)Nc1cc(I)ccc1O)N1CCCCCC1 ZINC000610486138 566834936 /nfs/dbraw/zinc/83/49/36/566834936.db2.gz MVSVXQIFHIIHSH-NSHDSACASA-N 0 1 388.249 3.200 10 0 GGAEMN C[C@H](C(=O)Nc1cc(I)ccc1O)N1[C@H](C)CC[C@@H]1C ZINC000610490763 566836859 /nfs/dbraw/zinc/83/68/59/566836859.db2.gz IEDWKVHYDSWELO-OUAUKWLOSA-N 0 1 388.249 3.197 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1 ZINC000490223491 566837157 /nfs/dbraw/zinc/83/71/57/566837157.db2.gz OJNQNQBSAJNUQY-ACJLOTCBSA-N 0 1 396.329 3.256 10 0 GGAEMN Cc1[nH]ncc1CCCNS(=O)(=O)c1c(C)cc(Br)cc1C ZINC000451555518 566837488 /nfs/dbraw/zinc/83/74/88/566837488.db2.gz BWBSJEPMNVKTDD-UHFFFAOYSA-N 0 1 386.315 3.009 10 0 GGAEMN Cc1cc(CN2CCC(C(=O)Nc3ccc(Br)cc3)CC2)ncn1 ZINC000428391149 566837587 /nfs/dbraw/zinc/83/75/87/566837587.db2.gz FMGJHFPQOQBZDD-UHFFFAOYSA-N 0 1 389.297 3.398 10 0 GGAEMN O=C(NCCOc1cccc(F)c1)c1n[nH]c2ccc(Br)cc21 ZINC000517642340 566838048 /nfs/dbraw/zinc/83/80/48/566838048.db2.gz QYZOJGRIYNCIHZ-UHFFFAOYSA-N 0 1 378.201 3.273 10 0 GGAEMN O=S(=O)(Nc1ccc(-c2csnn2)cc1)c1ccc(C(F)(F)F)nc1 ZINC000542936088 566839547 /nfs/dbraw/zinc/83/95/47/566839547.db2.gz VMUMMTPYFXMQIM-UHFFFAOYSA-N 0 1 386.380 3.420 10 0 GGAEMN Brc1ccccc1N1CC[C@@H](NCc2cc3n(n2)CCCC3)C1 ZINC000655738489 566840726 /nfs/dbraw/zinc/84/07/26/566840726.db2.gz VUSZXJBBJDBLOF-CQSZACIVSA-N 0 1 375.314 3.350 10 0 GGAEMN Cc1nc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(-c2ccccc2)s1 ZINC000632026752 566841910 /nfs/dbraw/zinc/84/19/10/566841910.db2.gz LLOLEPYZASFFNU-CJNGLKHVSA-N 0 1 379.551 3.222 10 0 GGAEMN Cn1ccc([C@H](NCCCn2cc(Br)cn2)c2ccc(F)cc2)n1 ZINC000490355963 566844236 /nfs/dbraw/zinc/84/42/36/566844236.db2.gz RWYKPWHHUWFADA-QGZVFWFLSA-N 0 1 392.276 3.288 10 0 GGAEMN COc1cc(Br)ccc1CCC(=O)N[C@@H](C)Cc1cc(C)[nH]n1 ZINC000543004513 566844463 /nfs/dbraw/zinc/84/44/63/566844463.db2.gz VDHZEOASZHFDQD-NSHDSACASA-N 0 1 380.286 3.169 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(-c3cccc(Br)c3)o2)CCN1CCO ZINC000428461007 566845450 /nfs/dbraw/zinc/84/54/50/566845450.db2.gz OGIPIWMRWOVKOJ-CQSZACIVSA-N 0 1 379.298 3.208 10 0 GGAEMN O[C@H](CNCc1cn(-c2cccc(Cl)c2Cl)nn1)Cc1ccccc1 ZINC000517777975 566847383 /nfs/dbraw/zinc/84/73/83/566847383.db2.gz ONRLCBZBAKNEQM-HNNXBMFYSA-N 0 1 377.275 3.267 10 0 GGAEMN Brc1ccc2c(c1)[C@@H](NCc1n[nH]c([C@@H]3CCCO3)n1)CCCO2 ZINC000655797074 566849199 /nfs/dbraw/zinc/84/91/99/566849199.db2.gz KWSAEYZVGINMEU-ZFWWWQNUSA-N 0 1 393.285 3.422 10 0 GGAEMN Fc1ccc2c(c1Br)CC[C@@H]2[NH2+]Cc1nnc([C@H]2CCCO2)[n-]1 ZINC000655795821 566849248 /nfs/dbraw/zinc/84/92/48/566849248.db2.gz CRKQCHNZEZYBHJ-QWHCGFSZSA-N 0 1 381.249 3.335 10 0 GGAEMN OC[C@@H](CNCc1cc2n(n1)CCCC2)Cc1cc(Br)ccc1F ZINC000655779063 566850005 /nfs/dbraw/zinc/85/00/05/566850005.db2.gz BGQJBPDQSPMZNS-CYBMUJFWSA-N 0 1 396.304 3.062 10 0 GGAEMN Brc1ccc2c(c1)[C@H](NCc1n[nH]c([C@H]3CCCO3)n1)CCCO2 ZINC000655797073 566850081 /nfs/dbraw/zinc/85/00/81/566850081.db2.gz KWSAEYZVGINMEU-UKRRQHHQSA-N 0 1 393.285 3.422 10 0 GGAEMN Cn1nnnc1CCN[C@H](c1ccccc1)c1ccc(Br)cc1F ZINC000679351693 566850823 /nfs/dbraw/zinc/85/08/23/566850823.db2.gz NLDIHMHBJXOWIH-QGZVFWFLSA-N 0 1 390.260 3.033 10 0 GGAEMN Brc1ccccc1-n1cc(CN[C@@H](C2CC2)[C@H]2CCCCO2)nn1 ZINC000655812646 566851984 /nfs/dbraw/zinc/85/19/84/566851984.db2.gz QJEFNWUFJNLFJG-MSOLQXFVSA-N 0 1 391.313 3.467 10 0 GGAEMN CCN(CCNC(=O)NC1CCC(OC(F)F)CC1)CCC(F)(F)F ZINC000655845529 566854087 /nfs/dbraw/zinc/85/40/87/566854087.db2.gz FOVUHURTKXOFDK-UHFFFAOYSA-N 0 1 375.382 3.110 10 0 GGAEMN C[C@H]1CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC2(CCC2)O1 ZINC000582362237 566854575 /nfs/dbraw/zinc/85/45/75/566854575.db2.gz ADROTGXUUHAHDZ-NSHDSACASA-N 0 1 391.265 3.074 10 0 GGAEMN O=C(Nc1nc(-c2cccs2)ns1)c1nnn(C2CC2)c1C(F)(F)F ZINC000679404941 566855509 /nfs/dbraw/zinc/85/55/09/566855509.db2.gz NBJBXRKNNIOUJD-UHFFFAOYSA-N 0 1 386.384 3.464 10 0 GGAEMN Cc1cc(CNC[C@H]2CS(=O)(=O)c3ccccc3O2)ccc1Br ZINC000563122209 566856377 /nfs/dbraw/zinc/85/63/77/566856377.db2.gz LNKRQMHYKRBKQT-AWEZNQCLSA-N 0 1 396.306 3.082 10 0 GGAEMN O[C@H](COC[C@H]1CCCO1)CN1CCC[C@H]1c1ccc(Br)s1 ZINC000543176824 566859993 /nfs/dbraw/zinc/85/99/93/566859993.db2.gz MIXSCPBMMBXNPN-MJBXVCDLSA-N 0 1 390.343 3.204 10 0 GGAEMN CC[C@@H](NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)[C@H](O)C(F)F ZINC000451709351 566866633 /nfs/dbraw/zinc/86/66/33/566866633.db2.gz KLMQGBWPULDPPM-BDAKNGLRSA-N 0 1 382.643 3.330 10 0 GGAEMN COc1cc(Br)c(C[NH2+][C@@H](CC(=O)[O-])c2ccncc2)c(OC)c1 ZINC000582498325 566867057 /nfs/dbraw/zinc/86/70/57/566867057.db2.gz OKYPBQLCHUYYPA-HNNXBMFYSA-N 0 1 395.253 3.167 10 0 GGAEMN Cc1cc(OC[C@H](O)CN2CCSC[C@H]2CCO)c(C(C)C)cc1Cl ZINC000470367201 566867974 /nfs/dbraw/zinc/86/79/74/566867974.db2.gz MIDZVVYJCROKGN-HZPDHXFCSA-N 0 1 387.973 3.311 10 0 GGAEMN Cc1cc(OC[C@H](O)CN2CCSC[C@@H]2CCO)c(C(C)C)cc1Cl ZINC000470367202 566868022 /nfs/dbraw/zinc/86/80/22/566868022.db2.gz MIDZVVYJCROKGN-JKSUJKDBSA-N 0 1 387.973 3.311 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@@H](CO)NCc1cccc(Br)c1OC(F)F ZINC000563261186 566869419 /nfs/dbraw/zinc/86/94/19/566869419.db2.gz KYACYVBVWCEEQX-WCQYABFASA-N 0 1 396.272 3.298 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NC(=O)c2n[nH]c3ccc(Cl)cc32)[C@@H]1O ZINC000563276595 566871225 /nfs/dbraw/zinc/87/12/25/566871225.db2.gz PEWXKEPTNZJFMC-HIFRSBDPSA-N 0 1 377.853 3.281 10 0 GGAEMN O=S(=O)(NC1(CF)CCOCC1)c1c(Cl)cc(Cl)cc1Cl ZINC000451735701 566872521 /nfs/dbraw/zinc/87/25/21/566872521.db2.gz KJMGSBNMULCTGS-UHFFFAOYSA-N 0 1 376.664 3.444 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN1CCCC[C@H]1C(N)=O ZINC000679817516 566874803 /nfs/dbraw/zinc/87/48/03/566874803.db2.gz MXWHOJSAIOGJRX-HNNXBMFYSA-N 0 1 396.329 3.124 10 0 GGAEMN NC(=O)c1ncc(Br)cc1NC[C@H](c1ccco1)N1CCCCC1 ZINC000543398913 566878355 /nfs/dbraw/zinc/87/83/55/566878355.db2.gz RIIZNBSXSVVEBV-CQSZACIVSA-N 0 1 393.285 3.175 10 0 GGAEMN CSc1ccc([C@H](C)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)cc1F ZINC000582605522 566879426 /nfs/dbraw/zinc/87/94/26/566879426.db2.gz CSEPBFWULOWEBE-GXTWGEPZSA-N 0 1 381.494 3.433 10 0 GGAEMN Cc1c(Br)cccc1CS(=O)(=O)Nc1ncc(C(F)(F)F)[nH]1 ZINC000656182633 566881878 /nfs/dbraw/zinc/88/18/78/566881878.db2.gz IMPRCMRXDGDERD-UHFFFAOYSA-N 0 1 398.204 3.441 10 0 GGAEMN C[C@@H](c1ccccc1)[C@@H](NCc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000428838939 566882087 /nfs/dbraw/zinc/88/20/87/566882087.db2.gz ZFDUTRJKBYEIRF-APPDUMDISA-N 0 1 387.281 3.073 10 0 GGAEMN CCN(C1CCN(C)CC1)S(=O)(=O)Cc1cccc(Br)c1C ZINC000632408463 566882348 /nfs/dbraw/zinc/88/23/48/566882348.db2.gz GYIWTARCJSTJQP-UHFFFAOYSA-N 0 1 389.359 3.003 10 0 GGAEMN CS(=O)(=O)CC[C@@H]1CCCCN1CCCc1nc(-c2cccs2)no1 ZINC000428837245 566883246 /nfs/dbraw/zinc/88/32/46/566883246.db2.gz GXBMUAKABZPUJU-AWEZNQCLSA-N 0 1 383.539 3.020 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1ccc(Br)cc1Cl ZINC000518456487 566884010 /nfs/dbraw/zinc/88/40/10/566884010.db2.gz ZMGPFFOTWFVLPK-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN O=c1[nH]cc(S(=O)(=O)N2CCCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)s1 ZINC000632433651 566884210 /nfs/dbraw/zinc/88/42/10/566884210.db2.gz ZSHPOBCUPQXJOU-LBPRGKRZSA-N 0 1 398.897 3.294 10 0 GGAEMN C[C@H](c1ccccc1)[C@@H](NCc1nc2ccc(Br)cc2[nH]1)C(N)=O ZINC000428838953 566884410 /nfs/dbraw/zinc/88/44/10/566884410.db2.gz ZFDUTRJKBYEIRF-PIGZYNQJSA-N 0 1 387.281 3.073 10 0 GGAEMN FC(F)(F)c1nc(NCc2n[nH]c([C@@H]3CCCO3)n2)ccc1Br ZINC000656208641 566885230 /nfs/dbraw/zinc/88/52/30/566885230.db2.gz VGQHRMUOSLDDGN-QMMMGPOBSA-N 0 1 392.179 3.445 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000543483132 566885951 /nfs/dbraw/zinc/88/59/51/566885951.db2.gz IGOADJNFPZBSDI-WBVHZDCISA-N 0 1 397.357 3.136 10 0 GGAEMN CC1(C)COC[C@H]1NCc1coc(-c2ccc(I)cc2)n1 ZINC000451810353 566885921 /nfs/dbraw/zinc/88/59/21/566885921.db2.gz LAKPZURIXSBWDB-CQSZACIVSA-N 0 1 398.244 3.461 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1CCOc1ccc(Cl)cc1Br ZINC000518471734 566886806 /nfs/dbraw/zinc/88/68/06/566886806.db2.gz VRXNICWVUJJIFV-LBPRGKRZSA-N 0 1 375.694 3.211 10 0 GGAEMN CC(C)[C@@H]1C[C@@H](CNS(=O)(=O)c2cc(C(F)(F)F)ccc2O)CCO1 ZINC000451817406 566887507 /nfs/dbraw/zinc/88/75/07/566887507.db2.gz LQRVRALFJWOQST-FZMZJTMJSA-N 0 1 381.416 3.141 10 0 GGAEMN COc1ccc(OC)c(CCNC(=O)c2cccc(Br)c2O)c1 ZINC000518544217 566889747 /nfs/dbraw/zinc/88/97/47/566889747.db2.gz AKMMQVCGKJXQIV-UHFFFAOYSA-N 0 1 380.238 3.144 10 0 GGAEMN C[C@H]1C[C@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000491095156 566894127 /nfs/dbraw/zinc/89/41/27/566894127.db2.gz XPNZVOGNDLICSV-LSDHHAIUSA-N 0 1 381.314 3.022 10 0 GGAEMN C[C@@H]1C[C@@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000491095149 566894234 /nfs/dbraw/zinc/89/42/34/566894234.db2.gz XPNZVOGNDLICSV-CABCVRRESA-N 0 1 381.314 3.022 10 0 GGAEMN COc1ccc(Br)c(CN(C)C(=O)N[C@H](C)Cc2cc(C)[nH]n2)c1 ZINC000428986742 566895384 /nfs/dbraw/zinc/89/53/84/566895384.db2.gz PQGBKPXCQQVBGS-LLVKDONJSA-N 0 1 395.301 3.262 10 0 GGAEMN CN(C)[C@@H](CN1C(=O)N[C@@H](Cc2cccc(Cl)c2)C1=O)c1cccs1 ZINC000518742396 566900757 /nfs/dbraw/zinc/90/07/57/566900757.db2.gz UMEZNCYGSKLPSS-GJZGRUSLSA-N 0 1 377.897 3.167 10 0 GGAEMN O[C@@H]([C@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)C(F)(F)F ZINC000451896653 566902505 /nfs/dbraw/zinc/90/25/05/566902505.db2.gz VHJNXOLTWOQMNQ-LRDDRELGSA-N 0 1 379.806 3.289 10 0 GGAEMN O[C@H]([C@@H]1CCN(CCc2cc(Cl)c3c(c2)OCCCO3)C1)C(F)(F)F ZINC000451896655 566902680 /nfs/dbraw/zinc/90/26/80/566902680.db2.gz VHJNXOLTWOQMNQ-MLGOLLRUSA-N 0 1 379.806 3.289 10 0 GGAEMN O[C@H]([C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000451895695 566903047 /nfs/dbraw/zinc/90/30/47/566903047.db2.gz UFHDFZCCURJFSF-AMIZOPFISA-N 0 1 378.192 3.071 10 0 GGAEMN O=C1C[C@H](N2CCC[C@H](CCF)C2)C(=O)N1c1ccc(Br)cc1 ZINC000656477136 566903441 /nfs/dbraw/zinc/90/34/41/566903441.db2.gz HCUSTNXHQKTBHM-DOMZBBRYSA-N 0 1 383.261 3.153 10 0 GGAEMN O=C(c1ccc2scc(Br)c2c1)N1CC[C@@H](c2nc[nH]n2)C1 ZINC000582901003 566904214 /nfs/dbraw/zinc/90/42/14/566904214.db2.gz KVOQHISTXULWOP-SNVBAGLBSA-N 0 1 377.267 3.412 10 0 GGAEMN CCOC(=O)C[C@H](O)CN1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000611238007 566904451 /nfs/dbraw/zinc/90/44/51/566904451.db2.gz WXYZFGDIJNXGEB-GXTWGEPZSA-N 0 1 376.280 3.151 10 0 GGAEMN OC[C@@H](NCCOCCOc1ccccc1)c1ccc(Br)c(F)c1 ZINC000429046844 566906258 /nfs/dbraw/zinc/90/62/58/566906258.db2.gz XVNYPYLFWXQLCL-GOSISDBHSA-N 0 1 398.272 3.307 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cccc(Br)c2Cl)CCN1C ZINC000563676568 566908022 /nfs/dbraw/zinc/90/80/22/566908022.db2.gz IQXGRQFSQSFXBP-MNOVXSKESA-N 0 1 395.750 3.206 10 0 GGAEMN COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)c1cccc(Br)c1O ZINC000543746450 566908030 /nfs/dbraw/zinc/90/80/30/566908030.db2.gz KOHQYUQCYCPJOP-LBPRGKRZSA-N 0 1 392.249 3.359 10 0 GGAEMN C[C@]1(c2cccc(Br)c2)C[C@@H]1C(=O)NC1(c2nnc[nH]2)CCC1 ZINC000632709296 566908631 /nfs/dbraw/zinc/90/86/31/566908631.db2.gz OJUJGXDSXYXGJG-CZUORRHYSA-N 0 1 375.270 3.040 10 0 GGAEMN Brc1ccc(-n2cc(CN3CC[C@@H](Nc4ncccn4)C3)cn2)cc1 ZINC000563713367 566911479 /nfs/dbraw/zinc/91/14/79/566911479.db2.gz MGFCDWHYZCORHG-MRXNPFEDSA-N 0 1 399.296 3.111 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1csc(C)n1)c1ccc(F)cc1 ZINC000563782419 566916246 /nfs/dbraw/zinc/91/62/46/566916246.db2.gz VFZBBGYKUBCFTN-UHFFFAOYSA-N 0 1 385.530 3.269 10 0 GGAEMN CCc1nc([C@H](C)S(=O)(=O)c2ccc(Br)c(Cl)c2)n[nH]1 ZINC000656556908 566916992 /nfs/dbraw/zinc/91/69/92/566916992.db2.gz VAFCPUIVJYYUQX-ZETCQYMHSA-N 0 1 378.679 3.318 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CC1)c1csc(-c2ccc(Cl)c(Cl)c2)n1 ZINC000470985673 566919518 /nfs/dbraw/zinc/91/95/18/566919518.db2.gz WKFXHTIKFLCLIR-UHFFFAOYSA-N 0 1 381.248 3.049 10 0 GGAEMN NC1(c2noc(-c3ncc(Br)cc3Br)n2)CCCC1 ZINC000563810495 566919724 /nfs/dbraw/zinc/91/97/24/566919724.db2.gz OXQZPHPPYRKPBX-UHFFFAOYSA-N 0 1 388.063 3.385 10 0 GGAEMN O=S(=O)(Cc1ccccc1Br)Nc1cc(-c2ccncc2)[nH]n1 ZINC000583106670 566921392 /nfs/dbraw/zinc/92/13/92/566921392.db2.gz HJHPKNNWIBTJNK-UHFFFAOYSA-N 0 1 393.266 3.176 10 0 GGAEMN CC(C)CN(CC(F)(F)F)C(=O)CN[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000543908147 566921737 /nfs/dbraw/zinc/92/17/37/566921737.db2.gz DYTHMISOWNWDIE-CANCMXDXSA-N 0 1 378.460 3.122 10 0 GGAEMN C[C@@H]1COCC[C@H]1c1nc(-c2nc(-c3cccc(Br)c3)n[nH]2)no1 ZINC000519129800 566922207 /nfs/dbraw/zinc/92/22/07/566922207.db2.gz NYMHBOYUTMTODV-BXKDBHETSA-N 0 1 390.241 3.424 10 0 GGAEMN C[C@H](O)[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccccc1F ZINC000519155492 566923922 /nfs/dbraw/zinc/92/39/22/566923922.db2.gz FRXRIICGKNFPOT-WPKBUWHJSA-N 0 1 398.272 3.040 10 0 GGAEMN C[C@H](O)[C@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccccc1F ZINC000519155493 566924057 /nfs/dbraw/zinc/92/40/57/566924057.db2.gz FRXRIICGKNFPOT-WRSAYESZSA-N 0 1 398.272 3.040 10 0 GGAEMN CSc1ccc(NC(=O)CN(C)C2CCN(CC(F)(F)F)CC2)cc1 ZINC000452035002 566924780 /nfs/dbraw/zinc/92/47/80/566924780.db2.gz VLHPQDMZLBPIKF-UHFFFAOYSA-N 0 1 375.460 3.306 10 0 GGAEMN COCc1ccc(NS(=O)(=O)c2cncc(OC)c2)cc1C(F)(F)F ZINC000656634547 566929509 /nfs/dbraw/zinc/92/95/09/566929509.db2.gz DDWYMVCRKGJHDI-UHFFFAOYSA-N 0 1 376.356 3.056 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cnc(C(F)(F)F)c(C)c2)cc1OC ZINC000656637113 566930410 /nfs/dbraw/zinc/93/04/10/566930410.db2.gz CPPWLWQJMRDCJN-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN CCc1sc(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)cc1Br ZINC000492265256 566930830 /nfs/dbraw/zinc/93/08/30/566930830.db2.gz DEPAEFVNYNPFEM-UHFFFAOYSA-N 0 1 393.266 3.301 10 0 GGAEMN Cc1cc(C(C)(C)C(=O)NCCCCN2CCOCC2)ccc1Br ZINC000583232800 566932516 /nfs/dbraw/zinc/93/25/16/566932516.db2.gz DAEQZLXCNVYAFT-UHFFFAOYSA-N 0 1 397.357 3.264 10 0 GGAEMN NC(=O)[C@@H](Cc1ccccc1)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000656685104 566933451 /nfs/dbraw/zinc/93/34/51/566933451.db2.gz KGRRHHQLILEHKK-IAGOWNOFSA-N 0 1 391.334 3.423 10 0 GGAEMN NC(=O)[C@H](Cc1ccccc1)N[C@H]1CSCc2ccc(Br)cc21 ZINC000656685105 566933615 /nfs/dbraw/zinc/93/36/15/566933615.db2.gz KGRRHHQLILEHKK-IRXDYDNUSA-N 0 1 391.334 3.423 10 0 GGAEMN NC(=O)[C@H](Cc1ccccc1)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000656685103 566934425 /nfs/dbraw/zinc/93/44/25/566934425.db2.gz KGRRHHQLILEHKK-DLBZAZTESA-N 0 1 391.334 3.423 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCOc2ncccc2C1 ZINC000680838373 566934510 /nfs/dbraw/zinc/93/45/10/566934510.db2.gz BHVCMVUDCYUKEC-UHFFFAOYSA-N 0 1 399.248 3.269 10 0 GGAEMN COC(=O)c1cc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)ccc1Cl ZINC000611732702 566935258 /nfs/dbraw/zinc/93/52/58/566935258.db2.gz KIGFZLTVCCPBFH-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN O[C@@H](CNCc1cnc(C(F)(F)F)nc1)COc1c(Cl)cccc1Cl ZINC000656703082 566936206 /nfs/dbraw/zinc/93/62/06/566936206.db2.gz ALZUHAIDWOZHKY-JTQLQIEISA-N 0 1 396.196 3.332 10 0 GGAEMN O[C@H](CNCc1cnc(C(F)(F)F)nc1)COc1cc(Cl)ccc1Cl ZINC000656704406 566936249 /nfs/dbraw/zinc/93/62/49/566936249.db2.gz IXPNSUIXDXTEDD-LLVKDONJSA-N 0 1 396.196 3.332 10 0 GGAEMN O[C@@H](CNCc1cnc(C(F)(F)F)nc1)COc1ccc(Cl)cc1Cl ZINC000656705300 566936263 /nfs/dbraw/zinc/93/62/63/566936263.db2.gz ODFPMOXKBPOCRT-NSHDSACASA-N 0 1 396.196 3.332 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@H]1CCCOC1 ZINC000519406361 566937832 /nfs/dbraw/zinc/93/78/32/566937832.db2.gz UAMDUVYHROYOFC-XHDPSFHLSA-N 0 1 378.270 3.357 10 0 GGAEMN CSC[C@H](O)CN1CCC[C@@H]1c1ccccc1I ZINC000493163260 566945655 /nfs/dbraw/zinc/94/56/55/566945655.db2.gz XNGPSSLKWIQNTG-BXUZGUMPSA-N 0 1 377.291 3.152 10 0 GGAEMN CC[C@H](C)N1CCN(C(=O)Nc2cnc3c(Br)cccn23)CC1 ZINC000564077319 566942270 /nfs/dbraw/zinc/94/22/70/566942270.db2.gz IPGSPNYZBBWVFT-LBPRGKRZSA-N 0 1 380.290 3.045 10 0 GGAEMN CC[C@@H](C)Oc1cccc(S(=O)(=O)Nc2n[nH]c(C)c2Br)c1 ZINC000656735422 566942769 /nfs/dbraw/zinc/94/27/69/566942769.db2.gz OQURVYMUZMQEAQ-SECBINFHSA-N 0 1 388.287 3.459 10 0 GGAEMN CN(Cc1ccccc1)[C@@H]1CCN(S(=O)(=O)c2c(F)cccc2Cl)C1 ZINC000680975828 566945753 /nfs/dbraw/zinc/94/57/53/566945753.db2.gz OVBMPDNEBCTXID-OAHLLOKOSA-N 0 1 382.888 3.374 10 0 GGAEMN CC(C)c1nc(CNC(=O)[C@H]2C[C@]2(C)c2cccc(Br)c2)n[nH]1 ZINC000633258280 566946476 /nfs/dbraw/zinc/94/64/76/566946476.db2.gz AONAGHRQKGOHLQ-CXAGYDPISA-N 0 1 377.286 3.285 10 0 GGAEMN CCc1nc(CNC(=O)c2oc3c(cc(Br)cc3C)c2C)n[nH]1 ZINC000452178799 566948707 /nfs/dbraw/zinc/94/87/07/566948707.db2.gz LKNUMSGUNRVKPX-UHFFFAOYSA-N 0 1 377.242 3.423 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](C)CCc1ccc(Br)cc1 ZINC000564131353 566948899 /nfs/dbraw/zinc/94/88/99/566948899.db2.gz DUSNYUZZFHSFET-CQSZACIVSA-N 0 1 391.375 3.031 10 0 GGAEMN CO[C@@H](C[N@H+]1Cc2cccc(Br)c2C[C@H]1C(=O)[O-])C1CCCC1 ZINC000656757006 566948967 /nfs/dbraw/zinc/94/89/67/566948967.db2.gz QKCISZICUYMPAD-IRXDYDNUSA-N 0 1 382.298 3.466 10 0 GGAEMN CCc1cc(NS(=O)(=O)c2cc(Br)cc3cccnc32)n(C)n1 ZINC000564131202 566948937 /nfs/dbraw/zinc/94/89/37/566948937.db2.gz MFVCKBLJNVXKNZ-UHFFFAOYSA-N 0 1 395.282 3.094 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1cccc(Cl)c1Br ZINC000493571784 566950412 /nfs/dbraw/zinc/95/04/12/566950412.db2.gz IMXOOUZZFSDJSO-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN C[C@@H]1CCCCN1CCNS(=O)(=O)c1cc(Cl)ccc1Br ZINC000429814961 566951098 /nfs/dbraw/zinc/95/10/98/566951098.db2.gz OHQRNUIFKDUOEG-LLVKDONJSA-N 0 1 395.750 3.255 10 0 GGAEMN Cn1c(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(=O)[O-])nc2ccc(Br)cc21 ZINC000519648489 566954592 /nfs/dbraw/zinc/95/45/92/566954592.db2.gz WGLRUAYGPPOEDG-KNHMANMVSA-N 0 1 378.270 3.021 10 0 GGAEMN Cc1nc(C(C)C)sc1[C@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000564209727 566955084 /nfs/dbraw/zinc/95/50/84/566955084.db2.gz DMYDOEMRQZKBKT-JSGCOSHPSA-N 0 1 380.535 3.460 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000656861796 566957849 /nfs/dbraw/zinc/95/78/49/566957849.db2.gz AZFDUNCPWNEUEV-OLZOCXBDSA-N 0 1 384.489 3.393 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@H](c1cccs1)N1CCCC1 ZINC000656861790 566957950 /nfs/dbraw/zinc/95/79/50/566957950.db2.gz AZFDUNCPWNEUEV-CHWSQXEVSA-N 0 1 384.489 3.393 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000656863376 566959047 /nfs/dbraw/zinc/95/90/47/566959047.db2.gz QQMQKJOOHIEWCK-GOEBONIOSA-N 0 1 378.460 3.331 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000656863378 566959202 /nfs/dbraw/zinc/95/92/02/566959202.db2.gz QQMQKJOOHIEWCK-ZBFHGGJFSA-N 0 1 378.460 3.331 10 0 GGAEMN CN(CCc1ccccn1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000544392495 566959263 /nfs/dbraw/zinc/95/92/63/566959263.db2.gz WDHYZCATFOEVOK-UHFFFAOYSA-N 0 1 386.249 3.000 10 0 GGAEMN C[C@@H]1[C@H](C)SCCN1C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000544389681 566959496 /nfs/dbraw/zinc/95/94/96/566959496.db2.gz ATCSQXCVYHZQRA-ZJUUUORDSA-N 0 1 381.295 3.257 10 0 GGAEMN Cc1cc([C@H](C)NCC(=O)Nc2cc(S(C)(=O)=O)ccc2F)c(C)s1 ZINC000544398931 566960753 /nfs/dbraw/zinc/96/07/53/566960753.db2.gz JKGRCBVBIAJSNR-NSHDSACASA-N 0 1 384.498 3.197 10 0 GGAEMN O=S(=O)(N[C@H](c1nnc[nH]1)c1ccccc1)c1ccc(Cl)cc1Cl ZINC000429895807 566964130 /nfs/dbraw/zinc/96/41/30/566964130.db2.gz NNMNQEWHGFLASG-AWEZNQCLSA-N 0 1 383.260 3.179 10 0 GGAEMN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](CO)c2ccsc2)cc1 ZINC000471617181 566965496 /nfs/dbraw/zinc/96/54/96/566965496.db2.gz GWTSWSUZBQADLU-KDOFPFPSSA-N 0 1 382.551 3.163 10 0 GGAEMN C[C@@H](CC(F)(F)F)CS(=O)(=O)N(CCN(C)C)Cc1cccc(F)c1 ZINC000656887681 566966031 /nfs/dbraw/zinc/96/60/31/566966031.db2.gz XOYNTPUTPRKEOO-ZDUSSCGKSA-N 0 1 384.439 3.108 10 0 GGAEMN O=C(c1ccc(F)cc1Br)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633524032 566967177 /nfs/dbraw/zinc/96/71/77/566967177.db2.gz FEFRXPWUVIKHPC-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN Cc1ccc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)cc1Br ZINC000633525014 566968383 /nfs/dbraw/zinc/96/83/83/566968383.db2.gz BIYCLYVVYZEZGL-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN Cc1nn(C(C)C)c(C)c1S(=O)(=O)Nc1nccc(C)c1Br ZINC000583642051 566969619 /nfs/dbraw/zinc/96/96/19/566969619.db2.gz MRWIDKVQURTXHO-UHFFFAOYSA-N 0 1 387.303 3.348 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)Nc2cc(Br)ccn2)ccc1F ZINC000429940798 566969770 /nfs/dbraw/zinc/96/97/70/566969770.db2.gz CLJFPKJJERSXRW-UHFFFAOYSA-N 0 1 381.249 3.367 10 0 GGAEMN Cc1n[nH]c(C(=O)N[C@H](C)c2ccc(Br)cc2OCCCO)c1C ZINC000519799594 566970409 /nfs/dbraw/zinc/97/04/09/566970409.db2.gz DUXLQGZQZXYBLN-GFCCVEGCSA-N 0 1 396.285 3.041 10 0 GGAEMN Cc1cc2cc(C(=O)NC[C@H]3CCCCN3CCO)oc2c(Br)c1 ZINC000452377485 566970663 /nfs/dbraw/zinc/97/06/63/566970663.db2.gz MPFPRRIKHCMCEW-CQSZACIVSA-N 0 1 395.297 3.080 10 0 GGAEMN CC(C)(Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000583667096 566970938 /nfs/dbraw/zinc/97/09/38/566970938.db2.gz KHMUAJFAGGBAPG-AWEZNQCLSA-N 0 1 391.313 3.350 10 0 GGAEMN Cc1cc2cc(C(=O)NC[C@@H]3CCCCN3CCO)oc2c(Br)c1 ZINC000452377482 566971019 /nfs/dbraw/zinc/97/10/19/566971019.db2.gz MPFPRRIKHCMCEW-AWEZNQCLSA-N 0 1 395.297 3.080 10 0 GGAEMN CCN1CCN(c2ccc(CNc3ncc(Br)cc3F)cn2)CC1 ZINC000681376016 566972156 /nfs/dbraw/zinc/97/21/56/566972156.db2.gz BGLAKQWGGCUVGZ-UHFFFAOYSA-N 0 1 394.292 3.132 10 0 GGAEMN O=C(CSc1cc(Cl)ccc1Cl)NC[C@H]1CCCCN1CCO ZINC000452389252 566972571 /nfs/dbraw/zinc/97/25/71/566972571.db2.gz LUJGPRKNLDICQQ-CYBMUJFWSA-N 0 1 377.337 3.049 10 0 GGAEMN CSc1cc(C(=O)NC[C@H]2CCCCN2CCO)c(Cl)cc1Cl ZINC000452387967 566973172 /nfs/dbraw/zinc/97/31/72/566973172.db2.gz IOMGUPWOCPKMLO-LLVKDONJSA-N 0 1 377.337 3.292 10 0 GGAEMN O=S(=O)(NCC[C@@H](O)C(F)(F)F)c1c(Cl)cc(Cl)cc1Cl ZINC000544611795 566973352 /nfs/dbraw/zinc/97/33/52/566973352.db2.gz JWFYBYSOCYJZMB-MRVPVSSYSA-N 0 1 386.606 3.238 10 0 GGAEMN CC(C)N1C(=O)C[C@H](NC[C@@H](O)C(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000494237383 566975663 /nfs/dbraw/zinc/97/56/63/566975663.db2.gz KMPNIPAXWHFKNR-GZBFAFLISA-N 0 1 382.785 3.042 10 0 GGAEMN CC(C)N1C(=O)C[C@H](NC[C@H](O)C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000494237385 566976268 /nfs/dbraw/zinc/97/62/68/566976268.db2.gz KMPNIPAXWHFKNR-YDHLFZDLSA-N 0 1 382.785 3.042 10 0 GGAEMN COc1c(Br)cc(Br)cc1CN(C)CCCCO ZINC000471795696 566978204 /nfs/dbraw/zinc/97/82/04/566978204.db2.gz AJVRLHMGDRRZPE-UHFFFAOYSA-N 0 1 381.108 3.425 10 0 GGAEMN C[C@@H](NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000633682980 566978816 /nfs/dbraw/zinc/97/88/16/566978816.db2.gz WPVFVRGKXONBGZ-KOLCDFICSA-N 0 1 381.249 3.229 10 0 GGAEMN CN1CCC[C@H](NC(=O)Nc2nnc(-c3cccc(Br)c3)s2)C1 ZINC000681471875 566978876 /nfs/dbraw/zinc/97/88/76/566978876.db2.gz MAJNQJRROSGEGG-LBPRGKRZSA-N 0 1 396.314 3.183 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@H](CO)Cc1ccccc1Br ZINC000430113701 566983765 /nfs/dbraw/zinc/98/37/65/566983765.db2.gz NKSSTQINZXXPPG-CYBMUJFWSA-N 0 1 394.313 3.185 10 0 GGAEMN Cc1cc(Br)c2c(c1)CCN(C(=O)CCCCc1cn[nH]n1)C2 ZINC000633732718 566985247 /nfs/dbraw/zinc/98/52/47/566985247.db2.gz MDIRZHZOLFEIOV-UHFFFAOYSA-N 0 1 377.286 3.173 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNC(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1 ZINC000471920562 566986854 /nfs/dbraw/zinc/98/68/54/566986854.db2.gz UEOULNLZSCGOAY-STQMWFEESA-N 0 1 387.933 3.128 10 0 GGAEMN C[C@@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@H](c1ccccc1)N(C)C ZINC000583831336 566987320 /nfs/dbraw/zinc/98/73/20/566987320.db2.gz LYFAXXHUZNLUAN-CXAGYDPISA-N 0 1 389.293 3.439 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNC(=O)Nc1ccc(Cl)c(S(C)(=O)=O)c1 ZINC000471920558 566987228 /nfs/dbraw/zinc/98/72/28/566987228.db2.gz UEOULNLZSCGOAY-BETUJISGSA-N 0 1 387.933 3.128 10 0 GGAEMN C[C@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@H](c1ccccc1)N(C)C ZINC000583831339 566987492 /nfs/dbraw/zinc/98/74/92/566987492.db2.gz LYFAXXHUZNLUAN-SUMWQHHRSA-N 0 1 389.293 3.439 10 0 GGAEMN CCCSc1nc(=NC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)s[n-]1 ZINC000471944076 566989026 /nfs/dbraw/zinc/98/90/26/566989026.db2.gz PYBREBMLNAYZBP-ZIAGYGMSSA-N 0 1 377.539 3.029 10 0 GGAEMN O=C(Nc1cccc2cc(Br)cnc21)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000520201058 566989814 /nfs/dbraw/zinc/98/98/14/566989814.db2.gz UBFUYJFSPDJHPU-OKILXGFUSA-N 0 1 375.270 3.356 10 0 GGAEMN CC(C)(CNC(=O)[C@@H]1CCc2[nH]cnc2C1)c1ccccc1Br ZINC000612723627 566991026 /nfs/dbraw/zinc/99/10/26/566991026.db2.gz PMOACHJFLBZNDZ-GFCCVEGCSA-N 0 1 376.298 3.371 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2ccc(OC)cc2Br)[C@@H]1n1cccn1 ZINC000564588294 566991147 /nfs/dbraw/zinc/99/11/47/566991147.db2.gz BLNMJEIYIGXPIN-BBWFWOEESA-N 0 1 380.286 3.163 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N(C)Cc2ccc(Br)cc2F)cn1 ZINC000633757788 566991710 /nfs/dbraw/zinc/99/17/10/566991710.db2.gz RELBMDQHZVYYDM-UHFFFAOYSA-N 0 1 380.261 3.317 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NC[C@H](CO)Cc1cccc(Br)c1 ZINC000430148472 566992424 /nfs/dbraw/zinc/99/24/24/566992424.db2.gz SFWPWAKARAGLKN-CQSZACIVSA-N 0 1 394.313 3.185 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C ZINC000656992310 566992420 /nfs/dbraw/zinc/99/24/20/566992420.db2.gz BHXMEUHQVXEQKJ-YCPHGPKFSA-N 0 1 378.460 3.157 10 0 GGAEMN CC[C@@H](NCC(=O)N1CCOC[C@@H]1C1CC1)c1cc(F)cc(Br)c1 ZINC000681596387 566993132 /nfs/dbraw/zinc/99/31/32/566993132.db2.gz KCOZCBSMWOIBQT-IAGOWNOFSA-N 0 1 399.304 3.266 10 0 GGAEMN O=C(Cc1[nH]nc2ccccc21)N[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12 ZINC000633773027 566994195 /nfs/dbraw/zinc/99/41/95/566994195.db2.gz DEVMLWAOSXRURJ-MJXNMMHHSA-N 0 1 382.261 3.322 10 0 GGAEMN COc1ccc(CNC(=O)c2n[nH]c3ccc(Br)cc32)cc1F ZINC000520335957 566997259 /nfs/dbraw/zinc/99/72/59/566997259.db2.gz OBABCAHEOUBFBD-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN O=C(CCc1cnc[nH]1)N1CC2(CCOCC2)c2ccc(Br)cc21 ZINC000633847053 566997298 /nfs/dbraw/zinc/99/72/98/566997298.db2.gz CBZHKFKLEDQQEK-UHFFFAOYSA-N 0 1 390.281 3.200 10 0 GGAEMN O=C(NCCc1ccc2c(c1)OCO2)c1n[nH]c2ccc(Br)cc21 ZINC000520334151 566997710 /nfs/dbraw/zinc/99/77/10/566997710.db2.gz XXZLPNVLCVAURP-UHFFFAOYSA-N 0 1 388.221 3.027 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1cc(I)ccc1F ZINC000544812568 566997723 /nfs/dbraw/zinc/99/77/23/566997723.db2.gz LRKKGDCRYKKJJD-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1cc(I)ccc1F ZINC000544812568 566997730 /nfs/dbraw/zinc/99/77/30/566997730.db2.gz LRKKGDCRYKKJJD-UHFFFAOYSA-N 0 1 386.168 3.068 10 0 GGAEMN CC[C@H](C(=O)N1CC2(CCOCC2)c2ccc(Br)cc21)N(C)C ZINC000633846988 566997867 /nfs/dbraw/zinc/99/78/67/566997867.db2.gz AWQFGVXMBFESQJ-OAHLLOKOSA-N 0 1 381.314 3.184 10 0 GGAEMN OC[C@H](NCc1cc(Br)c2c(c1)OCCCO2)c1ccsc1 ZINC000472077503 566998301 /nfs/dbraw/zinc/99/83/01/566998301.db2.gz HVOWHKIMKIVUNQ-AWEZNQCLSA-N 0 1 384.295 3.495 10 0 GGAEMN Cc1cc(CC(=O)N2CC3(CCOCC3)c3ccc(Br)cc32)n[nH]1 ZINC000633847786 566999102 /nfs/dbraw/zinc/99/91/02/566999102.db2.gz WPJLZKBQWICRII-UHFFFAOYSA-N 0 1 390.281 3.118 10 0 GGAEMN CC[C@@H]1Cc2c(Br)cccc2CN1C[C@@H](O)COC[C@@H]1CCCO1 ZINC000583974091 567000119 /nfs/dbraw/zinc/00/01/19/567000119.db2.gz GYDUTPCNIJUAJX-ZACQAIPSSA-N 0 1 398.341 3.142 10 0 GGAEMN C[C@@H]1C[C@]2(CCO1)CN(CCOc1cccc(Br)c1)C[C@H](C)O2 ZINC000430278062 567003231 /nfs/dbraw/zinc/00/32/31/567003231.db2.gz HQLDGHZCLYAGJY-RVKKMQEKSA-N 0 1 384.314 3.486 10 0 GGAEMN C[C@@H]1C[C@]2(CCO1)CN(CCOc1ccc(Br)cc1)C[C@H](C)O2 ZINC000430271529 567003459 /nfs/dbraw/zinc/00/34/59/567003459.db2.gz VJVGGEZPGQXNNS-RVKKMQEKSA-N 0 1 384.314 3.486 10 0 GGAEMN C[C@@H]1C[C@]2(CCO1)CN(CCOc1cccc(Br)c1)C[C@@H](C)O2 ZINC000430278060 567003493 /nfs/dbraw/zinc/00/34/93/567003493.db2.gz HQLDGHZCLYAGJY-IIDMSEBBSA-N 0 1 384.314 3.486 10 0 GGAEMN C[C@@H]1C[C@@]2(CCO1)CN(CCOc1cccc(Br)c1)C[C@H](C)O2 ZINC000430278063 567004062 /nfs/dbraw/zinc/00/40/62/567004062.db2.gz HQLDGHZCLYAGJY-VKJFTORMSA-N 0 1 384.314 3.486 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000452670519 567004231 /nfs/dbraw/zinc/00/42/31/567004231.db2.gz YOIJINUYZPNEKJ-NILFDRSVSA-N 0 1 378.270 3.091 10 0 GGAEMN CCN1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)C[C@H]1C ZINC000612953471 567004879 /nfs/dbraw/zinc/00/48/79/567004879.db2.gz NBJGRGJRGPNRPJ-CQSZACIVSA-N 0 1 380.330 3.216 10 0 GGAEMN C[C@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)cn1 ZINC000564779553 567007338 /nfs/dbraw/zinc/00/73/38/567007338.db2.gz VKQBXUSIOKBYDP-SUMWQHHRSA-N 0 1 376.298 3.194 10 0 GGAEMN Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2nc([C@H](N)CC(C)C)no2)s1 ZINC000564798572 567009815 /nfs/dbraw/zinc/00/98/15/567009815.db2.gz XZOVHOCUFPPJDF-OLZOCXBDSA-N 0 1 384.527 3.011 10 0 GGAEMN CCN(CC)S(=O)(=O)c1ccc(CNCc2cc(C)c(O)c(C)c2)s1 ZINC000584080128 567010488 /nfs/dbraw/zinc/01/04/88/567010488.db2.gz OFQZUUQDJHFPGG-UHFFFAOYSA-N 0 1 382.551 3.391 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)N[C@H](C)c1ccc(Br)cc1 ZINC000494644541 567013072 /nfs/dbraw/zinc/01/30/72/567013072.db2.gz CGOZBANWQCMJML-DOMZBBRYSA-N 0 1 397.338 3.319 10 0 GGAEMN CC(C)Oc1cc(NC(=O)[C@H]2CCCc3n[nH]nc32)ccc1Br ZINC000634057395 567014089 /nfs/dbraw/zinc/01/40/89/567014089.db2.gz KSTOFEXQFAMLKI-NSHDSACASA-N 0 1 379.258 3.413 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000494657701 567014744 /nfs/dbraw/zinc/01/47/44/567014744.db2.gz VERLPFCYXVCNDJ-FZMZJTMJSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@@H](C)C(=O)Nc1ccccc1Br ZINC000494652864 567014900 /nfs/dbraw/zinc/01/49/00/567014900.db2.gz XTIVOCKFTYJUOQ-FZMZJTMJSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)Nc1ccc(Br)cc1C ZINC000494658614 567015066 /nfs/dbraw/zinc/01/50/66/567015066.db2.gz YSLGXFJZGTWBAI-CQSZACIVSA-N 0 1 383.311 3.389 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)Nc1ccc(Br)cc1C ZINC000494658613 567015089 /nfs/dbraw/zinc/01/50/89/567015089.db2.gz YSLGXFJZGTWBAI-AWEZNQCLSA-N 0 1 383.311 3.389 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@@H](C)C(=O)Nc1nc2ccc(F)cc2s1 ZINC000494655675 567015148 /nfs/dbraw/zinc/01/51/48/567015148.db2.gz LJDAZHNTBBDJHX-GWCFXTLKSA-N 0 1 379.482 3.456 10 0 GGAEMN CN(C)Cc1cc(-c2noc(-c3c[nH]c(=O)c(Br)c3)n2)ccc1F ZINC000545035153 567015361 /nfs/dbraw/zinc/01/53/61/567015361.db2.gz UJTSRKZELLMBJZ-UHFFFAOYSA-N 0 1 393.216 3.467 10 0 GGAEMN Cc1ccsc1[C@H](CO)N[C@H](C)C(=O)Nc1ccccc1Br ZINC000494652866 567015314 /nfs/dbraw/zinc/01/53/14/567015314.db2.gz XTIVOCKFTYJUOQ-RISCZKNCSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@@H](C)C(=O)Nc1ccccc1Br ZINC000494652867 567015760 /nfs/dbraw/zinc/01/57/60/567015760.db2.gz XTIVOCKFTYJUOQ-SMDDNHRTSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@H](C)C(=O)Nc1ccc(Br)cc1 ZINC000494653727 567015803 /nfs/dbraw/zinc/01/58/03/567015803.db2.gz ZREAFLZPFJZCFH-BXUZGUMPSA-N 0 1 383.311 3.469 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)N(C)Cc1ccccc1Br ZINC000494688148 567016758 /nfs/dbraw/zinc/01/67/58/567016758.db2.gz SFWRIDLVGHKYAN-HNNXBMFYSA-N 0 1 397.338 3.101 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)Nc1ccc(Br)c(C)c1 ZINC000494672940 567017293 /nfs/dbraw/zinc/01/72/93/567017293.db2.gz OBZITOUZYFRXAG-CQSZACIVSA-N 0 1 383.311 3.389 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)Nc1ccc(Br)cc1F ZINC000494686844 567017706 /nfs/dbraw/zinc/01/77/06/567017706.db2.gz SSIJFJMRBGCHCA-CYBMUJFWSA-N 0 1 387.274 3.220 10 0 GGAEMN CC1(C)CN(C(=O)c2ccc(NS(C)(=O)=O)nc2)c2ccc(Cl)cc21 ZINC000634149418 567019710 /nfs/dbraw/zinc/01/97/10/567019710.db2.gz KBWQZQBAHHZXHK-UHFFFAOYSA-N 0 1 379.869 3.045 10 0 GGAEMN CCn1c2ccc(Br)cc2nc1NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613196051 567019875 /nfs/dbraw/zinc/01/98/75/567019875.db2.gz NHQMFYVMDOSQFT-JTQLQIEISA-N 0 1 388.269 3.285 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(Br)cc(N3CCCC3)c2)[C@H](C)CN1C ZINC000613190968 567019912 /nfs/dbraw/zinc/01/99/12/567019912.db2.gz KNERVKXKMKVREW-ZIAGYGMSSA-N 0 1 380.330 3.214 10 0 GGAEMN CCn1c2cc(Br)ccc2nc1NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000613225704 567022666 /nfs/dbraw/zinc/02/26/66/567022666.db2.gz KGVZACFBJNHMMD-SNVBAGLBSA-N 0 1 388.269 3.285 10 0 GGAEMN C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ncnc2cccc(I)c21 ZINC000545164833 567024567 /nfs/dbraw/zinc/02/45/67/567024567.db2.gz YSIGKAIFLOHPOP-HZMBPMFUSA-N 0 1 394.260 3.129 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3c[nH]c4ncc(Br)cc34)[nH]c21 ZINC000472430075 567025014 /nfs/dbraw/zinc/02/50/14/567025014.db2.gz XEALCPAACQREMF-UHFFFAOYSA-N 0 1 384.237 3.440 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1C[C@@H](CO)[C@H](C(F)(F)F)C1 ZINC000634233409 567026188 /nfs/dbraw/zinc/02/61/88/567026188.db2.gz HLYIKRBCTXRHSA-IONNQARKSA-N 0 1 379.791 3.034 10 0 GGAEMN C[C@H](O)[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccccc1F ZINC000564980101 567026409 /nfs/dbraw/zinc/02/64/09/567026409.db2.gz YQJBFHNVENMLJG-YEWDVWPNSA-N 0 1 398.272 3.040 10 0 GGAEMN C[C@@]1(CNS(=O)(=O)c2cc(Br)c(F)cc2F)CC1(F)F ZINC000657155117 567027731 /nfs/dbraw/zinc/02/77/31/567027731.db2.gz GJJYELILQKDQMJ-JTQLQIEISA-N 0 1 376.169 3.051 10 0 GGAEMN Cc1cccc(CN2CC[C@@H](NC(=O)c3nscc3Br)C2)c1 ZINC000634274432 567028193 /nfs/dbraw/zinc/02/81/93/567028193.db2.gz IIVNKVQESBNUOQ-CYBMUJFWSA-N 0 1 380.311 3.218 10 0 GGAEMN C[C@H](NCc1ccc(F)cc1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430709483 567030780 /nfs/dbraw/zinc/03/07/80/567030780.db2.gz XSJBAJUAIRWHRW-JTQLQIEISA-N 0 1 387.274 3.086 10 0 GGAEMN C[C@@H](NCc1ccc(F)cc1)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430709485 567030811 /nfs/dbraw/zinc/03/08/11/567030811.db2.gz XSJBAJUAIRWHRW-SNVBAGLBSA-N 0 1 387.274 3.086 10 0 GGAEMN CN(C)[C@@H](CNc1cc(Br)cnc1C(N)=O)c1ccccc1Cl ZINC000472502328 567031744 /nfs/dbraw/zinc/03/17/44/567031744.db2.gz PTPMUPBCMXZKSD-AWEZNQCLSA-N 0 1 397.704 3.311 10 0 GGAEMN O=C([O-])c1cncnc1NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000565034511 567032582 /nfs/dbraw/zinc/03/25/82/567032582.db2.gz AEISUKDPJZJRSS-UHFFFAOYSA-N 0 1 391.269 3.014 10 0 GGAEMN C[C@@H](CC(F)(F)F)N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430742975 567032550 /nfs/dbraw/zinc/03/25/50/567032550.db2.gz QKIBWWDAMREDJL-YUMQZZPRSA-N 0 1 389.237 3.088 10 0 GGAEMN C[C@@H](N[C@@H](C)CC(F)(F)F)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430742970 567032619 /nfs/dbraw/zinc/03/26/19/567032619.db2.gz QKIBWWDAMREDJL-JGVFFNPUSA-N 0 1 389.237 3.088 10 0 GGAEMN O[C@@H](COc1ccc(Cl)c(Cl)c1)CN1CCC[C@H](c2ccncn2)C1 ZINC000613380939 567034348 /nfs/dbraw/zinc/03/43/48/567034348.db2.gz RCAVZCNJBPMQFQ-UONOGXRCSA-N 0 1 382.291 3.403 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC(c3ccccc3Br)CC2)C1 ZINC000682202102 567035936 /nfs/dbraw/zinc/03/59/36/567035936.db2.gz DLXNWWPRZQTNSJ-HNNXBMFYSA-N 0 1 380.330 3.432 10 0 GGAEMN CCc1nc([C@@H](C)Sc2nc3sc4c(c3c(=O)n2C)CCCC4)n[nH]1 ZINC000657217978 567037676 /nfs/dbraw/zinc/03/76/76/567037676.db2.gz UNFPPGQGPMBVHA-SECBINFHSA-N 0 1 375.523 3.408 10 0 GGAEMN CN(Cc1ccccc1)C[C@@H](N)c1nc(-c2ccc(Br)o2)no1 ZINC000634555093 567038158 /nfs/dbraw/zinc/03/81/58/567038158.db2.gz ZZJJROVSNQVGQQ-GFCCVEGCSA-N 0 1 377.242 3.224 10 0 GGAEMN COc1cc(Br)ccc1CCCNC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613450350 567038853 /nfs/dbraw/zinc/03/88/53/567038853.db2.gz BABDWTAGEMNUKY-ZDUSSCGKSA-N 0 1 392.297 3.035 10 0 GGAEMN O=c1c2c([n-]n1-c1ccc(Br)cn1)C[N@H+](Cc1ccccc1)CC2 ZINC000634593376 567040867 /nfs/dbraw/zinc/04/08/67/567040867.db2.gz MYOWXVSQCNPNTC-HNNXBMFYSA-N 0 1 385.265 3.069 10 0 GGAEMN C[C@](O)(C[C@@H](O)CSc1nc(-c2ccccc2Br)n[nH]1)C1CC1 ZINC000634639361 567042384 /nfs/dbraw/zinc/04/23/84/567042384.db2.gz HNJNNMCUVRWSMM-BZNIZROVSA-N 0 1 398.326 3.238 10 0 GGAEMN Oc1ccc(CN2CCN(c3ncnc4ccc(Br)cc43)CC2)cc1 ZINC000682404857 567042734 /nfs/dbraw/zinc/04/27/34/567042734.db2.gz ARLCTRSHROGJIV-UHFFFAOYSA-N 0 1 399.292 3.420 10 0 GGAEMN COc1ccc(Cl)cc1-c1n[nH]c(SC[C@H](O)C[C@](C)(O)C2CC2)n1 ZINC000634638995 567042723 /nfs/dbraw/zinc/04/27/23/567042723.db2.gz ZWRIYZFDGAOBLN-PXAZEXFGSA-N 0 1 383.901 3.138 10 0 GGAEMN Fc1cncc(Br)c1CNC[C@H](c1ccccc1)N1CCOCC1 ZINC000657299247 567044696 /nfs/dbraw/zinc/04/46/96/567044696.db2.gz UGFJLWPBBQLGRU-GOSISDBHSA-N 0 1 394.288 3.146 10 0 GGAEMN Fc1cncc(Br)c1CNCC1(N2CCOCC2)CCCCC1 ZINC000657289134 567045305 /nfs/dbraw/zinc/04/53/05/567045305.db2.gz BMRFQEVNZDPCJE-UHFFFAOYSA-N 0 1 386.309 3.108 10 0 GGAEMN CC(C)(C)c1nc(CS(=O)(=O)c2ccc(Br)c(Cl)c2)n[nH]1 ZINC000453030247 567046121 /nfs/dbraw/zinc/04/61/21/567046121.db2.gz FTKYKBLOWKGYAA-UHFFFAOYSA-N 0 1 392.706 3.492 10 0 GGAEMN Cc1ccc(Br)c(NS(=O)(=O)c2cnn(C3CCCC3)c2)n1 ZINC000634659047 567046510 /nfs/dbraw/zinc/04/65/10/567046510.db2.gz RHLWPIKUZDAAJM-UHFFFAOYSA-N 0 1 385.287 3.265 10 0 GGAEMN O=C(NCCOc1ccc(Cl)cn1)c1n[nH]c2ccc(Br)cc21 ZINC000472703105 567046643 /nfs/dbraw/zinc/04/66/43/567046643.db2.gz URIHQODDWIXIPR-UHFFFAOYSA-N 0 1 395.644 3.183 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@H](O)COc1cccc(Cl)c1Cl ZINC000657330533 567047277 /nfs/dbraw/zinc/04/72/77/567047277.db2.gz SCDNGVJWBHFGAX-VIFPVBQESA-N 0 1 398.212 3.275 10 0 GGAEMN O=C(NCCOc1ncccc1Cl)c1n[nH]c2ccc(Br)cc21 ZINC000472719510 567048260 /nfs/dbraw/zinc/04/82/60/567048260.db2.gz DZBGBNOHWCXIKA-UHFFFAOYSA-N 0 1 395.644 3.183 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CCNCc1cc2n(n1)CCC2 ZINC000657342099 567049927 /nfs/dbraw/zinc/04/99/27/567049927.db2.gz FVRXFIUHQXWABC-UHFFFAOYSA-N 0 1 377.286 3.019 10 0 GGAEMN C[C@H](N[C@@H](Cc1ccccc1)C(=O)N(C)C)c1cncc(Br)c1 ZINC000565243731 567050532 /nfs/dbraw/zinc/05/05/32/567050532.db2.gz OOIXNSWQWRJHSQ-GUYCJALGSA-N 0 1 376.298 3.194 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)C1=Cc2cc(Br)ccc2OC1 ZINC000545444059 567050939 /nfs/dbraw/zinc/05/09/39/567050939.db2.gz MGHYPFUVOXNHJA-UHFFFAOYSA-N 0 1 375.226 3.249 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)C1=Cc2cc(Br)ccc2OC1 ZINC000545444059 567050945 /nfs/dbraw/zinc/05/09/45/567050945.db2.gz MGHYPFUVOXNHJA-UHFFFAOYSA-N 0 1 375.226 3.249 10 0 GGAEMN COc1cc(Br)ccc1CCC(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000545452082 567052701 /nfs/dbraw/zinc/05/27/01/567052701.db2.gz OJPQVPUGNZEEFT-UHFFFAOYSA-N 0 1 379.258 3.415 10 0 GGAEMN COc1cc(Br)ccc1CCC(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000545452082 567052706 /nfs/dbraw/zinc/05/27/06/567052706.db2.gz OJPQVPUGNZEEFT-UHFFFAOYSA-N 0 1 379.258 3.415 10 0 GGAEMN O=C(Nc1nc2ccc(Br)cc2[nH]1)c1cnn(CC(F)(F)F)c1 ZINC000682508576 567052859 /nfs/dbraw/zinc/05/28/59/567052859.db2.gz QDKFPQZTVKCJSV-UHFFFAOYSA-N 0 1 388.147 3.337 10 0 GGAEMN Cc1cc(N2CCC(NCc3c(F)cncc3Br)CC2)nc(C)n1 ZINC000657389039 567053626 /nfs/dbraw/zinc/05/36/26/567053626.db2.gz ISYYJGBJJWATDV-UHFFFAOYSA-N 0 1 394.292 3.149 10 0 GGAEMN Cn1ncc(C2CC2)c1CNCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000657390208 567054034 /nfs/dbraw/zinc/05/40/34/567054034.db2.gz UMKIDDNYOPKNKA-UHFFFAOYSA-N 0 1 387.285 3.135 10 0 GGAEMN Cn1ncc(C2CC2)c1CNCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000657390208 567054041 /nfs/dbraw/zinc/05/40/41/567054041.db2.gz UMKIDDNYOPKNKA-UHFFFAOYSA-N 0 1 387.285 3.135 10 0 GGAEMN CC(C)(COc1ncccc1Br)NCc1cn(C2CCC2)nn1 ZINC000657412990 567054251 /nfs/dbraw/zinc/05/42/51/567054251.db2.gz GBBREAQTJXTGLK-UHFFFAOYSA-N 0 1 380.290 3.108 10 0 GGAEMN Clc1ccccc1-c1n[n-]c(=N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)s1 ZINC000545472270 567054554 /nfs/dbraw/zinc/05/45/54/567054554.db2.gz OQCYBQLXFPNJEJ-HOTGVXAUSA-N 0 1 378.929 3.336 10 0 GGAEMN O=C1C[C@H](CNCc2c(F)cncc2Br)CN1Cc1ccccc1 ZINC000657419272 567054825 /nfs/dbraw/zinc/05/48/25/567054825.db2.gz LRACVJIUQZKHRR-CQSZACIVSA-N 0 1 392.272 3.122 10 0 GGAEMN O=C(CCN1CCO[C@@H](C(F)F)CC1)Nc1ccc(Br)cc1F ZINC000634751306 567055642 /nfs/dbraw/zinc/05/56/42/567055642.db2.gz OMEAUIBLXAWWBS-CYBMUJFWSA-N 0 1 395.219 3.273 10 0 GGAEMN O=C(CCN1CCO[C@H](C(F)F)CC1)Nc1ccc(Br)cc1F ZINC000634751307 567055947 /nfs/dbraw/zinc/05/59/47/567055947.db2.gz OMEAUIBLXAWWBS-ZDUSSCGKSA-N 0 1 395.219 3.273 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2Br)n[nH]1)[C@]12CCC[C@H]1OCC2 ZINC000634736256 567056789 /nfs/dbraw/zinc/05/67/89/567056789.db2.gz GJQCDWHEJJCCTB-WBMJQRKESA-N 0 1 377.242 3.132 10 0 GGAEMN CN1CCC[C@H](CNC(=O)c2cccc([S@@](C)=O)c2)[C@@H]1c1cccs1 ZINC000613711009 567057048 /nfs/dbraw/zinc/05/70/48/567057048.db2.gz XXVWPTOCNLNVQK-LNJIKXCHSA-N 0 1 376.547 3.298 10 0 GGAEMN C[S@@](=O)c1cccc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)c1 ZINC000613705009 567057254 /nfs/dbraw/zinc/05/72/54/567057254.db2.gz CLWRFCZPYRGABK-ODCWNRFASA-N 0 1 376.547 3.128 10 0 GGAEMN CCn1ccnc1[C@@H](C)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000453154059 567057638 /nfs/dbraw/zinc/05/76/38/567057638.db2.gz ZCNNESHJHJJAKM-LLVKDONJSA-N 0 1 375.274 3.301 10 0 GGAEMN CCn1ccnc1[C@@H](C)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000453154059 567057640 /nfs/dbraw/zinc/05/76/40/567057640.db2.gz ZCNNESHJHJJAKM-LLVKDONJSA-N 0 1 375.274 3.301 10 0 GGAEMN Cc1c(Br)cncc1CN[C@H]1CCN(Cc2ccc(F)cc2)C1=O ZINC000657449052 567057872 /nfs/dbraw/zinc/05/78/72/567057872.db2.gz YGUAVVAXAFGTIC-KRWDZBQOSA-N 0 1 392.272 3.182 10 0 GGAEMN O=C([C@@H]1CC[C@H](NCc2c(F)cncc2Br)C1)N1CCCCC1 ZINC000657454840 567058292 /nfs/dbraw/zinc/05/82/92/567058292.db2.gz MXDFOKFSCXPJFV-OLZOCXBDSA-N 0 1 384.293 3.254 10 0 GGAEMN Brc1cccc(N2CC[C@H](NCc3cn(C4CCC4)nn3)C2)c1 ZINC000657451242 567058946 /nfs/dbraw/zinc/05/89/46/567058946.db2.gz LRXOKCQNNVZISQ-AWEZNQCLSA-N 0 1 376.302 3.134 10 0 GGAEMN CCOc1cc(CN[C@@H]2CCN(C(C)(C)C)C2=O)cc(Br)c1O ZINC000521438274 567059377 /nfs/dbraw/zinc/05/93/77/567059377.db2.gz ZOVHAWDNEHDSHI-CYBMUJFWSA-N 0 1 385.302 3.042 10 0 GGAEMN Cc1ccc(C[C@@H](CO)CNCc2cn(C3CCC3)nn2)cc1Br ZINC000657483565 567060730 /nfs/dbraw/zinc/06/07/30/567060730.db2.gz LTALVBGOVJDISV-OAHLLOKOSA-N 0 1 393.329 3.015 10 0 GGAEMN O[C@@H]1CC[N@@H+](Cc2cccc(NCc3c(F)cncc3Br)c2)C1 ZINC000657471885 567061394 /nfs/dbraw/zinc/06/13/94/567061394.db2.gz CSSFLUDAJLSBJY-CQSZACIVSA-N 0 1 380.261 3.162 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)c1cn[nH]c1-c1ccccn1 ZINC000565394587 567064261 /nfs/dbraw/zinc/06/42/61/567064261.db2.gz KDWIEDVSNSKILT-AWEZNQCLSA-N 0 1 399.248 3.488 10 0 GGAEMN Cc1nc2ccccn2c(=O)c1CCN(C)Cc1ccccc1Br ZINC000565413158 567066021 /nfs/dbraw/zinc/06/60/21/567066021.db2.gz SDZVXACQGMDCHC-UHFFFAOYSA-N 0 1 386.293 3.440 10 0 GGAEMN CCn1nccc1NS(=O)(=O)c1cc(Br)cc2cccnc21 ZINC000565442903 567067622 /nfs/dbraw/zinc/06/76/22/567067622.db2.gz HEJFLTFEMLETFU-UHFFFAOYSA-N 0 1 381.255 3.015 10 0 GGAEMN Cc1n[nH]c(C(=O)N[C@H](C)c2nc(-c3ccc(Br)cc3)no2)c1C ZINC000473170977 567067626 /nfs/dbraw/zinc/06/76/26/567067626.db2.gz PKFSVWULSVCCFM-SNVBAGLBSA-N 0 1 390.241 3.330 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N(Cc2cccc(Br)c2)CC2CC2)C1 ZINC000682702227 567067712 /nfs/dbraw/zinc/06/77/12/567067712.db2.gz FUACZGHEAMFRGO-QGZVFWFLSA-N 0 1 380.330 3.465 10 0 GGAEMN CC[C@@H](CNS(C)(=O)=O)N[C@H](C)c1cc2cc(Br)ccc2o1 ZINC000453272580 567071637 /nfs/dbraw/zinc/07/16/37/567071637.db2.gz BAEDRLUNUQOEDN-MFKMUULPSA-N 0 1 389.315 3.174 10 0 GGAEMN COc1sc(CN[C@@H]2Cc3ccccc3N(C)C2=O)cc1Br ZINC000657574878 567072883 /nfs/dbraw/zinc/07/28/83/567072883.db2.gz PNBIFWSOFLRQRR-CYBMUJFWSA-N 0 1 381.295 3.197 10 0 GGAEMN Cc1ccc2nc(CN3C(=O)N[C@@H](c4ccc(Br)cc4)C3=O)[nH]c2c1 ZINC000431305982 567073596 /nfs/dbraw/zinc/07/35/96/567073596.db2.gz OOYNYMMTMSTNKI-INIZCTEOSA-N 0 1 399.248 3.427 10 0 GGAEMN COCc1nc(CNCc2csc(-c3cccc(Br)c3)n2)n[nH]1 ZINC000657608418 567073835 /nfs/dbraw/zinc/07/38/35/567073835.db2.gz YIOMRTWMPKHFFX-UHFFFAOYSA-N 0 1 394.298 3.127 10 0 GGAEMN COCc1nc(CNCc2cnc(-c3ccc(Br)cc3)s2)n[nH]1 ZINC000657607550 567074953 /nfs/dbraw/zinc/07/49/53/567074953.db2.gz IPNSZTWSBJRSFL-UHFFFAOYSA-N 0 1 394.298 3.127 10 0 GGAEMN Cc1ccc(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c(C)c1Br ZINC000682856459 567075515 /nfs/dbraw/zinc/07/55/15/567075515.db2.gz PNYWMCMWKNOOJN-ZIAGYGMSSA-N 0 1 383.330 3.295 10 0 GGAEMN CCCOc1c(Cl)cc(CN[C@@H]2CC[C@@H](C)S(=O)(=O)C2)cc1OC ZINC000657634602 567078071 /nfs/dbraw/zinc/07/80/71/567078071.db2.gz JIHDGNGVWBBGLZ-TZMCWYRMSA-N 0 1 375.918 3.193 10 0 GGAEMN CCCOc1c(Cl)cc(CN[C@H]2CC[C@@H](C)S(=O)(=O)C2)cc1OC ZINC000657634601 567078451 /nfs/dbraw/zinc/07/84/51/567078451.db2.gz JIHDGNGVWBBGLZ-OCCSQVGLSA-N 0 1 375.918 3.193 10 0 GGAEMN CN(C)c1ncc(CN[C@H]2CSCc3ccc(Br)cc32)cn1 ZINC000657641533 567080205 /nfs/dbraw/zinc/08/02/05/567080205.db2.gz FRHZKJMXNOMVFX-HNNXBMFYSA-N 0 1 379.327 3.383 10 0 GGAEMN CN(C)c1ncc(CN[C@H]2CSCc3ccc(Br)cc32)n1C ZINC000657641413 567080297 /nfs/dbraw/zinc/08/02/97/567080297.db2.gz FCQIJBNQNSHNDE-HNNXBMFYSA-N 0 1 381.343 3.326 10 0 GGAEMN C[C@H]1CC[C@@H](NCC2=Cc3cc(Cl)cc(Cl)c3OC2)CS1(=O)=O ZINC000657640066 567080535 /nfs/dbraw/zinc/08/05/35/567080535.db2.gz WXMAUPAYWPWEAR-IINYFYTJSA-N 0 1 376.305 3.325 10 0 GGAEMN CC1=CC[N@@H+](CCNC(=O)Nc2ccccc2I)CC1 ZINC000545861225 567081305 /nfs/dbraw/zinc/08/13/05/567081305.db2.gz DJXOJEFMYUKFGW-UHFFFAOYSA-N 0 1 385.249 3.065 10 0 GGAEMN CC1=CCN(CCNC(=O)Nc2ccccc2I)CC1 ZINC000545861225 567081310 /nfs/dbraw/zinc/08/13/10/567081310.db2.gz DJXOJEFMYUKFGW-UHFFFAOYSA-N 0 1 385.249 3.065 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)NCC[N@@H+]2CC=C(C)CC2)cc1Br ZINC000545858548 567081693 /nfs/dbraw/zinc/08/16/93/567081693.db2.gz CNXAWFBHSLAIJR-AWEZNQCLSA-N 0 1 396.329 3.470 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)NCCN2CC=C(C)CC2)cc1Br ZINC000545858548 567081701 /nfs/dbraw/zinc/08/17/01/567081701.db2.gz CNXAWFBHSLAIJR-AWEZNQCLSA-N 0 1 396.329 3.470 10 0 GGAEMN COc1nn(C)cc1NS(=O)(=O)c1ccc2cc(Br)ccc2c1 ZINC000473468552 567083063 /nfs/dbraw/zinc/08/30/63/567083063.db2.gz DYFZBXYEUUNPTF-UHFFFAOYSA-N 0 1 396.266 3.145 10 0 GGAEMN C[C@@H](NCc1nn(C)cc1I)[C@@H]1C[C@H]1c1ccccc1 ZINC000453379792 567084095 /nfs/dbraw/zinc/08/40/95/567084095.db2.gz QZVKKRCRGNTBIZ-XBFCOCLRSA-N 0 1 381.261 3.307 10 0 GGAEMN Cc1nc(CC2CC2)sc1C(=O)NCC1(N2CCSCC2)CCCC1 ZINC000473484030 567084742 /nfs/dbraw/zinc/08/47/42/567084742.db2.gz YVEFVCBCISEUER-UHFFFAOYSA-N 0 1 379.595 3.495 10 0 GGAEMN OC(CNCc1ncc(Br)cc1Br)(C1CC1)C1CC1 ZINC000657699661 567086058 /nfs/dbraw/zinc/08/60/58/567086058.db2.gz MXLXPMFNTJYXHW-UHFFFAOYSA-N 0 1 390.119 3.247 10 0 GGAEMN CCOC(=O)c1sc(CNC(=O)c2n[nH]c3ccc(Cl)cc32)nc1C ZINC000585763018 567087489 /nfs/dbraw/zinc/08/74/89/567087489.db2.gz VNNGBPUCPDNBAQ-UHFFFAOYSA-N 0 1 378.841 3.088 10 0 GGAEMN C[C@H](c1ccccc1Br)N(C)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000521947946 567087655 /nfs/dbraw/zinc/08/76/55/567087655.db2.gz OHFFWKUKOZFUAG-VXGBXAGGSA-N 0 1 377.286 3.432 10 0 GGAEMN CN(C)[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)c1ccsc1 ZINC000521967850 567089890 /nfs/dbraw/zinc/08/98/90/567089890.db2.gz GUTPTWJYCZEOHY-AWEZNQCLSA-N 0 1 393.310 3.420 10 0 GGAEMN O=C(N[C@H]1CSc2ccc(Br)cc21)[C@@H]1CCc2[nH]cnc2C1 ZINC000614150836 567090070 /nfs/dbraw/zinc/09/00/70/567090070.db2.gz SQNYUGQXMDJDMJ-OTYXRUKQSA-N 0 1 378.295 3.240 10 0 GGAEMN CCS(=O)(=O)C1(CNCc2ccc(Br)cc2SC)CC1 ZINC000657759900 567095290 /nfs/dbraw/zinc/09/52/90/567095290.db2.gz YBUJAGZDIVVDMP-UHFFFAOYSA-N 0 1 378.357 3.228 10 0 GGAEMN Cc1cc(Br)c(CNC[C@H](O)C[N@H+]2CCc3ccccc3C2)s1 ZINC000453566926 567090594 /nfs/dbraw/zinc/09/05/94/567090594.db2.gz GFNCGAWEOWFJGV-INIZCTEOSA-N 0 1 395.366 3.328 10 0 GGAEMN Cc1cc(Br)c(CNC[C@H]2CS(=O)(=O)c3ccccc32)s1 ZINC000453571529 567092335 /nfs/dbraw/zinc/09/23/35/567092335.db2.gz DMXCNBQUXMIKEM-NSHDSACASA-N 0 1 386.336 3.480 10 0 GGAEMN CCS(=O)(=O)C1(CNCc2cc(Br)ccc2OC(F)F)CC1 ZINC000657758050 567092601 /nfs/dbraw/zinc/09/26/01/567092601.db2.gz WROKPJJQXAANTC-UHFFFAOYSA-N 0 1 398.269 3.107 10 0 GGAEMN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000522037497 567095346 /nfs/dbraw/zinc/09/53/46/567095346.db2.gz LDCRECDXUKNESQ-HNNXBMFYSA-N 0 1 390.325 3.476 10 0 GGAEMN O=C(N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@H]1CCc2[nH]cnc2C1 ZINC000614254511 567097720 /nfs/dbraw/zinc/09/77/20/567097720.db2.gz UDZNVNIPUFXCQP-ZIBATOQPSA-N 0 1 378.245 3.089 10 0 GGAEMN C[C@H](O)[C@@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccccc1 ZINC000657819962 567098512 /nfs/dbraw/zinc/09/85/12/567098512.db2.gz VBMWQAVHGHHVAF-YVEFUNNKSA-N 0 1 378.266 3.432 10 0 GGAEMN Cc1cc(C(=O)N2CCN(Cc3ccc(Br)cc3C)[C@H](C)C2)n[nH]1 ZINC000453618360 567098682 /nfs/dbraw/zinc/09/86/82/567098682.db2.gz SMWXYQXVUXBVES-CQSZACIVSA-N 0 1 391.313 3.136 10 0 GGAEMN Cc1cc(C2CCN(C(=O)Cc3ccc(Br)cc3O)CC2)n[nH]1 ZINC000497518499 567103406 /nfs/dbraw/zinc/10/34/06/567103406.db2.gz YKXQHBMWIQAUTQ-UHFFFAOYSA-N 0 1 378.270 3.135 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)s[n-]1 ZINC000473824027 567104284 /nfs/dbraw/zinc/10/42/84/567104284.db2.gz NPVXYNJPQHWGTH-CYBMUJFWSA-N 0 1 379.555 3.096 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)s[n-]1 ZINC000473845453 567106083 /nfs/dbraw/zinc/10/60/83/567106083.db2.gz WWHMEXJEQYQAEW-AAEUAGOBSA-N 0 1 379.555 3.239 10 0 GGAEMN O=C(N[C@H]1CCOc2ccc(Br)cc21)c1ccc(-c2nnc[nH]2)cc1 ZINC000473837593 567106238 /nfs/dbraw/zinc/10/62/38/567106238.db2.gz SFDOLGFRZKWCLM-HNNXBMFYSA-N 0 1 399.248 3.488 10 0 GGAEMN O=C1CCCN1CCCN1CCC[C@@H]1c1ccccc1I ZINC000522245704 567108441 /nfs/dbraw/zinc/10/84/41/567108441.db2.gz XAUNNOOGBFCEBZ-MRXNPFEDSA-N 0 1 398.288 3.441 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)c1cnccc1N(C)C ZINC000546134995 567108863 /nfs/dbraw/zinc/10/88/63/567108863.db2.gz MEXJGBBBWDPFRG-PXAZEXFGSA-N 0 1 392.297 3.416 10 0 GGAEMN CN1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CC1(C)C ZINC000614409740 567111004 /nfs/dbraw/zinc/11/10/04/567111004.db2.gz JNARWFZWMMQXME-UHFFFAOYSA-N 0 1 380.330 3.216 10 0 GGAEMN Cc1nc([C@@](C)(NC(=O)c2cc(Br)cc3nc[nH]c32)C2CC2)no1 ZINC000497577457 567111554 /nfs/dbraw/zinc/11/15/54/567111554.db2.gz DQBQKPGPOSXXRJ-INIZCTEOSA-N 0 1 390.241 3.072 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCO[C@H](c2ccc(F)c(Br)c2)C1 ZINC000635814765 567113230 /nfs/dbraw/zinc/11/32/30/567113230.db2.gz SVVNSBPNGXECMG-HSMVNMDESA-N 0 1 394.244 3.015 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCC(Oc2cccc(Br)c2)CC1 ZINC000635798197 567113377 /nfs/dbraw/zinc/11/33/77/567113377.db2.gz NYCSQVKYUIWDSM-HZPDHXFCSA-N 0 1 390.281 3.346 10 0 GGAEMN Cc1n[nH]c(C(=O)NCCSCCOc2cccc(Br)c2)c1C ZINC000522415875 567116330 /nfs/dbraw/zinc/11/63/30/567116330.db2.gz OBWSWUMKOUSRLX-UHFFFAOYSA-N 0 1 398.326 3.331 10 0 GGAEMN C[C@@H](NC[C@@H]1CC[N@H+]1C(C)(C)C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658060172 567118417 /nfs/dbraw/zinc/11/84/17/567118417.db2.gz KGVZBSUNOKEYBM-MNOVXSKESA-N 0 1 394.368 3.164 10 0 GGAEMN O=C1NCC[C@@H]1N[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000658052188 567118767 /nfs/dbraw/zinc/11/87/67/567118767.db2.gz BPYMRZXBGQPENR-OCCSQVGLSA-N 0 1 392.322 3.428 10 0 GGAEMN CO[C@@H](CCNS(=O)(=O)c1ccc(Cl)c(F)c1Cl)C(F)(F)F ZINC000473955264 567118882 /nfs/dbraw/zinc/11/88/82/567118882.db2.gz BPYNJPGBOZMTNT-QMMMGPOBSA-N 0 1 384.178 3.378 10 0 GGAEMN CC[C@H](COCC1CC1)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658092600 567122214 /nfs/dbraw/zinc/12/22/14/567122214.db2.gz QSLKXPPDFHTRKP-CMPLNLGQSA-N 0 1 395.352 3.497 10 0 GGAEMN CC[C@@H](COCC1CC1)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658092605 567122545 /nfs/dbraw/zinc/12/25/45/567122545.db2.gz QSLKXPPDFHTRKP-PWSUYJOCSA-N 0 1 395.352 3.497 10 0 GGAEMN O=C(Nc1nnc(COc2ccc(Cl)cc2)s1)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000636042571 567123487 /nfs/dbraw/zinc/12/34/87/567123487.db2.gz RVXQUZWSLKWISS-VXGBXAGGSA-N 0 1 375.841 3.236 10 0 GGAEMN Cc1ccncc1CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000658122233 567123643 /nfs/dbraw/zinc/12/36/43/567123643.db2.gz FFDJLVKUUQVALP-INIZCTEOSA-N 0 1 395.322 3.203 10 0 GGAEMN COCc1nnc(C[NH2+][C@@H]2c3cc(Br)ccc3SC[C@@H]2C)[n-]1 ZINC000658157737 567125692 /nfs/dbraw/zinc/12/56/92/567125692.db2.gz CWDJFHBGSKZFAA-VFZGTOFNSA-N 0 1 383.315 3.286 10 0 GGAEMN COCc1nc(CN[C@H](c2ccco2)c2ccc(Br)cc2)n[nH]1 ZINC000658157760 567126794 /nfs/dbraw/zinc/12/67/94/567126794.db2.gz DIIDSARGUFNEJK-INIZCTEOSA-N 0 1 377.242 3.186 10 0 GGAEMN COc1cccc([C@@H](CNC(=O)Cc2cscc2Br)N(C)C)c1 ZINC000432053174 567127533 /nfs/dbraw/zinc/12/75/33/567127533.db2.gz DGGJVOQNQZOZLG-MRXNPFEDSA-N 0 1 397.338 3.481 10 0 GGAEMN Cc1noc(C)c1[C@@H](C)NC(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000683482514 567127660 /nfs/dbraw/zinc/12/76/60/567127660.db2.gz JXJWGPSDCFFMBF-MRVPVSSYSA-N 0 1 390.237 3.386 10 0 GGAEMN Cc1noc(C)c1[C@H](C)NC(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000683482515 567127740 /nfs/dbraw/zinc/12/77/40/567127740.db2.gz JXJWGPSDCFFMBF-QMMMGPOBSA-N 0 1 390.237 3.386 10 0 GGAEMN CN(C)C[C@H](Cc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1Cl ZINC000614632825 567128069 /nfs/dbraw/zinc/12/80/69/567128069.db2.gz FOYRSVFPSPPRBI-AWEZNQCLSA-N 0 1 387.332 3.445 10 0 GGAEMN CC1(C)CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)C(C)(C)CO1 ZINC000683483177 567128183 /nfs/dbraw/zinc/12/81/83/567128183.db2.gz VWSDVBMOOQGTKA-UHFFFAOYSA-N 0 1 393.281 3.320 10 0 GGAEMN CSc1n[nH]c(NC(=O)Cn2c(C)c(Br)c3ccccc32)n1 ZINC000522721847 567128534 /nfs/dbraw/zinc/12/85/34/567128534.db2.gz DPBUNNNCVJSEKS-UHFFFAOYSA-N 0 1 380.271 3.191 10 0 GGAEMN Cc1ccc(CN(C)C(=O)c2c[nH]c3ccc(Br)cc3c2=O)nc1 ZINC000683501580 567129318 /nfs/dbraw/zinc/12/93/18/567129318.db2.gz VOICXJYNPUPTBB-UHFFFAOYSA-N 0 1 386.249 3.266 10 0 GGAEMN Cc1c([C@H](C)N[C@@H]2C[C@@H](O)C23CCC3)nnn1-c1cccc(Br)c1 ZINC000658257442 567130849 /nfs/dbraw/zinc/13/08/49/567130849.db2.gz XXEGCJTUQJJGSZ-IUIKQTSFSA-N 0 1 391.313 3.292 10 0 GGAEMN Cc1ccc(C(=O)C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1 ZINC000588652792 567132059 /nfs/dbraw/zinc/13/20/59/567132059.db2.gz NOORXWIEKLEJKA-UHFFFAOYSA-N 0 1 399.248 3.042 10 0 GGAEMN Cc1ccc(C(=O)C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1 ZINC000588652792 567132066 /nfs/dbraw/zinc/13/20/66/567132066.db2.gz NOORXWIEKLEJKA-UHFFFAOYSA-N 0 1 399.248 3.042 10 0 GGAEMN Cc1nc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)oc1C ZINC000588687368 567133034 /nfs/dbraw/zinc/13/30/34/567133034.db2.gz MKQZWXBHPFTSCF-UHFFFAOYSA-N 0 1 391.229 3.161 10 0 GGAEMN Cc1nc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)oc1C ZINC000588687368 567133039 /nfs/dbraw/zinc/13/30/39/567133039.db2.gz MKQZWXBHPFTSCF-UHFFFAOYSA-N 0 1 391.229 3.161 10 0 GGAEMN CC1(C)CN(C(=O)[C@H]2CCCc3n[nH]nc32)c2ccc(Br)cc21 ZINC000614708679 567133091 /nfs/dbraw/zinc/13/30/91/567133091.db2.gz AFGDRZGLYJDAOB-NSHDSACASA-N 0 1 375.270 3.312 10 0 GGAEMN C[C@@H](N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2)c1ncc(Br)cc1F ZINC000658291169 567133660 /nfs/dbraw/zinc/13/36/60/567133660.db2.gz TVESHFUJBDAAJN-DAXOMENPSA-N 0 1 398.320 3.277 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2ccc(Br)s2)[nH]n1 ZINC000432143244 567133827 /nfs/dbraw/zinc/13/38/27/567133827.db2.gz LXMKADHMDVCAAX-UHFFFAOYSA-N 0 1 381.299 3.007 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(Br)c(C)c3)[nH]c21 ZINC000497937134 567134148 /nfs/dbraw/zinc/13/41/48/567134148.db2.gz IGEBPPNDZSFIDZ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN CC[N@H+]1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)[C@@H](C)C1 ZINC000614710174 567134221 /nfs/dbraw/zinc/13/42/21/567134221.db2.gz KEJLNNFIBGDATP-AWEZNQCLSA-N 0 1 380.330 3.216 10 0 GGAEMN CCN1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)[C@@H](C)C1 ZINC000614710174 567134226 /nfs/dbraw/zinc/13/42/26/567134226.db2.gz KEJLNNFIBGDATP-AWEZNQCLSA-N 0 1 380.330 3.216 10 0 GGAEMN O=C1N(CCN[C@@H]2CCc3c2c(Br)ccc3F)C[C@H]2CCCCN12 ZINC000658303691 567134568 /nfs/dbraw/zinc/13/45/68/567134568.db2.gz CNOCYPLWNCVGAU-MLGOLLRUSA-N 0 1 396.304 3.455 10 0 GGAEMN COc1ccc([C@H](C)NCCN2C[C@H]3CCCCN3C2=O)c(Br)c1 ZINC000658307743 567135292 /nfs/dbraw/zinc/13/52/92/567135292.db2.gz WBTOBHNHHLYQJO-UONOGXRCSA-N 0 1 396.329 3.398 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)CC1 ZINC000546565762 567137410 /nfs/dbraw/zinc/13/74/10/567137410.db2.gz HZDBKRLWMSLMFL-IRXDYDNUSA-N 0 1 378.314 3.256 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3cc(Br)ccc3F)[nH]c21 ZINC000497968721 567137741 /nfs/dbraw/zinc/13/77/41/567137741.db2.gz NVFVGGKDZHVPPT-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN CC(=O)c1cnc(NC(=O)c2cc(=O)c3cc(Br)ccc3[nH]2)s1 ZINC000522919260 567138135 /nfs/dbraw/zinc/13/81/35/567138135.db2.gz PLXGDJKANNXYLH-UHFFFAOYSA-N 0 1 392.234 3.202 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](CCOc2ccc(Br)cc2)C[C@H]1C(F)(F)F ZINC000497996740 567140197 /nfs/dbraw/zinc/14/01/97/567140197.db2.gz QPSZOKHRVWBCSR-VXGBXAGGSA-N 0 1 382.176 3.023 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(C)c(Br)c3)[nH]c21 ZINC000497984372 567140370 /nfs/dbraw/zinc/14/03/70/567140370.db2.gz QQAKMHVMAROLLZ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN Cc1[nH]c2nc(S(=O)(=O)[C@H]3CCc4ccccc43)nc-2cc1Br ZINC000683732330 567148595 /nfs/dbraw/zinc/14/85/95/567148595.db2.gz QVEANTMRLKQNQX-AWEZNQCLSA-N 0 1 392.278 3.490 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC[C@H]1C(F)(F)F ZINC000615029367 567152266 /nfs/dbraw/zinc/15/22/66/567152266.db2.gz HOHLIORWIWNQEM-NSHDSACASA-N 0 1 375.144 3.067 10 0 GGAEMN CN(C)C(=O)CC[NH+]1CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474258914 567152305 /nfs/dbraw/zinc/15/23/05/567152305.db2.gz KVRDXGMYDHJVIY-UHFFFAOYSA-N 0 1 386.367 3.412 10 0 GGAEMN O=C(Nc1cnn(-c2ccncc2)c1)C1=Cc2cc(Br)ccc2OC1 ZINC000589074482 567154308 /nfs/dbraw/zinc/15/43/08/567154308.db2.gz DQJLZGJWTKGYJI-UHFFFAOYSA-N 0 1 397.232 3.444 10 0 GGAEMN CSc1ccc(S(=O)(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1 ZINC000474301440 567157490 /nfs/dbraw/zinc/15/74/90/567157490.db2.gz CTTQTJHLPQBGSM-KRWDZBQOSA-N 0 1 376.547 3.304 10 0 GGAEMN CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)Cc1ccccc1Cl ZINC000474302788 567157634 /nfs/dbraw/zinc/15/76/34/567157634.db2.gz NIJKCMTUYLVEFQ-SFHVURJKSA-N 0 1 378.925 3.376 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CSC)cc1 ZINC000546779073 567157748 /nfs/dbraw/zinc/15/77/48/567157748.db2.gz WQZIANZGPCWOHY-UHFFFAOYSA-N 0 1 385.532 3.144 10 0 GGAEMN CN([C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(F)cc1Cl ZINC000474307882 567157784 /nfs/dbraw/zinc/15/77/84/567157784.db2.gz HRSMRINQJVNNBD-MRXNPFEDSA-N 0 1 382.888 3.374 10 0 GGAEMN Cc1cccc(S(=O)(=O)Nc2ccc(C(N)=O)c(OC(C)C)c2)c1Cl ZINC000432480457 567162501 /nfs/dbraw/zinc/16/25/01/567162501.db2.gz WFXGCRGPFNUIIY-UHFFFAOYSA-N 0 1 382.869 3.335 10 0 GGAEMN CC(C)Oc1cc(NS(=O)(=O)c2ccc(F)cc2Cl)ccc1C(N)=O ZINC000432484632 567162880 /nfs/dbraw/zinc/16/28/80/567162880.db2.gz GRFPLOCKHPAOMU-UHFFFAOYSA-N 0 1 386.832 3.166 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1C[C@@H](OC)C[C@H]1CC(=O)[O-] ZINC000566566414 567168617 /nfs/dbraw/zinc/16/86/17/567168617.db2.gz IKWGZXCEUVCBLD-GJZGRUSLSA-N 0 1 386.286 3.302 10 0 GGAEMN COc1ccsc1S(=O)(=O)N[C@@]1(C(F)(F)F)CCc2ccccc21 ZINC000546879982 567168667 /nfs/dbraw/zinc/16/86/67/567168667.db2.gz QNFGARBWJIZJSX-AWEZNQCLSA-N 0 1 377.409 3.439 10 0 GGAEMN O=C(Cc1cccs1)N1CCC[C@@H]1C(=O)Nc1cc(F)cc(Cl)c1O ZINC000474428756 567170130 /nfs/dbraw/zinc/17/01/30/567170130.db2.gz FFUPBXBEXXIRKW-CQSZACIVSA-N 0 1 382.844 3.418 10 0 GGAEMN C[C@@H]1CC[C@H](CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000474446351 567172870 /nfs/dbraw/zinc/17/28/70/567172870.db2.gz BFMXTUAHBNZYIG-NEPJUHHUSA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@@H]1CC[C@H](CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000474446351 567172879 /nfs/dbraw/zinc/17/28/79/567172879.db2.gz BFMXTUAHBNZYIG-NEPJUHHUSA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@H]1CC[C@H](CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000474446353 567173186 /nfs/dbraw/zinc/17/31/86/567173186.db2.gz BFMXTUAHBNZYIG-RYUDHWBXSA-N 0 1 392.301 3.470 10 0 GGAEMN C[C@H]1CC[C@H](CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000474446353 567173190 /nfs/dbraw/zinc/17/31/90/567173190.db2.gz BFMXTUAHBNZYIG-RYUDHWBXSA-N 0 1 392.301 3.470 10 0 GGAEMN C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000615277543 567174626 /nfs/dbraw/zinc/17/46/26/567174626.db2.gz WLSULDHXXSAZRS-IHETXDGRSA-N 0 1 383.319 3.419 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3ccc(I)cc3)[nH]c21 ZINC000498387413 567175255 /nfs/dbraw/zinc/17/52/55/567175255.db2.gz XWNUGYJXAQEWIO-UHFFFAOYSA-N 0 1 391.212 3.406 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3cc4c(c(Br)c3)OCO4)[nH]c21 ZINC000498412375 567176250 /nfs/dbraw/zinc/17/62/50/567176250.db2.gz VMJGWJBATWZTEK-UHFFFAOYSA-N 0 1 388.221 3.293 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)C[C@@H]1C(=O)[O-] ZINC000566679506 567180048 /nfs/dbraw/zinc/18/00/48/567180048.db2.gz WHSLHPRGQHWTSM-AAEUAGOBSA-N 0 1 384.270 3.153 10 0 GGAEMN COC(=O)CCS(=O)(=O)Nc1cc(Cl)ccc1SCC(F)(F)F ZINC000589553601 567184028 /nfs/dbraw/zinc/18/40/28/567184028.db2.gz SNMVCEBPTHOZTQ-UHFFFAOYSA-N 0 1 391.820 3.299 10 0 GGAEMN O=C(Cn1cc(-c2ccccc2)nn1)Nc1nc2ccc(Br)cc2[nH]1 ZINC000474696879 567192412 /nfs/dbraw/zinc/19/24/12/567192412.db2.gz SQTLONGHWMLRIA-UHFFFAOYSA-N 0 1 397.236 3.223 10 0 GGAEMN CN1CCC[C@H](NC(=O)N(Cc2cc(Br)ccc2F)C2CC2)C1 ZINC000589767870 567193589 /nfs/dbraw/zinc/19/35/89/567193589.db2.gz WTMVJCMWILXQDA-AWEZNQCLSA-N 0 1 384.293 3.356 10 0 GGAEMN Cc1ccc2nc(CNC(=O)c3sc4c(c3Br)CNC4)[nH]c2c1 ZINC000659256359 567196147 /nfs/dbraw/zinc/19/61/47/567196147.db2.gz LOLLIMFJKKXGEZ-UHFFFAOYSA-N 0 1 391.294 3.229 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000524351737 567196288 /nfs/dbraw/zinc/19/62/88/567196288.db2.gz RQGJTBDSWVVALM-LLVKDONJSA-N 0 1 385.942 3.366 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000659256962 567196500 /nfs/dbraw/zinc/19/65/00/567196500.db2.gz POJLSYOUJSLAGG-UONOGXRCSA-N 0 1 387.343 3.197 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N(Cc1cc(Br)ccc1F)C(C)C ZINC000659274623 567197505 /nfs/dbraw/zinc/19/75/05/567197505.db2.gz CNJDJKPRDSENCD-HNNXBMFYSA-N 0 1 375.282 3.078 10 0 GGAEMN CCc1ncc(S(=O)(=O)NC[C@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000547304187 567197845 /nfs/dbraw/zinc/19/78/45/567197845.db2.gz FZYGININFQFALL-MLGOLLRUSA-N 0 1 385.580 3.128 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC/C=C/c2ccc(Br)cc2)n[nH]1 ZINC000454707890 567198387 /nfs/dbraw/zinc/19/83/87/567198387.db2.gz MAACFLWSWJWBRZ-PCAWENJQSA-N 0 1 377.286 3.424 10 0 GGAEMN CC(C)c1nc(CNC(=O)c2cc(Br)cc(N3CCCC3)c2)n[nH]1 ZINC000615670874 567198555 /nfs/dbraw/zinc/19/85/55/567198555.db2.gz WYUGORAUSFRXFI-UHFFFAOYSA-N 0 1 392.301 3.221 10 0 GGAEMN CCc1ncc(S(=O)(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)s1 ZINC000547304182 567198689 /nfs/dbraw/zinc/19/86/89/567198689.db2.gz FZYGININFQFALL-BLLLJJGKSA-N 0 1 385.580 3.128 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)NC1(c2cccc(Br)c2)CCCCC1 ZINC000659279264 567198851 /nfs/dbraw/zinc/19/88/51/567198851.db2.gz YIKYBFRHFBTMIW-INIZCTEOSA-N 0 1 383.330 3.477 10 0 GGAEMN CCOc1c(Br)cc(Cl)cc1NC(=O)[C@@H](N)COC(C)C ZINC000659274940 567198874 /nfs/dbraw/zinc/19/88/74/567198874.db2.gz BTNKSVIAWRCFFK-NSHDSACASA-N 0 1 379.682 3.192 10 0 GGAEMN CCOC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccnc(SC)c2)c1 ZINC000589976755 567201252 /nfs/dbraw/zinc/20/12/52/567201252.db2.gz XOVIKAPJBOTWGH-UHFFFAOYSA-N 0 1 386.882 3.434 10 0 GGAEMN O=C(c1sc2c(c1Br)CNC2)N1CCN(C2CCCCC2)CC1 ZINC000659316251 567203660 /nfs/dbraw/zinc/20/36/60/567203660.db2.gz HLEBJGAKFXBABV-UHFFFAOYSA-N 0 1 398.370 3.204 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000659328602 567206815 /nfs/dbraw/zinc/20/68/15/567206815.db2.gz HRNOGKNJGRAGAQ-AWEZNQCLSA-N 0 1 394.730 3.048 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)Nc1nnc(-c2cc(Cl)cc(Cl)c2)s1 ZINC000659337730 567207105 /nfs/dbraw/zinc/20/71/05/567207105.db2.gz MBZSRBVQVDJLED-NSHDSACASA-N 0 1 375.281 3.203 10 0 GGAEMN Cc1nc2ccc(Br)cn2c1C(=O)Nc1cnn(-c2ccncc2)c1 ZINC000684428318 567207819 /nfs/dbraw/zinc/20/78/19/567207819.db2.gz GJBNINQWAVWTGI-UHFFFAOYSA-N 0 1 397.236 3.238 10 0 GGAEMN Cc1ccoc1CN(C)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000566978898 567208106 /nfs/dbraw/zinc/20/81/06/567208106.db2.gz DURUDUMKGSCAIK-UHFFFAOYSA-N 0 1 395.200 3.341 10 0 GGAEMN NC(=O)[C@H](CNCc1c(F)cccc1Br)Cc1ccc(F)cc1 ZINC000474890904 567208603 /nfs/dbraw/zinc/20/86/03/567208603.db2.gz BRNVOGHZOCUISU-LBPRGKRZSA-N 0 1 383.236 3.161 10 0 GGAEMN COC1CCN(CCNC(=O)c2cc(F)c(Br)cc2Cl)CC1 ZINC000684454257 567208942 /nfs/dbraw/zinc/20/89/42/567208942.db2.gz FGEBWXMODMJNEE-UHFFFAOYSA-N 0 1 393.684 3.082 10 0 GGAEMN CCOc1c(Br)cc(C(=O)N(C)[C@H]2CN3CCC2CC3)cc1OC ZINC000524694924 567209933 /nfs/dbraw/zinc/20/99/33/567209933.db2.gz IHOXRTKVBHKIES-HNNXBMFYSA-N 0 1 397.313 3.023 10 0 GGAEMN Cc1ccc(O[C@H](C)C(=O)N(C)[C@@H]2CN3CCC2CC3)c(Br)c1 ZINC000524694389 567210216 /nfs/dbraw/zinc/21/02/16/567210216.db2.gz MPZONJAKYVXJME-CZUORRHYSA-N 0 1 381.314 3.077 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)Nc1ccn(-c2ccc(Br)cc2)n1 ZINC000498909370 567211750 /nfs/dbraw/zinc/21/17/50/567211750.db2.gz WEIVHEFKHXJYTL-UHFFFAOYSA-N 0 1 388.269 3.464 10 0 GGAEMN COc1cccc(S(=O)(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c1 ZINC000684579054 567217982 /nfs/dbraw/zinc/21/79/82/567217982.db2.gz DIAGVMDEYRYIIZ-KBXCAEBGSA-N 0 1 380.535 3.118 10 0 GGAEMN O=C(Cc1c(F)ccc(Br)c1F)Nc1nc(-c2ccncc2)n[nH]1 ZINC000433082633 567220823 /nfs/dbraw/zinc/22/08/23/567220823.db2.gz LBVCUCNDOMPUMH-UHFFFAOYSA-N 0 1 394.179 3.089 10 0 GGAEMN C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)[N@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000659797853 567225774 /nfs/dbraw/zinc/22/57/74/567225774.db2.gz VDAYNPAMNZFRRR-VOAKCMCISA-N 0 1 376.280 3.307 10 0 GGAEMN CCC[C@@H]1CN(C(=O)Nc2nc(C(F)(F)F)cs2)CCN1CCOC ZINC000499143503 567227008 /nfs/dbraw/zinc/22/70/08/567227008.db2.gz YDKKCGKYXSJHPK-LLVKDONJSA-N 0 1 380.436 3.127 10 0 GGAEMN Cc1cc([C@@H]2CCCN2C[C@@H](O)COC[C@@H]2CCCO2)ccc1Br ZINC000684668079 567227535 /nfs/dbraw/zinc/22/75/35/567227535.db2.gz AGXZLNZEZPDCOU-AOIWGVFYSA-N 0 1 398.341 3.451 10 0 GGAEMN CO[C@@H]1CN(Cc2ccc(Br)cc2N2CCOCC2)CC[C@@H]1C ZINC000475127656 567227915 /nfs/dbraw/zinc/22/79/15/567227915.db2.gz DEGWVSDTPWPFTH-KBXCAEBGSA-N 0 1 383.330 3.143 10 0 GGAEMN CCc1nc([C@H](C)N2CCN(Cc3ccc(Br)s3)CC2)n[nH]1 ZINC000659831849 567230103 /nfs/dbraw/zinc/23/01/03/567230103.db2.gz KZZWTVMCPFFMNT-NSHDSACASA-N 0 1 384.347 3.070 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCO[C@H](C2CC2)C1 ZINC000547605958 567230248 /nfs/dbraw/zinc/23/02/48/567230248.db2.gz NTLULXGVWZSPAC-INIZCTEOSA-N 0 1 376.254 3.090 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCC[C@@H]1c1ccc(Br)cn1 ZINC000616197332 567232149 /nfs/dbraw/zinc/23/21/49/567232149.db2.gz QMMMSYBNJSBSNT-BDJLRTHQSA-N 0 1 375.270 3.036 10 0 GGAEMN CCN1CCN(c2ccc(CNc3ncc(C)cc3Br)cn2)CC1 ZINC000684760410 567234119 /nfs/dbraw/zinc/23/41/19/567234119.db2.gz LHFABMPIIYFBPH-UHFFFAOYSA-N 0 1 390.329 3.302 10 0 GGAEMN Cc1ccsc1[C@@H](CO)N[C@H]1CCN(c2cccc(Br)c2)C1=O ZINC000433245159 567235541 /nfs/dbraw/zinc/23/55/41/567235541.db2.gz IMSBEWJCPRQTJV-LSDHHAIUSA-N 0 1 395.322 3.248 10 0 GGAEMN CC1=CCCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000684806749 567238457 /nfs/dbraw/zinc/23/84/57/567238457.db2.gz MEPDQDPATZGFLC-UHFFFAOYSA-N 0 1 376.258 3.096 10 0 GGAEMN CC1=CCCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000684806749 567238460 /nfs/dbraw/zinc/23/84/60/567238460.db2.gz MEPDQDPATZGFLC-UHFFFAOYSA-N 0 1 376.258 3.096 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cccc(Br)c2OC)[C@@H]1n1cccn1 ZINC000567372128 567239501 /nfs/dbraw/zinc/23/95/01/567239501.db2.gz XFCPTPYNAZOOCG-OAGGEKHMSA-N 0 1 380.286 3.163 10 0 GGAEMN CCOc1c(Br)cc(C[N@H+]2CC[C@H](C)[C@H](C(=O)[O-])C2)cc1OC ZINC000567385950 567241758 /nfs/dbraw/zinc/24/17/58/567241758.db2.gz YEPDAGFOZACJJX-WCQYABFASA-N 0 1 386.286 3.399 10 0 GGAEMN Brc1cc(CNCc2ccc(-c3cc[nH]n3)o2)cc2c1OCO2 ZINC000433312939 567241868 /nfs/dbraw/zinc/24/18/68/567241868.db2.gz NXHWCHOWLKQVNU-UHFFFAOYSA-N 0 1 376.210 3.451 10 0 GGAEMN Brc1cc(CNCc2ccc(-c3cc[nH]n3)o2)cc2c1OCCO2 ZINC000433315700 567242605 /nfs/dbraw/zinc/24/26/05/567242605.db2.gz ZCBQTWFKUKXVBS-UHFFFAOYSA-N 0 1 390.237 3.493 10 0 GGAEMN CC(C)(CO)[C@@H](NCC(=O)Nc1nc2c(s1)CCCC2)c1cccs1 ZINC000567401734 567242801 /nfs/dbraw/zinc/24/28/01/567242801.db2.gz WSSVEBSPEBKTTM-INIZCTEOSA-N 0 1 379.551 3.371 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC(c3cccc(Br)c3)CC2)C1 ZINC000684888479 567244196 /nfs/dbraw/zinc/24/41/96/567244196.db2.gz CVSNPKTYDBACJK-QGZVFWFLSA-N 0 1 380.330 3.432 10 0 GGAEMN O=S(=O)(Cc1ccccc1C(F)(F)F)Nc1cc([C@H]2CCCO2)[nH]n1 ZINC000567418981 567244644 /nfs/dbraw/zinc/24/46/44/567244644.db2.gz UQKLULDGVDTBCY-CYBMUJFWSA-N 0 1 375.372 3.222 10 0 GGAEMN CCC[C@H]1CN(C(=O)Cc2ccc(Br)s2)CCN1CCOC ZINC000499441260 567249822 /nfs/dbraw/zinc/24/98/22/567249822.db2.gz IBMBVXYLEFLCKA-ZDUSSCGKSA-N 0 1 389.359 3.012 10 0 GGAEMN Cc1c(C(=O)Nc2cc(Br)ccc2N2CCN(C)CC2)ccn1C ZINC000684963387 567250093 /nfs/dbraw/zinc/25/00/93/567250093.db2.gz FVHUJSOKQIKHBB-UHFFFAOYSA-N 0 1 391.313 3.100 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCN(c2cc(Cl)ccc2Cl)CC1 ZINC000616522516 567250652 /nfs/dbraw/zinc/25/06/52/567250652.db2.gz CJTKCLNCGWCSGI-LBPRGKRZSA-N 0 1 379.291 3.170 10 0 GGAEMN CC[C@H]1CCCN1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000525513895 567252027 /nfs/dbraw/zinc/25/20/27/567252027.db2.gz XZROEODZPUGUHZ-ZDUSSCGKSA-N 0 1 378.274 3.318 10 0 GGAEMN CC[C@H]1CCCN1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000525513895 567252035 /nfs/dbraw/zinc/25/20/35/567252035.db2.gz XZROEODZPUGUHZ-ZDUSSCGKSA-N 0 1 378.274 3.318 10 0 GGAEMN Cc1ncc(NS(=O)(=O)c2cc3c(c(Cl)c2)O[C@H](C)C3)c(C2CC2)n1 ZINC000685006581 567253545 /nfs/dbraw/zinc/25/35/45/567253545.db2.gz CNHPPZBLVIMGKQ-SECBINFHSA-N 0 1 379.869 3.440 10 0 GGAEMN CCN(CCNC(=O)c1sc(C(C)(C)OC)nc1C)CCC(F)(F)F ZINC000567529952 567255237 /nfs/dbraw/zinc/25/52/37/567255237.db2.gz QEOCSAXAEWYTAX-UHFFFAOYSA-N 0 1 381.464 3.337 10 0 GGAEMN CN(C)CCN(Cc1ccccc1)S(=O)(=O)c1ccc2ncsc2c1 ZINC000475541268 567256199 /nfs/dbraw/zinc/25/61/99/567256199.db2.gz DLDMUWKZCKCSIR-UHFFFAOYSA-N 0 1 375.519 3.049 10 0 GGAEMN Cc1ccc(CCNC(=O)c2n[nH]c3ccc(I)cc32)o1 ZINC000525705565 567260264 /nfs/dbraw/zinc/26/02/64/567260264.db2.gz SQHGOUYWGLXLFE-UHFFFAOYSA-N 0 1 395.200 3.041 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N[C@H]1CC12CCCC2 ZINC000567667544 567266114 /nfs/dbraw/zinc/26/61/14/567266114.db2.gz BBFVEFIFHSAEIC-ZDUSSCGKSA-N 0 1 390.285 3.366 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N[C@H]1CC12CCCC2 ZINC000567667544 567266120 /nfs/dbraw/zinc/26/61/20/567266120.db2.gz BBFVEFIFHSAEIC-ZDUSSCGKSA-N 0 1 390.285 3.366 10 0 GGAEMN Cc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2Br)n1 ZINC000567678888 567267334 /nfs/dbraw/zinc/26/73/34/567267334.db2.gz DLQCSDXIDBEUPF-CQSZACIVSA-N 0 1 385.689 3.335 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@H](c2ccco2)N2CCCC2)c1Br ZINC000525845759 567267717 /nfs/dbraw/zinc/26/77/17/567267717.db2.gz YIKPOSZLIOBCPI-CQSZACIVSA-N 0 1 393.285 3.126 10 0 GGAEMN NC(=O)[C@H](NC[C@@H]1CC12CCSCC2)c1ccc(Br)cc1F ZINC000567722607 567272617 /nfs/dbraw/zinc/27/26/17/567272617.db2.gz NUMMDAPJJNXCAU-IINYFYTJSA-N 0 1 387.318 3.238 10 0 GGAEMN CC[C@@H]1CN(CC)CCN1C(=O)Nc1ccc2nccnc2c1Br ZINC000455418185 567272956 /nfs/dbraw/zinc/27/29/56/567272956.db2.gz XYWGNVBORVEYQO-GFCCVEGCSA-N 0 1 392.301 3.340 10 0 GGAEMN COCCOCCOCCCN1Cc2cc(Br)ccc2C[C@H]1C ZINC000660162204 567273743 /nfs/dbraw/zinc/27/37/43/567273743.db2.gz LKXJUOSAYLIENY-OAHLLOKOSA-N 0 1 386.330 3.265 10 0 GGAEMN O=C1c2ccccc2C(=O)N1CCNCc1cc(F)c(F)cc1Br ZINC000685445649 567275222 /nfs/dbraw/zinc/27/52/22/567275222.db2.gz JPIRODZERMWCPN-UHFFFAOYSA-N 0 1 395.203 3.113 10 0 GGAEMN O[C@@H](CCNCc1nc(-c2cccc(Br)c2)c[nH]1)C(F)(F)F ZINC000685458261 567275745 /nfs/dbraw/zinc/27/57/45/567275745.db2.gz MWZDWMSNXKOULF-LBPRGKRZSA-N 0 1 378.192 3.242 10 0 GGAEMN COc1nsc(CNC[C@@H](c2cccs2)N(C)C)c1Br ZINC000638861871 567276423 /nfs/dbraw/zinc/27/64/23/567276423.db2.gz AXARELDOULDYIS-VIFPVBQESA-N 0 1 376.345 3.368 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cc(O)cc(F)c2)c(Br)c1 ZINC000475787098 567277616 /nfs/dbraw/zinc/27/76/16/567277616.db2.gz DWDWNXFARQEFAL-UHFFFAOYSA-N 0 1 376.203 3.103 10 0 GGAEMN CC(C)[C@@H]1CN(C)CCN1C(=O)Cc1c(F)ccc(Br)c1F ZINC000499880699 567280450 /nfs/dbraw/zinc/28/04/50/567280450.db2.gz PSBNJBXDQSGYIY-AWEZNQCLSA-N 0 1 375.257 3.068 10 0 GGAEMN COCCOCCOCCCN1CCc2cc(Br)cc(C)c2C1 ZINC000660210846 567280723 /nfs/dbraw/zinc/28/07/23/567280723.db2.gz YEBJZEWBGLLGSJ-UHFFFAOYSA-N 0 1 386.330 3.185 10 0 GGAEMN C[C@@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)n1cccc1 ZINC000591455393 567282693 /nfs/dbraw/zinc/28/26/93/567282693.db2.gz ZMROHWHYPGMZCC-LBPRGKRZSA-N 0 1 388.269 3.303 10 0 GGAEMN C[C@@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)n1cccc1 ZINC000591455393 567282701 /nfs/dbraw/zinc/28/27/01/567282701.db2.gz ZMROHWHYPGMZCC-LBPRGKRZSA-N 0 1 388.269 3.303 10 0 GGAEMN C[C@@H](NCC1(O)CCSCC1)c1nc(-c2ccc(Br)cc2)no1 ZINC000660271975 567283150 /nfs/dbraw/zinc/28/31/50/567283150.db2.gz MNWIHNJTFJMKHK-LLVKDONJSA-N 0 1 398.326 3.408 10 0 GGAEMN COc1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cc1OC ZINC000499938082 567285145 /nfs/dbraw/zinc/28/51/45/567285145.db2.gz WZRBTCAMXZLOQR-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@@H]1c1ccccc1Br ZINC000685593763 567285648 /nfs/dbraw/zinc/28/56/48/567285648.db2.gz CJOVIMGVJMTMNM-MRXNPFEDSA-N 0 1 389.359 3.258 10 0 GGAEMN CC(C)[C@H]1C[C@@H]1C(=O)Nc1cc(Br)ccc1N1CCN(C)CC1 ZINC000475890935 567285451 /nfs/dbraw/zinc/28/54/51/567285451.db2.gz DQOQBTOLPRNNIM-CABCVRRESA-N 0 1 380.330 3.432 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@H]1c1ccccc1Br ZINC000685593762 567286114 /nfs/dbraw/zinc/28/61/14/567286114.db2.gz CJOVIMGVJMTMNM-INIZCTEOSA-N 0 1 389.359 3.258 10 0 GGAEMN Cc1cc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)ccc1O ZINC000499942907 567286130 /nfs/dbraw/zinc/28/61/30/567286130.db2.gz AJSCQDYCSHMRCP-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN Cc1cc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)ccc1O ZINC000499942907 567286135 /nfs/dbraw/zinc/28/61/35/567286135.db2.gz AJSCQDYCSHMRCP-UHFFFAOYSA-N 0 1 387.237 3.178 10 0 GGAEMN C[C@@H](NC(=O)CN1CC[C@H](O)CC12CCC2)c1ccc(Br)cc1 ZINC000567885888 567286432 /nfs/dbraw/zinc/28/64/32/567286432.db2.gz APKGIRXPWMYPTK-CJNGLKHVSA-N 0 1 381.314 3.006 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@@H](c2ccsc2)N(C)C)C[C@@H](CC(F)(F)F)O1 ZINC000660313408 567286576 /nfs/dbraw/zinc/28/65/76/567286576.db2.gz XTXROTCKBFWPNV-BNOWGMLFSA-N 0 1 379.448 3.102 10 0 GGAEMN CCc1nc([C@H](C)N2CCO[C@H](c3ccc(F)c(Br)c3)C2)n[nH]1 ZINC000660312498 567286901 /nfs/dbraw/zinc/28/69/01/567286901.db2.gz HAUYKUGKEAYZBF-HZMBPMFUSA-N 0 1 383.265 3.403 10 0 GGAEMN CN(C)[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)c1cccs1 ZINC000499950622 567287256 /nfs/dbraw/zinc/28/72/56/567287256.db2.gz QZCVFMXFMPJIHT-ZDUSSCGKSA-N 0 1 393.310 3.420 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@H](c2ccsc2)N(C)C)C[C@@H](CC(F)(F)F)O1 ZINC000660313412 567287844 /nfs/dbraw/zinc/28/78/44/567287844.db2.gz XTXROTCKBFWPNV-MRVWCRGKSA-N 0 1 379.448 3.102 10 0 GGAEMN CS(=O)(=O)CC1(CCNC(=O)c2cc(Cl)c3ccccc3c2O)CC1 ZINC000617181727 567288778 /nfs/dbraw/zinc/28/87/78/567288778.db2.gz MGCIEHSQGKPEQY-UHFFFAOYSA-N 0 1 381.881 3.144 10 0 GGAEMN O=C(NCc1cc(F)cc(Br)c1)c1cn[nH]c1-c1ccccn1 ZINC000685635439 567288902 /nfs/dbraw/zinc/28/89/02/567288902.db2.gz OWSQSJAVNKNKKI-UHFFFAOYSA-N 0 1 375.201 3.303 10 0 GGAEMN COCC(=O)COc1ccc(Cl)cc1NS(=O)(=O)c1ccc(C)cc1 ZINC000475976384 567290062 /nfs/dbraw/zinc/29/00/62/567290062.db2.gz LUOWQEGMRHUOLJ-UHFFFAOYSA-N 0 1 383.853 3.044 10 0 GGAEMN O=C(Nc1nc2c(cccc2Br)s1)N[C@H]1CCc2nc[nH]c2C1 ZINC000685655304 567290488 /nfs/dbraw/zinc/29/04/88/567290488.db2.gz UDWLNKIMGUJJLY-QMMMGPOBSA-N 0 1 392.282 3.461 10 0 GGAEMN COC[C@H](CN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1)OC ZINC000660383190 567291116 /nfs/dbraw/zinc/29/11/16/567291116.db2.gz ZVFVFYDMZICMEW-SWLSCSKDSA-N 0 1 396.285 3.297 10 0 GGAEMN C[C@@H]1C[N@H+](CCCNC(=O)[C@H]2CCc3cc(Br)ccc32)C[C@H](C)O1 ZINC000567945148 567291947 /nfs/dbraw/zinc/29/19/47/567291947.db2.gz IMKIEIFWWNNHDA-IYOUNJFTSA-N 0 1 395.341 3.094 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)[C@H]2CCc3cc(Br)ccc32)C[C@H](C)O1 ZINC000567945148 567291955 /nfs/dbraw/zinc/29/19/55/567291955.db2.gz IMKIEIFWWNNHDA-IYOUNJFTSA-N 0 1 395.341 3.094 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)Nc2ccc(Br)cc2C(=O)OC)C[C@@H]1C ZINC000500033783 567292263 /nfs/dbraw/zinc/29/22/63/567292263.db2.gz CJDGQBTUYZAKOW-NWDGAFQWSA-N 0 1 398.301 3.182 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H](c1nccs1)C(F)(F)F)c1ccsc1 ZINC000455664996 567293931 /nfs/dbraw/zinc/29/39/31/567293931.db2.gz USPWVUZBZKGRBE-MNOVXSKESA-N 0 1 378.445 3.410 10 0 GGAEMN CCOc1cc(Br)c(F)cc1NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000567971585 567294074 /nfs/dbraw/zinc/29/40/74/567294074.db2.gz CNOAYLCBRTVBTD-SECBINFHSA-N 0 1 397.248 3.389 10 0 GGAEMN C[C@H](CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000591769684 567294950 /nfs/dbraw/zinc/29/49/50/567294950.db2.gz HRILZIRYMSWSSL-SNVBAGLBSA-N 0 1 378.274 3.080 10 0 GGAEMN C[C@H](CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000591769684 567294957 /nfs/dbraw/zinc/29/49/57/567294957.db2.gz HRILZIRYMSWSSL-SNVBAGLBSA-N 0 1 378.274 3.080 10 0 GGAEMN CC[C@@H](C)[C@@H](C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000591769616 567295296 /nfs/dbraw/zinc/29/52/96/567295296.db2.gz BTEVJMUCSFDGRR-GHMZBOCLSA-N 0 1 380.290 3.468 10 0 GGAEMN CC[C@@H](C)[C@@H](C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000591769616 567295300 /nfs/dbraw/zinc/29/53/00/567295300.db2.gz BTEVJMUCSFDGRR-GHMZBOCLSA-N 0 1 380.290 3.468 10 0 GGAEMN Clc1cc(Br)cnc1CN1CCC[C@@H](CN2CCOCC2)C1 ZINC000660482611 567299439 /nfs/dbraw/zinc/29/94/39/567299439.db2.gz GPNFITWABMSJGT-ZDUSSCGKSA-N 0 1 388.737 3.042 10 0 GGAEMN O=C1N[C@@H]2CCCC[C@@H]2C[C@H]1N[C@H]1CCOc2c(Br)cccc21 ZINC000660481606 567299617 /nfs/dbraw/zinc/29/96/17/567299617.db2.gz SFIXOJMLXGBNFF-BQDHKBFISA-N 0 1 379.298 3.310 10 0 GGAEMN CNS(=O)(=O)c1ccc(CN2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000660489349 567301227 /nfs/dbraw/zinc/30/12/27/567301227.db2.gz WDCGALWPGZFDDL-OAHLLOKOSA-N 0 1 376.444 3.149 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074491 567303035 /nfs/dbraw/zinc/30/30/35/567303035.db2.gz KINIYCXCDJSBIG-HOTGVXAUSA-N 0 1 380.897 3.451 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074491 567303039 /nfs/dbraw/zinc/30/30/39/567303039.db2.gz KINIYCXCDJSBIG-HOTGVXAUSA-N 0 1 380.897 3.451 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3n[nH]c4ccc(Br)cc43)n(C)c21 ZINC000434350506 567305435 /nfs/dbraw/zinc/30/54/35/567305435.db2.gz UEBVDYDFMIKVMM-UHFFFAOYSA-N 0 1 398.264 3.451 10 0 GGAEMN CC(C)[C@H](N[C@H](C)C(=O)Nc1ccccc1Br)[C@H](O)C(F)(F)F ZINC000660527227 567305582 /nfs/dbraw/zinc/30/55/82/567305582.db2.gz DBYGBCUYESMAGL-ICCXJUOJSA-N 0 1 397.235 3.314 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(COc3ccc(Br)cc3)o2)C1 ZINC000617415496 567306711 /nfs/dbraw/zinc/30/67/11/567306711.db2.gz DNZXGLVPUSRWBI-CQSZACIVSA-N 0 1 393.281 3.445 10 0 GGAEMN O[C@@]1(CN2CCN(c3ccc(C(F)(F)F)cc3Cl)CC2)CCCOC1 ZINC000660545470 567307901 /nfs/dbraw/zinc/30/79/01/567307901.db2.gz UPLKVAHIOHYYFO-MRXNPFEDSA-N 0 1 378.822 3.022 10 0 GGAEMN C[C@H](NC(=O)Nc1ccc(C(F)(F)F)c(Br)c1)c1nnc[nH]1 ZINC000527056807 567309318 /nfs/dbraw/zinc/30/93/18/567309318.db2.gz MGJDINHJYAQBBE-LURJTMIESA-N 0 1 378.152 3.469 10 0 GGAEMN Nc1n[nH]c(C2CCN(Cc3oc4ccccc4c3Br)CC2)n1 ZINC000660565807 567310262 /nfs/dbraw/zinc/31/02/62/567310262.db2.gz YJWPZJNCPKDKOK-UHFFFAOYSA-N 0 1 376.258 3.275 10 0 GGAEMN C[C@H]1COCCN1C1CCN(Cc2ncc(Br)cc2Cl)CC1 ZINC000660588807 567310298 /nfs/dbraw/zinc/31/02/98/567310298.db2.gz BOTRMGBRYHMWKK-LBPRGKRZSA-N 0 1 388.737 3.183 10 0 GGAEMN O=C(NCCc1ccccc1Br)N1CCC(c2cnc[nH]2)CC1 ZINC000434465975 567310709 /nfs/dbraw/zinc/31/07/09/567310709.db2.gz SVDJPNOEENIVQQ-UHFFFAOYSA-N 0 1 377.286 3.304 10 0 GGAEMN CC1(C)CC(CNC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000548360215 567311083 /nfs/dbraw/zinc/31/10/83/567311083.db2.gz UHLUULFIMJSQQM-UHFFFAOYSA-N 0 1 392.301 3.470 10 0 GGAEMN CC1(C)CC(CNC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000548360215 567311090 /nfs/dbraw/zinc/31/10/90/567311090.db2.gz UHLUULFIMJSQQM-UHFFFAOYSA-N 0 1 392.301 3.470 10 0 GGAEMN O=C(NCc1ccc2c(c1)OCCO2)c1n[nH]c2ccc(Br)cc21 ZINC000548389280 567311980 /nfs/dbraw/zinc/31/19/80/567311980.db2.gz CSPQOBBWUGRXMQ-UHFFFAOYSA-N 0 1 388.221 3.027 10 0 GGAEMN C[C@H](NCCc1ccc2c(c1)OC(F)(F)O2)c1ncc(Br)cn1 ZINC000660624509 567313926 /nfs/dbraw/zinc/31/39/26/567313926.db2.gz ANYUEEKXDRSOMQ-VIFPVBQESA-N 0 1 386.196 3.454 10 0 GGAEMN COCCN1CCC[C@H](NC(=O)CSc2cccc(C(F)(F)F)c2)C1 ZINC000592096577 567314335 /nfs/dbraw/zinc/31/43/35/567314335.db2.gz BXQGSIXDLMMIBF-AWEZNQCLSA-N 0 1 376.444 3.025 10 0 GGAEMN C[C@H](NCc1cnc(-c2ccc(Br)cc2)s1)C(=O)NCCF ZINC000500422383 567318889 /nfs/dbraw/zinc/31/88/89/567318889.db2.gz IPCAOGFXUQIYAT-JTQLQIEISA-N 0 1 386.290 3.136 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cc(C)c(Cl)cc2OC)[C@@H]1SC ZINC000592174241 567319626 /nfs/dbraw/zinc/31/96/26/567319626.db2.gz JFBBJMRGAGDLRV-WQFMGJDKSA-N 0 1 386.945 3.483 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2Br)[C@@H]1SC ZINC000592169724 567320051 /nfs/dbraw/zinc/32/00/51/567320051.db2.gz QKFZCRUDBWYMFD-QOWREQOWSA-N 0 1 387.343 3.275 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cccc(Br)c2)[C@@H]1SC ZINC000592169314 567320463 /nfs/dbraw/zinc/32/04/63/567320463.db2.gz RAEOMUSDZDOPNY-QZKOUSHUSA-N 0 1 387.343 3.275 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc3c(cc2Br)OCCO3)[C@@H]1SC ZINC000592170184 567320531 /nfs/dbraw/zinc/32/05/31/567320531.db2.gz XKERLUJGAJBNMM-WQVCFCJDSA-N 0 1 388.327 3.219 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@H]2CCN(c3cccc(Br)c3)C2=O)[C@@H]1SC ZINC000592173408 567320669 /nfs/dbraw/zinc/32/06/69/567320669.db2.gz SHAJDZNYADMAOJ-JJXSEGSLSA-N 0 1 399.354 3.053 10 0 GGAEMN COCc1nc(C(=O)Nc2nc(Sc3ccc(OC)cc3)ns2)co1 ZINC000548520037 567322024 /nfs/dbraw/zinc/32/20/24/567322024.db2.gz MMEVLNRMIFBOKX-UHFFFAOYSA-N 0 1 378.435 3.085 10 0 GGAEMN CCN(C(=O)c1cc(Br)sc1Br)[C@@H]1CCN(C)C1 ZINC000617554905 567322161 /nfs/dbraw/zinc/32/21/61/567322161.db2.gz MDWRAAPOYIMHPI-MRVPVSSYSA-N 0 1 396.148 3.439 10 0 GGAEMN Brc1cc2c(cc1CN1CCC[C@H](n3ccnn3)CC1)OCCO2 ZINC000639814109 567324234 /nfs/dbraw/zinc/32/42/34/567324234.db2.gz CCDMRTNGBCEQEH-AWEZNQCLSA-N 0 1 393.285 3.039 10 0 GGAEMN CCOC(=O)c1cc(C(F)(F)F)sc1NC(=O)N[C@H]1CCCN(C)C1 ZINC000592257484 567326197 /nfs/dbraw/zinc/32/61/97/567326197.db2.gz GKERJSDJOQCFAF-VIFPVBQESA-N 0 1 379.404 3.159 10 0 GGAEMN CCOC(=O)c1cc(C(F)(F)F)sc1NC(=O)N[C@@H]1CCCN(C)C1 ZINC000592257483 567326477 /nfs/dbraw/zinc/32/64/77/567326477.db2.gz GKERJSDJOQCFAF-SECBINFHSA-N 0 1 379.404 3.159 10 0 GGAEMN COc1ccc(-c2nc([C@@H](N)CC(C)C)no2)cc1I ZINC000592353130 567332034 /nfs/dbraw/zinc/33/20/34/567332034.db2.gz XDPHQWXQAWXUSU-NSHDSACASA-N 0 1 387.221 3.396 10 0 GGAEMN Ic1ccc2nc(-c3nc([C@@H]4CCCN4)no3)ccc2c1 ZINC000592356179 567332147 /nfs/dbraw/zinc/33/21/47/567332147.db2.gz FSQIPSLDAYHRKG-LBPRGKRZSA-N 0 1 392.200 3.314 10 0 GGAEMN COc1ccc(-c2nc([C@H](N)CC(C)C)no2)cc1I ZINC000592353129 567332612 /nfs/dbraw/zinc/33/26/12/567332612.db2.gz XDPHQWXQAWXUSU-LLVKDONJSA-N 0 1 387.221 3.396 10 0 GGAEMN CCOC(=O)c1sc(NS(=O)(=O)CCCC2CCOCC2)cc1C ZINC000592381651 567333511 /nfs/dbraw/zinc/33/35/11/567333511.db2.gz MRPVAJFEUJQDEZ-UHFFFAOYSA-N 0 1 375.512 3.182 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 ZINC000617776177 567334252 /nfs/dbraw/zinc/33/42/52/567334252.db2.gz IWZLOCNZJOSYEM-UHFFFAOYSA-N 0 1 379.291 3.417 10 0 GGAEMN COCCN1CCN(Cc2ncc(Br)cc2Cl)C(C)(C)C1 ZINC000660917146 567334685 /nfs/dbraw/zinc/33/46/85/567334685.db2.gz OXOQHOYZWURAID-UHFFFAOYSA-N 0 1 376.726 3.040 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2Cc3ccc(C)c(Br)c3C2)n[nH]1 ZINC000660929075 567336131 /nfs/dbraw/zinc/33/61/31/567336131.db2.gz DNJJHEHCMUPDIM-LLVKDONJSA-N 0 1 377.286 3.445 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCN(c2ccc(Cl)cc2Cl)CC1 ZINC000617790325 567336012 /nfs/dbraw/zinc/33/60/12/567336012.db2.gz KXAXRQMTYOIGTG-CYBMUJFWSA-N 0 1 379.291 3.485 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCN(c2ccc(Cl)cc2Cl)CC1 ZINC000617789516 567336176 /nfs/dbraw/zinc/33/61/76/567336176.db2.gz LFEKIMIBINPOEE-LBPRGKRZSA-N 0 1 379.291 3.170 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCO[C@@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000592504811 567342457 /nfs/dbraw/zinc/34/24/57/567342457.db2.gz ZFDVYQGZRCFURO-MEDUHNTESA-N 0 1 390.286 3.310 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)c(Cl)cc1F ZINC000435131657 567344137 /nfs/dbraw/zinc/34/41/37/567344137.db2.gz DRRXDYBFANVKCJ-GFCCVEGCSA-N 0 1 382.844 3.192 10 0 GGAEMN CCOC(=O)c1sc([C@@H](C)NC(=O)[C@@H](N)c2cccc(Cl)c2)nc1C ZINC000592538548 567344993 /nfs/dbraw/zinc/34/49/93/567344993.db2.gz TZZBNJREZPTYIR-MFKMUULPSA-N 0 1 381.885 3.159 10 0 GGAEMN CC(C)c1nc(CNC(=O)N2CCc3ccc(F)c(Br)c3C2)n[nH]1 ZINC000527611601 567349746 /nfs/dbraw/zinc/34/97/46/567349746.db2.gz PUPCFYGJAIPZSO-UHFFFAOYSA-N 0 1 396.264 3.098 10 0 GGAEMN CN(C)C[C@@H]1CCCN1S(=O)(=O)c1ccc2nc(C(C)(C)C)sc2c1 ZINC000435229316 567351022 /nfs/dbraw/zinc/35/10/22/567351022.db2.gz GOAQSUKFWZXJSQ-ZDUSSCGKSA-N 0 1 381.567 3.309 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2ccc(F)c(Br)c2C1 ZINC000527627943 567351468 /nfs/dbraw/zinc/35/14/68/567351468.db2.gz KAPYHMXRIVKBBL-LLVKDONJSA-N 0 1 378.245 3.001 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1 ZINC000476856566 567352344 /nfs/dbraw/zinc/35/23/44/567352344.db2.gz PHQCHZCBGPAJGS-ZDUSSCGKSA-N 0 1 379.291 3.463 10 0 GGAEMN Brc1cccc(-c2cnc(CN3CC[C@H](Cn4ccnn4)C3)o2)c1 ZINC000661145598 567352508 /nfs/dbraw/zinc/35/25/08/567352508.db2.gz UPFCFAXNAHZIBG-ZDUSSCGKSA-N 0 1 388.269 3.218 10 0 GGAEMN O=c1cc(CN2CCC(c3ccco3)CC2)nc2ccc(Br)cn12 ZINC000661162152 567353305 /nfs/dbraw/zinc/35/33/05/567353305.db2.gz JJZNKXYJAZQCFU-UHFFFAOYSA-N 0 1 388.265 3.430 10 0 GGAEMN COC[C@H](NCc1nc(-c2cccc(Br)c2)no1)C1CCOCC1 ZINC000661161229 567353647 /nfs/dbraw/zinc/35/36/47/567353647.db2.gz SDGWRTNKXOAUSP-HNNXBMFYSA-N 0 1 396.285 3.030 10 0 GGAEMN C[C@]1(C2CC2)CN(CCC(=O)Nc2ccc(Br)cc2F)CCO1 ZINC000661171542 567354550 /nfs/dbraw/zinc/35/45/50/567354550.db2.gz XGVSWQVMZJALPK-QGZVFWFLSA-N 0 1 385.277 3.418 10 0 GGAEMN CS(=O)(=O)c1ccc(OCCNCc2ccsc2Br)cc1 ZINC000527656233 567356034 /nfs/dbraw/zinc/35/60/34/567356034.db2.gz FFIYRYYQPNDNFP-UHFFFAOYSA-N 0 1 390.324 3.083 10 0 GGAEMN CC[N@H+]1CCC[C@@H]1CNC(=O)NCc1cc(F)c(Br)cc1F ZINC000527653968 567356721 /nfs/dbraw/zinc/35/67/21/567356721.db2.gz XYAZTMOGWSTNDY-LLVKDONJSA-N 0 1 376.245 3.011 10 0 GGAEMN CC[N@H+]1CCC[C@H]1CNC(=O)NCc1cc(F)c(Br)cc1F ZINC000527653972 567356837 /nfs/dbraw/zinc/35/68/37/567356837.db2.gz XYAZTMOGWSTNDY-NSHDSACASA-N 0 1 376.245 3.011 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)N1CC[C@H]1c1ccc(Br)cc1 ZINC000661204301 567357289 /nfs/dbraw/zinc/35/72/89/567357289.db2.gz HTDDZLMFVLHMFC-CJNGLKHVSA-N 0 1 375.270 3.186 10 0 GGAEMN COc1ccccc1N1CC[C@H](NCc2ncc(Br)cc2F)C1 ZINC000527676219 567360433 /nfs/dbraw/zinc/36/04/33/567360433.db2.gz XHLXYCKEELWGPZ-ZDUSSCGKSA-N 0 1 380.261 3.360 10 0 GGAEMN C[C@H](Cn1ncc2ccccc2c1=O)NCc1ccsc1Br ZINC000527686730 567361227 /nfs/dbraw/zinc/36/12/27/567361227.db2.gz IWIKXWXYWKJNIU-LLVKDONJSA-N 0 1 378.295 3.399 10 0 GGAEMN Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)N(C)CC1CN(C)C1 ZINC000618196054 567362166 /nfs/dbraw/zinc/36/21/66/567362166.db2.gz HGSLWNOALIDTCU-UHFFFAOYSA-N 0 1 379.913 3.318 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1cc(COc2ccc(Cl)cc2Cl)on1 ZINC000618192237 567362228 /nfs/dbraw/zinc/36/22/28/567362228.db2.gz HPLKKQQVEFZQSC-UHFFFAOYSA-N 0 1 384.263 3.194 10 0 GGAEMN Cc1cc(Br)c(CN[C@@H](C)C[S@@](C)=O)cc1Br ZINC000527691694 567362542 /nfs/dbraw/zinc/36/25/42/567362542.db2.gz NNBJKQOWYISIQJ-HUTHGQBESA-N 0 1 383.149 3.377 10 0 GGAEMN Cc1onc(-c2cccc(Br)c2)c1C(=O)N(C)CC1CN(C)C1 ZINC000618192522 567362904 /nfs/dbraw/zinc/36/29/04/567362904.db2.gz PTRNHCBXLJVDEL-UHFFFAOYSA-N 0 1 378.270 3.046 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1cccnc1Oc1cccc(Br)c1 ZINC000618195471 567362985 /nfs/dbraw/zinc/36/29/85/567362985.db2.gz KKIKMCNPFGZDIS-UHFFFAOYSA-N 0 1 390.281 3.270 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2ccc(Br)c(F)c2F)[C@@H]1n1cccn1 ZINC000527711876 567366335 /nfs/dbraw/zinc/36/63/35/567366335.db2.gz BOSWBZPLBKQLNZ-ZENOOKHLSA-N 0 1 386.240 3.432 10 0 GGAEMN C[C@@H](NC(=O)c1cccc(Br)c1O)c1ccc(-n2cncn2)cc1 ZINC000592825229 567367092 /nfs/dbraw/zinc/36/70/92/567367092.db2.gz HBLGXNHAMIYOSH-LLVKDONJSA-N 0 1 387.237 3.226 10 0 GGAEMN O=c1ccc(Br)cn1CCNCc1ccsc1Br ZINC000527712397 567367206 /nfs/dbraw/zinc/36/72/06/567367206.db2.gz FISSBJIHMVVMDI-UHFFFAOYSA-N 0 1 392.116 3.225 10 0 GGAEMN CC[C@@H]1CN(CC)CCN1C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000456372114 567367277 /nfs/dbraw/zinc/36/72/77/567367277.db2.gz HHKXWTSYKRGFCC-CYBMUJFWSA-N 0 1 392.297 3.259 10 0 GGAEMN COC(=O)[C@H](CC(C)(C)C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000592831563 567368281 /nfs/dbraw/zinc/36/82/81/567368281.db2.gz NONBFPZXORULRJ-LBPRGKRZSA-N 0 1 382.258 3.033 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2ccsc2C(F)(F)F)Oc2ccccc21 ZINC000527723717 567369981 /nfs/dbraw/zinc/36/99/81/567369981.db2.gz GIJKCQHKQUMNLZ-LLVKDONJSA-N 0 1 377.409 3.091 10 0 GGAEMN CC(C)c1[nH]nc(C(=O)Nc2cnn(-c3ccncc3)c2)c1Br ZINC000592871095 567371602 /nfs/dbraw/zinc/37/16/02/567371602.db2.gz RPFIXTKIWONHPO-UHFFFAOYSA-N 0 1 375.230 3.129 10 0 GGAEMN FC(F)(F)[C@@H](CNCc1cnc2ccc(Br)cn12)n1cccn1 ZINC000527742381 567371748 /nfs/dbraw/zinc/37/17/48/567371748.db2.gz KKLLUXQXUPUNFM-GFCCVEGCSA-N 0 1 388.191 3.187 10 0 GGAEMN FC(F)(F)[C@@H](CNCc1cccc(I)c1)n1cccn1 ZINC000527741486 567371836 /nfs/dbraw/zinc/37/18/36/567371836.db2.gz CTTWCJNZHHDSQO-GFCCVEGCSA-N 0 1 395.166 3.381 10 0 GGAEMN COc1ccc(CNC[C@]2(C)COc3ccccc3O2)c(Br)c1O ZINC000527739267 567372042 /nfs/dbraw/zinc/37/20/42/567372042.db2.gz VDBPFJSHWTWNHH-GOSISDBHSA-N 0 1 394.265 3.483 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@@](C)(N)c2ccccc2)cc1Br ZINC000569004627 567372337 /nfs/dbraw/zinc/37/23/37/567372337.db2.gz IJTNORQWTPZOHG-SFHVURJKSA-N 0 1 376.298 3.323 10 0 GGAEMN O[C@H](CNCc1csc(-c2cccc(Br)c2)n1)[C@H]1CCCO1 ZINC000527760853 567373233 /nfs/dbraw/zinc/37/32/33/567373233.db2.gz SYTAKXLYNWUYEQ-HUUCEWRRSA-N 0 1 383.311 3.202 10 0 GGAEMN COc1ccc(CN2CC[C@@H]2CNCc2ncc(Br)s2)cc1 ZINC000527773874 567373602 /nfs/dbraw/zinc/37/36/02/567373602.db2.gz OIDFGRNZFYLTBE-CYBMUJFWSA-N 0 1 382.327 3.278 10 0 GGAEMN COc1c(Br)cccc1CNC[C@@H]1c2ccccc2C(=O)N1C ZINC000527807846 567374610 /nfs/dbraw/zinc/37/46/10/567374610.db2.gz OXJMCPNPALZMSC-MRXNPFEDSA-N 0 1 375.266 3.374 10 0 GGAEMN CN1C(=O)c2ccccc2[C@H]1CNCc1cc2c(cc1Br)OCO2 ZINC000527804537 567374729 /nfs/dbraw/zinc/37/47/29/567374729.db2.gz DYNPRPULECGKNS-OAHLLOKOSA-N 0 1 389.249 3.094 10 0 GGAEMN CSCCCC(=O)Nc1cc(Br)ccc1N1CCN(C)CC1 ZINC000501248023 567374703 /nfs/dbraw/zinc/37/47/03/567374703.db2.gz MSFHKKMSLZJCKY-UHFFFAOYSA-N 0 1 386.359 3.283 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3ncccc3Br)cccc21 ZINC000477155099 567376251 /nfs/dbraw/zinc/37/62/51/567376251.db2.gz XFSJDTQIXYDRPL-CQSZACIVSA-N 0 1 376.254 3.482 10 0 GGAEMN O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@@H]1CCc2[nH]cnc2C1 ZINC000618359856 567377666 /nfs/dbraw/zinc/37/76/66/567377666.db2.gz GJWIOVYGISNTTL-HWPZZCPQSA-N 0 1 392.322 3.381 10 0 GGAEMN O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@H]1CCCc2n[nH]nc21 ZINC000618359917 567378067 /nfs/dbraw/zinc/37/80/67/567378067.db2.gz ICGPIUTYXGGVFH-FZMZJTMJSA-N 0 1 393.310 3.091 10 0 GGAEMN CC1(C)NC(=O)CC[C@@H]1NCc1cc(Cl)ccc1I ZINC000593030219 567379276 /nfs/dbraw/zinc/37/92/76/567379276.db2.gz JOSQFMZVZMZGCA-LBPRGKRZSA-N 0 1 392.668 3.091 10 0 GGAEMN CO[C@@H](CN1CCO[C@H](c2ccc(Br)cc2)[C@H]1C)[C@@H]1CCOC1 ZINC000661517988 567378697 /nfs/dbraw/zinc/37/86/97/567378697.db2.gz ZXJTXDLCTJJJLM-WCZJQEMASA-N 0 1 384.314 3.262 10 0 GGAEMN O=C(N[C@H]1CSCc2ccc(Br)cc21)c1[nH]nc2c1CCC2 ZINC000618361314 567378860 /nfs/dbraw/zinc/37/88/60/567378860.db2.gz JRVNADMMNXBWNR-AWEZNQCLSA-N 0 1 378.295 3.379 10 0 GGAEMN C[C@H]1CC[N@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@@H]1C(=O)[O-] ZINC000569101787 567379693 /nfs/dbraw/zinc/37/96/93/567379693.db2.gz DKAPPXGEERJGPU-IUCAKERBSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3ccc(Br)s3)no2)C[C@@H]1C(=O)[O-] ZINC000569101787 567379698 /nfs/dbraw/zinc/37/96/98/567379698.db2.gz DKAPPXGEERJGPU-IUCAKERBSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@@H](NC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(Br)cn1 ZINC000527893881 567381654 /nfs/dbraw/zinc/38/16/54/567381654.db2.gz LBLCOTCFAXVTFG-DOMZBBRYSA-N 0 1 381.318 3.221 10 0 GGAEMN O=S1(=O)C[C@H](CN[C@H]2CCc3cc(F)c(Cl)cc32)Oc2ccccc21 ZINC000527907741 567383034 /nfs/dbraw/zinc/38/30/34/567383034.db2.gz BEGOXGWVBDPEBJ-LRDDRELGSA-N 0 1 381.856 3.291 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)Cn2c(C)c(Br)c3ccccc32)n[nH]1 ZINC000477246005 567383033 /nfs/dbraw/zinc/38/30/33/567383033.db2.gz YYWPNPMSSLVUDB-SNVBAGLBSA-N 0 1 390.285 3.270 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@@H]3C[C@@]3(C)Br)cc2)C[C@@H](C)O1 ZINC000527907743 567383747 /nfs/dbraw/zinc/38/37/47/567383747.db2.gz BUGSRLJCKDXOHL-XNWVLMOPSA-N 0 1 395.341 3.086 10 0 GGAEMN CCC[C@@H]1CN(C(=O)Nc2ncc(C(F)(F)F)s2)CCN1CCOC ZINC000549287262 567384038 /nfs/dbraw/zinc/38/40/38/567384038.db2.gz HUQLEXYLDAIWEW-LLVKDONJSA-N 0 1 380.436 3.127 10 0 GGAEMN O[C@]1(C2CC2)CCCN(Cc2cc3c(cc2Br)OCCCO3)C1 ZINC000661628924 567384767 /nfs/dbraw/zinc/38/47/67/567384767.db2.gz WKSAPPGPLZUKLQ-GOSISDBHSA-N 0 1 382.298 3.347 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)N[C@@H]2CSC2(C)C)cc1 ZINC000549335379 567386303 /nfs/dbraw/zinc/38/63/03/567386303.db2.gz PQJJQAXDXWHHGT-CQSZACIVSA-N 0 1 396.559 3.481 10 0 GGAEMN CN(C)[C@H](CNC(=O)Cc1ccc(Br)cc1O)c1cccs1 ZINC000477289923 567386657 /nfs/dbraw/zinc/38/66/57/567386657.db2.gz GIUYMHLCVZAIOF-CYBMUJFWSA-N 0 1 383.311 3.178 10 0 GGAEMN CN(C)[C@@H](CNC(=O)Cc1ccc(Br)cc1O)c1cccs1 ZINC000477289925 567386858 /nfs/dbraw/zinc/38/68/58/567386858.db2.gz GIUYMHLCVZAIOF-ZDUSSCGKSA-N 0 1 383.311 3.178 10 0 GGAEMN CN(C)[C@H](CNC(=O)Cc1ccc(Br)cc1O)c1cccc(F)c1 ZINC000477310692 567388356 /nfs/dbraw/zinc/38/83/56/567388356.db2.gz MJTXKVTZDFCWDV-MRXNPFEDSA-N 0 1 395.272 3.255 10 0 GGAEMN C[C@H]1Cc2ccc(Br)cc2CN1CCc1nnnn1-c1ccccc1 ZINC000501427308 567388866 /nfs/dbraw/zinc/38/88/66/567388866.db2.gz QWJGKNLOZWYLCY-AWEZNQCLSA-N 0 1 398.308 3.414 10 0 GGAEMN C[C@H](N[C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000528006921 567390344 /nfs/dbraw/zinc/39/03/44/567390344.db2.gz PNHSSIUJRGXAFZ-UIKYCXINSA-N 0 1 381.325 3.103 10 0 GGAEMN C[C@@H]1C[C@@H](C)CN(C(=O)CN[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000501548306 567395063 /nfs/dbraw/zinc/39/50/63/567395063.db2.gz YBZNVUTXGCUDHN-XJKCOSOUSA-N 0 1 381.314 3.367 10 0 GGAEMN C[C@@H]1C[C@@H](C)CN(C(=O)CN[C@H]2CCOc3c(Br)cccc32)C1 ZINC000501548305 567395630 /nfs/dbraw/zinc/39/56/30/567395630.db2.gz YBZNVUTXGCUDHN-IOASZLSFSA-N 0 1 381.314 3.367 10 0 GGAEMN C[C@@H]1C[C@H](C)CN(C(=O)CN[C@H]2CCOc3c(Br)cccc32)C1 ZINC000501548307 567395941 /nfs/dbraw/zinc/39/59/41/567395941.db2.gz YBZNVUTXGCUDHN-ZENOOKHLSA-N 0 1 381.314 3.367 10 0 GGAEMN COc1ccc(CNC(=O)CNC2(c3ccc(Br)cc3)CC2)cc1 ZINC000477460949 567396116 /nfs/dbraw/zinc/39/61/16/567396116.db2.gz UQGFAKMJQNUOIX-UHFFFAOYSA-N 0 1 389.293 3.353 10 0 GGAEMN CCN1CCN(CC(=O)N2CCC[C@H]2c2ccc(Br)c(C)c2)CC1 ZINC000435982168 567398363 /nfs/dbraw/zinc/39/83/63/567398363.db2.gz WKBWUWDVXTZADL-SFHVURJKSA-N 0 1 394.357 3.059 10 0 GGAEMN CC1(N2CCOCC2)CCN(c2ccnc3cc(Br)cnc32)CC1 ZINC000528188826 567400971 /nfs/dbraw/zinc/40/09/71/567400971.db2.gz GCMGJNSZBZKFPH-UHFFFAOYSA-N 0 1 391.313 3.083 10 0 GGAEMN CC1(N2CCOCC2)CCN(c2ncnc3ccc(Br)cc32)CC1 ZINC000528190504 567400984 /nfs/dbraw/zinc/40/09/84/567400984.db2.gz UNQDLGQWONUUOZ-UHFFFAOYSA-N 0 1 391.313 3.083 10 0 GGAEMN O=C(c1cn[nH]c1-c1ccc(Cl)s1)N1CC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000456683269 567402066 /nfs/dbraw/zinc/40/20/66/567402066.db2.gz IEJPXFOHDMEHSB-JVXZTZIISA-N 0 1 379.791 3.177 10 0 GGAEMN Cn1ccnc1-c1cc(=NC(=O)c2cc(F)c(Br)c(Cl)c2)[nH][nH]1 ZINC000501782099 567405581 /nfs/dbraw/zinc/40/55/81/567405581.db2.gz UARBOJZUKPRZLU-UHFFFAOYSA-N 0 1 398.623 3.039 10 0 GGAEMN CCOC(=O)c1nnc(NC(=O)c2c(F)ccc(Br)c2F)s1 ZINC000618675324 567406273 /nfs/dbraw/zinc/40/62/73/567406273.db2.gz ABVIRBPCBGUNCG-UHFFFAOYSA-N 0 1 392.181 3.008 10 0 GGAEMN CN1C(=O)CN(Cc2nc3ccc(Br)cc3[nH]2)[C@@H]1c1ccccc1 ZINC000569477103 567406687 /nfs/dbraw/zinc/40/66/87/567406687.db2.gz VLZFKQRAFRWKLQ-GOSISDBHSA-N 0 1 385.265 3.298 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N(C)Cc2cc(Br)ccc2F)cn1 ZINC000549754796 567408558 /nfs/dbraw/zinc/40/85/58/567408558.db2.gz SAIQZPNDWUEJHH-UHFFFAOYSA-N 0 1 380.261 3.317 10 0 GGAEMN Cc1c(Br)scc1C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1 ZINC000477699260 567410392 /nfs/dbraw/zinc/41/03/92/567410392.db2.gz HORSESDGLQPHLI-UHFFFAOYSA-N 0 1 379.239 3.047 10 0 GGAEMN COC(=O)c1cccc(F)c1NS(=O)(=O)c1ccc(Br)s1 ZINC000436188666 567412649 /nfs/dbraw/zinc/41/26/49/567412649.db2.gz RWYDZCHWHVYGTL-UHFFFAOYSA-N 0 1 394.243 3.237 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)N1CCC(c2nnc(-c3ccccc3)[nH]2)CC1 ZINC000528335192 567412660 /nfs/dbraw/zinc/41/26/60/567412660.db2.gz CJOVPLQIJFGUOJ-KSSFIOAISA-N 0 1 389.297 3.351 10 0 GGAEMN CC(C)NC(=O)[C@H]1CCCN([C@@H](C)C(=O)Nc2ccc(Br)cc2)C1 ZINC000662120012 567412940 /nfs/dbraw/zinc/41/29/40/567412940.db2.gz BSEOJYHIWVMAAV-KBPBESRZSA-N 0 1 396.329 3.013 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN(Cc2nc3ccc(Br)cc3o2)C1 ZINC000662116371 567413135 /nfs/dbraw/zinc/41/31/35/567413135.db2.gz BZBRJDUPOMDTJX-GFCCVEGCSA-N 0 1 380.286 3.327 10 0 GGAEMN CSCC1(CC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000593446601 567413239 /nfs/dbraw/zinc/41/32/39/567413239.db2.gz UMIXUMMNKZEQMP-UHFFFAOYSA-N 0 1 395.326 3.384 10 0 GGAEMN CSCC1(CC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000593446601 567413243 /nfs/dbraw/zinc/41/32/43/567413243.db2.gz UMIXUMMNKZEQMP-UHFFFAOYSA-N 0 1 395.326 3.384 10 0 GGAEMN COc1ccc(Br)cc1[C@H]1CCCN1C[C@@H](O)CC1(O)CCC1 ZINC000528364414 567414712 /nfs/dbraw/zinc/41/47/12/567414712.db2.gz MPHRSYKNEYHZTB-GOEBONIOSA-N 0 1 384.314 3.261 10 0 GGAEMN COc1ccc(Br)cc1[C@H]1CCCN1C[C@H](O)CC1(O)CCC1 ZINC000528364410 567415492 /nfs/dbraw/zinc/41/54/92/567415492.db2.gz MPHRSYKNEYHZTB-GDBMZVCRSA-N 0 1 384.314 3.261 10 0 GGAEMN Cc1nnc(SCC(=O)N2C[C@H](c3cccc(Cl)c3)OCC2(C)C)[nH]1 ZINC000618783831 567415628 /nfs/dbraw/zinc/41/56/28/567415628.db2.gz NQRXYMZMBWNMPY-CQSZACIVSA-N 0 1 380.901 3.237 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N2C[C@H](c3cccc(Cl)c3)OCC2(C)C)n1 ZINC000618783831 567415633 /nfs/dbraw/zinc/41/56/33/567415633.db2.gz NQRXYMZMBWNMPY-CQSZACIVSA-N 0 1 380.901 3.237 10 0 GGAEMN CC[C@H]1C[C@H](N=c2nc[nH]c3cc(I)sc32)CCO1 ZINC000593480921 567418456 /nfs/dbraw/zinc/41/84/56/567418456.db2.gz ZBWJKYDBXYUPIV-BDAKNGLRSA-N 0 1 389.262 3.087 10 0 GGAEMN Cc1cc(NC(=O)N2CCCN(C)CC2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000502195354 567423136 /nfs/dbraw/zinc/42/31/36/567423136.db2.gz MROIGDPHBGEIEB-UHFFFAOYSA-N 0 1 382.295 3.079 10 0 GGAEMN O=C(CN1C[C@]23COC[C@@]2(C1)CCCC3)Nc1ccc(Br)cc1 ZINC000662313027 567425456 /nfs/dbraw/zinc/42/54/56/567425456.db2.gz IUINPEDLDDTAFV-HDICACEKSA-N 0 1 379.298 3.280 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)c1conc1C(C)(C)N ZINC000569707937 567425835 /nfs/dbraw/zinc/42/58/35/567425835.db2.gz NDIIGCVJPPWZCT-VIFPVBQESA-N 0 1 382.258 3.131 10 0 GGAEMN O=S(=O)(NC[C@H]1CCN1C1CCCCC1)c1ccccc1Br ZINC000528471360 567427353 /nfs/dbraw/zinc/42/73/53/567427353.db2.gz CEVPTWRDGMFXFE-CQSZACIVSA-N 0 1 387.343 3.134 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000528497784 567430140 /nfs/dbraw/zinc/43/01/40/567430140.db2.gz RYAAYDFYGLCMFX-PBHICJAKSA-N 0 1 387.362 3.090 10 0 GGAEMN C[N@@H+]1CC[C@@H](NC(=O)c2ccc(Br)cc2[O-])[C@@H]1c1ccccc1 ZINC000436524736 567431609 /nfs/dbraw/zinc/43/16/09/567431609.db2.gz KJKBJQGNVUORHO-WBVHZDCISA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)cc2[O-])[C@@H]1c1ccccc1 ZINC000436524736 567431614 /nfs/dbraw/zinc/43/16/14/567431614.db2.gz KJKBJQGNVUORHO-WBVHZDCISA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@@H+]1CC[C@H](NC(=O)c2cc(Br)ccc2[O-])[C@H]1c1ccccc1 ZINC000436524311 567431632 /nfs/dbraw/zinc/43/16/32/567431632.db2.gz GOMWKQRISGKBCR-DOTOQJQBSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@H](NC(=O)c2cc(Br)ccc2[O-])[C@H]1c1ccccc1 ZINC000436524311 567431635 /nfs/dbraw/zinc/43/16/35/567431635.db2.gz GOMWKQRISGKBCR-DOTOQJQBSA-N 0 1 375.266 3.330 10 0 GGAEMN CN(Cc1nc(-c2cccnc2)no1)C(=O)c1c(O)cc(Cl)cc1Cl ZINC000436541732 567433001 /nfs/dbraw/zinc/43/30/01/567433001.db2.gz ZKYLMYXXAVFJKU-UHFFFAOYSA-N 0 1 379.203 3.416 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)no2)C[C@@H]1C(=O)[O-] ZINC000569810535 567434828 /nfs/dbraw/zinc/43/48/28/567434828.db2.gz LSMAGQVJQDZKJJ-MFKMUULPSA-N 0 1 380.242 3.042 10 0 GGAEMN Oc1cc(Br)ccc1-c1nc(-c2ncccc2-n2cccn2)no1 ZINC000436571358 567434880 /nfs/dbraw/zinc/43/48/80/567434880.db2.gz VJWLTYLQJXRCBE-UHFFFAOYSA-N 0 1 384.193 3.452 10 0 GGAEMN O=S(=O)(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc(Cl)ccc1OC(F)F ZINC000528546997 567435206 /nfs/dbraw/zinc/43/52/06/567435206.db2.gz GGEASGORCUKRLZ-ZDUSSCGKSA-N 0 1 394.871 3.237 10 0 GGAEMN O=S(=O)(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc(Cl)ccc1OC(F)F ZINC000528546995 567436054 /nfs/dbraw/zinc/43/60/54/567436054.db2.gz GGEASGORCUKRLZ-CYBMUJFWSA-N 0 1 394.871 3.237 10 0 GGAEMN Cc1cccc(S(=O)(=O)NC[C@@H]2CCN2C2CCCC2)c1Br ZINC000528551584 567437775 /nfs/dbraw/zinc/43/77/75/567437775.db2.gz NWIMURMCARGBCT-AWEZNQCLSA-N 0 1 387.343 3.053 10 0 GGAEMN C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)N1C(=O)c1cccc(Br)c1O ZINC000593769785 567438918 /nfs/dbraw/zinc/43/89/18/567438918.db2.gz JRHAQKFAYFMERD-ZWNOBZJWSA-N 0 1 384.270 3.490 10 0 GGAEMN O=C(Nc1nncn1-c1ccccc1)c1cc(Br)cc2nc[nH]c21 ZINC000550282854 567438923 /nfs/dbraw/zinc/43/89/23/567438923.db2.gz WZWIYRGHCBZEIR-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN CCC(=O)c1ccc(O)c(NC(=O)c2cnn3cc(Br)cnc23)c1 ZINC000436642843 567439881 /nfs/dbraw/zinc/43/98/81/567439881.db2.gz CIQGQGWCKWYIOV-UHFFFAOYSA-N 0 1 389.209 3.042 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cc(Br)cc3c2OCC3)[C@H]1n1cccn1 ZINC000550325274 567441715 /nfs/dbraw/zinc/44/17/15/567441715.db2.gz RJMJSTPZOJOCQN-GVDBMIGSSA-N 0 1 392.297 3.089 10 0 GGAEMN Cc1cccc(-c2nnnn2[C@@H]2C[C@H]2C)c1NS(=O)(=O)c1ccsc1 ZINC000436676142 567441867 /nfs/dbraw/zinc/44/18/67/567441867.db2.gz NITOWQPGJQPVNR-BXUZGUMPSA-N 0 1 375.479 3.092 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc(Br)cc3c2OCC3)[C@H]1n1cccn1 ZINC000550325273 567442036 /nfs/dbraw/zinc/44/20/36/567442036.db2.gz RJMJSTPZOJOCQN-BRWVUGGUSA-N 0 1 392.297 3.089 10 0 GGAEMN CC(C)(C)OC(=O)CN(CC1CC1)C(=O)c1cccc(Br)c1O ZINC000593820542 567442325 /nfs/dbraw/zinc/44/23/25/567442325.db2.gz YVVHRLXAVYCRBU-UHFFFAOYSA-N 0 1 384.270 3.349 10 0 GGAEMN Cc1c(Br)ccc(C(=O)Nc2c(C(N)=O)[nH]nc2C(C)C)c1F ZINC000457127909 567442401 /nfs/dbraw/zinc/44/24/01/567442401.db2.gz QTSXKXWGVDZAHK-UHFFFAOYSA-N 0 1 383.221 3.094 10 0 GGAEMN O=C(c1cc(-c2cccc(Br)c2)no1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000662514896 567444706 /nfs/dbraw/zinc/44/47/06/567444706.db2.gz FMCIIMCZPILKBO-OKILXGFUSA-N 0 1 376.254 3.071 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NC2(c3ccc(Br)cc3)CCC2)on1 ZINC000662518133 567444863 /nfs/dbraw/zinc/44/48/63/567444863.db2.gz QQAPQRGVLBZNGC-UHFFFAOYSA-N 0 1 378.270 3.440 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)c3cc(C)c(Br)cc3C)[C@H]2C1 ZINC000502636612 567444936 /nfs/dbraw/zinc/44/49/36/567444936.db2.gz LFOGYVNUJOWBJD-DLBZAZTESA-N 0 1 381.314 3.001 10 0 GGAEMN OC[C@@H]1CCC2(CCOCC2)CN1CCOc1ccccc1Br ZINC000528646524 567444875 /nfs/dbraw/zinc/44/48/75/567444875.db2.gz WFXYIPRLMJKEGY-HNNXBMFYSA-N 0 1 384.314 3.081 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NC2(c3cccc(Br)c3)CCC2)on1 ZINC000662523371 567444972 /nfs/dbraw/zinc/44/49/72/567444972.db2.gz AMVMJNRPOJBLBV-UHFFFAOYSA-N 0 1 378.270 3.440 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)c3cc(Cl)ccc3Br)[C@H]2C1 ZINC000502634663 567445205 /nfs/dbraw/zinc/44/52/05/567445205.db2.gz MOIZKPHERHUQEF-LSDHHAIUSA-N 0 1 387.705 3.038 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@@H](C)Cc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502633672 567445460 /nfs/dbraw/zinc/44/54/60/567445460.db2.gz BHTMJXMMVCOBJZ-DOPJRALCSA-N 0 1 385.335 3.494 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)CCOc3cccc(Cl)c3Cl)[C@H]2C1 ZINC000502656249 567445609 /nfs/dbraw/zinc/44/56/09/567445609.db2.gz UVVWTDWLILWOHE-LSDHHAIUSA-N 0 1 387.307 3.084 10 0 GGAEMN O=C(CN[C@@H](c1ccccn1)C1CCC1)Nc1ccc(Br)cn1 ZINC000528657681 567446105 /nfs/dbraw/zinc/44/61/05/567446105.db2.gz KIKRXINVLDWJMM-QGZVFWFLSA-N 0 1 375.270 3.309 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC2(CCCC2=O)CC1 ZINC000619331373 567446557 /nfs/dbraw/zinc/44/65/57/567446557.db2.gz YFBPXDIQOJXMBG-UHFFFAOYSA-N 0 1 376.254 3.301 10 0 GGAEMN COc1ccc(C(C)(C)NCC(=O)Nc2ccc(Br)cn2)cc1F ZINC000528677041 567447430 /nfs/dbraw/zinc/44/74/30/567447430.db2.gz YBBBIEFAMWFJQS-UHFFFAOYSA-N 0 1 396.260 3.455 10 0 GGAEMN O=C(NCCCOc1ccc(Cl)cc1Cl)N[C@@H]1CCc2nc[nH]c2C1 ZINC000570018762 567452869 /nfs/dbraw/zinc/45/28/69/567452869.db2.gz AEVRFLGBSPPMRO-GFCCVEGCSA-N 0 1 383.279 3.342 10 0 GGAEMN O=C(N[C@@H](CO)c1ccc(Cl)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000502808764 567453270 /nfs/dbraw/zinc/45/32/70/567453270.db2.gz KGTZVWPPGPKCSL-AWEZNQCLSA-N 0 1 394.656 3.442 10 0 GGAEMN CN(C)C[C@H](NCc1cc(=O)n2ccsc2n1)c1ccc(Cl)c(Cl)c1 ZINC000528763686 567453363 /nfs/dbraw/zinc/45/33/63/567453363.db2.gz IAHSZHIOQQBMPC-HNNXBMFYSA-N 0 1 397.331 3.455 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccc(F)cc1OCCC(F)(F)F)C1CC1 ZINC000570044342 567453988 /nfs/dbraw/zinc/45/39/88/567453988.db2.gz FWWRAWDJUNBGLW-AWEZNQCLSA-N 0 1 385.379 3.324 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1cc(Br)ccc1F ZINC000594030837 567454175 /nfs/dbraw/zinc/45/41/75/567454175.db2.gz SKLDBJDKARFHCU-TXEJJXNPSA-N 0 1 393.322 3.129 10 0 GGAEMN O=C(CCCN1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccc(Br)cc1 ZINC000528788027 567455902 /nfs/dbraw/zinc/45/59/02/567455902.db2.gz KFAJONZTHDUPDG-VVBPWWLESA-N 0 1 384.339 3.397 10 0 GGAEMN O=S(=O)(c1sccc1Br)N1CCCC[C@H](N2CCCC2)C1 ZINC000594044633 567456088 /nfs/dbraw/zinc/45/60/88/567456088.db2.gz RTYXVCOYOGWLAV-LBPRGKRZSA-N 0 1 393.372 3.150 10 0 GGAEMN O=S(=O)(c1sccc1Br)N1CCCC[C@@H](N2CCCC2)C1 ZINC000594044629 567456204 /nfs/dbraw/zinc/45/62/04/567456204.db2.gz RTYXVCOYOGWLAV-GFCCVEGCSA-N 0 1 393.372 3.150 10 0 GGAEMN CCC[C@H]1CNCCN1C(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000570091648 567457165 /nfs/dbraw/zinc/45/71/65/567457165.db2.gz SASAUALRMNPBFA-INIZCTEOSA-N 0 1 391.313 3.157 10 0 GGAEMN Cc1cc(=NC(=O)c2cc(Br)cc3[nH]cnc32)[nH]n1[C@@H](C)C1CC1 ZINC000502859060 567457729 /nfs/dbraw/zinc/45/77/29/567457729.db2.gz GTCSINCAAKDNDT-JTQLQIEISA-N 0 1 388.269 3.476 10 0 GGAEMN COCC[C@H](Cc1ccco1)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000502846433 567457813 /nfs/dbraw/zinc/45/78/13/567457813.db2.gz SIONGWFWIZALLI-GFCCVEGCSA-N 0 1 392.253 3.296 10 0 GGAEMN CC[N@@H+]1CC[C@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C[C@@H]1C ZINC000662743906 567461385 /nfs/dbraw/zinc/46/13/85/567461385.db2.gz WZXTUZKPQNZWEZ-QWRGUYRKSA-N 0 1 386.359 3.059 10 0 GGAEMN CC(C)(C)OC(=O)CCCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000502988470 567463371 /nfs/dbraw/zinc/46/33/71/567463371.db2.gz CZUZBEGSLFGOBR-UHFFFAOYSA-N 0 1 382.258 3.177 10 0 GGAEMN CCO[C@@H]1C[C@@H](NC(=O)c2cc(Br)cc3nc[nH]c32)C12CCC2 ZINC000502992671 567463403 /nfs/dbraw/zinc/46/34/03/567463403.db2.gz AATXPYWZBYTWAH-ZIAGYGMSSA-N 0 1 378.270 3.403 10 0 GGAEMN C[S@@](=O)c1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1 ZINC000502983634 567463860 /nfs/dbraw/zinc/46/38/60/567463860.db2.gz PUJVTWWRUFNZBG-JOCHJYFZSA-N 0 1 378.251 3.315 10 0 GGAEMN Cc1ccc(NC(=O)N2CCC(C)(N3CCOCC3)CC2)c(Br)c1 ZINC000528864007 567464360 /nfs/dbraw/zinc/46/43/60/567464360.db2.gz MXVKWRHMNDBRIA-UHFFFAOYSA-N 0 1 396.329 3.476 10 0 GGAEMN O=c1cc(CNS(=O)(=O)c2c(Cl)ccc(F)c2F)c2ccccc2[nH]1 ZINC000550832413 567465435 /nfs/dbraw/zinc/46/54/35/567465435.db2.gz SCIWYNPCIDSIBS-UHFFFAOYSA-N 0 1 384.791 3.351 10 0 GGAEMN C[C@@H](CCc1cccn1C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503005405 567465490 /nfs/dbraw/zinc/46/54/90/567465490.db2.gz YSJLHUXPXOQLAR-NSHDSACASA-N 0 1 375.270 3.415 10 0 GGAEMN COCCN1CCCN(C(=O)CCCOc2cccc(Cl)c2Cl)CC1 ZINC000478536374 567465755 /nfs/dbraw/zinc/46/57/55/567465755.db2.gz PAOHEXSDRNIWAT-UHFFFAOYSA-N 0 1 389.323 3.333 10 0 GGAEMN COCCN1CCCN(C(=O)CCCCc2ccc(Br)cc2)CC1 ZINC000478555471 567467066 /nfs/dbraw/zinc/46/70/66/567467066.db2.gz GINTWFUJELSDJP-UHFFFAOYSA-N 0 1 397.357 3.343 10 0 GGAEMN COCCN1CCCN(C(=O)C2(c3ccc(Br)cc3)CCC2)CC1 ZINC000478560336 567467132 /nfs/dbraw/zinc/46/71/32/567467132.db2.gz LHQBLTKZNOGEHF-UHFFFAOYSA-N 0 1 395.341 3.052 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000570252041 567470117 /nfs/dbraw/zinc/47/01/17/567470117.db2.gz BZSPMYSKDDCAPP-WQVCFCJDSA-N 0 1 392.297 3.481 10 0 GGAEMN C[C@](N)(C(=O)N1CCOc2cc(Br)ccc2C1)c1ccccc1 ZINC000662940859 567470230 /nfs/dbraw/zinc/47/02/30/567470230.db2.gz YTXYKDSFRGRMHK-GOSISDBHSA-N 0 1 375.266 3.044 10 0 GGAEMN CCCOc1ncccc1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503150589 567470849 /nfs/dbraw/zinc/47/08/49/567470849.db2.gz NTZISUHTFVCJCV-UHFFFAOYSA-N 0 1 389.253 3.439 10 0 GGAEMN CC(C)C[C@H](N)c1noc(-c2n[nH]c3ccc(I)cc32)n1 ZINC000570279559 567471805 /nfs/dbraw/zinc/47/18/05/567471805.db2.gz RMYOVRZKYXSAJL-JTQLQIEISA-N 0 1 397.220 3.263 10 0 GGAEMN COc1cccc([C@@H]2[C@H](NC(=O)[C@H]3C[C@@]3(C)Br)CCN2C2CC2)c1 ZINC000528983311 567475085 /nfs/dbraw/zinc/47/50/85/567475085.db2.gz UMAZMVKOLJEKKC-YWTNHNAXSA-N 0 1 393.325 3.263 10 0 GGAEMN COC(=O)CC1(NC(=O)c2cc(Br)cc3nc[nH]c32)CCCCC1 ZINC000619725057 567475662 /nfs/dbraw/zinc/47/56/62/567475662.db2.gz GFCCFVYZDCZLCS-UHFFFAOYSA-N 0 1 394.269 3.321 10 0 GGAEMN COc1cccc([C@@H]2[C@H](NC(=O)[C@@H]3C[C@]3(C)Br)CCN2C2CC2)c1 ZINC000528983309 567475852 /nfs/dbraw/zinc/47/58/52/567475852.db2.gz UMAZMVKOLJEKKC-FAJBIJEISA-N 0 1 393.325 3.263 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2cc(C)c(F)cc2Cl)cc1OC ZINC000478708781 567477200 /nfs/dbraw/zinc/47/72/00/567477200.db2.gz GGXPJLDHSNQHLE-UHFFFAOYSA-N 0 1 387.816 3.384 10 0 GGAEMN COc1ccc(-c2n[nH]c(SCc3ncccn3)n2)cc1Br ZINC000478709332 567477288 /nfs/dbraw/zinc/47/72/88/567477288.db2.gz GPGFXMLDKKUEQD-UHFFFAOYSA-N 0 1 378.255 3.325 10 0 GGAEMN C[C@H](NC(=O)CN1CC[C@@H](C)C1)c1nc(-c2ccc(Br)cc2)no1 ZINC000570343519 567477397 /nfs/dbraw/zinc/47/73/97/567477397.db2.gz QRFHFVHDAKIBQP-NEPJUHHUSA-N 0 1 393.285 3.018 10 0 GGAEMN O=C(Cc1c(F)ccc(Br)c1F)Nc1nc(-c2ccco2)n[nH]1 ZINC000503286450 567478571 /nfs/dbraw/zinc/47/85/71/567478571.db2.gz NBSUFIAUICXFDG-UHFFFAOYSA-N 0 1 383.152 3.287 10 0 GGAEMN COc1ccc(CCNC(=O)c2cc(Br)cc3nc[nH]c32)cc1F ZINC000503294466 567480257 /nfs/dbraw/zinc/48/02/57/567480257.db2.gz AYQMUISWWDIWRZ-UHFFFAOYSA-N 0 1 392.228 3.446 10 0 GGAEMN COC(=O)c1sccc1S(=O)(=O)N[C@H](c1ccc(C)o1)C(F)(F)F ZINC000594481228 567480687 /nfs/dbraw/zinc/48/06/87/567480687.db2.gz KBCMYOCBNBAZCP-LLVKDONJSA-N 0 1 383.369 3.018 10 0 GGAEMN O=C(N[C@H](c1nn[nH]n1)c1ccc(Cl)c(F)c1)[C@@H]1C[C@H]1c1ccsc1 ZINC000529046120 567480771 /nfs/dbraw/zinc/48/07/71/567480771.db2.gz UVMMTOPQBMMMKT-WDMOLILDSA-N 0 1 377.832 3.063 10 0 GGAEMN COC(=O)c1scc(C)c1S(=O)(=O)N[C@@H](c1ccc(C)o1)C(F)(F)F ZINC000594481254 567480857 /nfs/dbraw/zinc/48/08/57/567480857.db2.gz KPDUECQQZFJGNG-LBPRGKRZSA-N 0 1 397.396 3.326 10 0 GGAEMN Ic1cnc(CN[C@@H](C2CC2)[C@@H]2CCCCO2)s1 ZINC000594509990 567483582 /nfs/dbraw/zinc/48/35/82/567483582.db2.gz MNHXSMJZVAVDIL-GWCFXTLKSA-N 0 1 378.279 3.185 10 0 GGAEMN Ic1cnc(CN[C@H](C2CC2)[C@H]2CCCCO2)s1 ZINC000594509995 567483901 /nfs/dbraw/zinc/48/39/01/567483901.db2.gz MNHXSMJZVAVDIL-ZWNOBZJWSA-N 0 1 378.279 3.185 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@H](c2cccs2)N(C)C)C[C@H](CC(F)(F)F)O1 ZINC000663238635 567484407 /nfs/dbraw/zinc/48/44/07/567484407.db2.gz GNIYFXDZALCDKY-FRRDWIJNSA-N 0 1 379.448 3.102 10 0 GGAEMN C[C@@H]1CN(C(=O)NC[C@@H](c2cccs2)N(C)C)C[C@H](CC(F)(F)F)O1 ZINC000663238634 567484527 /nfs/dbraw/zinc/48/45/27/567484527.db2.gz GNIYFXDZALCDKY-AGIUHOORSA-N 0 1 379.448 3.102 10 0 GGAEMN CCn1nccc1S(=O)(=O)Nc1noc(-c2ccccc2)c1Br ZINC000551171859 567484560 /nfs/dbraw/zinc/48/45/60/567484560.db2.gz VBVDBEOJUAWWHV-UHFFFAOYSA-N 0 1 397.254 3.121 10 0 GGAEMN O=C(COc1ccsc1)Nc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000503483796 567488575 /nfs/dbraw/zinc/48/85/75/567488575.db2.gz BJXCAAPQEQWFMT-UHFFFAOYSA-N 0 1 379.239 3.313 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503512793 567490128 /nfs/dbraw/zinc/49/01/28/567490128.db2.gz YWEZUKPHSAVASW-GFCCVEGCSA-N 0 1 380.267 3.159 10 0 GGAEMN COC(=O)c1ccnc(NS(=O)(=O)c2c(C)cc(Br)cc2C)c1 ZINC000437314592 567490511 /nfs/dbraw/zinc/49/05/11/567490511.db2.gz WHCDUVFUJXJMIB-UHFFFAOYSA-N 0 1 399.266 3.048 10 0 GGAEMN C[C@@H](CCO)C1(CNC(=O)c2cc(Br)cc3nc[nH]c32)CCC1 ZINC000503519520 567491338 /nfs/dbraw/zinc/49/13/38/567491338.db2.gz RCXZSIPZAGNVDS-NSHDSACASA-N 0 1 380.286 3.244 10 0 GGAEMN C[C@H](CCO)C1(CNC(=O)c2cc(Br)cc3nc[nH]c32)CCC1 ZINC000503519519 567491464 /nfs/dbraw/zinc/49/14/64/567491464.db2.gz RCXZSIPZAGNVDS-LLVKDONJSA-N 0 1 380.286 3.244 10 0 GGAEMN CCc1nc(S(=O)(=O)Nc2nc(C)ccc2Br)cn1CC1CC1 ZINC000663300639 567494285 /nfs/dbraw/zinc/49/42/85/567494285.db2.gz UWTYEFCYXIFYAV-UHFFFAOYSA-N 0 1 399.314 3.122 10 0 GGAEMN CC(C)(C)c1nc(C[S@](=O)Cc2ncc(Br)cc2Cl)n[nH]1 ZINC000594676582 567494886 /nfs/dbraw/zinc/49/48/86/567494886.db2.gz UVKZEILLENFRQW-OAQYLSRUSA-N 0 1 391.722 3.362 10 0 GGAEMN CC(C)(C)S(=O)(=O)CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000503570516 567495374 /nfs/dbraw/zinc/49/53/74/567495374.db2.gz ASKJXDVLAQRYHL-CQSZACIVSA-N 0 1 383.901 3.093 10 0 GGAEMN C[S@@](=O)c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503595325 567496611 /nfs/dbraw/zinc/49/66/11/567496611.db2.gz XPRFXRGFRATIDN-JOCHJYFZSA-N 0 1 378.251 3.315 10 0 GGAEMN NC(=O)[C@H](NCCc1ccc2ccccc2n1)c1cccc(Br)c1 ZINC000479027289 567497118 /nfs/dbraw/zinc/49/71/18/567497118.db2.gz ZJQLOHNETXBMKG-GOSISDBHSA-N 0 1 384.277 3.356 10 0 GGAEMN CC(C)CC[C@@](C)(O)CN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479052680 567498230 /nfs/dbraw/zinc/49/82/30/567498230.db2.gz BOWNSOCCDCWIQY-MEDUHNTESA-N 0 1 397.368 3.479 10 0 GGAEMN CC(C)CC[C@](C)(O)CN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479052678 567498533 /nfs/dbraw/zinc/49/85/33/567498533.db2.gz BOWNSOCCDCWIQY-BZNIZROVSA-N 0 1 397.368 3.479 10 0 GGAEMN C[C@@H](Cc1ccc(Br)cc1)NC(=O)NCc1n[nH]c(C(C)(C)C)n1 ZINC000457866253 567499963 /nfs/dbraw/zinc/49/99/63/567499963.db2.gz GXYDNEDKTUQJPB-NSHDSACASA-N 0 1 394.317 3.295 10 0 GGAEMN CN1CCc2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc2C1=O ZINC000503670907 567500371 /nfs/dbraw/zinc/50/03/71/567500371.db2.gz MFBQMPCZTPEDCB-UHFFFAOYSA-N 0 1 399.248 3.206 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)NC(=O)NCc1n[nH]c(C(C)(C)C)n1 ZINC000457866251 567500599 /nfs/dbraw/zinc/50/05/99/567500599.db2.gz GXYDNEDKTUQJPB-LLVKDONJSA-N 0 1 394.317 3.295 10 0 GGAEMN O=C(Nc1cccc([C@@H]2CNC(=O)C2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000503684807 567501053 /nfs/dbraw/zinc/50/10/53/567501053.db2.gz KPCYLMJMLBMSRB-NSHDSACASA-N 0 1 399.248 3.181 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000437626476 567501535 /nfs/dbraw/zinc/50/15/35/567501535.db2.gz FECNHYORSOWUBP-WMLDXEAASA-N 0 1 386.323 3.261 10 0 GGAEMN COc1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)c(F)c1 ZINC000503703501 567502464 /nfs/dbraw/zinc/50/24/64/567502464.db2.gz UUDWSBXSVDTZFN-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN CCOc1ccc(NC(=O)c2cc(Br)cc3nc[nH]c32)cc1CO ZINC000503713951 567503800 /nfs/dbraw/zinc/50/38/00/567503800.db2.gz BHNAXACTOKSTJD-UHFFFAOYSA-N 0 1 390.237 3.469 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1cc2c(cc1Br)OCO2 ZINC000551421962 567504328 /nfs/dbraw/zinc/50/43/28/567504328.db2.gz MIYBFKWIWXPEMI-CYBMUJFWSA-N 0 1 383.286 3.059 10 0 GGAEMN CC(C)Oc1cc(CNC(=O)c2cc(Br)cc3nc[nH]c32)ccn1 ZINC000503749002 567505149 /nfs/dbraw/zinc/50/51/49/567505149.db2.gz QNIUIQPFWUIXGQ-UHFFFAOYSA-N 0 1 389.253 3.438 10 0 GGAEMN C[C@@H](CS(C)(=O)=O)N[C@@H]1CCCSc2ccc(Br)cc21 ZINC000663443296 567508665 /nfs/dbraw/zinc/50/86/65/567508665.db2.gz QPWRUHSLCGTLCS-GXFFZTMASA-N 0 1 378.357 3.399 10 0 GGAEMN C[C@@H](NC(=O)N1C[C@H]2CCC[C@@H](C1)N2)c1cc(F)c(Br)cc1F ZINC000529351210 567509038 /nfs/dbraw/zinc/50/90/38/567509038.db2.gz REKODUBKYQSOCX-MXWKQRLJSA-N 0 1 388.256 3.324 10 0 GGAEMN C[C@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cncc(Br)c1 ZINC000570740310 567509374 /nfs/dbraw/zinc/50/93/74/567509374.db2.gz KGWMXEAYSPQZKE-SJCJKPOMSA-N 0 1 392.272 3.435 10 0 GGAEMN CCN(CC)[C@@H](CNS(=O)(=O)CC1CC1)c1ccc(C(F)(F)F)cc1 ZINC000479173402 567512338 /nfs/dbraw/zinc/51/23/38/567512338.db2.gz SJUKTGIOSMPYRS-INIZCTEOSA-N 0 1 378.460 3.418 10 0 GGAEMN C[C@@](O)(C1CCN(C(=O)c2[nH]nc3ccc(Cl)cc32)CC1)C(F)(F)F ZINC000551522971 567514311 /nfs/dbraw/zinc/51/43/11/567514311.db2.gz GIXIONNPOBNDCU-OAHLLOKOSA-N 0 1 375.778 3.382 10 0 GGAEMN C[C@H]1COCCN1C1CCN(C(=O)c2sc3ncccc3c2Cl)CC1 ZINC000529411476 567514509 /nfs/dbraw/zinc/51/45/09/567514509.db2.gz SNPHQZIYCCXMSN-LBPRGKRZSA-N 0 1 379.913 3.275 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)c2cc3c(cccc3Br)[nH]2)n[nH]1 ZINC000458024812 567514474 /nfs/dbraw/zinc/51/44/74/567514474.db2.gz OLOLDTVAZQLBIC-UHFFFAOYSA-N 0 1 376.258 3.276 10 0 GGAEMN CN(C)[C@@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)c1ccsc1 ZINC000503957291 567514727 /nfs/dbraw/zinc/51/47/27/567514727.db2.gz HGZWEEFRHHBHOH-AWEZNQCLSA-N 0 1 393.310 3.420 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2cc(F)ccc2Cl)C1 ZINC000437938710 567515259 /nfs/dbraw/zinc/51/52/59/567515259.db2.gz DBYGNDRGCBGHMN-MRXNPFEDSA-N 0 1 388.936 3.185 10 0 GGAEMN CCC[C@H](C)[C@@H](CO)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000570807558 567515497 /nfs/dbraw/zinc/51/54/97/567515497.db2.gz XBZOWNPEEMDICL-TUKIKUTGSA-N 0 1 390.343 3.054 10 0 GGAEMN COc1cccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)c1OC ZINC000503970397 567516037 /nfs/dbraw/zinc/51/60/37/567516037.db2.gz SHLIIVXSGWVBHT-UHFFFAOYSA-N 0 1 390.237 3.273 10 0 GGAEMN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)CCSc1nnc(C)[nH]1 ZINC000620339422 567516585 /nfs/dbraw/zinc/51/65/85/567516585.db2.gz HHPUQCFBLIZCLW-AWEZNQCLSA-N 0 1 397.342 3.495 10 0 GGAEMN CC(C)(C(=O)NCc1n[nH]c(C2CC2)n1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000529444471 567516757 /nfs/dbraw/zinc/51/67/57/567516757.db2.gz WGLVRTHRRHAIFK-AWEZNQCLSA-N 0 1 383.279 3.365 10 0 GGAEMN COc1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cc1F ZINC000503987728 567518260 /nfs/dbraw/zinc/51/82/60/567518260.db2.gz UQMPFGWYTOIFFG-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN CC(C)Oc1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)cn1 ZINC000504007640 567518366 /nfs/dbraw/zinc/51/83/66/567518366.db2.gz RRPQPQZYKZRUKF-UHFFFAOYSA-N 0 1 389.253 3.438 10 0 GGAEMN C[C@H](N[C@@H](CO)C[C@@H](O)C(C)(C)C)c1ccccc1I ZINC000551573022 567518495 /nfs/dbraw/zinc/51/84/95/567518495.db2.gz YUGJUNUGCHGTQD-YWPYICTPSA-N 0 1 391.293 3.100 10 0 GGAEMN C[C@H](N[C@H](CO)C[C@H](O)C(C)(C)C)c1ccccc1I ZINC000551573020 567518607 /nfs/dbraw/zinc/51/86/07/567518607.db2.gz YUGJUNUGCHGTQD-HUBLWGQQSA-N 0 1 391.293 3.100 10 0 GGAEMN Cc1cc(C(=O)N2CCc3cc(Br)c(Br)cc3C2)n[nH]1 ZINC000620359651 567519327 /nfs/dbraw/zinc/51/93/27/567519327.db2.gz CFPCHKXMNDJARJ-UHFFFAOYSA-N 0 1 399.086 3.442 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)NC[C@]1(C)CC1(F)F ZINC000594856554 567520355 /nfs/dbraw/zinc/52/03/55/567520355.db2.gz HQRZNEDPFNJMMV-LBPRGKRZSA-N 0 1 388.219 3.104 10 0 GGAEMN CCN1CC[C@H](NC(=O)c2scc(Br)c2Br)C1 ZINC000529493217 567520783 /nfs/dbraw/zinc/52/07/83/567520783.db2.gz RVMUDMYYADCHSI-ZETCQYMHSA-N 0 1 382.121 3.097 10 0 GGAEMN CC(C)(C(=O)N1CC[C@@H](c2nc[nH]n2)C1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000529509238 567522323 /nfs/dbraw/zinc/52/23/23/567522323.db2.gz WPNGTJKEGRPGNE-YGRLFVJLSA-N 0 1 383.279 3.187 10 0 GGAEMN COC(=O)[C@](C)(CCF)NS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl ZINC000594867071 567522941 /nfs/dbraw/zinc/52/29/41/567522941.db2.gz UNGGUBRSSMNCFV-LBPRGKRZSA-N 0 1 392.663 3.216 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@H](C(=O)OC)c1ccccc1Br ZINC000594882380 567523624 /nfs/dbraw/zinc/52/36/24/567523624.db2.gz TUOSCTBNEMKNER-NSHDSACASA-N 0 1 386.271 3.163 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)c1ccc2cncn2c1 ZINC000551633375 567524688 /nfs/dbraw/zinc/52/46/88/567524688.db2.gz CIRJMDNVVVPUKM-UHFFFAOYSA-N 0 1 394.294 3.447 10 0 GGAEMN Brc1cccc(-c2n[nH]c(-c3noc(C=C[C@H]4CCCO4)n3)n2)c1 ZINC000643966524 567525440 /nfs/dbraw/zinc/52/54/40/567525440.db2.gz XVSPJWVSRMXIDO-ZHRWSRJISA-N 0 1 388.225 3.476 10 0 GGAEMN CCN1CCN(c2nnc([C@@H]3CCCS3)n2Cc2cccs2)C[C@H]1C ZINC000643965963 567526186 /nfs/dbraw/zinc/52/61/86/567526186.db2.gz XPYQKIGQFKRWBL-ZBFHGGJFSA-N 0 1 377.583 3.486 10 0 GGAEMN COc1ccc([C@H](C)NC[C@@H]2CS(=O)(=O)c3ccccc3O2)cc1Cl ZINC000570964008 567526482 /nfs/dbraw/zinc/52/64/82/567526482.db2.gz BOVJAKGMGJVWLE-GXTWGEPZSA-N 0 1 381.881 3.234 10 0 GGAEMN CO[C@@H](CNCc1cc(Cl)ccc1I)[C@@H]1CCOC1 ZINC000594954431 567529132 /nfs/dbraw/zinc/52/91/32/567529132.db2.gz ZSUDIGVYWKKROF-YGRLFVJLSA-N 0 1 395.668 3.086 10 0 GGAEMN CC[C@@H](NCc1cc(Cl)ccc1I)[C@@H](O)C(F)F ZINC000594957019 567529487 /nfs/dbraw/zinc/52/94/87/567529487.db2.gz MPBQONUFRHARFF-GHMZBOCLSA-N 0 1 389.611 3.439 10 0 GGAEMN CN1CCN(C(C)(C)CNC(=O)N[C@@H]2CCCc3sc(Cl)cc32)CC1 ZINC000644100931 567531119 /nfs/dbraw/zinc/53/11/19/567531119.db2.gz IKMHYDQPVGAVSD-CQSZACIVSA-N 0 1 384.977 3.104 10 0 GGAEMN Fc1ccc2c(c1)C[C@@H]1[C@@H](NCc3ncc(I)s3)[C@H]21 ZINC000594994010 567532185 /nfs/dbraw/zinc/53/21/85/567532185.db2.gz CYWMXKHAZJKVRC-ZLKJLUDKSA-N 0 1 386.233 3.315 10 0 GGAEMN Cc1cncc(CCNCc2c(F)ccc(I)c2F)n1 ZINC000594993245 567532575 /nfs/dbraw/zinc/53/25/75/567532575.db2.gz CCCSQRCDYZTJPU-UHFFFAOYSA-N 0 1 389.187 3.000 10 0 GGAEMN C[C@H](NC[C@H]1CCC(C)(C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000479430528 567534824 /nfs/dbraw/zinc/53/48/24/567534824.db2.gz KZUMLGXFYHTSMC-VHSXEESVSA-N 0 1 381.325 3.249 10 0 GGAEMN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000551779834 567535126 /nfs/dbraw/zinc/53/51/26/567535126.db2.gz XXDNCBOJTDIBOA-GFCCVEGCSA-N 0 1 387.281 3.178 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1ccc(C(=O)OC)cc1Br ZINC000551811545 567537770 /nfs/dbraw/zinc/53/77/70/567537770.db2.gz FHSKGFGZLGEYAR-OAHLLOKOSA-N 0 1 397.313 3.116 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1ccc(C(=O)OC)cc1Br ZINC000551811544 567538310 /nfs/dbraw/zinc/53/83/10/567538310.db2.gz FHSKGFGZLGEYAR-HNNXBMFYSA-N 0 1 397.313 3.116 10 0 GGAEMN CC(=O)Nc1cc(F)c(F)cc1NS(=O)(=O)c1ccc2ncsc2c1 ZINC000479494126 567541100 /nfs/dbraw/zinc/54/11/00/567541100.db2.gz AGHMHHQIAWUVRQ-UHFFFAOYSA-N 0 1 383.401 3.334 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000571184436 567543150 /nfs/dbraw/zinc/54/31/50/567543150.db2.gz ZBPSPJIDGCCRQA-SJWGOKEGSA-N 0 1 396.329 3.061 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000571184437 567543277 /nfs/dbraw/zinc/54/32/77/567543277.db2.gz ZBPSPJIDGCCRQA-VDNDLQMASA-N 0 1 396.329 3.061 10 0 GGAEMN OC[C@@H](CN=c1nc(C(F)(F)F)[n-]s1)Cc1ccc(C(F)(F)F)cc1 ZINC000571189703 567543720 /nfs/dbraw/zinc/54/37/20/567543720.db2.gz UUXFJGYTSCIASE-SECBINFHSA-N 0 1 385.333 3.261 10 0 GGAEMN C[C@H](NC(=O)[C@H]1CCc2[nH]cnc2C1)c1cc(F)c(Br)cc1F ZINC000529750533 567544931 /nfs/dbraw/zinc/54/49/31/567544931.db2.gz MJSDRKFHOSYMIJ-IUCAKERBSA-N 0 1 384.224 3.433 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000620807828 567544978 /nfs/dbraw/zinc/54/49/78/567544978.db2.gz ANZZTWMTGAJNBG-GUYCJALGSA-N 0 1 389.323 3.066 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cccc(Br)c2O)C[C@@H](CC(F)(F)F)O1 ZINC000620801655 567545260 /nfs/dbraw/zinc/54/52/60/567545260.db2.gz QEAYHFVITAANDZ-RKDXNWHRSA-N 0 1 382.176 3.337 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2cccc(OCC(F)(F)F)c2)cs1 ZINC000438803650 567546664 /nfs/dbraw/zinc/54/66/64/567546664.db2.gz GQXDFKOLBSOTDJ-UHFFFAOYSA-N 0 1 395.380 3.277 10 0 GGAEMN C[C@H](C(=O)N1CCC(C)(N2CCOCC2)CC1)c1ccc(Br)cc1 ZINC000529911619 567554817 /nfs/dbraw/zinc/55/48/17/567554817.db2.gz VPMMBXUFDQDQCB-HNNXBMFYSA-N 0 1 395.341 3.266 10 0 GGAEMN Cc1cc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c(Br)s1 ZINC000529913328 567555285 /nfs/dbraw/zinc/55/52/85/567555285.db2.gz GHPINEMODSKLKI-UHFFFAOYSA-N 0 1 387.343 3.146 10 0 GGAEMN C[C@@H](C(=O)N1CCC(C)(N2CCOCC2)CC1)c1cccc(Br)c1 ZINC000529908978 567555502 /nfs/dbraw/zinc/55/55/02/567555502.db2.gz PBBUTVXPQWOQAD-OAHLLOKOSA-N 0 1 395.341 3.266 10 0 GGAEMN Cc1ccc(CC(=O)N2CCC(C)(N3CCOCC3)CC2)cc1Br ZINC000529910483 567555542 /nfs/dbraw/zinc/55/55/42/567555542.db2.gz UFASPFYNEMVVCJ-UHFFFAOYSA-N 0 1 395.341 3.013 10 0 GGAEMN CC1(C)C[C@@]1(C)NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000664202886 567557025 /nfs/dbraw/zinc/55/70/25/567557025.db2.gz QSXUYRLGGODGHX-MRXNPFEDSA-N 0 1 378.274 3.222 10 0 GGAEMN CC1(C)C[C@@]1(C)NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000664202886 567557030 /nfs/dbraw/zinc/55/70/30/567557030.db2.gz QSXUYRLGGODGHX-MRXNPFEDSA-N 0 1 378.274 3.222 10 0 GGAEMN CC1(C)CC(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000664202932 567557048 /nfs/dbraw/zinc/55/70/48/567557048.db2.gz RLPAIKBABLGWCU-UHFFFAOYSA-N 0 1 378.274 3.222 10 0 GGAEMN CC1(C)CC(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000664202932 567557052 /nfs/dbraw/zinc/55/70/52/567557052.db2.gz RLPAIKBABLGWCU-UHFFFAOYSA-N 0 1 378.274 3.222 10 0 GGAEMN C[C@H](CC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000571373065 567557797 /nfs/dbraw/zinc/55/77/97/567557797.db2.gz UVOCVINYVNQVHQ-PWSUYJOCSA-N 0 1 380.261 3.479 10 0 GGAEMN Cn1c(=O)ccc2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc21 ZINC000505081132 567558836 /nfs/dbraw/zinc/55/88/36/567558836.db2.gz WJMXVDUSWFFDIN-UHFFFAOYSA-N 0 1 397.232 3.430 10 0 GGAEMN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(F)cc1Br ZINC000552097188 567559038 /nfs/dbraw/zinc/55/90/38/567559038.db2.gz VTXJCDPFJDAHCQ-YPMHNXCESA-N 0 1 393.322 3.053 10 0 GGAEMN CN1CC[C@@H](CNC(=O)N2C[C@@H]3C[C@H]2CS3)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000458628113 567559841 /nfs/dbraw/zinc/55/98/41/567559841.db2.gz WFWSMIUKRZPUBG-WSMBLCCSSA-N 0 1 383.920 3.371 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)C(=O)c1cc(F)cc2nn[nH]c21 ZINC000505116768 567560275 /nfs/dbraw/zinc/56/02/75/567560275.db2.gz GAQSYXBWTKXQIU-UHFFFAOYSA-N 0 1 377.217 3.440 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1c(Cl)cnn1C)c1ccc(Cl)c(Cl)c1 ZINC000530034314 567563097 /nfs/dbraw/zinc/56/30/97/567563097.db2.gz UUCMMHSFJKUIOF-ZDUSSCGKSA-N 0 1 375.687 3.413 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccc(Cl)c(Cl)c1 ZINC000530032551 567563464 /nfs/dbraw/zinc/56/34/64/567563464.db2.gz IUXLFRMIGPTCMZ-VBQJREDUSA-N 0 1 381.307 3.250 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1cn(C(C)(C)C)nn1)c1ccc(Cl)c(Cl)c1 ZINC000530032142 567563738 /nfs/dbraw/zinc/56/37/38/567563738.db2.gz FWYHYSYGTZXQEZ-AWEZNQCLSA-N 0 1 384.311 3.373 10 0 GGAEMN CN(C)C[C@@H](NC(=O)c1ccc(C(N)=O)s1)c1ccc(Cl)c(Cl)c1 ZINC000530032691 567564029 /nfs/dbraw/zinc/56/40/29/567564029.db2.gz VRMYUNYFNHCDGT-GFCCVEGCSA-N 0 1 386.304 3.187 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCC[C@H]2c2ccc(Br)cn2)CC1 ZINC000458678516 567564872 /nfs/dbraw/zinc/56/48/72/567564872.db2.gz ZKHTWYSXZBYISV-KRWDZBQOSA-N 0 1 393.329 3.343 10 0 GGAEMN CCOC(=O)c1c(C)[nH]nc1CN[C@@H]1CCOc2c(Br)cccc21 ZINC000595471874 567566862 /nfs/dbraw/zinc/56/68/62/567566862.db2.gz FWJXGSLBOAZVID-CYBMUJFWSA-N 0 1 394.269 3.271 10 0 GGAEMN CC(C)(CNC(=O)c1cn[nH]c1-c1ccc(Cl)s1)C(=O)N1CCCC1 ZINC000530084800 567568949 /nfs/dbraw/zinc/56/89/49/567568949.db2.gz IINYWHTWUBBCCX-UHFFFAOYSA-N 0 1 380.901 3.170 10 0 GGAEMN Cn1ccnc1CNCCOc1ccc(Br)cc1C(F)(F)F ZINC000479947378 567570121 /nfs/dbraw/zinc/57/01/21/567570121.db2.gz FJOKPZPPLQSYNZ-UHFFFAOYSA-N 0 1 378.192 3.370 10 0 GGAEMN COCCC1CCN(CN2CC[C@H](c3cccc(Br)c3)C2=O)CC1 ZINC000530093927 567570240 /nfs/dbraw/zinc/57/02/40/567570240.db2.gz GRHSLMDMKZPWKM-GOSISDBHSA-N 0 1 395.341 3.471 10 0 GGAEMN O=S1(=O)CC[C@@H](N(CCCCc2cccc(Cl)c2)C[C@H]2CCCO2)C1 ZINC000621271104 567571355 /nfs/dbraw/zinc/57/13/55/567571355.db2.gz XCCGOEXYJKGORX-RTBURBONSA-N 0 1 385.957 3.331 10 0 GGAEMN NC(=O)[C@H](NC[C@@H]1CCN1C1CCCCC1)c1ccc(Br)cc1F ZINC000530128910 567571709 /nfs/dbraw/zinc/57/17/09/567571709.db2.gz DDMJAOFIEYWJKR-WMLDXEAASA-N 0 1 398.320 3.111 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(F)c(Br)c1 ZINC000439231128 567573063 /nfs/dbraw/zinc/57/30/63/567573063.db2.gz AHXYYSDDCKKHAY-RYUDHWBXSA-N 0 1 393.322 3.129 10 0 GGAEMN O=C(CN1CC[C@@H](Sc2cccc(Cl)c2)C1)N1CCOC[C@@H]1C1CC1 ZINC000644786077 567579158 /nfs/dbraw/zinc/57/91/58/567579158.db2.gz FPCLRWCDUBZHHI-QZTJIDSGSA-N 0 1 380.941 3.144 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@H+](C[C@H](O)c1ccccc1Br)CC2 ZINC000530168158 567579534 /nfs/dbraw/zinc/57/95/34/567579534.db2.gz JAUQBRCOPUHLAX-KRWDZBQOSA-N 0 1 394.240 3.378 10 0 GGAEMN O=C([O-])c1ccc(F)c2c1C[N@@H+](C[C@H](O)c1ccccc1Br)CC2 ZINC000530168158 567579541 /nfs/dbraw/zinc/57/95/41/567579541.db2.gz JAUQBRCOPUHLAX-KRWDZBQOSA-N 0 1 394.240 3.378 10 0 GGAEMN C[C@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1ccc(Br)cc1F ZINC000552340434 567580029 /nfs/dbraw/zinc/58/00/29/567580029.db2.gz URTNLDSVGIWHDA-AAEUAGOBSA-N 0 1 393.322 3.053 10 0 GGAEMN C[C@@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cc(Cl)ccc1OC(F)F ZINC000552340021 567580465 /nfs/dbraw/zinc/58/04/65/567580465.db2.gz JFDMUGLEJKAPCQ-DGCLKSJQSA-N 0 1 396.887 3.406 10 0 GGAEMN C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)[N@@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000530180099 567580507 /nfs/dbraw/zinc/58/05/07/567580507.db2.gz RHNWGUHZYOOVGG-GFQSEFKGSA-N 0 1 376.280 3.307 10 0 GGAEMN C[C@@H](NC[C@@H]1CCCCN1S(C)(=O)=O)c1nc(-c2ccccc2)cs1 ZINC000552340455 567580691 /nfs/dbraw/zinc/58/06/91/567580691.db2.gz VICJRXLQVYBZLO-ZBFHGGJFSA-N 0 1 379.551 3.275 10 0 GGAEMN CN(C[C@@H](O)Cc1ccccc1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000552357319 567582263 /nfs/dbraw/zinc/58/22/63/567582263.db2.gz TZHVWGLUFKFBCZ-AWEZNQCLSA-N 0 1 388.265 3.001 10 0 GGAEMN O=S1(=O)CC[C@H](NCCc2ccccc2O)c2cc(Br)ccc21 ZINC000480156463 567583103 /nfs/dbraw/zinc/58/31/03/567583103.db2.gz BDNTVTHJPVWLBG-HNNXBMFYSA-N 0 1 396.306 3.206 10 0 GGAEMN O=S1(=O)C[C@@H](CN[C@H]2CCSc3ccc(F)cc32)Oc2ccccc21 ZINC000571761665 567586292 /nfs/dbraw/zinc/58/62/92/567586292.db2.gz NHEPFLMHIQYFQF-HIFRSBDPSA-N 0 1 379.478 3.187 10 0 GGAEMN O=S1(=O)C[C@H](CN[C@H]2CCSc3ccc(F)cc32)Oc2ccccc21 ZINC000571761667 567586998 /nfs/dbraw/zinc/58/69/98/567586998.db2.gz NHEPFLMHIQYFQF-ZFWWWQNUSA-N 0 1 379.478 3.187 10 0 GGAEMN Cn1c(CN[C@@H](c2nnc[nH]2)c2ccccc2)nc2ccc(Br)cc21 ZINC000439444220 567587209 /nfs/dbraw/zinc/58/72/09/567587209.db2.gz BAOUGHTVCZPPQA-QGZVFWFLSA-N 0 1 397.280 3.333 10 0 GGAEMN Cc1csc([C@@H](C)NC[C@@H](O)COc2cc(F)cc(Br)c2)n1 ZINC000439451106 567587693 /nfs/dbraw/zinc/58/76/93/567587693.db2.gz LIQYFQBKERBHNI-ZWNOBZJWSA-N 0 1 389.290 3.444 10 0 GGAEMN O=C(c1c[nH]c2cccc(Br)c12)N1CCC[C@@H](c2n[nH]c(=O)o2)C1 ZINC000644884307 567588070 /nfs/dbraw/zinc/58/80/70/567588070.db2.gz UGCRQASQLIALCB-SECBINFHSA-N 0 1 391.225 3.039 10 0 GGAEMN CCCc1ncc(CNC[C@H](O)COc2cc(F)cc(Br)c2)o1 ZINC000571791286 567589690 /nfs/dbraw/zinc/58/96/90/567589690.db2.gz WGFOVIFWZPTONL-ZDUSSCGKSA-N 0 1 387.249 3.058 10 0 GGAEMN CCc1nc([C@H](C)N2Cc3sc(C(=O)OC)c(Br)c3C2)n[nH]1 ZINC000595906221 567591639 /nfs/dbraw/zinc/59/16/39/567591639.db2.gz ZJVHLMCXKFVXCU-ZETCQYMHSA-N 0 1 385.287 3.055 10 0 GGAEMN NC(=O)[C@@H](N[C@@H]1CCc2ccccc2C1)c1ccc(Br)cc1F ZINC000439547627 567591809 /nfs/dbraw/zinc/59/18/09/567591809.db2.gz HRFHHNNKUHBHGX-PBHICJAKSA-N 0 1 377.257 3.262 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CC[C@@H](Cc3ccc(Br)cc3)C2)C1 ZINC000644943367 567592429 /nfs/dbraw/zinc/59/24/29/567592429.db2.gz JWNXCPWEZOPHIU-DOTOQJQBSA-N 0 1 380.330 3.117 10 0 GGAEMN Cc1nccc(NC(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c1Br ZINC000530354404 567595432 /nfs/dbraw/zinc/59/54/32/567595432.db2.gz CXCSHUWXWIKKSM-DOTOQJQBSA-N 0 1 389.297 3.141 10 0 GGAEMN O=C(CSCc1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000552536802 567595540 /nfs/dbraw/zinc/59/55/40/567595540.db2.gz VDAGJWLFDLFFJA-ZDUSSCGKSA-N 0 1 380.311 3.079 10 0 GGAEMN COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Cl)cc2Cl)cc1 ZINC000552684598 567601970 /nfs/dbraw/zinc/60/19/70/567601970.db2.gz YOFBHUYCPSJXKG-HNNXBMFYSA-N 0 1 384.259 3.310 10 0 GGAEMN CCc1nc(CNC(=O)N[C@@H]2CCCCc3cc(Br)ccc32)n[nH]1 ZINC000664972003 567604180 /nfs/dbraw/zinc/60/41/80/567604180.db2.gz ZLKKXSJTVXFMNA-CQSZACIVSA-N 0 1 392.301 3.397 10 0 GGAEMN O=C(Nc1nnc(SCc2cccs2)s1)[C@H]1CCc2[nH]cnc2C1 ZINC000621706501 567604864 /nfs/dbraw/zinc/60/48/64/567604864.db2.gz WIMISMXWMHSUOZ-VIFPVBQESA-N 0 1 377.520 3.359 10 0 GGAEMN CCN(CC)[C@H](C(=O)N[C@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552732417 567605469 /nfs/dbraw/zinc/60/54/69/567605469.db2.gz WZPORVHPQUWNDX-CJNGLKHVSA-N 0 1 391.313 3.499 10 0 GGAEMN CN(C(=O)[C@@H]1CCCc2[nH]ncc21)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O ZINC000480443114 567605812 /nfs/dbraw/zinc/60/58/12/567605812.db2.gz SGLGJDUHHJMZER-FDOKIQAASA-N 0 1 380.275 3.253 10 0 GGAEMN CCN(C)[C@H](C(=O)N[C@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552729711 567605936 /nfs/dbraw/zinc/60/59/36/567605936.db2.gz FBRRDNXNHNYXJS-DOMZBBRYSA-N 0 1 377.286 3.109 10 0 GGAEMN OC[C@H](CNCc1ncc(Br)s1)Cc1ccc(F)c(F)c1 ZINC000480467446 567607632 /nfs/dbraw/zinc/60/76/32/567607632.db2.gz HSTLCUIBBBAMLX-JTQLQIEISA-N 0 1 377.254 3.125 10 0 GGAEMN COc1cnccc1[C@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000506037841 567607929 /nfs/dbraw/zinc/60/79/29/567607929.db2.gz JHQGLMVPSGWPPJ-VIFPVBQESA-N 0 1 375.226 3.220 10 0 GGAEMN C[C@@H](CN[C@H](c1ccc(Br)cc1)C(F)F)CN1CCOCC1 ZINC000621752959 567608564 /nfs/dbraw/zinc/60/85/64/567608564.db2.gz FQSOVIXOPFPXQP-SWLSCSKDSA-N 0 1 377.273 3.313 10 0 GGAEMN COCCN1CCC[C@@H]1CN[C@H](c1ccc(Br)cc1)C(F)F ZINC000621752314 567609219 /nfs/dbraw/zinc/60/92/19/567609219.db2.gz XUXRABSCPDCKHL-HUUCEWRRSA-N 0 1 377.273 3.456 10 0 GGAEMN Cc1cc(Br)c(CNC(=O)NCc2n[nH]c(C(C)(C)C)n2)s1 ZINC000665113399 567609263 /nfs/dbraw/zinc/60/92/63/567609263.db2.gz VTUBGHHHHUSPFX-UHFFFAOYSA-N 0 1 386.319 3.234 10 0 GGAEMN OCCCN1CCC[C@H](N[C@@H](c2ccc(Br)cc2)C(F)F)C1 ZINC000621762403 567609820 /nfs/dbraw/zinc/60/98/20/567609820.db2.gz BLBMZVXTZCAKAB-GJZGRUSLSA-N 0 1 377.273 3.192 10 0 GGAEMN Brc1ccc2nc(CN3CCN(Cc4ccco4)CC3)[nH]c2c1 ZINC000480516402 567609632 /nfs/dbraw/zinc/60/96/32/567609632.db2.gz SRGWKOPOOCNLBK-UHFFFAOYSA-N 0 1 375.270 3.236 10 0 GGAEMN OCCCN1CCC[C@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621763470 567609791 /nfs/dbraw/zinc/60/97/91/567609791.db2.gz YHVLWFQNTOZLFW-GJZGRUSLSA-N 0 1 377.273 3.192 10 0 GGAEMN OCCN1CCCC[C@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621763250 567610529 /nfs/dbraw/zinc/61/05/29/567610529.db2.gz UPXBMJRKXSPKDB-GJZGRUSLSA-N 0 1 377.273 3.192 10 0 GGAEMN CO[C@@H](C)c1noc(CN(C)Cc2nc3ccc(Br)cc3[nH]2)n1 ZINC000480554642 567610966 /nfs/dbraw/zinc/61/09/66/567610966.db2.gz NVOIWMJRBRWTPO-VIFPVBQESA-N 0 1 380.246 3.048 10 0 GGAEMN O=C(c1cscc1C(F)(F)F)N1CCC(CCN2CCOCC2)CC1 ZINC000621791775 567612366 /nfs/dbraw/zinc/61/23/66/567612366.db2.gz IEJNOCATJGAWDK-UHFFFAOYSA-N 0 1 376.444 3.341 10 0 GGAEMN O=C([O-])[C@]12COC[C@H]1C[N@@H+](Cc1cc(Br)cc(C(F)(F)F)c1)C2 ZINC000665345013 567619419 /nfs/dbraw/zinc/61/94/19/567619419.db2.gz AQCBXJJTGSMFHG-BXUZGUMPSA-N 0 1 394.187 3.001 10 0 GGAEMN Cc1noc(C2CCC(NC(=O)c3cccc(Br)c3O)CC2)n1 ZINC000530759472 567621885 /nfs/dbraw/zinc/62/18/85/567621885.db2.gz SPPWQXLRAIDSHY-UHFFFAOYSA-N 0 1 380.242 3.302 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1csc(Br)c1 ZINC000440309700 567622143 /nfs/dbraw/zinc/62/21/43/567622143.db2.gz ZANQJIYUVDYHQX-UHFFFAOYSA-N 0 1 377.267 3.268 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(F)c(Br)c(Cl)c1 ZINC000506358220 567622366 /nfs/dbraw/zinc/62/23/66/567622366.db2.gz VPXOAFUTVZGWHI-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN CCn1c(NC(=O)C(C)(C)c2cnc[nH]2)nc2cc(Br)ccc21 ZINC000621939677 567623172 /nfs/dbraw/zinc/62/31/72/567623172.db2.gz MBIADQGYGHFDNL-UHFFFAOYSA-N 0 1 376.258 3.458 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)C(C)(C)c1cnc[nH]1 ZINC000621942191 567623650 /nfs/dbraw/zinc/62/36/50/567623650.db2.gz NXGKNUOCVCSVQK-ABAIWWIYSA-N 0 1 380.286 3.342 10 0 GGAEMN O=C(Nc1nc(-c2cccs2)ns1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000621947268 567624671 /nfs/dbraw/zinc/62/46/71/567624671.db2.gz QIMMARYELJLPJD-DTWKUNHWSA-N 0 1 393.412 3.189 10 0 GGAEMN CCn1nncc1C[N@@H+](Cc1cccc(Br)c1)C1CCOCC1 ZINC000459443158 567626175 /nfs/dbraw/zinc/62/61/75/567626175.db2.gz YEYKQJCQYOLCLZ-UHFFFAOYSA-N 0 1 379.302 3.242 10 0 GGAEMN CCn1nncc1CN(Cc1cccc(Br)c1)C1CCOCC1 ZINC000459443158 567626179 /nfs/dbraw/zinc/62/61/79/567626179.db2.gz YEYKQJCQYOLCLZ-UHFFFAOYSA-N 0 1 379.302 3.242 10 0 GGAEMN CCOc1cc(CN[C@@H](CC)[C@@H](O)C(F)(F)F)cc(Br)c1O ZINC000459466608 567627555 /nfs/dbraw/zinc/62/75/55/567627555.db2.gz YYLIMSZWYFKWEQ-GXFFZTMASA-N 0 1 386.208 3.345 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@H](C)NCc1cn2cccnc2n1 ZINC000459465490 567627841 /nfs/dbraw/zinc/62/78/41/567627841.db2.gz NLRKHZHFRLLRRM-LRDDRELGSA-N 0 1 375.270 3.358 10 0 GGAEMN CCOc1cc(CN[C@@H](CC)[C@H](O)C(F)(F)F)cc(Br)c1O ZINC000459466607 567627996 /nfs/dbraw/zinc/62/79/96/567627996.db2.gz YYLIMSZWYFKWEQ-GWCFXTLKSA-N 0 1 386.208 3.345 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)NCC[N@@H+]1CCCC[C@H]1C ZINC000506496523 567628631 /nfs/dbraw/zinc/62/86/31/567628631.db2.gz SDNFYJVTTGVHQZ-CYBMUJFWSA-N 0 1 397.313 3.021 10 0 GGAEMN CC(=O)c1cc(Br)ccc1OCC(=O)NCCN1CCCC[C@H]1C ZINC000506496523 567628634 /nfs/dbraw/zinc/62/86/34/567628634.db2.gz SDNFYJVTTGVHQZ-CYBMUJFWSA-N 0 1 397.313 3.021 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSC[C@@H]2CCCCC2(F)F)C1 ZINC000596397847 567629193 /nfs/dbraw/zinc/62/91/93/567629193.db2.gz YDMOQNAIFVKDHU-JKSUJKDBSA-N 0 1 378.529 3.018 10 0 GGAEMN CN(CC(=O)NCc1ccccc1)Cc1nc2ccc(Br)cc2[nH]1 ZINC000480771193 567630170 /nfs/dbraw/zinc/63/01/70/567630170.db2.gz UQNUQFDGDVAYJR-UHFFFAOYSA-N 0 1 387.281 3.074 10 0 GGAEMN CCOC(=O)c1csc(CCNCc2cccc(O)c2Br)n1 ZINC000459501062 567630566 /nfs/dbraw/zinc/63/05/66/567630566.db2.gz YUYATPZSLLDLGU-UHFFFAOYSA-N 0 1 385.283 3.120 10 0 GGAEMN Cc1cc(S(C)(=O)=O)ccc1NS(=O)(=O)c1csc2ccccc21 ZINC000506599498 567633093 /nfs/dbraw/zinc/63/30/93/567633093.db2.gz BMGSSSMBJRUWAP-UHFFFAOYSA-N 0 1 381.500 3.414 10 0 GGAEMN O=C([C@@H]1CC[C@H]([NH2+]Cc2cccc([O-])c2Br)C1)N1CCCCC1 ZINC000459524081 567634658 /nfs/dbraw/zinc/63/46/58/567634658.db2.gz GLVHCMNAEGQCAE-HIFRSBDPSA-N 0 1 381.314 3.426 10 0 GGAEMN CCOc1cc(CN2CCCC[C@H]2CCC(=O)NC)cc(Br)c1O ZINC000459549144 567635702 /nfs/dbraw/zinc/63/57/02/567635702.db2.gz MRCLOUHFLCZMJR-AWEZNQCLSA-N 0 1 399.329 3.434 10 0 GGAEMN C[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCN1CC(F)(F)F ZINC000480853120 567636158 /nfs/dbraw/zinc/63/61/58/567636158.db2.gz KRGFEPRIBFYCCR-JTQLQIEISA-N 0 1 391.235 3.394 10 0 GGAEMN C[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCN1CC(F)(F)F ZINC000480853123 567636589 /nfs/dbraw/zinc/63/65/89/567636589.db2.gz KRGFEPRIBFYCCR-SNVBAGLBSA-N 0 1 391.235 3.394 10 0 GGAEMN C[C@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@H](c1ccccc1)N(C)C ZINC000480895412 567640487 /nfs/dbraw/zinc/64/04/87/567640487.db2.gz IFRNFEVSYWUIOH-SCLBCKFNSA-N 0 1 375.519 3.266 10 0 GGAEMN CO[C@@H](CS(=O)(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)C(C)C ZINC000645596054 567645951 /nfs/dbraw/zinc/64/59/51/567645951.db2.gz DWGJTIONQYTBBX-HOTGVXAUSA-N 0 1 385.917 3.354 10 0 GGAEMN OC[C@@]1(O)CCCN(Cc2c(-c3ccc(Cl)cc3)nc3sccn23)C1 ZINC000459657874 567646805 /nfs/dbraw/zinc/64/68/05/567646805.db2.gz XOLTWTOIMVRXIB-GOSISDBHSA-N 0 1 377.897 3.035 10 0 GGAEMN COC(=O)CCC1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)CC1 ZINC000531236754 567647768 /nfs/dbraw/zinc/64/77/68/567647768.db2.gz YXMGUPZPGUXTBM-UHFFFAOYSA-N 0 1 394.269 3.131 10 0 GGAEMN CC(C)N1C(=O)CN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)CC1(C)C ZINC000622398712 567647866 /nfs/dbraw/zinc/64/78/66/567647866.db2.gz JCOVMJNONCWQGZ-UHFFFAOYSA-N 0 1 380.901 3.263 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000572570685 567649150 /nfs/dbraw/zinc/64/91/50/567649150.db2.gz XZSDQAFKJRKYHY-KGLIPLIRSA-N 0 1 391.313 3.350 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000572570686 567649247 /nfs/dbraw/zinc/64/92/47/567649247.db2.gz XZSDQAFKJRKYHY-UONOGXRCSA-N 0 1 391.313 3.350 10 0 GGAEMN C[C@H](C1CC1)N(C)S(=O)(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000531244990 567649632 /nfs/dbraw/zinc/64/96/32/567649632.db2.gz IOLAGVPRNPSZMQ-BDJLRTHQSA-N 0 1 382.917 3.328 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)Cc3ccc(Br)cc3)[nH]c2c1 ZINC000481008247 567650609 /nfs/dbraw/zinc/65/06/09/567650609.db2.gz FICOBCMRBUGMIB-UHFFFAOYSA-N 0 1 394.294 3.253 10 0 GGAEMN O=C([O-])[C@@H]1C[N@H+](C[C@@H](O)C2CCCCC2)C[C@H]1c1ccc(Br)cc1 ZINC000572609499 567653385 /nfs/dbraw/zinc/65/33/85/567653385.db2.gz RRVXMDKGRPHVJH-RCCFBDPRSA-N 0 1 396.325 3.490 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NS(=O)(=O)c2cccc(Cl)c2F)[C@@H]1O ZINC000572616590 567653443 /nfs/dbraw/zinc/65/34/43/567653443.db2.gz NJDZOJBWWCWQQN-OCCSQVGLSA-N 0 1 391.873 3.092 10 0 GGAEMN C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H]1COc2c1cccc2Cl ZINC000666107960 567654362 /nfs/dbraw/zinc/65/43/62/567654362.db2.gz MOUQWYVIFKUQED-IINYFYTJSA-N 0 1 383.673 3.376 10 0 GGAEMN Cc1ccn([C@@H](C)CC(=O)Nc2nc(-c3ccccc3Br)n[nH]2)n1 ZINC000622773922 567656415 /nfs/dbraw/zinc/65/64/15/567656415.db2.gz OLERVQLHRWCWSS-NSHDSACASA-N 0 1 389.257 3.329 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NC[C@@H](C)N1CCc2ccccc2C1 ZINC000666168061 567657678 /nfs/dbraw/zinc/65/76/78/567657678.db2.gz MDLICVQVSIRSHC-CYBMUJFWSA-N 0 1 388.309 3.329 10 0 GGAEMN Cc1ccc2nc(NC(=O)c3ccc(I)c(O)c3)[nH]c2c1 ZINC000553474889 567658074 /nfs/dbraw/zinc/65/80/74/567658074.db2.gz XQALNASLFCGRRL-UHFFFAOYSA-N 0 1 393.184 3.434 10 0 GGAEMN CCN(CCNC(=O)Cc1cscc1Br)CCC(F)(F)F ZINC000507087508 567658380 /nfs/dbraw/zinc/65/83/80/567658380.db2.gz PFKQTWAAIDVQRU-UHFFFAOYSA-N 0 1 387.265 3.444 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CN1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441284446 567659714 /nfs/dbraw/zinc/65/97/14/567659714.db2.gz XJLYRTTVMGYRCO-HUUCEWRRSA-N 0 1 381.314 3.445 10 0 GGAEMN COc1cc(Br)c(C[NH2+][C@H](CC(=O)[O-])c2ccncc2)cc1OC ZINC000572736216 567661431 /nfs/dbraw/zinc/66/14/31/567661431.db2.gz MIUHHUGLTQJOPN-CQSZACIVSA-N 0 1 395.253 3.167 10 0 GGAEMN CC(C)[C@H]1CCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000531526749 567662837 /nfs/dbraw/zinc/66/28/37/567662837.db2.gz PFJMDFUFVBEYPL-ZDUSSCGKSA-N 0 1 392.301 3.422 10 0 GGAEMN CC(C)[C@H]1CCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000531526749 567662841 /nfs/dbraw/zinc/66/28/41/567662841.db2.gz PFJMDFUFVBEYPL-ZDUSSCGKSA-N 0 1 392.301 3.422 10 0 GGAEMN O=S(=O)(NCC[C@H]1COc2ccccc2O1)c1c(Cl)ccc(F)c1F ZINC000553534728 567662789 /nfs/dbraw/zinc/66/27/89/567662789.db2.gz OXFGAALGXWYHOT-JTQLQIEISA-N 0 1 389.807 3.127 10 0 GGAEMN O=S(=O)(NCc1ccnc(OC(F)F)c1)c1c(Cl)ccc(F)c1F ZINC000553557349 567666166 /nfs/dbraw/zinc/66/61/66/567666166.db2.gz IMMPYAFFPACYRY-UHFFFAOYSA-N 0 1 384.738 3.093 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000441516548 567667097 /nfs/dbraw/zinc/66/70/97/567667097.db2.gz ULQWKQRVUKYSMV-CQSZACIVSA-N 0 1 378.270 3.334 10 0 GGAEMN Cc1cc(CCNC(=O)[C@@](C)(N)c2ccc(Br)cc2)cc(C)c1O ZINC000572840146 567670250 /nfs/dbraw/zinc/67/02/50/567670250.db2.gz SLDJOMCONDODOU-IBGZPJMESA-N 0 1 391.309 3.304 10 0 GGAEMN O=C1[C@@H](NCc2ccc(Br)c(F)c2)CCN1Cc1ccccc1 ZINC000531658601 567670991 /nfs/dbraw/zinc/67/09/91/567670991.db2.gz YVKATXSOWJDMQE-KRWDZBQOSA-N 0 1 377.257 3.479 10 0 GGAEMN C[C@@H]1CCN(CC(=O)Nc2c(-c3ccc(Br)cc3)ncn2C)C1 ZINC000572854375 567671596 /nfs/dbraw/zinc/67/15/96/567671596.db2.gz ACKQRTLENGRFMG-GFCCVEGCSA-N 0 1 377.286 3.130 10 0 GGAEMN CC(C)Sc1ccccc1NS(=O)(=O)c1ccc2c(c1)S(=O)(=O)CC2 ZINC000531653299 567671822 /nfs/dbraw/zinc/67/18/22/567671822.db2.gz IYNABMGOCIHZGN-UHFFFAOYSA-N 0 1 397.543 3.318 10 0 GGAEMN CC1CCN(CCNC(=O)c2c(F)c(F)c(Br)c(F)c2F)CC1 ZINC000666413225 567676447 /nfs/dbraw/zinc/67/64/47/567676447.db2.gz DRSIDGJVCIACEA-UHFFFAOYSA-N 0 1 397.210 3.467 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)n[nH]1 ZINC000572966043 567678290 /nfs/dbraw/zinc/67/82/90/567678290.db2.gz HLIVPNMOYFCVJD-LURJTMIESA-N 0 1 390.658 3.143 10 0 GGAEMN CCS(=O)(=O)c1ccc(CNCc2ccc(C(=O)OC)c(Cl)c2)cc1 ZINC000597072922 567680027 /nfs/dbraw/zinc/68/00/27/567680027.db2.gz BNGLJZKWHIOOPC-UHFFFAOYSA-N 0 1 381.881 3.210 10 0 GGAEMN CC(C)c1n[nH]c(C(N)=O)c1NC(=O)[C@@H]1CCc2cc(Br)ccc21 ZINC000573003627 567681334 /nfs/dbraw/zinc/68/13/34/567681334.db2.gz URQYWNDVAVHWND-GFCCVEGCSA-N 0 1 391.269 3.063 10 0 GGAEMN COC(=O)[C@](C)(CNCc1c(F)cncc1Br)c1ccccc1 ZINC000597110072 567682142 /nfs/dbraw/zinc/68/21/42/567682142.db2.gz JIFPJMAPKIHPSY-QGZVFWFLSA-N 0 1 381.245 3.204 10 0 GGAEMN Cc1nc([C@@H](C)NC(=O)NCC2(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000666546124 567684587 /nfs/dbraw/zinc/68/45/87/567684587.db2.gz JQGAFUBIOMQVDL-LLVKDONJSA-N 0 1 392.301 3.259 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@H](NCc1nn(C)cc1Br)CC3 ZINC000573059088 567685078 /nfs/dbraw/zinc/68/50/78/567685078.db2.gz QJCHTYZONDBCKA-LLVKDONJSA-N 0 1 389.297 3.320 10 0 GGAEMN CC[C@@H](NCc1ccc(C(=O)OC)c(Cl)c1)C(=O)NCc1cccs1 ZINC000597157878 567685430 /nfs/dbraw/zinc/68/54/30/567685430.db2.gz STEJKWANTOOGBW-MRXNPFEDSA-N 0 1 380.897 3.373 10 0 GGAEMN Cc1nc2cc(Br)cc(NC(=O)N[C@H]3CCc4nc[nH]c4C3)c2o1 ZINC000573063193 567685555 /nfs/dbraw/zinc/68/55/55/567685555.db2.gz ZRRLGLHUXQVUJC-JTQLQIEISA-N 0 1 390.241 3.301 10 0 GGAEMN COC(=O)[C@@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000531900334 567685936 /nfs/dbraw/zinc/68/59/36/567685936.db2.gz QGVRGLYEYXNYAY-CZUORRHYSA-N 0 1 385.291 3.152 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCC(=O)N2CCC[C@@H]2C)CC1 ZINC000645974322 567685930 /nfs/dbraw/zinc/68/59/30/567685930.db2.gz PJIAIZIACCNKHF-ZDUSSCGKSA-N 0 1 381.314 3.437 10 0 GGAEMN COc1ccc(Br)cc1C1(NCCC(=O)N2CCCCC2)CC1 ZINC000645973924 567686658 /nfs/dbraw/zinc/68/66/58/567686658.db2.gz ZJZROQDJVBKTOT-UHFFFAOYSA-N 0 1 381.314 3.439 10 0 GGAEMN COc1ccc(Br)cc1C1(NC[C@@H](O)COc2ccccc2)CC1 ZINC000645974865 567686815 /nfs/dbraw/zinc/68/68/15/567686815.db2.gz GFEBTFDDFRICBA-OAHLLOKOSA-N 0 1 392.293 3.476 10 0 GGAEMN COc1ccc(Br)cc1C1(NC[C@H](O)COCc2ccco2)CC1 ZINC000645974594 567687073 /nfs/dbraw/zinc/68/70/73/567687073.db2.gz MTFINZJEXXTOKP-AWEZNQCLSA-N 0 1 396.281 3.207 10 0 GGAEMN COC(=O)[C@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000531900335 567687087 /nfs/dbraw/zinc/68/70/87/567687087.db2.gz QGVRGLYEYXNYAY-XJKSGUPXSA-N 0 1 385.291 3.152 10 0 GGAEMN Fc1cncc(N2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)c1 ZINC000573132927 567691254 /nfs/dbraw/zinc/69/12/54/567691254.db2.gz KIJIHUZAVDCIIV-UHFFFAOYSA-N 0 1 390.260 3.182 10 0 GGAEMN CC(C)NC(=O)[C@@H]1CCCN(Cc2cccc(I)c2)C1 ZINC000597231557 567691599 /nfs/dbraw/zinc/69/15/99/567691599.db2.gz LTOIGWABGJDAEB-CQSZACIVSA-N 0 1 386.277 3.028 10 0 GGAEMN O=C(Nc1ccccc1)C1(NS(=O)(=O)c2c(Cl)ccc(F)c2F)CC1 ZINC000553858089 567692290 /nfs/dbraw/zinc/69/22/90/567692290.db2.gz JSTREPFBKVSTBD-UHFFFAOYSA-N 0 1 386.807 3.068 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(CCCc2ccccc2Br)C1 ZINC000646112134 567695328 /nfs/dbraw/zinc/69/53/28/567695328.db2.gz IINNWUTZNNPTNM-OAHLLOKOSA-N 0 1 393.247 3.382 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCc3ccc(F)c(Br)c3C2)[nH]1 ZINC000623285161 567696653 /nfs/dbraw/zinc/69/66/53/567696653.db2.gz XYQOYCQHRUNMRW-UHFFFAOYSA-N 0 1 399.289 3.082 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cnc3c(Br)cccn23)c(C)c1 ZINC000460648000 567697436 /nfs/dbraw/zinc/69/74/36/567697436.db2.gz JLJOVPCULPGUFL-UHFFFAOYSA-N 0 1 396.266 3.215 10 0 GGAEMN O=C(N[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Br)c1O ZINC000532078874 567697527 /nfs/dbraw/zinc/69/75/27/567697527.db2.gz VTJODRADDJSTGS-JTQLQIEISA-N 0 1 396.672 3.212 10 0 GGAEMN Brc1cncnc1N1CCCN(CCCc2ccccc2)CC1 ZINC000481703141 567697670 /nfs/dbraw/zinc/69/76/70/567697670.db2.gz JZMJVJHDJYMQMP-UHFFFAOYSA-N 0 1 375.314 3.384 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@H](c1cccs1)N(C)C ZINC000460820348 567703441 /nfs/dbraw/zinc/70/34/41/567703441.db2.gz XXXNKKKLOIYJCB-CQSZACIVSA-N 0 1 397.338 3.481 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1ccnn1Cc1cccc(Cl)c1Cl ZINC000666800413 567704147 /nfs/dbraw/zinc/70/41/47/567704147.db2.gz AOBGIYKFUMWJHD-UHFFFAOYSA-N 0 1 382.295 3.264 10 0 GGAEMN COc1ccc(Br)c2[nH]c(C(=O)N[C@H](C)Cc3cc(C)[nH]n3)cc21 ZINC000532272064 567705693 /nfs/dbraw/zinc/70/56/93/567705693.db2.gz OWFVICUXANEDGH-SECBINFHSA-N 0 1 391.269 3.332 10 0 GGAEMN Cc1cc(Br)c(CNCCC(=O)N(C)C)cc1Br ZINC000623387560 567706314 /nfs/dbraw/zinc/70/63/14/567706314.db2.gz ITGLIIOEGHKCRR-UHFFFAOYSA-N 0 1 378.108 3.088 10 0 GGAEMN CC[C@H]1C[C@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000507807197 567706584 /nfs/dbraw/zinc/70/65/84/567706584.db2.gz UBZUNJZROFNDTD-QAPCUYQASA-N 0 1 395.341 3.412 10 0 GGAEMN CC[C@H]1C[C@@H](CN2CCN(C(=O)c3ccc(Br)cc3)CC2)CCO1 ZINC000507807198 567706905 /nfs/dbraw/zinc/70/69/05/567706905.db2.gz UBZUNJZROFNDTD-YJBOKZPZSA-N 0 1 395.341 3.412 10 0 GGAEMN CN(C)c1nc(CSc2nc(-c3ccc(Br)cc3)n[nH]2)ns1 ZINC000532281187 567706928 /nfs/dbraw/zinc/70/69/28/567706928.db2.gz GAIAVFGXUIZEKT-UHFFFAOYSA-N 0 1 397.327 3.444 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)NCc2csc(C(F)(F)F)c2)C[C@H](C)O1 ZINC000623403863 567707110 /nfs/dbraw/zinc/70/71/10/567707110.db2.gz JVQQSQVVCNDWAQ-TXEJJXNPSA-N 0 1 379.448 3.065 10 0 GGAEMN Cn1cc([C@@H](NC(=O)c2c(O)cc(Cl)cc2Cl)C2(CO)CCC2)cn1 ZINC000646332480 567707146 /nfs/dbraw/zinc/70/71/46/567707146.db2.gz KWOUERVWRZRYCC-OAHLLOKOSA-N 0 1 384.263 3.066 10 0 GGAEMN CC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)c1 ZINC000442840353 567710829 /nfs/dbraw/zinc/71/08/29/567710829.db2.gz LBILUQSXOSYODJ-UHFFFAOYSA-N 0 1 375.324 3.294 10 0 GGAEMN CC1(C)CN(C(=O)c2[nH]nc3ccc(I)cc32)[C@@H]1C1CC1 ZINC000460980966 567714444 /nfs/dbraw/zinc/71/44/44/567714444.db2.gz VDOZHABYZGGUOH-CQSZACIVSA-N 0 1 395.244 3.428 10 0 GGAEMN COC[C@H](CNCc1cc(Br)c(C)cc1Br)OC ZINC000623488277 567714550 /nfs/dbraw/zinc/71/45/50/567714550.db2.gz NQACYSYPJAAOJT-NSHDSACASA-N 0 1 381.108 3.271 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2ccc(F)cc2Cl)C1 ZINC000507895916 567715118 /nfs/dbraw/zinc/71/51/18/567715118.db2.gz PWYMHQTVPHNKOU-INIZCTEOSA-N 0 1 388.936 3.185 10 0 GGAEMN CCC(CC)c1nnc(NC(=O)C(C[C@H]2COCCO2)C(F)(F)F)s1 ZINC000666969445 567715560 /nfs/dbraw/zinc/71/55/60/567715560.db2.gz RIRYPBCZHLSFPY-QWRGUYRKSA-N 0 1 381.420 3.364 10 0 GGAEMN Cc1ccn2cc(CNC[C@@H](O)COc3c(Cl)cccc3Cl)nc2c1 ZINC000573478349 567716403 /nfs/dbraw/zinc/71/64/03/567716403.db2.gz PKJSNIRJOFQXGR-CQSZACIVSA-N 0 1 380.275 3.479 10 0 GGAEMN Cc1ccn2cc(CNC[C@H](O)COc3c(Cl)cccc3Cl)nc2c1 ZINC000573478347 567716857 /nfs/dbraw/zinc/71/68/57/567716857.db2.gz PKJSNIRJOFQXGR-AWEZNQCLSA-N 0 1 380.275 3.479 10 0 GGAEMN Cc1cc(CN[C@@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)ncc1Br ZINC000623513634 567717614 /nfs/dbraw/zinc/71/76/14/567717614.db2.gz GLIARSRPWKLXEP-RDTXWAMCSA-N 0 1 388.309 3.432 10 0 GGAEMN NS(=O)(=O)C1CCN(Cc2cccc(SCc3ccccc3)c2)CC1 ZINC000554240992 567717831 /nfs/dbraw/zinc/71/78/31/567717831.db2.gz CHLCCOQHZSJMRF-UHFFFAOYSA-N 0 1 376.547 3.232 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1C[C@@H]2CCCC[C@@H]21 ZINC000597828749 567717882 /nfs/dbraw/zinc/71/78/82/567717882.db2.gz JBYGLPUWILSHJX-ZANVPECISA-N 0 1 381.217 3.182 10 0 GGAEMN CCCN1CCN(c2nnc(COc3ccc(Cl)cc3Cl)n2C)CC1 ZINC000507958380 567718815 /nfs/dbraw/zinc/71/88/15/567718815.db2.gz ZVWNTXUMQJHOMH-UHFFFAOYSA-N 0 1 384.311 3.233 10 0 GGAEMN C[C@H](CCc1ccc(Br)cc1)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000667033589 567719702 /nfs/dbraw/zinc/71/97/02/567719702.db2.gz UGSWFECFOOMVLV-OCCSQVGLSA-N 0 1 376.298 3.415 10 0 GGAEMN CC(C)CN1CCN(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC1 ZINC000623543835 567720729 /nfs/dbraw/zinc/72/07/29/567720729.db2.gz ALCHXZNVMLYNEL-BPQIPLTHSA-N 0 1 377.326 3.135 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C ZINC000573529123 567720761 /nfs/dbraw/zinc/72/07/61/567720761.db2.gz OBWWMDYPDVPOJD-OAHLLOKOSA-N 0 1 381.567 3.441 10 0 GGAEMN Cn1c(-c2ccc(Br)cc2Cl)nnc1N1CCN(C2CC2)CC1 ZINC000507985124 567721602 /nfs/dbraw/zinc/72/16/02/567721602.db2.gz YLFOYQGPQJCFKT-UHFFFAOYSA-N 0 1 396.720 3.182 10 0 GGAEMN Cc1cc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)ncc1Br ZINC000623564093 567722352 /nfs/dbraw/zinc/72/23/52/567722352.db2.gz RRUBKDJGHHWCNY-GOSISDBHSA-N 0 1 390.325 3.009 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2[nH]c3c(cccc3Br)c2C1 ZINC000667102062 567724327 /nfs/dbraw/zinc/72/43/27/567724327.db2.gz QHHHTLDBFHSPFH-LLVKDONJSA-N 0 1 399.292 3.343 10 0 GGAEMN COc1ccc(CNC[C@@H]2Cc3ccccc3CO2)c(Br)c1O ZINC000623602259 567725301 /nfs/dbraw/zinc/72/53/01/567725301.db2.gz IRZQHRBPBAYILI-HNNXBMFYSA-N 0 1 378.266 3.394 10 0 GGAEMN COc1cccc(N2C[C@H](NCc3ccc(Br)s3)CC2=O)c1 ZINC000508073274 567725260 /nfs/dbraw/zinc/72/52/60/567725260.db2.gz VVQJGKQPKQWDDM-LLVKDONJSA-N 0 1 381.295 3.414 10 0 GGAEMN COc1ccc(CN2CC[C@H]2CNCc2c(F)cncc2Br)cc1 ZINC000623640942 567726849 /nfs/dbraw/zinc/72/68/49/567726849.db2.gz BFIASUSTSLQRBE-AWEZNQCLSA-N 0 1 394.288 3.356 10 0 GGAEMN Cc1cc(Br)c(F)c(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c1 ZINC000623638215 567726858 /nfs/dbraw/zinc/72/68/58/567726858.db2.gz YVWYICKHAJITLT-CHWSQXEVSA-N 0 1 387.293 3.126 10 0 GGAEMN CO[C@H](C)[C@@H](C)NC(=O)c1sccc1S(=O)(=O)Nc1ccc(C)cc1 ZINC000461273931 567727385 /nfs/dbraw/zinc/72/73/85/567727385.db2.gz JMXHWPMUAOAAHT-CHWSQXEVSA-N 0 1 382.507 3.011 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)C2=Cc3cc(Br)ccc3OC2)n[nH]1 ZINC000532671033 567727635 /nfs/dbraw/zinc/72/76/35/567727635.db2.gz FELMNRSSEQKZAH-JTQLQIEISA-N 0 1 376.254 3.004 10 0 GGAEMN COCc1nc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)cs1 ZINC000623644800 567727935 /nfs/dbraw/zinc/72/79/35/567727935.db2.gz AUXIETIQEGYXDS-QGZVFWFLSA-N 0 1 397.338 3.062 10 0 GGAEMN CC(C)n1ccnc1CN[C@@]1(CO)CCc2cc(Br)ccc2C1 ZINC000623644880 567728073 /nfs/dbraw/zinc/72/80/73/567728073.db2.gz DFOWRGJWVXOQAO-SFHVURJKSA-N 0 1 378.314 3.236 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1Br ZINC000508094388 567729278 /nfs/dbraw/zinc/72/92/78/567729278.db2.gz HTPGSBSTXOPYDV-SECBINFHSA-N 0 1 399.086 3.222 10 0 GGAEMN COCCc1ccnc(NS(=O)(=O)c2c(C)cc(Br)cc2C)c1 ZINC000508095296 567729330 /nfs/dbraw/zinc/72/93/30/567729330.db2.gz KQRPXHNZCCJZHF-UHFFFAOYSA-N 0 1 399.310 3.451 10 0 GGAEMN COc1ncc(Br)cc1CNC1CC[NH+](Cc2ccccn2)CC1 ZINC000623664860 567729504 /nfs/dbraw/zinc/72/95/04/567729504.db2.gz QSWFRRRXLZTTOF-UHFFFAOYSA-N 0 1 391.313 3.002 10 0 GGAEMN COc1ncc(Br)cc1CN[C@H](C)CC(=O)Nc1ccccc1 ZINC000623663959 567729943 /nfs/dbraw/zinc/72/99/43/567729943.db2.gz JORRFNYFEFCBPK-GFCCVEGCSA-N 0 1 378.270 3.360 10 0 GGAEMN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)N[C@H]1CCCN(C)C1 ZINC000623717370 567733596 /nfs/dbraw/zinc/73/35/96/567733596.db2.gz XNUILWSMZTZFLE-GOEBONIOSA-N 0 1 396.329 3.398 10 0 GGAEMN COc1cc(Br)ccc1[C@H]1CCCN1C(=O)N[C@@H]1CCCN(C)C1 ZINC000623717369 567733771 /nfs/dbraw/zinc/73/37/71/567733771.db2.gz XNUILWSMZTZFLE-GDBMZVCRSA-N 0 1 396.329 3.398 10 0 GGAEMN NC(=O)[C@@H](NC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(Br)c1 ZINC000573769809 567734950 /nfs/dbraw/zinc/73/49/50/567734950.db2.gz FRGILTZMRKULDX-SQNIBIBYSA-N 0 1 389.293 3.485 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2ccc(Cl)c(F)c2)C1 ZINC000443154654 567736460 /nfs/dbraw/zinc/73/64/60/567736460.db2.gz GYZMNHWBYPKJTR-HNNXBMFYSA-N 0 1 388.936 3.185 10 0 GGAEMN CN1C(=O)CCc2cc(NC(=O)c3cc(Br)cc4nc[nH]c43)ccc21 ZINC000554567388 567737390 /nfs/dbraw/zinc/73/73/90/567737390.db2.gz SLHXSOPQRILPAC-UHFFFAOYSA-N 0 1 399.248 3.487 10 0 GGAEMN Cc1noc([C@@H]2OCC[C@@H]2NCc2cc(Br)c(Cl)s2)n1 ZINC000623816879 567739268 /nfs/dbraw/zinc/73/92/68/567739268.db2.gz SIJPWFBWBXPGGH-VHSXEESVSA-N 0 1 378.679 3.475 10 0 GGAEMN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@@H]1CCNC1=O ZINC000532879636 567741379 /nfs/dbraw/zinc/74/13/79/567741379.db2.gz NDPTZZOAVGSDOK-NOZJJQNGSA-N 0 1 380.311 3.420 10 0 GGAEMN O=C1[C@@H](NCc2ccc(OC(F)F)c(Br)c2)CCN1C1CCC1 ZINC000623840923 567741921 /nfs/dbraw/zinc/74/19/21/567741921.db2.gz JBFMKDFUFKZIMO-ZDUSSCGKSA-N 0 1 389.240 3.294 10 0 GGAEMN C[C@H](CC(=O)Nc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCCO1 ZINC000667425823 567746774 /nfs/dbraw/zinc/74/67/74/567746774.db2.gz OJGQOJAUMNVGOF-MFKMUULPSA-N 0 1 379.258 3.378 10 0 GGAEMN CCN1CCN(CC(=O)Nc2ccc(Sc3nc(C)cs3)cc2)CC1 ZINC000461888903 567751950 /nfs/dbraw/zinc/75/19/50/567751950.db2.gz VSFHVALHGPPTCY-UHFFFAOYSA-N 0 1 376.551 3.179 10 0 GGAEMN Cc1cc(NC(=O)NCc2cn[nH]c2C)nn1-c1ccc(Cl)c(Cl)c1 ZINC000461928572 567755310 /nfs/dbraw/zinc/75/53/10/567755310.db2.gz SYGZHEOODSEQDE-UHFFFAOYSA-N 0 1 379.251 3.263 10 0 GGAEMN O=C(CSc1nc(-c2cc(Cl)cc(Cl)c2)n[nH]1)Nc1ccncc1 ZINC000443427687 567756403 /nfs/dbraw/zinc/75/64/03/567756403.db2.gz MYXUIJXESJXOKP-UHFFFAOYSA-N 0 1 380.260 3.326 10 0 GGAEMN CCCN1CCN(c2nnc(-c3ccc(Br)cc3Cl)n2C)CC1 ZINC000508579610 567756406 /nfs/dbraw/zinc/75/64/06/567756406.db2.gz FIKFQYHQGCEGKM-UHFFFAOYSA-N 0 1 398.736 3.430 10 0 GGAEMN CCN1CCN(CC(=O)N[C@H](c2ccsc2)c2ccc(Cl)cc2)CC1 ZINC000461969666 567758001 /nfs/dbraw/zinc/75/80/01/567758001.db2.gz XFBDQJVOYBNODX-IBGZPJMESA-N 0 1 377.941 3.245 10 0 GGAEMN O=C(NCC/C=C\c1ccc(Br)cc1)N[C@H]1CCc2nc[nH]c2C1 ZINC000624087432 567759288 /nfs/dbraw/zinc/75/92/88/567759288.db2.gz WZZOBJCUYLMXPK-BGGTVIOKSA-N 0 1 389.297 3.432 10 0 GGAEMN O=S(=O)(Nc1cccc2ccsc21)c1ccc2c(c1)S(=O)(=O)CC2 ZINC000443469213 567759786 /nfs/dbraw/zinc/75/97/86/567759786.db2.gz YJHYYNXAQSVWHS-UHFFFAOYSA-N 0 1 379.484 3.032 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(C)[C@@H](C)Cc1ccccc1C(F)(F)F ZINC000554969209 567759785 /nfs/dbraw/zinc/75/97/85/567759785.db2.gz GUJRCRMONPRUPY-AWEZNQCLSA-N 0 1 380.476 3.240 10 0 GGAEMN C[C@H](N[C@@H]1CCN(c2ccc3nncn3n2)C1)c1cc(Cl)sc1Cl ZINC000624113752 567760611 /nfs/dbraw/zinc/76/06/11/567760611.db2.gz MMNUYVQVTPAVCR-VHSXEESVSA-N 0 1 383.308 3.422 10 0 GGAEMN COc1ncc(Br)cc1CN[C@@H](C)CC(=O)Nc1cccc(F)c1 ZINC000624133757 567762061 /nfs/dbraw/zinc/76/20/61/567762061.db2.gz WBJSETKQPYOXLN-NSHDSACASA-N 0 1 396.260 3.499 10 0 GGAEMN COc1ncc(Br)cc1CN[C@H](C)CC(=O)Nc1ccc(F)cc1 ZINC000624132842 567762458 /nfs/dbraw/zinc/76/24/58/567762458.db2.gz AXOMGLIACRCBAS-LLVKDONJSA-N 0 1 396.260 3.499 10 0 GGAEMN CSC[C@@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598425706 567766367 /nfs/dbraw/zinc/76/63/67/567766367.db2.gz XONHCVGVUKGQMD-SSDOTTSWSA-N 0 1 375.235 3.105 10 0 GGAEMN CO[C@H](CN1CCN(c2ccc(Br)cn2)CC1)c1ccccc1 ZINC000555012942 567763095 /nfs/dbraw/zinc/76/30/95/567763095.db2.gz UXLGAAMSDVREJE-QGZVFWFLSA-N 0 1 376.298 3.354 10 0 GGAEMN COc1cc(Br)ccc1CNCc1ccccc1Cn1cncn1 ZINC000508731905 567763654 /nfs/dbraw/zinc/76/36/54/567763654.db2.gz ZEYZMRFTCCNSKT-UHFFFAOYSA-N 0 1 387.281 3.387 10 0 GGAEMN C[C@H]1CC(=O)CC[C@@H]1C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598423100 567764864 /nfs/dbraw/zinc/76/48/64/567764864.db2.gz KAFOWJKVEBNJNT-KWQFWETISA-N 0 1 397.216 3.111 10 0 GGAEMN C[C@@H]1C[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)CCC1=O ZINC000598422988 567764902 /nfs/dbraw/zinc/76/49/02/567764902.db2.gz INGLUPQSJVDPQU-BDAKNGLRSA-N 0 1 397.216 3.111 10 0 GGAEMN CC[C@@H]1CC[C@@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598424840 567765086 /nfs/dbraw/zinc/76/50/86/567765086.db2.gz RAVURUFHVGRQQC-SKDRFNHKSA-N 0 1 385.205 3.064 10 0 GGAEMN O=C(CC[C@@H]1CCCCO1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598424867 567765195 /nfs/dbraw/zinc/76/51/95/567765195.db2.gz RKVFGFVOAVUPNZ-NSHDSACASA-N 0 1 399.232 3.455 10 0 GGAEMN CC(C)(C)c1ccc(NS(=O)(=O)c2cc(Cl)cc(C(N)=O)c2)c(O)c1 ZINC000443525820 567765059 /nfs/dbraw/zinc/76/50/59/567765059.db2.gz AVJIUGHKILJTIM-UHFFFAOYSA-N 0 1 382.869 3.243 10 0 GGAEMN COCCC(C)(C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598427083 567766095 /nfs/dbraw/zinc/76/60/95/567766095.db2.gz GEPHWUNVSLWPLS-UHFFFAOYSA-N 0 1 387.221 3.169 10 0 GGAEMN CSC[C@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598425709 567766396 /nfs/dbraw/zinc/76/63/96/567766396.db2.gz XONHCVGVUKGQMD-ZETCQYMHSA-N 0 1 375.235 3.105 10 0 GGAEMN C[C@H]1C(=O)CC[C@H]1CC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428247 567767285 /nfs/dbraw/zinc/76/72/85/567767285.db2.gz NSXOROZZPQFLOU-BDAKNGLRSA-N 0 1 397.216 3.111 10 0 GGAEMN COC1CCC(C(=O)Nc2nc3ccc(I)cc3[nH]2)CC1 ZINC000598429622 567767394 /nfs/dbraw/zinc/76/73/94/567767394.db2.gz ZYZSGUQOSPSXCD-UHFFFAOYSA-N 0 1 399.232 3.311 10 0 GGAEMN COCC(C)(C)CC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598429173 567767407 /nfs/dbraw/zinc/76/74/07/567767407.db2.gz VPICVVGNPKWGSG-UHFFFAOYSA-N 0 1 387.221 3.169 10 0 GGAEMN CC1(C)CC[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)O1 ZINC000598428827 567767751 /nfs/dbraw/zinc/76/77/51/567767751.db2.gz STUPZQUKGWIVMU-LLVKDONJSA-N 0 1 385.205 3.064 10 0 GGAEMN C[C@H]1C(=O)CC[C@@H]1CC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428250 567767868 /nfs/dbraw/zinc/76/78/68/567767868.db2.gz NSXOROZZPQFLOU-RKDXNWHRSA-N 0 1 397.216 3.111 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285273 567769113 /nfs/dbraw/zinc/76/91/13/567769113.db2.gz KDYFQVHOYMBTQF-VXGBXAGGSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285273 567769118 /nfs/dbraw/zinc/76/91/18/567769118.db2.gz KDYFQVHOYMBTQF-VXGBXAGGSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285272 567769271 /nfs/dbraw/zinc/76/92/71/567769271.db2.gz KDYFQVHOYMBTQF-RYUDHWBXSA-N 0 1 394.212 3.115 10 0 GGAEMN CO[C@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cc(Br)ccc2OC(F)F)C1 ZINC000574285272 567769274 /nfs/dbraw/zinc/76/92/74/567769274.db2.gz KDYFQVHOYMBTQF-RYUDHWBXSA-N 0 1 394.212 3.115 10 0 GGAEMN C[C@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1ccccc1Br ZINC000624266362 567770806 /nfs/dbraw/zinc/77/08/06/567770806.db2.gz MGIZRGDOSDROIZ-DOTOQJQBSA-N 0 1 390.325 3.396 10 0 GGAEMN O=S(=O)(c1ccc(C(F)(F)F)s1)N1CCCC[C@@H](N2CCCC2)C1 ZINC000462100536 567771433 /nfs/dbraw/zinc/77/14/33/567771433.db2.gz HOAMLTFLXAZMFJ-GFCCVEGCSA-N 0 1 382.473 3.406 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3ccc(C(F)(F)F)s3)[nH]c2c1 ZINC000462104345 567772154 /nfs/dbraw/zinc/77/21/54/567772154.db2.gz QAFTUTAUQQWQCX-UHFFFAOYSA-N 0 1 375.397 3.430 10 0 GGAEMN C[C@H](C(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)N1CCSCC1 ZINC000533548450 567774090 /nfs/dbraw/zinc/77/40/90/567774090.db2.gz AVPUISCJQPMAKL-WBMJQRKESA-N 0 1 378.929 3.317 10 0 GGAEMN COC(=O)c1sc2c(c1Br)CN(C(=O)c1cc(C(C)C)[nH]n1)C2 ZINC000598544355 567774757 /nfs/dbraw/zinc/77/47/57/567774757.db2.gz MIUGUCZZNUXLKH-UHFFFAOYSA-N 0 1 398.282 3.300 10 0 GGAEMN FC(F)(F)c1nc(N2CCC(N3CCOCC3)CC2)ccc1Br ZINC000624404872 567778883 /nfs/dbraw/zinc/77/88/83/567778883.db2.gz YADFMWQOSLWCLH-UHFFFAOYSA-N 0 1 394.235 3.164 10 0 GGAEMN CCOC(=O)C1([S@](C)=O)CCN(CCCCc2cccc(Cl)c2)CC1 ZINC000598618762 567779812 /nfs/dbraw/zinc/77/98/12/567779812.db2.gz QAKWHHGHRSDUEK-VWLOTQADSA-N 0 1 385.957 3.439 10 0 GGAEMN O=S1(=O)CC[C@@H](NC[C@@H]2CSc3ccccc3O2)c2cc(F)ccc21 ZINC000647314286 567779709 /nfs/dbraw/zinc/77/97/09/567779709.db2.gz BLMIYCOHFMGQLE-UKRRQHHQSA-N 0 1 379.478 3.187 10 0 GGAEMN C[N@H+]1C[C@H]2CCN(Cc3cc(Br)c([O-])c(Br)c3)[C@@H]2C1 ZINC000668186574 567799341 /nfs/dbraw/zinc/79/93/41/567799341.db2.gz MHHRWRNLFGRQMD-ZWNOBZJWSA-N 0 1 390.119 3.053 10 0 GGAEMN COC(=O)c1ccc(CS(=O)(=O)N[C@@H](C(F)F)C2CCCCC2)cc1 ZINC000598629145 567780001 /nfs/dbraw/zinc/78/00/01/567780001.db2.gz YDDFXKXABOGAAS-OAHLLOKOSA-N 0 1 375.437 3.107 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N(Cc1ccccn1)C1CC1 ZINC000443923783 567780130 /nfs/dbraw/zinc/78/01/30/567780130.db2.gz CTQZANUDMVSIQH-UHFFFAOYSA-N 0 1 398.260 3.490 10 0 GGAEMN COC(=O)c1cc(OC)c(S(=O)(=O)N[C@H](C(F)F)C2CCCCC2)s1 ZINC000598628930 567780303 /nfs/dbraw/zinc/78/03/03/567780303.db2.gz UTSDURZCCWTGDT-LBPRGKRZSA-N 0 1 397.465 3.036 10 0 GGAEMN CC(C)(CNC(=O)[C@H]1CCc2[nH]cnc2C1)c1cccc(Br)c1 ZINC000667884732 567780456 /nfs/dbraw/zinc/78/04/56/567780456.db2.gz BIRZGRVKKBQAQI-LBPRGKRZSA-N 0 1 376.298 3.371 10 0 GGAEMN C[C@H]1CC[N@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@H]1C(=O)[O-] ZINC000647368311 567781951 /nfs/dbraw/zinc/78/19/51/567781951.db2.gz TUYOAXARRNCYMW-WCBMZHEXSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@H]1C(=O)[O-] ZINC000647368311 567781955 /nfs/dbraw/zinc/78/19/55/567781955.db2.gz TUYOAXARRNCYMW-WCBMZHEXSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@H]1CC[N@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@@H]1C(=O)[O-] ZINC000647368312 567782206 /nfs/dbraw/zinc/78/22/06/567782206.db2.gz TUYOAXARRNCYMW-WPRPVWTQSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@@H]1C(=O)[O-] ZINC000647368312 567782214 /nfs/dbraw/zinc/78/22/14/567782214.db2.gz TUYOAXARRNCYMW-WPRPVWTQSA-N 0 1 386.271 3.103 10 0 GGAEMN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N1[C@@H](C)CN(C)C[C@@H]1C ZINC000533755425 567785411 /nfs/dbraw/zinc/78/54/11/567785411.db2.gz CRBDQTYZVJGOPG-RYUDHWBXSA-N 0 1 378.314 3.332 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000667947671 567786060 /nfs/dbraw/zinc/78/60/60/567786060.db2.gz ZTADNDLDEIEQKE-BNOWGMLFSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000667947671 567786063 /nfs/dbraw/zinc/78/60/63/567786063.db2.gz ZTADNDLDEIEQKE-BNOWGMLFSA-N 0 1 375.270 3.287 10 0 GGAEMN Cc1ncc(CN(C)C(=O)c2c[nH]c3ccc(Br)cc3c2=O)s1 ZINC000444041179 567786502 /nfs/dbraw/zinc/78/65/02/567786502.db2.gz XNHBJKKXKVFQKN-UHFFFAOYSA-N 0 1 392.278 3.328 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCC(c2n[nH]c(=O)o2)CC1 ZINC000555526876 567787031 /nfs/dbraw/zinc/78/70/31/567787031.db2.gz QPLDDMVIXANWOK-VIFPVBQESA-N 0 1 386.235 3.256 10 0 GGAEMN O=C([O-])c1ccc(N2CC[NH+](CCc3ccc(Cl)c(Cl)c3)CC2)nc1 ZINC000647452397 567787470 /nfs/dbraw/zinc/78/74/70/567787470.db2.gz YJUAPMWWMZVTGB-UHFFFAOYSA-N 0 1 380.275 3.451 10 0 GGAEMN CSc1ccccc1S(=O)(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 ZINC000444082281 567790955 /nfs/dbraw/zinc/79/09/55/567790955.db2.gz HMNDGYOEWABTHK-KRWDZBQOSA-N 0 1 376.547 3.304 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CC(CC2CC2)C1 ZINC000598782370 567791721 /nfs/dbraw/zinc/79/17/21/567791721.db2.gz ZOGSQCRLYCOSDX-UHFFFAOYSA-N 0 1 381.217 3.040 10 0 GGAEMN COCCN(Cc1cc(Br)cs1)C(=O)[C@H]1CCCc2[nH]ncc21 ZINC000555634090 567793308 /nfs/dbraw/zinc/79/33/08/567793308.db2.gz HZWRPEPLRFGORO-ZDUSSCGKSA-N 0 1 398.326 3.329 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2cc(Br)ccc2OC)[C@H]1n1cccn1 ZINC000555646346 567793545 /nfs/dbraw/zinc/79/35/45/567793545.db2.gz VLFCRCAKLOXPQY-USXIJHARSA-N 0 1 380.286 3.163 10 0 GGAEMN OCCN(Cc1cc(Br)cs1)Cc1ccnn1-c1ccncc1 ZINC000668060844 567794395 /nfs/dbraw/zinc/79/43/95/567794395.db2.gz UTOQYNKOVAZXOV-UHFFFAOYSA-N 0 1 393.310 3.086 10 0 GGAEMN COc1ccccc1[C@H](N)CNC(=O)[C@@H]1CCc2cc(Br)ccc21 ZINC000647633769 567794987 /nfs/dbraw/zinc/79/49/87/567794987.db2.gz BORSCXPEPJXPKG-NVXWUHKLSA-N 0 1 389.293 3.304 10 0 GGAEMN C[C@H](CN1CCC(c2ccc(OC(F)(F)F)cc2)CC1)CS(C)(=O)=O ZINC000555729337 567796443 /nfs/dbraw/zinc/79/64/43/567796443.db2.gz TVEUZHVMSNOFHG-CYBMUJFWSA-N 0 1 379.444 3.445 10 0 GGAEMN Cc1nsc(C)c1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000555738224 567796569 /nfs/dbraw/zinc/79/65/69/567796569.db2.gz DYVLUZNOOGZXNP-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN Cc1nsc(C)c1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000555738224 567796573 /nfs/dbraw/zinc/79/65/73/567796573.db2.gz DYVLUZNOOGZXNP-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN Cc1cc(Br)cc(S(=O)(=O)NCc2nc3cccc(C)c3[nH]2)c1 ZINC000444218678 567798137 /nfs/dbraw/zinc/79/81/37/567798137.db2.gz XTZCVJZPLIZKTQ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN CCCN(Cc1c(F)cccc1Cl)C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000444248263 567798941 /nfs/dbraw/zinc/79/89/41/567798941.db2.gz NDTHTTMUOGKMDQ-AWEZNQCLSA-N 0 1 376.925 3.363 10 0 GGAEMN C[C@@H]1Cc2cn[nH]c2[C@H](C(=O)Nc2cc(I)ccc2O)C1 ZINC000598934190 567799034 /nfs/dbraw/zinc/79/90/34/567799034.db2.gz OLRCVTCPQYUPHU-LDYMZIIASA-N 0 1 397.216 3.025 10 0 GGAEMN C[N@H+]1C[C@H]2CCN(Cc3cc(Br)c([O-])c(Br)c3)[C@H]2C1 ZINC000668186573 567799494 /nfs/dbraw/zinc/79/94/94/567799494.db2.gz MHHRWRNLFGRQMD-MFKMUULPSA-N 0 1 390.119 3.053 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)c2c(F)cccc2F)[C@H]1c1ccc(Cl)cc1 ZINC000534083691 567799655 /nfs/dbraw/zinc/79/96/55/567799655.db2.gz IFQAVLFBLOOTFW-HZPDHXFCSA-N 0 1 386.851 3.342 10 0 GGAEMN O=C1[C@H](Nc2ccc3cc(Br)c(F)cc3n2)CCN1C1CCC1 ZINC000624780225 567800010 /nfs/dbraw/zinc/80/00/10/567800010.db2.gz AQXDMAIMLIRPJN-CQSZACIVSA-N 0 1 378.245 3.124 10 0 GGAEMN COC[C@@]1(C)CN(c2ccnc3cc(OC)c(Br)cc32)CCO1 ZINC000624777101 567800062 /nfs/dbraw/zinc/80/00/62/567800062.db2.gz JUDMGNSDWPUSRB-QGZVFWFLSA-N 0 1 381.270 3.248 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3ccc(Cl)cc3Br)cc21 ZINC000534129793 567800193 /nfs/dbraw/zinc/80/01/93/567800193.db2.gz SMAJXGFXBPZBLR-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCC(C(F)F)CC1 ZINC000444341906 567801735 /nfs/dbraw/zinc/80/17/35/567801735.db2.gz SWJLGFAMDSQRIK-UHFFFAOYSA-N 0 1 385.208 3.408 10 0 GGAEMN O=C(N[C@@H]1CCOC2(CCC2)C1)c1c[nH]c2ccc(Br)cc2c1=O ZINC000444333805 567802136 /nfs/dbraw/zinc/80/21/36/567802136.db2.gz CESBPOZYZOHHAI-GFCCVEGCSA-N 0 1 391.265 3.122 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@H]2CCc3cc(Br)ccc32)n[nH]1 ZINC000574918280 567804797 /nfs/dbraw/zinc/80/47/97/567804797.db2.gz JHQBPBZDSPIIFY-ZDUSSCGKSA-N 0 1 377.286 3.211 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CC[C@H](C2CC2)C1 ZINC000534270594 567806130 /nfs/dbraw/zinc/80/61/30/567806130.db2.gz HEPTYILMKFLLEX-ZDUSSCGKSA-N 0 1 390.285 3.176 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CC[C@H](C2CC2)C1 ZINC000534270594 567806133 /nfs/dbraw/zinc/80/61/33/567806133.db2.gz HEPTYILMKFLLEX-ZDUSSCGKSA-N 0 1 390.285 3.176 10 0 GGAEMN Cn1cc([C@@H](NCc2ccc(F)c(Br)c2)C2(CO)CCC2)cn1 ZINC000647943594 567807729 /nfs/dbraw/zinc/80/77/29/567807729.db2.gz RLVCNJKGFRPMQG-MRXNPFEDSA-N 0 1 382.277 3.315 10 0 GGAEMN Cc1cc(Br)ccc1CN[C@@H](c1cnn(C)c1)C1(CO)CCC1 ZINC000647942867 567808042 /nfs/dbraw/zinc/80/80/42/567808042.db2.gz BRHIMINFQGDZHB-KRWDZBQOSA-N 0 1 378.314 3.485 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)Nc1cc(Cl)cc2c1OCC(=O)N2 ZINC000575018904 567808990 /nfs/dbraw/zinc/80/89/90/567808990.db2.gz YUXVABAYNNEIBM-UHFFFAOYSA-N 0 1 387.244 3.434 10 0 GGAEMN C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C[C@H]1C(=O)[O-] ZINC000575045807 567810319 /nfs/dbraw/zinc/81/03/19/567810319.db2.gz SDYBMHSRGHVBJP-GXSJLCMTSA-N 0 1 378.778 3.340 10 0 GGAEMN C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C[C@@H]1C(=O)[O-] ZINC000575045808 567810453 /nfs/dbraw/zinc/81/04/53/567810453.db2.gz SDYBMHSRGHVBJP-KOLCDFICSA-N 0 1 378.778 3.340 10 0 GGAEMN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1cc(OC(F)F)ccc1Br ZINC000648002412 567810419 /nfs/dbraw/zinc/81/04/19/567810419.db2.gz UUAJGIREIGUCMG-ZJUUUORDSA-N 0 1 377.229 3.136 10 0 GGAEMN C[C@@]1(c2ccccc2)CC[C@@H](N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)C1 ZINC000668469869 567810955 /nfs/dbraw/zinc/81/09/55/567810955.db2.gz MMTFVFYVRRZCNA-LTIDMASMSA-N 0 1 375.456 3.404 10 0 GGAEMN Cc1cc(=O)n2nc(CN(C)Cc3ccc(Br)cc3C)sc2n1 ZINC000444693692 567811085 /nfs/dbraw/zinc/81/10/85/567811085.db2.gz OVOSOMJQBDHMIJ-UHFFFAOYSA-N 0 1 393.310 3.162 10 0 GGAEMN O[C@H]([C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000444723606 567811504 /nfs/dbraw/zinc/81/15/04/567811504.db2.gz WNZODXROKUECNX-YMTOWFKASA-N 0 1 392.219 3.461 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@H]1CCCN(c2ccn(C)n2)C1=O ZINC000444710110 567811527 /nfs/dbraw/zinc/81/15/27/567811527.db2.gz TVJKMHVGAWOASK-INIZCTEOSA-N 0 1 391.313 3.118 10 0 GGAEMN C[C@@H]1CN(C)C[C@H](C)N1C(=O)c1ccc(I)c(Cl)c1 ZINC000534490924 567812661 /nfs/dbraw/zinc/81/26/61/567812661.db2.gz WSZLNVZZGNGTNY-AOOOYVTPSA-N 0 1 392.668 3.109 10 0 GGAEMN C[C@@H]1CN(C)C[C@@H](C)N1C(=O)c1ccc(I)c(Cl)c1 ZINC000534490925 567812759 /nfs/dbraw/zinc/81/27/59/567812759.db2.gz WSZLNVZZGNGTNY-NXEZZACHSA-N 0 1 392.668 3.109 10 0 GGAEMN C[C@H]1CN(C)C[C@H](C)N1C(=O)c1ccc(I)c(Cl)c1 ZINC000534490926 567812943 /nfs/dbraw/zinc/81/29/43/567812943.db2.gz WSZLNVZZGNGTNY-UWVGGRQHSA-N 0 1 392.668 3.109 10 0 GGAEMN CN(Cc1cnc(-c2ccc(Br)cc2)s1)C[C@H]1COCCO1 ZINC000668544816 567813193 /nfs/dbraw/zinc/81/31/93/567813193.db2.gz HWNMMTKCZGRQBA-AWEZNQCLSA-N 0 1 383.311 3.420 10 0 GGAEMN COc1cc(Br)c(CNCCc2cn3c(cccc3C)n2)cc1O ZINC000648078701 567813336 /nfs/dbraw/zinc/81/33/36/567813336.db2.gz ATTKVUNYWTZHSV-UHFFFAOYSA-N 0 1 390.281 3.452 10 0 GGAEMN CN(C(=O)c1cc(-c2cccc(Br)c2)no1)[C@H]1CN2CCC1CC2 ZINC000668588212 567814164 /nfs/dbraw/zinc/81/41/64/567814164.db2.gz GAQYCVLGUQTYRC-INIZCTEOSA-N 0 1 390.281 3.270 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1C[C@@H]2COC[C@]2(C)C1 ZINC000668594844 567814336 /nfs/dbraw/zinc/81/43/36/567814336.db2.gz HRHVLDUXCFVOAU-QAPCUYQASA-N 0 1 384.314 3.333 10 0 GGAEMN CN(C(=O)c1cc(-c2ccc(Br)cc2)no1)[C@@H]1CN2CCC1CC2 ZINC000668588033 567814373 /nfs/dbraw/zinc/81/43/73/567814373.db2.gz DDGMPNCWFIDRRS-MRXNPFEDSA-N 0 1 390.281 3.270 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1C[C@@H]2COC[C@@]2(C)C1 ZINC000668594842 567814381 /nfs/dbraw/zinc/81/43/81/567814381.db2.gz HRHVLDUXCFVOAU-CRAIPNDOSA-N 0 1 384.314 3.333 10 0 GGAEMN N[C@@H](C(=O)NCCN1CCc2c(Cl)cccc2C1)c1cccc(Cl)c1 ZINC000648172445 567814453 /nfs/dbraw/zinc/81/44/53/567814453.db2.gz OJZGGXBNFOMNDH-GOSISDBHSA-N 0 1 378.303 3.168 10 0 GGAEMN C[C@@H](NC(=O)[C@H](N)c1cccc(Cl)c1)C1CCN(CC(F)(F)F)CC1 ZINC000648172127 567814514 /nfs/dbraw/zinc/81/45/14/567814514.db2.gz KODPGFZCNAGBBA-IAQYHMDHSA-N 0 1 377.838 3.119 10 0 GGAEMN N[C@H](C(=O)NCCN1CCc2c(Cl)cccc2C1)c1cccc(Cl)c1 ZINC000648172446 567814540 /nfs/dbraw/zinc/81/45/40/567814540.db2.gz OJZGGXBNFOMNDH-SFHVURJKSA-N 0 1 378.303 3.168 10 0 GGAEMN CN(C(=O)c1cc(-c2ccc(Br)cc2)no1)[C@H]1CCN(C2CC2)C1 ZINC000668598170 567814856 /nfs/dbraw/zinc/81/48/56/567814856.db2.gz IXVMGGLEBLAMOT-HNNXBMFYSA-N 0 1 390.281 3.413 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(C)=O)c(C)c2)cc1Cl ZINC000534619062 567815350 /nfs/dbraw/zinc/81/53/50/567815350.db2.gz OTLKSNNIJSHMQV-UHFFFAOYSA-N 0 1 381.837 3.438 10 0 GGAEMN CCOC(=O)CCNC(=O)c1ccc(-c2cc(-c3cccc(OC)c3)n[nH]2)cc1 ZINC000023305079 570210463 /nfs/dbraw/zinc/21/04/63/570210463.db2.gz BCTQYESDKOBBFB-UHFFFAOYSA-N 0 1 393.443 3.435 10 0 GGAEMN CC(C)(C)[C@@H](NCN1C(=O)C(=O)N(Cc2ccccc2)C1=O)c1cccs1 ZINC000048340490 570239175 /nfs/dbraw/zinc/23/91/75/570239175.db2.gz NOUIOLDUGLVOOD-INIZCTEOSA-N 0 1 385.489 3.373 10 0 GGAEMN CCCN1CCN(c2ncc3c(n2)CCN(Cc2ccc(CC)cc2)C3)CC1 ZINC000015779575 570243717 /nfs/dbraw/zinc/24/37/17/570243717.db2.gz GNIYVHBAQKJCLW-UHFFFAOYSA-N 0 1 379.552 3.129 10 0 GGAEMN Cc1cccnc1NC(=O)[C@@H]1CCCN(C[C@H](O)c2ccc(F)c(F)c2)C1 ZINC000051424121 570278046 /nfs/dbraw/zinc/27/80/46/570278046.db2.gz BEIQDRWUQSYACO-QAPCUYQASA-N 0 1 375.419 3.052 10 0 GGAEMN CCOc1ccccc1NS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCS2 ZINC000032943749 570287991 /nfs/dbraw/zinc/28/79/91/570287991.db2.gz FWMVRLRECLOZRE-UHFFFAOYSA-N 0 1 392.502 3.345 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCS2 ZINC000032943764 570288382 /nfs/dbraw/zinc/28/83/82/570288382.db2.gz RIUNEXRRKVKUON-UHFFFAOYSA-N 0 1 392.502 3.263 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2ccc(OCC3CCCCC3)cc2)CC1 ZINC000186621161 570306325 /nfs/dbraw/zinc/30/63/25/570306325.db2.gz QZGDFUGZTOUCCN-UHFFFAOYSA-N 0 1 388.508 3.267 10 0 GGAEMN CCOc1ccc(S(=O)(=O)Nc2ccccc2C(=O)O[C@H](C)C(C)=O)cc1 ZINC000022140869 570306460 /nfs/dbraw/zinc/30/64/60/570306460.db2.gz IAZDFRYBWCNFSP-CQSZACIVSA-N 0 1 391.445 3.020 10 0 GGAEMN Cc1ccccc1CN1CCN([C@@H](C)C(=O)Nc2ccc(N(C)C)cc2)CC1 ZINC000022791750 570328357 /nfs/dbraw/zinc/32/83/57/570328357.db2.gz DOJUTIZEWDCVSI-IBGZPJMESA-N 0 1 380.536 3.206 10 0 GGAEMN CCCN(Cc1c(C)nn(-c2ccccc2)c1N1CCN(C)CC1)C(=O)CC ZINC000034831198 570335440 /nfs/dbraw/zinc/33/54/40/570335440.db2.gz WATAGQQAKROAFF-UHFFFAOYSA-N 0 1 383.540 3.081 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)c3ccc4c(c3)C(=O)c3ccccc3-4)cn2)CC1 ZINC000022955466 570339316 /nfs/dbraw/zinc/33/93/16/570339316.db2.gz GXXUOVLVBXORMD-UHFFFAOYSA-N 0 1 398.466 3.297 10 0 GGAEMN Cc1ccc(CN(C)C(=O)CN2CCC(C(=O)Nc3ccccc3)CC2)cc1 ZINC000023039720 570341260 /nfs/dbraw/zinc/34/12/60/570341260.db2.gz FEYJKZRZNGDQFZ-UHFFFAOYSA-N 0 1 379.504 3.304 10 0 GGAEMN CCOc1ccc([C@@H](c2c(O)cc(C)n(CC)c2=O)N2CCN(CC)CC2)cc1 ZINC000024022947 570342573 /nfs/dbraw/zinc/34/25/73/570342573.db2.gz KPWRKBXKTPWYPN-QFIPXVFZSA-N 0 1 399.535 3.008 10 0 GGAEMN O=C(CCN1CCSC1=O)N1CCN(Cc2cccc3ccccc32)CC1 ZINC000023717827 570369914 /nfs/dbraw/zinc/36/99/14/570369914.db2.gz YIZHQIYWSYTMMU-UHFFFAOYSA-N 0 1 383.517 3.043 10 0 GGAEMN CCOc1ccc(NC(=O)CCCC2=Nc3ccccc3S(=O)(=O)N2)cc1 ZINC000006350565 570395987 /nfs/dbraw/zinc/39/59/87/570395987.db2.gz IJGIPQGLIPVFDW-UHFFFAOYSA-N 0 1 387.461 3.216 10 0 GGAEMN COc1ccc(OC)c(NS(=O)(=O)c2cc(-c3noc(C)n3)ccc2C)c1 ZINC000033086405 570400066 /nfs/dbraw/zinc/40/00/66/570400066.db2.gz JPUCKUVRTIDENE-UHFFFAOYSA-N 0 1 389.433 3.171 10 0 GGAEMN Cc1c(C(=O)N(C)Cc2ccccc2)sc2ncnc(N3CCN(C)CC3)c12 ZINC000033048198 570400433 /nfs/dbraw/zinc/40/04/33/570400433.db2.gz PLFZLDOAWKSWJV-UHFFFAOYSA-N 0 1 395.532 3.024 10 0 GGAEMN Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)N[C@H]1CCc2ccccc21 ZINC000024989767 570402287 /nfs/dbraw/zinc/40/22/87/570402287.db2.gz SBIGSAUMIMWTDR-FQEVSTJZSA-N 0 1 379.435 3.349 10 0 GGAEMN O=C(c1ccc2[nH]nnc2c1)N1Cc2cc3c(cc2C2(CCCC2)C1)OCCO3 ZINC000024991704 570402699 /nfs/dbraw/zinc/40/26/99/570402699.db2.gz LSFDVKYNQBTUNP-UHFFFAOYSA-N 0 1 390.443 3.197 10 0 GGAEMN COc1ccc(-c2nc(CN3CCC(C(=O)NC4CC4)CC3)c(C)o2)cc1OC ZINC000005043085 570405214 /nfs/dbraw/zinc/40/52/14/570405214.db2.gz HPYRACQWVGWSTN-UHFFFAOYSA-N 0 1 399.491 3.158 10 0 GGAEMN COCCNC(=O)C1CCN(Cc2nc(-c3cccc(Cl)c3)oc2C)CC1 ZINC000005043749 570405222 /nfs/dbraw/zinc/40/52/22/570405222.db2.gz ARTMSDCRHJCEBV-UHFFFAOYSA-N 0 1 391.899 3.278 10 0 GGAEMN O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CCC[C@H]1c1nnc2ccccn21 ZINC000025078840 570405809 /nfs/dbraw/zinc/40/58/09/570405809.db2.gz OHDUIQZGRHTSCA-KRWDZBQOSA-N 0 1 376.395 3.236 10 0 GGAEMN Cc1cccc(N2C[C@H](C(=O)Nc3nc(-c4ccccc4)n[nH]3)CC2=O)c1C ZINC000025155417 570407172 /nfs/dbraw/zinc/40/71/72/570407172.db2.gz VIHWAWBJNAZQMM-MRXNPFEDSA-N 0 1 375.432 3.080 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@H](c1cccs1)N(C)C ZINC000025385303 570412513 /nfs/dbraw/zinc/41/25/13/570412513.db2.gz CCDOXKXCXJCSRY-SJLPKXTDSA-N 0 1 391.512 3.061 10 0 GGAEMN CC(C)[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@H](c1cccs1)N(C)C ZINC000025385307 570412913 /nfs/dbraw/zinc/41/29/13/570412913.db2.gz CCDOXKXCXJCSRY-AEFFLSMTSA-N 0 1 391.512 3.061 10 0 GGAEMN COc1ccccc1NC(=O)Cc1noc(CN2CC[C@@H]3CCCC[C@@H]3C2)n1 ZINC000025410871 570413289 /nfs/dbraw/zinc/41/32/89/570413289.db2.gz RPPFJUREURQDAI-JKSUJKDBSA-N 0 1 384.480 3.272 10 0 GGAEMN Cc1cc(NCCN2CCN(Cc3ccccc3)CC2)nc(-c2ccncc2)n1 ZINC000060217853 570418578 /nfs/dbraw/zinc/41/85/78/570418578.db2.gz IEMQGTGXMAIHLH-UHFFFAOYSA-N 0 1 388.519 3.077 10 0 GGAEMN O=S(=O)(Nc1cccc(-c2ccc(N3CCCCC3)nn2)c1)c1cccnc1 ZINC000005144752 570426595 /nfs/dbraw/zinc/42/65/95/570426595.db2.gz LITUDHDBOQMYEX-UHFFFAOYSA-N 0 1 395.488 3.330 10 0 GGAEMN CC(C)NC(=O)CN1CCCN(c2cc(C(F)(F)F)nc3ccccc32)CC1 ZINC000026706052 570428055 /nfs/dbraw/zinc/42/80/55/570428055.db2.gz JPBMOCHNTQQQNH-UHFFFAOYSA-N 0 1 394.441 3.290 10 0 GGAEMN C[C@@H](SCc1ccccc1)C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1 ZINC000239367318 570429487 /nfs/dbraw/zinc/42/94/87/570429487.db2.gz AIFOQZYIZDUUBW-KNQAVFIVSA-N 0 1 397.588 3.413 10 0 GGAEMN C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CC[C@H]2CCCC[C@H]2C1 ZINC000241965671 570432230 /nfs/dbraw/zinc/43/22/30/570432230.db2.gz UUXMTJVRWVBWBJ-MCIONIFRSA-N 0 1 375.538 3.175 10 0 GGAEMN COc1ccccc1NC(=O)Cc1noc(CN2CC[C@@H]3CCCC[C@H]3C2)n1 ZINC000248140702 570443228 /nfs/dbraw/zinc/44/32/28/570443228.db2.gz RPPFJUREURQDAI-HOTGVXAUSA-N 0 1 384.480 3.272 10 0 GGAEMN CCc1ncc(C[N@H+]2CCC[C@H](C(=O)Nc3ccc(-c4cc[nH]n4)cc3)C2)cn1 ZINC000011935890 570449699 /nfs/dbraw/zinc/44/96/99/570449699.db2.gz YQGRLICJADLUIV-SFHVURJKSA-N 0 1 390.491 3.280 10 0 GGAEMN CCc1ncc(CN2CCC[C@H](C(=O)Nc3ccc(-c4cc[nH]n4)cc3)C2)cn1 ZINC000011935890 570449702 /nfs/dbraw/zinc/44/97/02/570449702.db2.gz YQGRLICJADLUIV-SFHVURJKSA-N 0 1 390.491 3.280 10 0 GGAEMN CCNC(=O)[C@H]1Cc2ccccc2N2CCN(Cc3ccc(Cl)cc3)C[C@H]12 ZINC000035869953 570468041 /nfs/dbraw/zinc/46/80/41/570468041.db2.gz YDLDNZVHLUKFFQ-PZJWPPBQSA-N 0 1 383.923 3.339 10 0 GGAEMN O=C(NCC1CC1)[C@@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@@H]12 ZINC000035870022 570468469 /nfs/dbraw/zinc/46/84/69/570468469.db2.gz YCAAGSKTEKPAIL-GGAORHGYSA-N 0 1 393.506 3.215 10 0 GGAEMN O=C(NCC1CC1)[C@@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@H]12 ZINC000035870020 570468511 /nfs/dbraw/zinc/46/85/11/570468511.db2.gz YCAAGSKTEKPAIL-FYYLOGMGSA-N 0 1 393.506 3.215 10 0 GGAEMN Cc1nccn1-c1ccc(CNC(=O)[C@H](C)N(C)Cc2ccccc2)cc1F ZINC000072289322 570481742 /nfs/dbraw/zinc/48/17/42/570481742.db2.gz CVPCIEHWZFKZTR-INIZCTEOSA-N 0 1 380.467 3.457 10 0 GGAEMN C[N@H+]1CCCN(c2ccc(NC(=O)c3ccc(Cl)cc3)c(C(=O)[O-])c2)CC1 ZINC000064588734 570489190 /nfs/dbraw/zinc/48/91/90/570489190.db2.gz GESPWIDJKISXMM-UHFFFAOYSA-N 0 1 387.867 3.432 10 0 GGAEMN CCOc1cccc2cc([C@H](C)NC(=O)c3cc(=O)c4c(C)nn(C)c4[nH]3)oc21 ZINC000072307011 570524740 /nfs/dbraw/zinc/52/47/40/570524740.db2.gz AKDPCCVMNTVVLF-NSHDSACASA-N 0 1 394.431 3.206 10 0 GGAEMN CCN1CCN([C@@H](c2ccc(Cl)cc2)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022697051 570529389 /nfs/dbraw/zinc/52/93/89/570529389.db2.gz QIHWZKKYKNGLEB-FQEVSTJZSA-N 0 1 389.927 3.263 10 0 GGAEMN CCN1CCN([C@@H](c2cccc(Cl)c2)c2c(O)cc(C)n(CC)c2=O)CC1 ZINC000022696999 570529414 /nfs/dbraw/zinc/52/94/14/570529414.db2.gz MHVIBPXDMLMSGP-FQEVSTJZSA-N 0 1 389.927 3.263 10 0 GGAEMN COCCN(Cc1ccccc1OC)C[C@H](O)COc1ccc(Cl)cc1 ZINC000036096196 570535673 /nfs/dbraw/zinc/53/56/73/570535673.db2.gz VTECOYVCBQDRGS-SFHVURJKSA-N 0 1 379.884 3.237 10 0 GGAEMN Cc1[nH]c(SCC(=O)Nc2sccc2C(N)=O)nc1Cc1ccccc1 ZINC000005312429 570552118 /nfs/dbraw/zinc/55/21/18/570552118.db2.gz PVRWPUPLAOXEPG-UHFFFAOYSA-N 0 1 386.502 3.200 10 0 GGAEMN COc1ccc(CNC(=O)C2=CCN(Cc3cccc(F)c3)CC2)cc1OC ZINC000064818102 570553697 /nfs/dbraw/zinc/55/36/97/570553697.db2.gz VHDCEKMNIMLCLB-UHFFFAOYSA-N 0 1 384.451 3.291 10 0 GGAEMN CCC[C@@H](O)CN[C@H](c1nc(-c2cc(OC)c(OC)c(OC)c2)no1)C(C)C ZINC000036160527 570555850 /nfs/dbraw/zinc/55/58/50/570555850.db2.gz KCWMBFSWRQOPTD-PBHICJAKSA-N 0 1 393.484 3.210 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2ccc(C)c(F)c2)cc(C(=O)N2CCCCC2)n1C ZINC000064922282 570593558 /nfs/dbraw/zinc/59/35/58/570593558.db2.gz YBIYUJWDETWYIF-UHFFFAOYSA-N 0 1 393.484 3.208 10 0 GGAEMN C[C@H]1CN(Cc2ccc(F)cc2)CCN1CCC(=O)Nc1cc(N)ccc1F ZINC000225610215 570593905 /nfs/dbraw/zinc/59/39/05/570593905.db2.gz IUUCUDXQMKZJBD-HNNXBMFYSA-N 0 1 388.462 3.082 10 0 GGAEMN CN(C)CCN(Cc1ccccc1)C(=O)N1CCC[S@](=O)c2ccccc21 ZINC000225646982 570597700 /nfs/dbraw/zinc/59/77/00/570597700.db2.gz VUNNXHWOILWXMP-MHZLTWQESA-N 0 1 385.533 3.188 10 0 GGAEMN CC(C)CNC(=O)[C@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@@H]12 ZINC000169681662 570602546 /nfs/dbraw/zinc/60/25/46/570602546.db2.gz ATJSGHZSKHAGRG-GMAHTHKFSA-N 0 1 395.522 3.461 10 0 GGAEMN CCc1nc(C)nc(N2CCN(CC(C)(C)O)CC2)c1Cc1ccc(C)cc1 ZINC000036316576 570615085 /nfs/dbraw/zinc/61/50/85/570615085.db2.gz WNPROLAIOTVVRO-UHFFFAOYSA-N 0 1 382.552 3.140 10 0 GGAEMN CCCc1ccc(S(=O)(=O)NCCc2n[nH]c(Cc3ccc(C)cc3)n2)cc1 ZINC000064969605 570619465 /nfs/dbraw/zinc/61/94/65/570619465.db2.gz ZEHPQBOXJSLBTJ-UHFFFAOYSA-N 0 1 398.532 3.177 10 0 GGAEMN CC(C)c1ccc(S(=O)(=O)NCCc2nnc(-c3ccc(F)cc3)[nH]2)cc1 ZINC000064969591 570619793 /nfs/dbraw/zinc/61/97/93/570619793.db2.gz GEWCIIVYLAPAKE-UHFFFAOYSA-N 0 1 388.468 3.255 10 0 GGAEMN CCc1nc(C)nc(N2CCN(C[C@@H](O)CC)CC2)c1Cc1ccc(C)cc1 ZINC000036340638 570625533 /nfs/dbraw/zinc/62/55/33/570625533.db2.gz GMRFJFZDTYCZLW-FQEVSTJZSA-N 0 1 382.552 3.140 10 0 GGAEMN COc1ccc([C@@H]2CC(c3ccccc3OC)=NN2C(=O)CN2CCCC2)cc1 ZINC000036345151 570627711 /nfs/dbraw/zinc/62/77/11/570627711.db2.gz KXCNAMCUOADUSG-NRFANRHFSA-N 0 1 393.487 3.477 10 0 GGAEMN Cc1nc(C(=O)N2CC[C@H](C3CCN(Cc4cccc(F)c4F)CC3)C2)c[nH]1 ZINC000012299903 570635121 /nfs/dbraw/zinc/63/51/21/570635121.db2.gz ZEBSTYDNMIDXSY-INIZCTEOSA-N 0 1 388.462 3.371 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC[C@H](Nc2ccc3c(c2)OCCO3)C1 ZINC000012304795 570638086 /nfs/dbraw/zinc/63/80/86/570638086.db2.gz MFZGPDJNBQNNKU-HNNXBMFYSA-N 0 1 378.432 3.051 10 0 GGAEMN O=C(CCN(C(=O)c1cccc(Cl)c1)C1CCCCCC1)N1CCNCC1 ZINC000045966567 570649929 /nfs/dbraw/zinc/64/99/29/570649929.db2.gz ADFLGLLKYNORKQ-UHFFFAOYSA-N 0 1 391.943 3.327 10 0 GGAEMN Cc1[nH]n(-c2ccccc2)c(=O)c1C=C1NC(=O)N(Cc2ccc(F)cc2)C1=O ZINC000004345327 570679898 /nfs/dbraw/zinc/67/98/98/570679898.db2.gz XGNAHGITAVFXLI-WQRHYEAKSA-N 0 1 392.390 3.118 10 0 GGAEMN COc1ccc(-c2cc(C)no2)cc1S(=O)(=O)Nc1ccc2c(c1)OCO2 ZINC000006887760 570682932 /nfs/dbraw/zinc/68/29/32/570682932.db2.gz LMPOIBFAFUIYCG-UHFFFAOYSA-N 0 1 388.401 3.188 10 0 GGAEMN CC[C@@H](C)n1ncc(C(=O)Nc2ccc3nc(CN4CCOCC4)[nH]c3c2)c1C ZINC000242292552 570689137 /nfs/dbraw/zinc/68/91/37/570689137.db2.gz YNFFGACCXSKOND-CQSZACIVSA-N 0 1 396.495 3.123 10 0 GGAEMN Cc1c(C(=O)NCCC2=CCCCC2)sc2ncnc(N3CCN(C)CC3)c12 ZINC000033048191 570698509 /nfs/dbraw/zinc/69/85/09/570698509.db2.gz SNUJXHGSUMDDQW-UHFFFAOYSA-N 0 1 399.564 3.372 10 0 GGAEMN CCN(Cc1ccccc1)C(=O)CCCC1=Nc2ccccc2S(=O)(=O)N1 ZINC000006914161 570700943 /nfs/dbraw/zinc/70/09/43/570700943.db2.gz MYCLUEYVTIIJIX-UHFFFAOYSA-N 0 1 385.489 3.228 10 0 GGAEMN Cc1ccc(SCCNC(=O)NCCCN2C[C@@H](C)O[C@@H](C)C2)cc1C ZINC000058145714 570710841 /nfs/dbraw/zinc/71/08/41/570710841.db2.gz CRXWUZNJWFVFSE-HDICACEKSA-N 0 1 379.570 3.194 10 0 GGAEMN O=C(Nc1ccc2nc(-c3ccco3)[nH]c2c1)C1CCN(C(=O)C2CC2)CC1 ZINC000058227601 570722076 /nfs/dbraw/zinc/72/20/76/570722076.db2.gz ZRQIXEQEOQMLQV-UHFFFAOYSA-N 0 1 378.432 3.410 10 0 GGAEMN CCCCn1nc(C(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)ccc1=O ZINC000058297948 570725492 /nfs/dbraw/zinc/72/54/92/570725492.db2.gz KPVARNPPAUEKEC-SFHVURJKSA-N 0 1 379.464 3.205 10 0 GGAEMN Cc1nnc(-c2c(C)n(C)c(C)c2S(=O)(=O)Nc2ccc(F)c(C)c2)o1 ZINC000065194130 570725701 /nfs/dbraw/zinc/72/57/01/570725701.db2.gz QMWBWOPLKGYGFU-UHFFFAOYSA-N 0 1 378.429 3.249 10 0 GGAEMN O=C(CN1CCC[C@H]1CN1CCc2ccccc21)N[C@@H]1CCOc2ccccc21 ZINC000058324529 570727301 /nfs/dbraw/zinc/72/73/01/570727301.db2.gz KILZVJZPCBVPPH-PZJWPPBQSA-N 0 1 391.515 3.154 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1 ZINC000058343777 570728425 /nfs/dbraw/zinc/72/84/25/570728425.db2.gz MBWPUEKPLQBJTF-UHFFFAOYSA-N 0 1 390.509 3.189 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000249073618 570732531 /nfs/dbraw/zinc/73/25/31/570732531.db2.gz ALUGUOZMQRMSNM-IXDOHACOSA-N 0 1 398.425 3.206 10 0 GGAEMN Cc1ccccc1-c1n[nH]c(SCc2cc(=O)n3nc(C4CC4)sc3n2)n1 ZINC000007007171 570739286 /nfs/dbraw/zinc/73/92/86/570739286.db2.gz UXFVOGDBJXMURU-UHFFFAOYSA-N 0 1 396.501 3.414 10 0 GGAEMN O=S(=O)(Nc1cccn2c1nnc2C1CCC1)c1cccc2cccnc21 ZINC000065228808 570739813 /nfs/dbraw/zinc/73/98/13/570739813.db2.gz LSQLTFBBNKFIJG-UHFFFAOYSA-N 0 1 379.445 3.346 10 0 GGAEMN Cc1ccc(Cn2cc(-c3noc(C(=O)Nc4ccc(F)cc4F)n3)nn2)cc1 ZINC000065236813 570743482 /nfs/dbraw/zinc/74/34/82/570743482.db2.gz IKNBSTPPNRKJLK-UHFFFAOYSA-N 0 1 396.357 3.215 10 0 GGAEMN CCOc1ccccc1NC(=O)NCCc1n[nH]c(Cc2ccc(C)cc2)n1 ZINC000033062559 570748655 /nfs/dbraw/zinc/74/86/55/570748655.db2.gz OYRRHCJLLPGXOZ-UHFFFAOYSA-N 0 1 379.464 3.467 10 0 GGAEMN COc1ccc(C)cc1NC(=O)NCCc1n[nH]c(Cc2ccc(F)cc2)n1 ZINC000033062615 570748753 /nfs/dbraw/zinc/74/87/53/570748753.db2.gz ZMKRHPONDITMNM-UHFFFAOYSA-N 0 1 383.427 3.216 10 0 GGAEMN Cc1ccc(CN(CCC(=O)N2CCNCC2)C(=O)c2cccc(Cl)c2)cc1 ZINC000065314933 570758108 /nfs/dbraw/zinc/75/81/08/570758108.db2.gz BOYUKEIGCSAVFD-UHFFFAOYSA-N 0 1 399.922 3.113 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CC1 ZINC000249174748 570763801 /nfs/dbraw/zinc/76/38/01/570763801.db2.gz YMKPDAUNKPQYRD-VNQPRFMTSA-N 0 1 398.425 3.206 10 0 GGAEMN O=C(CCN(Cc1ccccn1)C[C@@H]1CCCO1)N1CCc2ccccc2C1 ZINC000065386960 570763945 /nfs/dbraw/zinc/76/39/45/570763945.db2.gz JGHYYDUUYBSKIY-QFIPXVFZSA-N 0 1 379.504 3.038 10 0 GGAEMN CCC(CC)N1CCN(C(=O)c2nc3csc(C)c3c(N(C)C)n2)CC1 ZINC000065283487 570780687 /nfs/dbraw/zinc/78/06/87/570780687.db2.gz LIHRUZPXDUDAGC-UHFFFAOYSA-N 0 1 375.542 3.012 10 0 GGAEMN Cc1scc2nc(C(=O)N3CCN(C4CCCCC4)CC3)nc(N(C)C)c12 ZINC000065283463 570780690 /nfs/dbraw/zinc/78/06/90/570780690.db2.gz XRBREWKLPCXLPH-UHFFFAOYSA-N 0 1 387.553 3.156 10 0 GGAEMN CC(C)OCCCNC(=O)C1CCN(c2nc3ccc(Cl)cc3[nH]2)CC1 ZINC000033071171 570802856 /nfs/dbraw/zinc/80/28/56/570802856.db2.gz NFSVOVJGRSXOSH-UHFFFAOYSA-N 0 1 378.904 3.364 10 0 GGAEMN COc1cc([C@@H]2NC(=N)Nc3nc4ccccc4n32)cc(Cl)c1OC(F)F ZINC000007127538 570803109 /nfs/dbraw/zinc/80/31/09/570803109.db2.gz FBVLVHYOFGFVHS-CQSZACIVSA-N 0 1 393.781 3.396 10 0 GGAEMN COc1ccc(CNC(=O)[C@H]2CCCN(c3nc4ccc(C)cc4[nH]3)C2)cc1 ZINC000033071995 570803655 /nfs/dbraw/zinc/80/36/55/570803655.db2.gz FLOVSWLRTKRUPQ-KRWDZBQOSA-N 0 1 378.476 3.413 10 0 GGAEMN O=C(CSc1nc(-c2ccncc2)n[nH]1)Nc1ccc(N2CCCC2)cc1 ZINC000007176508 570810609 /nfs/dbraw/zinc/81/06/09/570810609.db2.gz NQSRZTYMGFXRRW-UHFFFAOYSA-N 0 1 380.477 3.198 10 0 GGAEMN CCNC(=O)NC(=O)[C@@H](Sc1nc(-c2cccs2)n[nH]1)c1ccccc1 ZINC000006035535 570816210 /nfs/dbraw/zinc/81/62/10/570816210.db2.gz YRRNPDMPLHWIGT-ZDUSSCGKSA-N 0 1 387.490 3.212 10 0 GGAEMN COc1ccccc1N1CCN(C(=O)CN2CCC[C@H]2c2cccs2)CC1 ZINC000007216204 570816743 /nfs/dbraw/zinc/81/67/43/570816743.db2.gz CYHZBRNAPAIJAZ-SFHVURJKSA-N 0 1 385.533 3.242 10 0 GGAEMN COc1ccc2c(CN[C@H](C)c3ccc(S(C)(=O)=O)cc3)cc(=O)oc2c1 ZINC000032797371 570819812 /nfs/dbraw/zinc/81/98/12/570819812.db2.gz HXAZLMRIVPJEMM-CYBMUJFWSA-N 0 1 387.457 3.056 10 0 GGAEMN Nc1nc(CSc2nc(-c3cccs3)n[nH]2)nc(Nc2ccccc2)n1 ZINC000005702313 570827709 /nfs/dbraw/zinc/82/77/09/570827709.db2.gz KPFDHTFSHNVWEE-UHFFFAOYSA-N 0 1 382.478 3.336 10 0 GGAEMN O=S(=O)(Nc1cc(C(F)(F)F)ccc1-n1cncn1)c1ccc(F)cc1 ZINC000007421480 570840476 /nfs/dbraw/zinc/84/04/76/570840476.db2.gz NMTBHQLQJPVPOA-UHFFFAOYSA-N 0 1 386.330 3.226 10 0 GGAEMN O=C(Nc1ccc(CN2CCOCC2)cn1)c1cn[nH]c1-c1cccc(Cl)c1 ZINC000170591023 570849017 /nfs/dbraw/zinc/84/90/17/570849017.db2.gz KOMZSZVQBYKEHT-UHFFFAOYSA-N 0 1 397.866 3.210 10 0 GGAEMN Cc1cc(=O)[nH]c(-c2ccc(NS(=O)(=O)c3ccc(F)cc3Cl)cc2)n1 ZINC000102510059 570851239 /nfs/dbraw/zinc/85/12/39/570851239.db2.gz QVULGPHHRZXVAR-UHFFFAOYSA-N 0 1 393.827 3.339 10 0 GGAEMN COc1ccccc1N1CC[C@@H](C)N(CC(=O)N2CCc3ccccc3C2)CC1 ZINC000170597284 570855210 /nfs/dbraw/zinc/85/52/10/570855210.db2.gz TXPKHIGTIBNIOA-LJQANCHMSA-N 0 1 393.531 3.181 10 0 GGAEMN CCn1c(C)cc(C(=O)CSc2nc(O)cc(=O)n2C2CCCC2)c1C ZINC000102689820 570857242 /nfs/dbraw/zinc/85/72/42/570857242.db2.gz DXYMBYZBYGWKSK-UHFFFAOYSA-N 0 1 375.494 3.477 10 0 GGAEMN COc1ccc2nc([C@H](C)NC(=O)[C@H]3CC(c4cccc(F)c4)=NO3)[nH]c2c1 ZINC000170600529 570858187 /nfs/dbraw/zinc/85/81/87/570858187.db2.gz MEHASNSEUIJPAW-BBATYDOGSA-N 0 1 382.395 3.081 10 0 GGAEMN COc1ccc2nc([C@@H](C)NC(=O)[C@H]3CC(c4cccc(F)c4)=NO3)[nH]c2c1 ZINC000170600530 570858283 /nfs/dbraw/zinc/85/82/83/570858283.db2.gz MEHASNSEUIJPAW-ADLMAVQZSA-N 0 1 382.395 3.081 10 0 GGAEMN Cc1cc2[nH]ncc2cc1NC(=O)[C@@H]1CS[C@@]2(c3ccccc3)CCC(=O)N12 ZINC000170611492 570868179 /nfs/dbraw/zinc/86/81/79/570868179.db2.gz ZUNFQRZLGXDSEV-GHTZIAJQSA-N 0 1 392.484 3.401 10 0 GGAEMN O=C(NC[C@H](c1c(F)cccc1Cl)N1CCCC1)[C@@H]1CCCN1C1CC1 ZINC000170615867 570873331 /nfs/dbraw/zinc/87/33/31/570873331.db2.gz ICACSGIKIKKWSI-ZWKOTPCHSA-N 0 1 379.907 3.359 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NC(=O)c2ccc(-n3cccc3)c(F)c2)c1 ZINC000170621658 570877353 /nfs/dbraw/zinc/87/73/53/570877353.db2.gz ULBMPNFGBLCCCS-UHFFFAOYSA-N 0 1 388.420 3.368 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)CCC(=O)c3ccc(Cl)s3)cn2)CC1 ZINC000032889373 570886006 /nfs/dbraw/zinc/88/60/06/570886006.db2.gz ICIFISDWJPKVED-UHFFFAOYSA-N 0 1 392.912 3.150 10 0 GGAEMN CCOC[C@H](O)C[N@H+](Cc1cccc(F)c1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982515 570911119 /nfs/dbraw/zinc/91/11/19/570911119.db2.gz KEHZNWMPRRYIFK-NHCUHLMSSA-N 0 1 386.467 3.218 10 0 GGAEMN CCOC[C@H](O)CN(Cc1cccc(F)c1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104982515 570911123 /nfs/dbraw/zinc/91/11/23/570911123.db2.gz KEHZNWMPRRYIFK-NHCUHLMSSA-N 0 1 386.467 3.218 10 0 GGAEMN O=C(CSc1nc(C2CCCC2)n[nH]1)Nc1ccccc1N1CCCC1=O ZINC000012104324 570959061 /nfs/dbraw/zinc/95/90/61/570959061.db2.gz ZTQDTVCHQNWRMZ-UHFFFAOYSA-N 0 1 385.493 3.320 10 0 GGAEMN O=C(CSc1n[nH]c(C2CCCC2)n1)Nc1ccccc1N1CCCC1=O ZINC000012104324 570959067 /nfs/dbraw/zinc/95/90/67/570959067.db2.gz ZTQDTVCHQNWRMZ-UHFFFAOYSA-N 0 1 385.493 3.320 10 0 GGAEMN COc1cccc2[nH]cc(CC(=O)Nc3cc(C)cc(N4CCN(C)CC4)c3)c21 ZINC000252484712 570969375 /nfs/dbraw/zinc/96/93/75/570969375.db2.gz GFGNLDLEEBKVLV-UHFFFAOYSA-N 0 1 392.503 3.418 10 0 GGAEMN C[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)CC[N@H+]1CCC(=O)[O-] ZINC000725240449 570974338 /nfs/dbraw/zinc/97/43/38/570974338.db2.gz HCAXGVPGTNTFKJ-MRXNPFEDSA-N 0 1 394.471 3.416 10 0 GGAEMN Nc1cc(N)nc(SCC(=O)N(CCc2ccccc2)Cc2cccs2)n1 ZINC000011391194 571000101 /nfs/dbraw/zinc/00/01/01/571000101.db2.gz OTYIBMAPJHPLNL-UHFFFAOYSA-N 0 1 399.545 3.066 10 0 GGAEMN CCCN(Cc1ccc(OC)c(OC)c1)Cc1cc(=O)n2cccc(C)c2n1 ZINC000045974062 571007158 /nfs/dbraw/zinc/00/71/58/571007158.db2.gz WXOMYLXKSMCCDR-UHFFFAOYSA-N 0 1 381.476 3.432 10 0 GGAEMN CCOc1cc(CN[C@@H](C)C(=O)NCC(F)(F)F)ccc1OCC(C)C ZINC000054177088 1406642360 /nfs/dbraw/zinc/64/23/60/1406642360.db2.gz CEZALDLKCVBBNX-ZDUSSCGKSA-N 0 1 376.419 3.277 10 0 GGAEMN Cc1cccc(N2CCN(C(=O)CN3CCC(c4ccc(O)cc4)CC3)CC2)c1 ZINC000055103414 1406885881 /nfs/dbraw/zinc/88/58/81/1406885881.db2.gz GGFCEWZBJLMFJK-UHFFFAOYSA-N 0 1 393.531 3.229 10 0 GGAEMN COc1ccccc1C(=O)NC(=O)COC(=O)Cc1ccc(Cl)c(Cl)c1 ZINC000003330087 1398335274 /nfs/dbraw/zinc/33/52/74/1398335274.db2.gz UITLPIQXWPSKAF-UHFFFAOYSA-N 0 1 396.226 3.044 10 0 GGAEMN C[C@H](NCC(=O)N1CCN(Cc2cccc3ccccc32)CC1)c1ccco1 ZINC000007802964 1398747668 /nfs/dbraw/zinc/74/76/68/1398747668.db2.gz DCJTWUDLJARZKD-SFHVURJKSA-N 0 1 377.488 3.428 10 0 GGAEMN C[C@@H](NCC(=O)N1CCN(Cc2cccc3ccccc32)CC1)c1ccco1 ZINC000007802967 1398747825 /nfs/dbraw/zinc/74/78/25/1398747825.db2.gz DCJTWUDLJARZKD-GOSISDBHSA-N 0 1 377.488 3.428 10 0 GGAEMN COc1ccc2nc(SCC(=O)N[C@H](C)c3ccc4c(c3)OCCO4)[nH]c2c1 ZINC000007901424 1398768838 /nfs/dbraw/zinc/76/88/38/1398768838.db2.gz SCESKCDGWQSSGF-GFCCVEGCSA-N 0 1 399.472 3.312 10 0 GGAEMN COc1ccc(CNC(=O)C2CCN(c3nc4ccc(C)cc4[nH]3)CC2)cc1 ZINC000008599367 1398841585 /nfs/dbraw/zinc/84/15/85/1398841585.db2.gz JHTQKCQKLPDZHJ-UHFFFAOYSA-N 0 1 378.476 3.413 10 0 GGAEMN C[C@H](NC(=O)CSc1nc(-c2ccccc2)n[nH]1)c1nc2ccccc2n1C ZINC000008614435 1398841898 /nfs/dbraw/zinc/84/18/98/1398841898.db2.gz CCUHJTBJGPJFRS-ZDUSSCGKSA-N 0 1 392.488 3.328 10 0 GGAEMN O=C(C[C@@H]1Sc2ccccc2NC1=O)NC[C@@H](c1ccco1)N1CCCC1 ZINC000008777798 1398846815 /nfs/dbraw/zinc/84/68/15/1398846815.db2.gz HKTDSCAIXANXNJ-YJBOKZPZSA-N 0 1 385.489 3.036 10 0 GGAEMN CCOc1ccc(NC(=O)CN(C)C(=O)c2[nH]nc3ccccc32)cc1OCC ZINC000009219908 1398855222 /nfs/dbraw/zinc/85/52/22/1398855222.db2.gz LRSWKVSIZSUBFA-UHFFFAOYSA-N 0 1 396.447 3.071 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2cccc(C)c2)c1C(=O)N1CCCCC1 ZINC000009684593 1398863328 /nfs/dbraw/zinc/86/33/28/1398863328.db2.gz YJQPEPNRGCVTAL-UHFFFAOYSA-N 0 1 375.494 3.367 10 0 GGAEMN CCc1ccc(NS(=O)(=O)c2c(C)[nH]c(C)c2C(=O)N2CCCC2)cc1 ZINC000009684085 1398863340 /nfs/dbraw/zinc/86/33/40/1398863340.db2.gz GOWHIHXTNUCPCQ-UHFFFAOYSA-N 0 1 375.494 3.231 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2ccc(C)cc2)c1C(=O)N1CCCCC1 ZINC000009684584 1398863365 /nfs/dbraw/zinc/86/33/65/1398863365.db2.gz RQYQNBWSPVZIMH-UHFFFAOYSA-N 0 1 375.494 3.367 10 0 GGAEMN Cn1nc(C(=O)N2CCN(C3CCCCC3)CC2)c2c1-c1ccsc1CC2 ZINC000009687554 1398863884 /nfs/dbraw/zinc/86/38/84/1398863884.db2.gz CYPLNUFXYLWIIR-UHFFFAOYSA-N 0 1 384.549 3.338 10 0 GGAEMN COc1ccc2c(c1)CCc1c(C(=O)N3CCN(c4ccccc4)CC3)n[nH]c1-2 ZINC000009728402 1398864760 /nfs/dbraw/zinc/86/47/60/1398864760.db2.gz NKZUKYXESMXUER-UHFFFAOYSA-N 0 1 388.471 3.146 10 0 GGAEMN O=C(c1n[nH]c2c1CCc1ccccc1-2)N1CCN(c2ccc(F)cc2)CC1 ZINC000009728302 1398864803 /nfs/dbraw/zinc/86/48/03/1398864803.db2.gz MVVCAJVNTDHXGN-UHFFFAOYSA-N 0 1 376.435 3.277 10 0 GGAEMN COc1ccc(OC)c(NC(=O)CSc2nc(C=Cc3ccco3)n[nH]2)c1 ZINC000010586392 1398902232 /nfs/dbraw/zinc/90/22/32/1398902232.db2.gz MFMTXPBYZOTMCK-SOFGYWHQSA-N 0 1 386.433 3.316 10 0 GGAEMN Cc1cc(CN(C)C(=O)c2cc(COc3ccc(F)cc3Cl)on2)n[nH]1 ZINC000012445379 1399043158 /nfs/dbraw/zinc/04/31/58/1399043158.db2.gz TUFSQKMXDTXLJS-UHFFFAOYSA-N 0 1 378.791 3.350 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)nc2ccc(NC(=S)NCc3ccco3)cc12 ZINC000020153735 1399343674 /nfs/dbraw/zinc/34/36/74/1399343674.db2.gz IIQSJROMWPYEGJ-UHFFFAOYSA-N 0 1 395.532 3.375 10 0 GGAEMN Cc1c(C(=O)Nc2ccc(C)c(F)c2)sc2ncnc(N3CCN(C)CC3)c12 ZINC000021926734 1399424705 /nfs/dbraw/zinc/42/47/05/1399424705.db2.gz WIBUZYGZZCHVRG-UHFFFAOYSA-N 0 1 399.495 3.451 10 0 GGAEMN Cc1nccnc1-c1cc(=O)[nH]c(-c2cccc(CN(C)Cc3ccoc3)c2)n1 ZINC000023337199 1399550192 /nfs/dbraw/zinc/55/01/92/1399550192.db2.gz KXLBDDVUYISDBB-UHFFFAOYSA-N 0 1 387.443 3.427 10 0 GGAEMN C[N@@H+](Cc1cccc(-c2nc([C@H]3CCCO3)cc(=O)[n-]2)c1)CC1CCOCC1 ZINC000023619891 1399575050 /nfs/dbraw/zinc/57/50/50/1399575050.db2.gz UPYUNFZEUAUBAN-HXUWFJFHSA-N 0 1 383.492 3.147 10 0 GGAEMN C[N@H+](Cc1cccc(-c2nc([C@H]3CCCO3)cc(=O)[n-]2)c1)CC1CCOCC1 ZINC000023619891 1399575055 /nfs/dbraw/zinc/57/50/55/1399575055.db2.gz UPYUNFZEUAUBAN-HXUWFJFHSA-N 0 1 383.492 3.147 10 0 GGAEMN CC[C@H](NCc1cc(OC)cc(OC)c1)c1ccccc1OCC(=O)N(C)C ZINC000048750719 1405281003 /nfs/dbraw/zinc/28/10/03/1405281003.db2.gz HKRKDYJWTPWYCQ-FQEVSTJZSA-N 0 1 386.492 3.412 10 0 GGAEMN CC[C@@H](NCc1cc(OC)cc(OC)c1)c1ccccc1OCC(=O)N(C)C ZINC000048750720 1405282393 /nfs/dbraw/zinc/28/23/93/1405282393.db2.gz HKRKDYJWTPWYCQ-HXUWFJFHSA-N 0 1 386.492 3.412 10 0 GGAEMN COc1cccc(CNCc2ccc(CS(C)(=O)=O)cc2)c1OC(F)F ZINC000048779674 1405291104 /nfs/dbraw/zinc/29/11/04/1405291104.db2.gz ARZGMSGAGJKNHN-UHFFFAOYSA-N 0 1 385.432 3.131 10 0 GGAEMN COCCOc1ccc([C@@H](C)NC(=O)Cc2[nH]nc3ccccc32)cc1OC ZINC000050583275 1405607260 /nfs/dbraw/zinc/60/72/60/1405607260.db2.gz HBEHKYSLBPGCRX-CQSZACIVSA-N 0 1 383.448 3.017 10 0 GGAEMN COc1ccc(CCNC(=O)CN[C@H](C)c2ccc(Cl)cc2)cc1OC ZINC000057877655 1407743632 /nfs/dbraw/zinc/74/36/32/1407743632.db2.gz AEVYVVATEKRVAR-CQSZACIVSA-N 0 1 376.884 3.367 10 0 GGAEMN C[C@H](NCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccc(Cl)cc1 ZINC000057876880 1407744186 /nfs/dbraw/zinc/74/41/86/1407744186.db2.gz CEQWBVZGJKQXMH-HNNXBMFYSA-N 0 1 375.875 3.479 10 0 GGAEMN Brc1cc(CNCc2cccc3c2OCO3)cc2c1OCCO2 ZINC000058065754 1407778509 /nfs/dbraw/zinc/77/85/09/1407778509.db2.gz GXIQPDMLCUVVNG-UHFFFAOYSA-N 0 1 378.222 3.239 10 0 GGAEMN NC(=O)CCOc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)n[nH]1 ZINC000058447139 1407829439 /nfs/dbraw/zinc/82/94/39/1407829439.db2.gz AAYISANMHZKYJP-UHFFFAOYSA-N 0 1 384.823 3.237 10 0 GGAEMN O=S(=O)(NCc1cc(Br)ccc1F)c1c(F)cc(F)cc1F ZINC000060499441 1407991734 /nfs/dbraw/zinc/99/17/34/1407991734.db2.gz COQGQRRIJYNTOK-UHFFFAOYSA-N 0 1 398.175 3.484 10 0 GGAEMN O[C@@H](CNCc1cccc2c1OCCO2)COc1cccc(Cl)c1Cl ZINC000063565871 1408372001 /nfs/dbraw/zinc/37/20/01/1408372001.db2.gz GMLNLQCYPCQFAD-ZDUSSCGKSA-N 0 1 384.259 3.294 10 0 GGAEMN C[C@@H](c1ccccc1)N(C)C(=O)C(=O)Nc1ccccc1CN1CCSCC1 ZINC000064270171 1408526206 /nfs/dbraw/zinc/52/62/06/1408526206.db2.gz GOUIAAXOMMIUHB-KRWDZBQOSA-N 0 1 397.544 3.394 10 0 GGAEMN CCOc1c(Br)cc(CN[C@H](C)C(=O)N[C@H](C)CC)cc1OC ZINC000065981781 1408767004 /nfs/dbraw/zinc/76/70/04/1408767004.db2.gz HKKDXRPZDCWETQ-VXGBXAGGSA-N 0 1 387.318 3.249 10 0 GGAEMN C[C@@H](N[C@H](C)c1ccccc1C(F)(F)F)C(=O)NC(=O)NCC(F)(F)F ZINC000066391046 1408828465 /nfs/dbraw/zinc/82/84/65/1408828465.db2.gz BJWLFEYUGZSUER-RKDXNWHRSA-N 0 1 385.308 3.133 10 0 GGAEMN CCCOc1ccc(CN[C@H](C)c2cccc(S(=O)(=O)NC)c2)cc1OC ZINC000067010370 1408979845 /nfs/dbraw/zinc/97/98/45/1408979845.db2.gz IAKIVXPEHDKTSC-OAHLLOKOSA-N 0 1 392.521 3.243 10 0 GGAEMN CCCOc1ccc(CN[C@@H](C)c2cccc(S(=O)(=O)NC)c2)cc1OC ZINC000067010369 1408979935 /nfs/dbraw/zinc/97/99/35/1408979935.db2.gz IAKIVXPEHDKTSC-HNNXBMFYSA-N 0 1 392.521 3.243 10 0 GGAEMN CCOc1cc(CN[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OC ZINC000067010814 1408980050 /nfs/dbraw/zinc/98/00/50/1408980050.db2.gz DDMXYXMROXYPJF-OAHLLOKOSA-N 0 1 392.521 3.195 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@@H](C)NCc2cc(Cl)c(OC)c(OC)c2)c1 ZINC000067010534 1408980065 /nfs/dbraw/zinc/98/00/65/1408980065.db2.gz BWQURTSDNKNFJZ-GFCCVEGCSA-N 0 1 398.912 3.116 10 0 GGAEMN CC[C@H](NCc1ccccc1OCC(=O)N(C)C)c1ccc2c(c1)OCCO2 ZINC000067220370 1409046197 /nfs/dbraw/zinc/04/61/97/1409046197.db2.gz DYRDLFHDZNUDQY-SFHVURJKSA-N 0 1 384.476 3.166 10 0 GGAEMN COc1ccc(Br)cc1CNC[C@H](O)COc1ccc(F)cc1 ZINC000067252539 1409053051 /nfs/dbraw/zinc/05/30/51/1409053051.db2.gz GNYLATWSPYCTEH-HNNXBMFYSA-N 0 1 384.245 3.126 10 0 GGAEMN COc1ccc(Br)cc1CNC[C@@H](O)COc1ccc(F)cc1 ZINC000067252541 1409053403 /nfs/dbraw/zinc/05/34/03/1409053403.db2.gz GNYLATWSPYCTEH-OAHLLOKOSA-N 0 1 384.245 3.126 10 0 GGAEMN O[C@@H](CNCc1cccc2c1OCCO2)COc1ccc(C(F)(F)F)cc1 ZINC000067255014 1409054620 /nfs/dbraw/zinc/05/46/20/1409054620.db2.gz CATCRVPVFVQPGC-HNNXBMFYSA-N 0 1 383.366 3.006 10 0 GGAEMN COC[C@H](C)NC(=O)Nc1ccc(NC(=O)CN2CCCCCCC2)cc1 ZINC000067308376 1409068915 /nfs/dbraw/zinc/06/89/15/1409068915.db2.gz HHSRSMIKHIGQHP-INIZCTEOSA-N 0 1 376.501 3.048 10 0 GGAEMN CCOc1c(Br)cc(CN[C@H](C)C(=O)N[C@@H](C)CC)cc1OC ZINC000068366988 1409381547 /nfs/dbraw/zinc/38/15/47/1409381547.db2.gz HKKDXRPZDCWETQ-NWDGAFQWSA-N 0 1 387.318 3.249 10 0 GGAEMN COc1ccc(CNCc2ccc(S(C)(=O)=O)cc2)cc1Br ZINC000068411937 1409394749 /nfs/dbraw/zinc/39/47/49/1409394749.db2.gz IFPJHJWCLCDODY-UHFFFAOYSA-N 0 1 384.295 3.151 10 0 GGAEMN C[C@H](Cc1ccccc1F)NC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1 ZINC000069286296 1409605185 /nfs/dbraw/zinc/60/51/85/1409605185.db2.gz DKCQQHOGFSSSGO-XMSQKQJNSA-N 0 1 398.526 3.045 10 0 GGAEMN Cc1cccc(C)c1NC(=O)CNCc1c[nH]nc1-c1ccc2c(c1)OCCO2 ZINC000069645926 1409667890 /nfs/dbraw/zinc/66/78/90/1409667890.db2.gz AORZBKBPMQQCFN-UHFFFAOYSA-N 0 1 392.459 3.193 10 0 GGAEMN Cc1nc([C@@H](NC(=O)Nc2ccc(-n3cnc4ccccc43)nc2)C(C)C)n[nH]1 ZINC000079017867 1409950150 /nfs/dbraw/zinc/95/01/50/1409950150.db2.gz JLQMWJAJWPGILS-SFHVURJKSA-N 0 1 390.451 3.366 10 0 GGAEMN COc1ccc(CN2CCCN(C(=O)c3c(O)cnc4ccccc43)CC2)cc1 ZINC000079019897 1409951490 /nfs/dbraw/zinc/95/14/90/1409951490.db2.gz HVKJBMWVVRZUGJ-UHFFFAOYSA-N 0 1 391.471 3.297 10 0 GGAEMN CN(C)Cc1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)cc1F ZINC000086234469 1410043855 /nfs/dbraw/zinc/04/38/55/1410043855.db2.gz GUEJJLVMJYQMID-ZWKOTPCHSA-N 0 1 375.488 3.255 10 0 GGAEMN CC(C)N1CC[C@@H](NCc2ccc(OC(F)F)c(Br)c2)C1=O ZINC000092565696 1410173630 /nfs/dbraw/zinc/17/36/30/1410173630.db2.gz FMCMCHOTUILDOM-GFCCVEGCSA-N 0 1 377.229 3.149 10 0 GGAEMN c1nc(CN2CCCN(Cc3ccc(OC[C@@H]4CCCO4)cc3)CC2)cs1 ZINC000093789191 1410266499 /nfs/dbraw/zinc/26/64/99/1410266499.db2.gz HXWQQSMOPZTPKD-NRFANRHFSA-N 0 1 387.549 3.409 10 0 GGAEMN COc1ccc(C(=O)Nc2c[nH]nc2[C@@H]2CCCN(Cc3ccccn3)C2)cc1 ZINC000096000189 1410320727 /nfs/dbraw/zinc/32/07/27/1410320727.db2.gz RHNMLVVCBDDTDK-QGZVFWFLSA-N 0 1 391.475 3.445 10 0 GGAEMN COc1ccc(C(=O)Nc2c[nH]nc2[C@H]2CCCN(Cc3cc(C)no3)C2)cc1 ZINC000096000179 1410320787 /nfs/dbraw/zinc/32/07/87/1410320787.db2.gz RNOYLRCWMSTFMG-INIZCTEOSA-N 0 1 395.463 3.347 10 0 GGAEMN O=C(CSc1nc(C=Cc2ccco2)n[nH]1)Nc1ccc2c(c1)OCCO2 ZINC000096941446 1410338490 /nfs/dbraw/zinc/33/84/90/1410338490.db2.gz NYSNLHHCGVOVTI-XQRVVYSFSA-N 0 1 384.417 3.070 10 0 GGAEMN CCCC(=O)NC[C@@H]1CCCN([C@@H](C)C(=O)N2c3ccccc3CC[C@@H]2C)C1 ZINC000101913117 1410520021 /nfs/dbraw/zinc/52/00/21/1410520021.db2.gz GGZIGRTZAOZDGG-FHWLQOOXSA-N 0 1 385.552 3.371 10 0 GGAEMN CCOC(=O)C1=C(CN[C@H](C)c2ccccc2C)NC(=O)N[C@@H]1c1ccco1 ZINC000102683781 1410697657 /nfs/dbraw/zinc/69/76/57/1410697657.db2.gz HHPSPIHRUNJRAB-AUUYWEPGSA-N 0 1 383.448 3.110 10 0 GGAEMN COc1ccccc1CN(CCO)C[C@@H](O)COc1cccc2ccccc21 ZINC000103143943 1410831468 /nfs/dbraw/zinc/83/14/68/1410831468.db2.gz BDKPWRZKNGTQHJ-HXUWFJFHSA-N 0 1 381.472 3.083 10 0 GGAEMN Cc1oc2c(c1C(=O)N1CCCN(C)CC1)CN(Cc1ccc(F)cc1)CC2 ZINC000105111487 1411029946 /nfs/dbraw/zinc/02/99/46/1411029946.db2.gz BZVSWWRLCILBTM-UHFFFAOYSA-N 0 1 385.483 3.063 10 0 GGAEMN NC(=O)C1CCN(c2ncccc2CNCc2ccccc2C(F)(F)F)CC1 ZINC000105430429 1411066047 /nfs/dbraw/zinc/06/60/47/1411066047.db2.gz DVGUKVVIOSJPFN-UHFFFAOYSA-N 0 1 392.425 3.092 10 0 GGAEMN COc1cccc(CNC[C@@H](O)COc2ccc(F)c(F)c2)c1OC(C)C ZINC000105499907 1411072995 /nfs/dbraw/zinc/07/29/95/1411072995.db2.gz AGJDKBMXPBIDLH-OAHLLOKOSA-N 0 1 381.419 3.290 10 0 GGAEMN CCN1CCN([C@@H]2CCN(C(=O)c3sc4cccc(F)c4c3C)C2)CC1 ZINC000106804150 1411304533 /nfs/dbraw/zinc/30/45/33/1411304533.db2.gz KEHFRQNXYTZTLZ-OAHLLOKOSA-N 0 1 375.513 3.201 10 0 GGAEMN Cc1ccccc1OC[C@H](O)CN1CCCC[C@@H]1CNC(=O)OC(C)(C)C ZINC000109610556 1411799930 /nfs/dbraw/zinc/79/99/30/1411799930.db2.gz ZGXJKNAWUDUMCA-QZTJIDSGSA-N 0 1 378.513 3.114 10 0 GGAEMN Cc1ccccc1OC[C@@H](O)CN1CCCC[C@@H]1CNC(=O)OC(C)(C)C ZINC000109610557 1411800015 /nfs/dbraw/zinc/80/00/15/1411800015.db2.gz ZGXJKNAWUDUMCA-MSOLQXFVSA-N 0 1 378.513 3.114 10 0 GGAEMN Cc1ccc(OC2CCN(C(=O)c3nnc4ccccc4c3O)CC2)cc1C ZINC000110063256 1411828881 /nfs/dbraw/zinc/82/88/81/1411828881.db2.gz ZCNVBFJVPJYQKQ-UHFFFAOYSA-N 0 1 377.444 3.224 10 0 GGAEMN COc1ccc(NC(=O)NC(=O)CN2CCC(Cc3ccc(F)cc3)CC2)cc1 ZINC000110301776 1411843404 /nfs/dbraw/zinc/84/34/04/1411843404.db2.gz GGTHBWKDODBOMS-UHFFFAOYSA-N 0 1 399.466 3.437 10 0 GGAEMN Cc1cc(Br)ccc1CNCc1cnc(N2CCOCC2)s1 ZINC000111388599 1411938892 /nfs/dbraw/zinc/93/88/92/1411938892.db2.gz BOKWJZBVQRCKQO-UHFFFAOYSA-N 0 1 382.327 3.340 10 0 GGAEMN Cc1[nH]c(S(=O)(=O)CC(=O)Nc2cc(C)ccc2C)nc1Cc1ccccc1 ZINC000113636808 1412325008 /nfs/dbraw/zinc/32/50/08/1412325008.db2.gz AFBKTCRTNXQENQ-UHFFFAOYSA-N 0 1 397.500 3.338 10 0 GGAEMN CNC(=O)c1cccc(CN2CCCC[C@@H]2CNC(=O)Nc2ccccc2)c1 ZINC000113929474 1412353561 /nfs/dbraw/zinc/35/35/61/1412353561.db2.gz HHABWCJCRZQGAQ-HXUWFJFHSA-N 0 1 380.492 3.222 10 0 GGAEMN CNC(=O)c1cccc(CN(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)c1 ZINC000113929310 1412353719 /nfs/dbraw/zinc/35/37/19/1412353719.db2.gz AOUHZYHLQVLPJO-UHFFFAOYSA-N 0 1 377.488 3.103 10 0 GGAEMN CCN(C(C)=O)c1nc(CNCC2(c3ccc(F)cc3)CCOCC2)cs1 ZINC000115613740 1412734527 /nfs/dbraw/zinc/73/45/27/1412734527.db2.gz BTMVYGXJBASJKV-UHFFFAOYSA-N 0 1 391.512 3.493 10 0 GGAEMN COc1ccc(CN[C@@H]2c3ccccc3C[C@H]2O)cc1OCc1cccnc1 ZINC000119161542 1413360060 /nfs/dbraw/zinc/36/00/60/1413360060.db2.gz HKUJKWBKEMJCKP-NFBKMPQASA-N 0 1 376.456 3.417 10 0 GGAEMN COc1cc(OC)c(OC)cc1CNCc1ccccc1CN1CCCC1=O ZINC000119238665 1413385912 /nfs/dbraw/zinc/38/59/12/1413385912.db2.gz GJEMARRVZYVBRD-UHFFFAOYSA-N 0 1 384.476 3.125 10 0 GGAEMN CC(C)(C)OC(=O)N1CCc2cccc(CN3CCC[C@H](n4cncn4)C3)c21 ZINC000119508921 1413470450 /nfs/dbraw/zinc/47/04/50/1413470450.db2.gz HJZRPZRXZMPIQX-SFHVURJKSA-N 0 1 383.496 3.413 10 0 GGAEMN C[C@H](CS(=O)(=O)c1ccccc1)NCc1ccc(N2CCCCC2=O)cc1 ZINC000119993347 1413645235 /nfs/dbraw/zinc/64/52/35/1413645235.db2.gz REOBPFFGGLBYLR-QGZVFWFLSA-N 0 1 386.517 3.156 10 0 GGAEMN NC(=O)[C@@H]1CCCN1Cc1cccc(NCc2ccc(OC(F)F)cc2)c1 ZINC000120056152 1413669755 /nfs/dbraw/zinc/66/97/55/1413669755.db2.gz FDPNQZKQJAPBAZ-SFHVURJKSA-N 0 1 375.419 3.350 10 0 GGAEMN Cc1ccc(-c2n[nH]cc2CNc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cc1 ZINC000120122783 1413696308 /nfs/dbraw/zinc/69/63/08/1413696308.db2.gz FZLBUIUALDYHTQ-OAQYLSRUSA-N 0 1 389.503 3.447 10 0 GGAEMN NC(=O)[C@@H]1CCCN1Cc1cccc(NCc2ccc(OCC(F)F)cc2)c1 ZINC000120126067 1413697606 /nfs/dbraw/zinc/69/76/06/1413697606.db2.gz HEDPUTGEJSYLAD-IBGZPJMESA-N 0 1 389.446 3.392 10 0 GGAEMN COCCOc1ccc([C@@H](C)N[C@H](C)C(=O)NC2CCCCC2)cc1OC ZINC000120350971 1413799711 /nfs/dbraw/zinc/79/97/11/1413799711.db2.gz HSCZYTJQZBGZDM-HZPDHXFCSA-N 0 1 378.513 3.208 10 0 GGAEMN COc1ccccc1S(=O)(=O)Nc1ccccc1N1C[C@H](C)O[C@@H](C)C1 ZINC000121886715 1414291711 /nfs/dbraw/zinc/29/17/11/1414291711.db2.gz CKBJJGHPLKVRSN-GJZGRUSLSA-N 0 1 376.478 3.110 10 0 GGAEMN COCCCOC1CCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000122535211 1414492620 /nfs/dbraw/zinc/49/26/20/1414492620.db2.gz AEYPXMFLIKQHMG-JKSUJKDBSA-N 0 1 382.932 3.423 10 0 GGAEMN COCCCOC1CCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000122535623 1414492912 /nfs/dbraw/zinc/49/29/12/1414492912.db2.gz AEYPXMFLIKQHMG-HOTGVXAUSA-N 0 1 382.932 3.423 10 0 GGAEMN Fc1ccc(OC2CCN(Cc3cnc(N4CCOCC4)s3)CC2)cc1 ZINC000122951748 1414603953 /nfs/dbraw/zinc/60/39/53/1414603953.db2.gz NTJMKRLOSFRCMJ-UHFFFAOYSA-N 0 1 377.485 3.162 10 0 GGAEMN CCC(CC)c1nnc(NC(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)s1 ZINC000124473084 1414976527 /nfs/dbraw/zinc/97/65/27/1414976527.db2.gz KDHLTIGQOUQAKW-ZDUSSCGKSA-N 0 1 381.546 3.159 10 0 GGAEMN CCC(CC)c1nnc(NC(=O)N2CCC(N3CCO[C@H](C)C3)CC2)s1 ZINC000124472844 1414976630 /nfs/dbraw/zinc/97/66/30/1414976630.db2.gz KDHLTIGQOUQAKW-CYBMUJFWSA-N 0 1 381.546 3.159 10 0 GGAEMN CC[C@H](C)NC(=O)[C@@H](C)NCc1cn(-c2ccc(Br)cc2)nc1C ZINC000124545556 1414991302 /nfs/dbraw/zinc/99/13/02/1414991302.db2.gz HQPWUMNIUGOJAX-GXTWGEPZSA-N 0 1 393.329 3.336 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@@H]1CCN(C(C)C)C1=O ZINC000125559330 1415226398 /nfs/dbraw/zinc/22/63/98/1415226398.db2.gz GTWREDFWMLQIGE-QGZVFWFLSA-N 0 1 391.313 3.042 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CN[C@H]1CCN(C(C)C)C1=O ZINC000125559570 1415226452 /nfs/dbraw/zinc/22/64/52/1415226452.db2.gz GTWREDFWMLQIGE-KRWDZBQOSA-N 0 1 391.313 3.042 10 0 GGAEMN Cc1[nH]c2ccc(Cl)cc2c1C(=O)NC[C@@H](O)CN1CCc2ccccc2C1 ZINC000126172090 1415376100 /nfs/dbraw/zinc/37/61/00/1415376100.db2.gz FGOHYLXHUJKDMS-GOSISDBHSA-N 0 1 397.906 3.279 10 0 GGAEMN CC(C)Oc1ccc(CNCc2ccccc2OCCN2CCOCC2)cc1 ZINC000126748247 1415546496 /nfs/dbraw/zinc/54/64/96/1415546496.db2.gz HOFZJOVMALQOFO-UHFFFAOYSA-N 0 1 384.520 3.475 10 0 GGAEMN COc1cc(OC)cc(N2CC[C@@H](NCc3cnc(C(C)C)s3)C2=O)c1 ZINC000133255174 1416871033 /nfs/dbraw/zinc/87/10/33/1416871033.db2.gz HCVDUBSTZBSLAJ-QGZVFWFLSA-N 0 1 375.494 3.179 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2cccc(CNCc3ccc(C)cn3)c2)cc1 ZINC000134330011 1417056537 /nfs/dbraw/zinc/05/65/37/1417056537.db2.gz AZYMILPEKBNECU-UHFFFAOYSA-N 0 1 397.500 3.489 10 0 GGAEMN O=C(CCN1CCN(c2ccc(F)cc2F)CC1)N1CCc2ccccc2C1 ZINC000144755260 1417671363 /nfs/dbraw/zinc/67/13/63/1417671363.db2.gz CZMMCEDVUFATIC-UHFFFAOYSA-N 0 1 385.458 3.062 10 0 GGAEMN CC(C)(C)OC(=O)N1CCc2cc(NS(=O)(=O)c3cccnc3)ccc2C1 ZINC000146522423 1417722399 /nfs/dbraw/zinc/72/23/99/1417722399.db2.gz LFGWEKXVJABOAL-UHFFFAOYSA-N 0 1 389.477 3.176 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2ccc(OC(F)F)c(OC)c2)C1=O ZINC000151511199 1418009582 /nfs/dbraw/zinc/00/95/82/1418009582.db2.gz HZGCYLTYYUHYKT-CQSZACIVSA-N 0 1 392.402 3.200 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)N2CCN(c3cccs3)CC2)CC1 ZINC000152487945 1422117848 /nfs/dbraw/zinc/11/78/48/1422117848.db2.gz NCCMMWJMSUTKSO-UHFFFAOYSA-N 0 1 399.564 3.244 10 0 GGAEMN COc1cc(CN2CC[C@@H](NCc3c(Cl)nc(Cl)n3C)C2)cc(OC)c1 ZINC000153362253 1422494692 /nfs/dbraw/zinc/49/46/92/1422494692.db2.gz GAIORYNSNNHUCK-CYBMUJFWSA-N 0 1 399.322 3.108 10 0 GGAEMN Cc1nn(C)c(N2CCOCC2)c1CN[C@H](C)c1cccc(N2CCCC2)c1 ZINC000154142629 1422846274 /nfs/dbraw/zinc/84/62/74/1422846274.db2.gz BKPJEZAOWOCPGJ-QGZVFWFLSA-N 0 1 383.540 3.016 10 0 GGAEMN COc1ccc([C@H](C)NCCS(=O)(=O)c2ccccc2)cc1Cn1cccn1 ZINC000154149096 1422846977 /nfs/dbraw/zinc/84/69/77/1422846977.db2.gz BCWAUECJHOSIOV-KRWDZBQOSA-N 0 1 399.516 3.065 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2ccc(OCC(F)F)cc2)C1=O ZINC000154437995 1422888854 /nfs/dbraw/zinc/88/88/54/1422888854.db2.gz AKANPJFJBFJMFY-MRXNPFEDSA-N 0 1 376.403 3.234 10 0 GGAEMN CCOc1ccc(CN[C@@H]2CCN(c3ccccc3OC)C2=O)cc1OCC ZINC000154441711 1422889135 /nfs/dbraw/zinc/88/91/35/1422889135.db2.gz BJJUVZPLOODPMS-QGZVFWFLSA-N 0 1 384.476 3.388 10 0 GGAEMN CCOc1ccc(CN[C@H]2CCN(c3ccccc3OC)C2=O)cc1OCC ZINC000154441819 1422889171 /nfs/dbraw/zinc/88/91/71/1422889171.db2.gz BJJUVZPLOODPMS-KRWDZBQOSA-N 0 1 384.476 3.388 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2cn(-c3ccccc3)nc2C)C1=O ZINC000154453278 1422890917 /nfs/dbraw/zinc/89/09/17/1422890917.db2.gz FSKXERPLCUVJOL-LJQANCHMSA-N 0 1 376.460 3.084 10 0 GGAEMN COCCOc1ccc(CNC(=O)CN[C@H](C)c2ccc(Cl)cc2)cc1 ZINC000154907400 1423076278 /nfs/dbraw/zinc/07/62/78/1423076278.db2.gz FKYUKHCCORIAKK-OAHLLOKOSA-N 0 1 376.884 3.332 10 0 GGAEMN C[C@@H](NCC(=O)NCc1ccccc1CN1CCCC1=O)c1ccc(Cl)cc1 ZINC000154910792 1423077596 /nfs/dbraw/zinc/07/75/96/1423077596.db2.gz GAFAQOIIUIPHHR-MRXNPFEDSA-N 0 1 399.922 3.429 10 0 GGAEMN COc1ccc([C@H]2CCN([C@@H](C)C(=O)Nc3cccc(NC(C)=O)c3)C2)cc1 ZINC000155236974 1423264584 /nfs/dbraw/zinc/26/45/84/1423264584.db2.gz FYJUHFTZEVYYNP-YJBOKZPZSA-N 0 1 381.476 3.470 10 0 GGAEMN COc1cc(C)cc(CNC(=O)C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)c1 ZINC000179905503 1429633570 /nfs/dbraw/zinc/63/35/70/1429633570.db2.gz BHAJDNDXJZKCNA-UHFFFAOYSA-N 0 1 388.374 3.072 10 0 GGAEMN C[S@@](=O)c1ccc(CNCc2cccc(NC(=O)c3ccncc3)c2)cc1 ZINC000155604517 1423441518 /nfs/dbraw/zinc/44/15/18/1423441518.db2.gz HBMDFRZJGPTLIN-MHZLTWQESA-N 0 1 379.485 3.361 10 0 GGAEMN Cc1nc(SCCC(=O)N2CCC[C@@H](c3nc4ccc(C)cc4[nH]3)C2)n[nH]1 ZINC000155760999 1423521745 /nfs/dbraw/zinc/52/17/45/1423521745.db2.gz AQHUHDFJDVMZTL-CQSZACIVSA-N 0 1 384.509 3.186 10 0 GGAEMN CN(CC(=O)Nc1ccccc1C(=O)Nc1ccc(F)cc1)CC1CCOCC1 ZINC000155977525 1423617017 /nfs/dbraw/zinc/61/70/17/1423617017.db2.gz BYTACJAUJKTMQE-UHFFFAOYSA-N 0 1 399.466 3.375 10 0 GGAEMN O=C1[C@@H](NCc2cnn(-c3ccc(Cl)cc3)c2)CCCN1CC(F)(F)F ZINC000158361466 1424237051 /nfs/dbraw/zinc/23/70/51/1424237051.db2.gz DNHIMKHGZGUFIO-HNNXBMFYSA-N 0 1 386.805 3.169 10 0 GGAEMN CCOc1cc(CN[C@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1OC ZINC000159942061 1424554932 /nfs/dbraw/zinc/55/49/32/1424554932.db2.gz DIGHDKVWJVYXGD-HXUWFJFHSA-N 0 1 382.504 3.417 10 0 GGAEMN CCN(C[C@H](O)c1ccc(C)cc1)[C@@H](C)C(=O)Nc1cc(C(=O)OC)ccc1C ZINC000159950453 1424555464 /nfs/dbraw/zinc/55/54/64/1424555464.db2.gz FKSJMMHXLWXAPQ-UWJYYQICSA-N 0 1 398.503 3.473 10 0 GGAEMN O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)N1CCN2CCCC[C@@H]2C1 ZINC000160668931 1424624356 /nfs/dbraw/zinc/62/43/56/1424624356.db2.gz UBOIZTWRSWUILI-OAHLLOKOSA-N 0 1 391.878 3.426 10 0 GGAEMN COc1cc([C@@H](C)N[C@H](CCO)c2ccccc2)ccc1S(=O)(=O)C(F)F ZINC000161042041 1424654121 /nfs/dbraw/zinc/65/41/21/1424654121.db2.gz FFQWIPYWBKESFQ-CZUORRHYSA-N 0 1 399.459 3.466 10 0 GGAEMN Fc1ccc(CNCc2ccccc2OCCN2CCOCC2)cc1Cl ZINC000161147924 1424662560 /nfs/dbraw/zinc/66/25/60/1424662560.db2.gz GUMCMZAJPGWMCF-UHFFFAOYSA-N 0 1 378.875 3.480 10 0 GGAEMN CC(C)(C)CCN1CCN(C(=O)c2cc(N3CCCC3=O)ccc2F)CC1 ZINC000161379877 1424682526 /nfs/dbraw/zinc/68/25/26/1424682526.db2.gz OGWMDLPLZGFKQT-UHFFFAOYSA-N 0 1 375.488 3.147 10 0 GGAEMN Cc1cc(=O)n(C)cc1NC(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1 ZINC000161951321 1424802546 /nfs/dbraw/zinc/80/25/46/1424802546.db2.gz AIHPYMLEVJVYQW-GOSISDBHSA-N 0 1 388.899 3.306 10 0 GGAEMN COc1ccc2c(CC(=O)NCCc3nnc(-c4ccccc4)[nH]3)coc2c1 ZINC000162893595 1424900111 /nfs/dbraw/zinc/90/01/11/1424900111.db2.gz BDASFDWUJXOFPJ-UHFFFAOYSA-N 0 1 376.416 3.128 10 0 GGAEMN CC(C)CCN1C(=O)CC[C@]2(C(=O)N3CCN(CC(C)C)CC3)CCCC[C@@H]12 ZINC000169755882 1425247660 /nfs/dbraw/zinc/24/76/60/1425247660.db2.gz CIPYDMUMQIXZOY-NFBKMPQASA-N 0 1 391.600 3.384 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC[C@H](Cc2noc(-c3cccnc3)n2)C1 ZINC000169771030 1425251435 /nfs/dbraw/zinc/25/14/35/1425251435.db2.gz LMBITMZGLJCZOZ-CQSZACIVSA-N 0 1 388.431 3.103 10 0 GGAEMN O=C(NC[C@@H]1Cn2cccc2CN1Cc1ccccc1)c1n[nH]c2ccccc21 ZINC000169779190 1425254926 /nfs/dbraw/zinc/25/49/26/1425254926.db2.gz GUVKXUNNIAHMEJ-LJQANCHMSA-N 0 1 385.471 3.179 10 0 GGAEMN Cc1ccncc1-c1noc(-c2cc(I)ccc2O)n1 ZINC000235783588 1433373654 /nfs/dbraw/zinc/37/36/54/1433373654.db2.gz RZNZUQKLCGUAKP-UHFFFAOYSA-N 0 1 379.157 3.417 10 0 GGAEMN Cc1ccc(-c2cc(C(=O)N3CCCN(Cc4cscn4)CC3)n[nH]2)cc1 ZINC000171022335 1425442198 /nfs/dbraw/zinc/44/21/98/1425442198.db2.gz CHNSIZQQIBZZQN-UHFFFAOYSA-N 0 1 381.505 3.190 10 0 GGAEMN C[C@H](NC(=O)[C@H](C)N1CCC(C2OCCO2)CC1)c1cccc2ccccc21 ZINC000171238298 1425560224 /nfs/dbraw/zinc/56/02/24/1425560224.db2.gz IBCLFQCOGZAMKO-IRXDYDNUSA-N 0 1 382.504 3.490 10 0 GGAEMN C[C@@H](NC(=O)[C@H](C)N1CCC(C2OCCO2)CC1)c1cccc2ccccc21 ZINC000171238303 1425561046 /nfs/dbraw/zinc/56/10/46/1425561046.db2.gz IBCLFQCOGZAMKO-SJORKVTESA-N 0 1 382.504 3.490 10 0 GGAEMN O=c1[nH]c2ccccc2cc1CN1CCN(c2ccc(C(F)(F)F)cn2)CC1 ZINC000171912521 1425850847 /nfs/dbraw/zinc/85/08/47/1425850847.db2.gz DAWNUYMXGSWDCA-UHFFFAOYSA-N 0 1 388.393 3.264 10 0 GGAEMN CC(C)(C)OC(=O)N1CC[C@@H](CN2CCN(c3nc4ccccc4o3)CC2)C1 ZINC000172790664 1426189684 /nfs/dbraw/zinc/18/96/84/1426189684.db2.gz RGQJDWRAPIKCCX-INIZCTEOSA-N 0 1 386.496 3.207 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCN([C@H](C)c3ccc(Cl)cc3)CC2)[nH]1 ZINC000173340700 1426520297 /nfs/dbraw/zinc/52/02/97/1426520297.db2.gz FOQBIEYGSFDRSW-CYBMUJFWSA-N 0 1 393.944 3.154 10 0 GGAEMN CCN1CCN([C@H]2CCN(C(=O)c3sc4ccc(OC)cc4c3C)C2)CC1 ZINC000173589316 1426752747 /nfs/dbraw/zinc/75/27/47/1426752747.db2.gz VRZBJESXDORNAX-INIZCTEOSA-N 0 1 387.549 3.070 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)[nH]1 ZINC000174175604 1427033412 /nfs/dbraw/zinc/03/34/12/1427033412.db2.gz ANSZXDBRURSQEH-UHFFFAOYSA-N 0 1 382.493 3.434 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@@H](C)c2noc(-c3ccc(Cl)cc3)n2)[nH]1 ZINC000175101027 1427546239 /nfs/dbraw/zinc/54/62/39/1427546239.db2.gz ABTOBXCUEFHLFM-VIFPVBQESA-N 0 1 392.872 3.176 10 0 GGAEMN CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2nn(-c3ccc(F)cc3C)cc2[O-])C1 ZINC000176012790 1428027032 /nfs/dbraw/zinc/02/70/32/1428027032.db2.gz HORQBQGOZWIQNH-MRXNPFEDSA-N 0 1 397.454 3.262 10 0 GGAEMN CC(=O)N1CC[C@@H](C(=O)Nc2ccc3nc(Cc4ccccc4F)[nH]c3c2)C1 ZINC000176179548 1428144299 /nfs/dbraw/zinc/14/42/99/1428144299.db2.gz HVCCNMAPHWBDHA-OAHLLOKOSA-N 0 1 380.423 3.100 10 0 GGAEMN COc1cccc(S(=O)(=O)CCN[C@@H](C)c2ccc(-n3cccn3)cc2)c1 ZINC000180826381 1430059750 /nfs/dbraw/zinc/05/97/50/1430059750.db2.gz CVPUTIRSBXFILK-INIZCTEOSA-N 0 1 385.489 3.005 10 0 GGAEMN COc1cc(NC(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)cc(OC)c1 ZINC000180849709 1430069067 /nfs/dbraw/zinc/06/90/67/1430069067.db2.gz DNKFFTWJEJKKDZ-OAHLLOKOSA-N 0 1 380.448 3.179 10 0 GGAEMN COC(=O)[C@H](NC(=O)c1cccc(-c2nnc[nH]2)c1)c1ccc2ccccc2c1 ZINC000180915544 1430111438 /nfs/dbraw/zinc/11/14/38/1430111438.db2.gz BBSXMKKACNRBQI-LJQANCHMSA-N 0 1 386.411 3.269 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1ccc2c(c1)N(C)CC2 ZINC000181162241 1430232861 /nfs/dbraw/zinc/23/28/61/1430232861.db2.gz DYFMEXYOXOVVKZ-UHFFFAOYSA-N 0 1 397.294 3.251 10 0 GGAEMN Cc1nc(CC(=O)N2CCC[C@H](c3nnc(-c4ccccc4)[nH]3)C2)c(C)s1 ZINC000181328805 1430274406 /nfs/dbraw/zinc/27/44/06/1430274406.db2.gz GRYYJYAXUQTJRB-INIZCTEOSA-N 0 1 381.505 3.494 10 0 GGAEMN CNC(=O)[C@@H](NC(=O)CN[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccccc1 ZINC000181531551 1430316110 /nfs/dbraw/zinc/31/61/10/1430316110.db2.gz IAUOVVVIAJRYMR-SGTLLEGYSA-N 0 1 394.302 3.248 10 0 GGAEMN COC(=O)Nc1ccc(CNC(=O)CN[C@@H](C)c2ccc(F)c(F)c2)cc1 ZINC000181624465 1430329930 /nfs/dbraw/zinc/32/99/30/1430329930.db2.gz FNJRWJAICLCEDA-LBPRGKRZSA-N 0 1 377.391 3.110 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccc(F)c(F)c1 ZINC000181640131 1430332905 /nfs/dbraw/zinc/33/29/05/1430332905.db2.gz CNDOUSZCSWAZRM-DJJJIMSYSA-N 0 1 378.394 3.355 10 0 GGAEMN O=C(Nc1ccccc1CN1CCC(O)CC1)c1cnc(-c2ccncc2)s1 ZINC000182064559 1430404736 /nfs/dbraw/zinc/40/47/36/1430404736.db2.gz DYTKQOHNVGGZMF-UHFFFAOYSA-N 0 1 394.500 3.414 10 0 GGAEMN Clc1cc(CCN2CCCN(c3cccnn3)CC2)cc2c1OCCCO2 ZINC000182752928 1430533785 /nfs/dbraw/zinc/53/37/85/1430533785.db2.gz LQDBXBNQGGTDMS-UHFFFAOYSA-N 0 1 388.899 3.046 10 0 GGAEMN COc1cc(OC)c(CNC(=O)CN[C@H](C)c2ccc(Cl)s2)c(OC)c1 ZINC000182984559 1430585560 /nfs/dbraw/zinc/58/55/60/1430585560.db2.gz BPQZCLDFWUYTCF-LLVKDONJSA-N 0 1 398.912 3.394 10 0 GGAEMN CCO[C@@H](C)c1noc(CN2CCN([C@@H](C)CCc3cccc(F)c3)CC2)n1 ZINC000183365122 1430690593 /nfs/dbraw/zinc/69/05/93/1430690593.db2.gz FJPHAHGNGDSWKO-IRXDYDNUSA-N 0 1 390.503 3.445 10 0 GGAEMN COc1ccc([C@@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)cc1F ZINC000185293643 1431102065 /nfs/dbraw/zinc/10/20/65/1431102065.db2.gz IAAJVYGLYDHNFK-CQSZACIVSA-N 0 1 378.469 3.225 10 0 GGAEMN COC(=O)c1ccc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)c(F)c1 ZINC000186029137 1431314104 /nfs/dbraw/zinc/31/41/04/1431314104.db2.gz ISZIKJPFWALHQK-ZVZYQTTQSA-N 0 1 392.471 3.347 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(OC(F)F)c3cccnc23)[nH]1 ZINC000186391752 1431399094 /nfs/dbraw/zinc/39/90/94/1431399094.db2.gz FCSJOFSIQBXCSN-UHFFFAOYSA-N 0 1 379.392 3.384 10 0 GGAEMN CCOc1cc(C(=O)NCc2ccc(OCC[NH+](C)C)cc2)cc(Cl)c1[O-] ZINC000186775217 1431513529 /nfs/dbraw/zinc/51/35/29/1431513529.db2.gz FFUSTXDWPXIWJO-UHFFFAOYSA-N 0 1 392.883 3.315 10 0 GGAEMN Cc1nc(C)n(C[C@H]2CCCN(C(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)C2)n1 ZINC000187069292 1431604779 /nfs/dbraw/zinc/60/47/79/1431604779.db2.gz USZXEPLVWHLOAJ-SFHVURJKSA-N 0 1 392.507 3.454 10 0 GGAEMN CN(CCCc1ccccc1)C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2 ZINC000187369112 1431711068 /nfs/dbraw/zinc/71/10/68/1431711068.db2.gz CHFHJCDMXNYJPD-UHFFFAOYSA-N 0 1 398.507 3.408 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N(C)CC1CCOCC1)c1cccc(C(F)(F)F)c1 ZINC000187473200 1431741849 /nfs/dbraw/zinc/74/18/49/1431741849.db2.gz HHPZNIHVMJCVKG-KRWDZBQOSA-N 0 1 387.446 3.376 10 0 GGAEMN C[C@@H]1c2ccccc2CCN1C(=O)c1[nH]nc2c1CN(C(=O)OC(C)(C)C)CC2 ZINC000187804015 1431814416 /nfs/dbraw/zinc/81/44/16/1431814416.db2.gz GCLGOVZYYRNFES-CQSZACIVSA-N 0 1 396.491 3.462 10 0 GGAEMN FC(F)(F)c1nnc(N2CCN(Cc3cnc(-c4ccccc4)[nH]3)CC2)s1 ZINC000188665628 1431925609 /nfs/dbraw/zinc/92/56/09/1431925609.db2.gz AUNGWXTYARUVOT-UHFFFAOYSA-N 0 1 394.426 3.269 10 0 GGAEMN Cc1ccc(-c2cc(C(=O)N3CCCN(Cc4cscn4)CC3)n[nH]2)cc1C ZINC000189624450 1432181725 /nfs/dbraw/zinc/18/17/25/1432181725.db2.gz FDGTVUUPMWGDGT-UHFFFAOYSA-N 0 1 395.532 3.498 10 0 GGAEMN CN(Cc1cccnc1)C[C@H]1CCN(C(=O)CCC(=O)c2ccc(F)cc2)C1 ZINC000190574542 1432410970 /nfs/dbraw/zinc/41/09/70/1432410970.db2.gz AOMVCXSWZRSDLX-GOSISDBHSA-N 0 1 383.467 3.164 10 0 GGAEMN CCc1n[nH]c(C2CCN([C@H](C)C(=O)Nc3cc(Cl)ccc3OC)CC2)n1 ZINC000190666290 1432437211 /nfs/dbraw/zinc/43/72/11/1432437211.db2.gz NHOFKFUWFLQXJG-GFCCVEGCSA-N 0 1 391.903 3.236 10 0 GGAEMN CCc1nnc(C2CCN([C@H](C)C(=O)Nc3cc(Cl)ccc3OC)CC2)[nH]1 ZINC000190666290 1432437212 /nfs/dbraw/zinc/43/72/12/1432437212.db2.gz NHOFKFUWFLQXJG-GFCCVEGCSA-N 0 1 391.903 3.236 10 0 GGAEMN COc1cc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)ccc1F ZINC000190759820 1432470104 /nfs/dbraw/zinc/47/01/04/1432470104.db2.gz XPQVKOPZSOVKFU-NVXWUHKLSA-N 0 1 392.496 3.166 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N(C)[C@@H]3CCN(Cc4ccccc4)C3=O)[nH]c21 ZINC000191833590 1432735581 /nfs/dbraw/zinc/73/55/81/1432735581.db2.gz SDLATZDNXGBZKZ-LJQANCHMSA-N 0 1 390.487 3.063 10 0 GGAEMN CC(C)Oc1ccc(CCNC(=O)CN[C@@H]2CCO[C@H]2c2ccccc2)cc1 ZINC000191974619 1432773031 /nfs/dbraw/zinc/77/30/31/1432773031.db2.gz IBHZNCJPRVTSAZ-GGAORHGYSA-N 0 1 382.504 3.252 10 0 GGAEMN COc1ccc(OC[C@@H](O)CN2CCC(C(=O)c3ccc(F)cc3)CC2)cc1 ZINC000192462336 1432847437 /nfs/dbraw/zinc/84/74/37/1432847437.db2.gz SBZXYCBOLIBVDM-IBGZPJMESA-N 0 1 387.451 3.169 10 0 GGAEMN Cc1nc(C2(NC(=O)CSc3nc(-c4ccc(C)cc4)n[nH]3)CCCC2)no1 ZINC000193660874 1433035857 /nfs/dbraw/zinc/03/58/57/1433035857.db2.gz CVZXWDQMKQECIB-UHFFFAOYSA-N 0 1 398.492 3.149 10 0 GGAEMN COCc1ccc(NS(=O)(=O)c2cc(Br)ccc2OC)cc1 ZINC000194241564 1433146823 /nfs/dbraw/zinc/14/68/23/1433146823.db2.gz GVEYMQYAJGTNKZ-UHFFFAOYSA-N 0 1 386.267 3.405 10 0 GGAEMN Cc1ccc2nc([C@H]3CCCN3C(=O)C(=O)Nc3ccc4c(c3)CCO4)[nH]c2c1 ZINC000194696142 1433216647 /nfs/dbraw/zinc/21/66/47/1433216647.db2.gz HOOAHMLDTFLMFY-GOSISDBHSA-N 0 1 390.443 3.108 10 0 GGAEMN O=C(CCN1CCN(c2ccc(F)cc2)CC1)NCc1ccccc1Cl ZINC000198380589 1433349692 /nfs/dbraw/zinc/34/96/92/1433349692.db2.gz DSVGFFKGIZSLEN-UHFFFAOYSA-N 0 1 375.875 3.308 10 0 GGAEMN Cc1cccc(-c2noc(-c3cc(I)ccc3O)n2)n1 ZINC000236008296 1433374094 /nfs/dbraw/zinc/37/40/94/1433374094.db2.gz XFMLMMQVRRYVLX-UHFFFAOYSA-N 0 1 379.157 3.417 10 0 GGAEMN CCN(C(C)=O)c1nc(CNCC(C)(C)N2CCc3ccccc3C2)cs1 ZINC000236823132 1433380199 /nfs/dbraw/zinc/38/01/99/1433380199.db2.gz ALYGQJPBCITQAD-UHFFFAOYSA-N 0 1 386.565 3.442 10 0 GGAEMN CCOc1c(Cl)cc(CNCc2ccc(S(C)(=O)=O)cc2)cc1OC ZINC000236850608 1433380875 /nfs/dbraw/zinc/38/08/75/1433380875.db2.gz GWIVTHZAGMDQHC-UHFFFAOYSA-N 0 1 383.897 3.441 10 0 GGAEMN CC(C)n1ncc2cc(CN[C@H](CN3CCOCC3)c3ccccc3)cnc21 ZINC000236868923 1433381396 /nfs/dbraw/zinc/38/13/96/1433381396.db2.gz BWMPGKLNVYPTEJ-OAQYLSRUSA-N 0 1 379.508 3.175 10 0 GGAEMN COc1ccccc1N1CC[C@@H](NCc2cccc(OC(F)(F)F)c2)C1=O ZINC000237097369 1433388901 /nfs/dbraw/zinc/38/89/01/1433388901.db2.gz DMOGFXPSAOWSCU-OAHLLOKOSA-N 0 1 380.366 3.489 10 0 GGAEMN COc1cc(CNC(=O)[C@@H]2Cc3ccccc3CN2)ccc1OCCC(C)C ZINC000237318158 1433397270 /nfs/dbraw/zinc/39/72/70/1433397270.db2.gz FSCUBUVAMOTCEN-FQEVSTJZSA-N 0 1 382.504 3.451 10 0 GGAEMN Fc1cc(CNCc2cnc(N3CCOCC3)s2)ccc1Br ZINC000237859222 1433429679 /nfs/dbraw/zinc/42/96/79/1433429679.db2.gz CKAHRIUYNFPZQW-UHFFFAOYSA-N 0 1 386.290 3.171 10 0 GGAEMN COC(=O)c1cccc(NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000242551128 1433446755 /nfs/dbraw/zinc/44/67/55/1433446755.db2.gz CBEISBGIHBHHNG-UHFFFAOYSA-N 0 1 384.505 3.034 10 0 GGAEMN COc1ccc(OC)c(NC(=S)Nc2ccc(N3CCN(C)CC3)cc2)c1 ZINC000243430950 1433449606 /nfs/dbraw/zinc/44/96/06/1433449606.db2.gz MZERHRYZHALLQV-UHFFFAOYSA-N 0 1 386.521 3.265 10 0 GGAEMN CCCC(=O)NC[C@@H]1CCCN([C@H](C)C(=O)N2c3ccccc3CC[C@H]2C)C1 ZINC000245389016 1433457536 /nfs/dbraw/zinc/45/75/36/1433457536.db2.gz GGZIGRTZAOZDGG-QRVBRYPASA-N 0 1 385.552 3.371 10 0 GGAEMN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000245557277 1433484679 /nfs/dbraw/zinc/48/46/79/1433484679.db2.gz ATRXPYDRROUYMO-ABSDTBQOSA-N 0 1 398.507 3.358 10 0 GGAEMN C[C@@H]1CC[N@@H+](CC(=O)NCc2ccc(F)cc2C(F)(F)F)C[C@H]1n1ccnc1 ZINC000245558274 1433484982 /nfs/dbraw/zinc/48/49/82/1433484982.db2.gz BDOHURDCXPATKE-CXAGYDPISA-N 0 1 398.404 3.240 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@H](C)[C@H](n3ccnc3)C2)C2CC2)cc1 ZINC000245561847 1433485404 /nfs/dbraw/zinc/48/54/04/1433485404.db2.gz CIMFADQUIBKWON-SAWYMBPVSA-N 0 1 382.508 3.042 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000246063901 1433563276 /nfs/dbraw/zinc/56/32/76/1433563276.db2.gz ANEXWMYGJPMREL-YQVWRLOYSA-N 0 1 393.535 3.160 10 0 GGAEMN C[C@H](NC(=O)[C@H]1C[C@H]1c1c(F)cccc1F)C1(N2CCOCC2)CCCC1 ZINC000246108052 1433570089 /nfs/dbraw/zinc/57/00/89/1433570089.db2.gz BTLRZLCPWTXDGI-XHSDSOJGSA-N 0 1 378.463 3.218 10 0 GGAEMN CCN(C)[C@@H](C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000246294647 1433591085 /nfs/dbraw/zinc/59/10/85/1433591085.db2.gz CJQPAWGPOHRIOG-PKOBYXMFSA-N 0 1 389.540 3.443 10 0 GGAEMN C[C@@H]1CCN([C@H]2CC(=O)N(c3cccc4ccccc43)C2=O)C[C@@H]1n1ccnc1 ZINC000246409147 1433608885 /nfs/dbraw/zinc/60/88/85/1433608885.db2.gz BYCSFFDNQWZEDF-CZAAIQMYSA-N 0 1 388.471 3.251 10 0 GGAEMN COc1cc([C@H](C)N[C@@H]2c3ccccc3C[C@H]2O)ccc1S(=O)(=O)C(F)F ZINC000246855674 1433678931 /nfs/dbraw/zinc/67/89/31/1433678931.db2.gz CHBGZCXQSICLPX-BKGUAONASA-N 0 1 397.443 3.000 10 0 GGAEMN COc1cc([C@H](C)N[C@H]2c3ccccc3C[C@H]2O)ccc1S(=O)(=O)C(F)F ZINC000246855732 1433679013 /nfs/dbraw/zinc/67/90/13/1433679013.db2.gz CHBGZCXQSICLPX-POHZPAGDSA-N 0 1 397.443 3.000 10 0 GGAEMN CCOC(=O)c1nn(C)cc1CN1CCCCC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000248677647 1433814877 /nfs/dbraw/zinc/81/48/77/1433814877.db2.gz DLJNDWNQFSLOTM-WOJBJXKFSA-N 0 1 385.508 3.465 10 0 GGAEMN CCCNC(=O)[C@@H]1CCCN([C@H](C)C(=O)N[C@@H](C)c2cc3ccccc3o2)C1 ZINC000250428738 1433856237 /nfs/dbraw/zinc/85/62/37/1433856237.db2.gz HBQDIQORCFQHBC-LZLYRXPVSA-N 0 1 385.508 3.237 10 0 GGAEMN O=C(CN1CCCCCC1)N1CC(=O)N(Cc2ccccc2)C2(CCCCC2)C1 ZINC000257173904 1433893228 /nfs/dbraw/zinc/89/32/28/1433893228.db2.gz AESIBAQALOSZDF-UHFFFAOYSA-N 0 1 397.563 3.436 10 0 GGAEMN COCCN1CC2(CCN(C(=O)c3ccccc3OC)CC2)[C@@H]1c1ccncc1 ZINC000257174639 1433893262 /nfs/dbraw/zinc/89/32/62/1433893262.db2.gz JAZKLRLJHKUTKP-NRFANRHFSA-N 0 1 395.503 3.016 10 0 GGAEMN Cc1cc(C(=O)N2CCCC[C@H]2c2noc(COc3ccc(F)cc3)n2)n[nH]1 ZINC000257176117 1433893453 /nfs/dbraw/zinc/89/34/53/1433893453.db2.gz AETWGKDIGJIGAF-INIZCTEOSA-N 0 1 385.399 3.187 10 0 GGAEMN Cc1ccc(C[N@H+]2CCC[C@H](C(=O)NCc3ccccc3)CCNC(=O)CC2)o1 ZINC000257184871 1433894104 /nfs/dbraw/zinc/89/41/04/1433894104.db2.gz VMSZNKBOXSHUMB-FQEVSTJZSA-N 0 1 397.519 3.013 10 0 GGAEMN Cc1cc(Cl)ccc1NC(=O)N1CCC[C@H]1c1nnc2n1CCN(C)CC2 ZINC000257190459 1433894565 /nfs/dbraw/zinc/89/45/65/1433894565.db2.gz MRXJMBXRSLEONU-INIZCTEOSA-N 0 1 388.903 3.097 10 0 GGAEMN CCN1C(=O)CCN(Cc2cccc(OC(F)(F)F)c2)CC12CCOCC2 ZINC000257194545 1433894814 /nfs/dbraw/zinc/89/48/14/1433894814.db2.gz UGODAUPNJVFQKK-UHFFFAOYSA-N 0 1 386.414 3.189 10 0 GGAEMN CC(C)C(=O)N1CCCn2ccnc2[C@H]1C1CCN(Cc2cccnc2)CC1 ZINC000257196729 1433894908 /nfs/dbraw/zinc/89/49/08/1433894908.db2.gz YTWCWJKBQLMELS-HXUWFJFHSA-N 0 1 381.524 3.120 10 0 GGAEMN Cc1noc(-c2ccccc2O[C@H]2CCN(C(=O)c3[nH]nc4ccccc43)C2)n1 ZINC000257196379 1433894933 /nfs/dbraw/zinc/89/49/33/1433894933.db2.gz YCYUDZUGDVHIIS-AWEZNQCLSA-N 0 1 389.415 3.215 10 0 GGAEMN C[C@@H]1CCCC[C@@H]1N(C)C(=O)CN1CCC(CNC(=O)OC(C)(C)C)CC1 ZINC000261379266 1433895533 /nfs/dbraw/zinc/89/55/33/1433895533.db2.gz DOBWBXMSLIONMJ-AEFFLSMTSA-N 0 1 381.561 3.260 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@@H](C)N2CCC(n3c(C)ccc3C)CC2)c1 ZINC000263661592 1434016783 /nfs/dbraw/zinc/01/67/83/1434016783.db2.gz DTDOJAUYXYGGKF-QGZVFWFLSA-N 0 1 382.508 3.129 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2cccc(NC(=O)OCC(C)C)c2)[nH]1 ZINC000266807018 1434377381 /nfs/dbraw/zinc/37/73/81/1434377381.db2.gz FCBAPAOMZMLTLZ-UHFFFAOYSA-N 0 1 377.470 3.439 10 0 GGAEMN C[C@H](C(=O)Nc1ccccc1Cc1ccccc1)N1CCC2(CNC(=O)C2)CC1 ZINC000267736630 1434459721 /nfs/dbraw/zinc/45/97/21/1434459721.db2.gz BVYFWLDBSQQONE-GOSISDBHSA-N 0 1 391.515 3.207 10 0 GGAEMN CC(=O)Nc1ccc(O)c(C(=O)Nc2ccc3nc([C@H]4CCCO4)[nH]c3c2)c1 ZINC000270034502 1434695279 /nfs/dbraw/zinc/69/52/79/1434695279.db2.gz IEQRPRBOYLWWJM-GOSISDBHSA-N 0 1 380.404 3.331 10 0 GGAEMN CCC(=O)N[C@H](CCSC)C(=O)Nc1cccc2c1CN(CC(C)C)C2 ZINC000270997176 1434794282 /nfs/dbraw/zinc/79/42/82/1434794282.db2.gz HASNOOGHTOXREW-GOSISDBHSA-N 0 1 377.554 3.245 10 0 GGAEMN CCCCCC(=O)NC1CCN(Cc2cc(OC)c(OC)c(OC)c2)CC1 ZINC000271140672 1434804348 /nfs/dbraw/zinc/80/43/48/1434804348.db2.gz AEJNVOSQIMYNFD-UHFFFAOYSA-N 0 1 378.513 3.373 10 0 GGAEMN CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](C(=O)Nc2ccccc2-c2nnc[nH]2)C1 ZINC000271487841 1434829017 /nfs/dbraw/zinc/82/90/17/1434829017.db2.gz FXRDTPYLGJRGRE-UONOGXRCSA-N 0 1 385.468 3.494 10 0 GGAEMN Cc1nn(C)c(Cl)c1/C=C/C(=O)N1CC[C@@H](n2c(C)nc3c2CCCC3)C1 ZINC000275217354 1435123662 /nfs/dbraw/zinc/12/36/62/1435123662.db2.gz COKAELXILRZBHJ-XVJNWHFHSA-N 0 1 387.915 3.252 10 0 GGAEMN COc1ccc(C[NH2+][C@@H](CC(=O)[O-])c2ccc(F)cc2F)c(OC)c1OC ZINC000277215048 1435279645 /nfs/dbraw/zinc/27/96/45/1435279645.db2.gz HLPXHMASGPFJJB-HNNXBMFYSA-N 0 1 381.375 3.296 10 0 GGAEMN Cc1cc([C@H]2CCCN(C(=O)C=Cc3ccc(C(=O)NC4CC4)cc3)C2)n[nH]1 ZINC000283336966 1435884932 /nfs/dbraw/zinc/88/49/32/1435884932.db2.gz AOIVYVMUSLRXQM-QKIXSCASSA-N 0 1 378.476 3.030 10 0 GGAEMN Cc1cc([C@H]2CCCN(C(=O)C=Cc3ccc(N4CCCC4=O)cc3)C2)n[nH]1 ZINC000283442114 1435890094 /nfs/dbraw/zinc/89/00/94/1435890094.db2.gz GZOUUWNAESSDOU-MZEUMTGBSA-N 0 1 378.476 3.264 10 0 GGAEMN CC[N@@H+](CCC1CCN(C(=O)c2cccc(Nc3nnn[n-]3)c2)CC1)CC(C)C ZINC001137792966 1443247817 /nfs/dbraw/zinc/24/78/17/1443247817.db2.gz ZEDOLYZFHJJPJS-UHFFFAOYSA-N 0 1 399.543 3.164 10 0 GGAEMN CC[N@H+](CCC1CCN(C(=O)c2cccc(Nc3nn[n-]n3)c2)CC1)CC(C)C ZINC001137792966 1443247822 /nfs/dbraw/zinc/24/78/22/1443247822.db2.gz ZEDOLYZFHJJPJS-UHFFFAOYSA-N 0 1 399.543 3.164 10 0 GGAEMN CC[N@@H+](CCC1CCN(C(=O)c2cccc(Nc3nn[n-]n3)c2)CC1)CC(C)C ZINC001137792966 1443247825 /nfs/dbraw/zinc/24/78/25/1443247825.db2.gz ZEDOLYZFHJJPJS-UHFFFAOYSA-N 0 1 399.543 3.164 10 0 GGAEMN CN1CCO[C@H]2CN(c3nc(-c4cccc(Cl)c4)nc4c3CCCC4)C[C@@H]21 ZINC000301659898 719465749 /nfs/dbraw/zinc/46/57/49/719465749.db2.gz MGENGWOEIWVLDR-OALUTQOASA-N 0 1 384.911 3.195 10 0 GGAEMN CC[N@H+](CC(=O)N[C@H](C(=O)[O-])c1ccccc1F)Cc1ccc(Cl)cc1 ZINC000095464040 939031932 /nfs/dbraw/zinc/03/19/32/939031932.db2.gz CEPVXSRSYTXYKO-SFHVURJKSA-N 0 1 378.831 3.243 10 0 GGAEMN CC[N@@H+](CC(=O)N[C@H](C(=O)[O-])c1ccccc1F)Cc1ccc(Cl)cc1 ZINC000095464040 939031936 /nfs/dbraw/zinc/03/19/36/939031936.db2.gz CEPVXSRSYTXYKO-SFHVURJKSA-N 0 1 378.831 3.243 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2)[C@@H]1c1cccs1 ZINC000780584829 939138673 /nfs/dbraw/zinc/13/86/73/939138673.db2.gz HMIVPYJRLMZZNH-CGTJXYLNSA-N 0 1 387.505 3.256 10 0 GGAEMN C[N@H+]1CCC[C@@H](CNC(=O)NC2(C(=O)[O-])CCCCC2)[C@@H]1c1cccs1 ZINC000780585502 939139237 /nfs/dbraw/zinc/13/92/37/939139237.db2.gz OWFGOLFDTICMBH-GOEBONIOSA-N 0 1 379.526 3.218 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)NC2(C(=O)[O-])CCCCC2)[C@H]1c1cccs1 ZINC000780585504 939139498 /nfs/dbraw/zinc/13/94/98/939139498.db2.gz OWFGOLFDTICMBH-ZBFHGGJFSA-N 0 1 379.526 3.218 10 0 GGAEMN C[N@H+]1CCC[C@H](CNC(=O)NC2(C(=O)[O-])CCCCC2)[C@@H]1c1cccs1 ZINC000780585501 939139629 /nfs/dbraw/zinc/13/96/29/939139629.db2.gz OWFGOLFDTICMBH-GDBMZVCRSA-N 0 1 379.526 3.218 10 0 GGAEMN C[N@@H+](CCCNC(=O)N[C@H](C(=O)[O-])C1CCCCCC1)Cc1ccccc1 ZINC000908759873 939314747 /nfs/dbraw/zinc/31/47/47/939314747.db2.gz FAUXTOFXUUJDTO-IBGZPJMESA-N 0 1 375.513 3.231 10 0 GGAEMN C[C@H](CNC(=O)N[C@H](C(=O)[O-])c1ccc2ccccc2c1)[N@H+]1CCC[C@@H](C)C1 ZINC000908811662 939325326 /nfs/dbraw/zinc/32/53/26/939325326.db2.gz AAWACHKUEXGHPB-QINHECLXSA-N 0 1 383.492 3.385 10 0 GGAEMN CC1(C)CCC[C@](NC(=O)NCCC[N@H+]2CCc3ccccc3C2)(C(=O)[O-])C1 ZINC000908821418 939329313 /nfs/dbraw/zinc/32/93/13/939329313.db2.gz KUBMDXTYYNDABW-JOCHJYFZSA-N 0 1 387.524 3.158 10 0 GGAEMN C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)N[C@@H](C(=O)[O-])C2CCCCCC2)C1 ZINC000908830165 939331866 /nfs/dbraw/zinc/33/18/66/939331866.db2.gz QMOUNLXPYDMNJI-ZIFCJYIRSA-N 0 1 381.561 3.467 10 0 GGAEMN CC1(C)CCC[C@](NC(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908847183 939335136 /nfs/dbraw/zinc/33/51/36/939335136.db2.gz KPDZUASZJVWGEU-PGRDOPGGSA-N 0 1 387.524 3.374 10 0 GGAEMN CC[N@@H+](C)Cc1cccc(CNC(=O)N[C@@]2(C(=O)[O-])CCCC(C)(C)C2)c1 ZINC000908882850 939344663 /nfs/dbraw/zinc/34/46/63/939344663.db2.gz MJQYEQYGJCEENG-NRFANRHFSA-N 0 1 375.513 3.361 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@H](C(=O)[O-])c1ccc(Br)cc1 ZINC000908909863 939349564 /nfs/dbraw/zinc/34/95/64/939349564.db2.gz BTSTUWOVRAAGSR-BZNIZROVSA-N 0 1 394.269 3.101 10 0 GGAEMN CC1(C)CCC[C@@](NC(=O)NC[C@@H]2CC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908924838 939354230 /nfs/dbraw/zinc/35/42/30/939354230.db2.gz MERFLCRAXFRJTA-AVRDEDQJSA-N 0 1 387.524 3.231 10 0 GGAEMN CC1(C)CCC[C@@](NC(=O)NC[C@H]2CC[N@@H+](Cc3ccccc3)C2)(C(=O)[O-])C1 ZINC000908924839 939354379 /nfs/dbraw/zinc/35/43/79/939354379.db2.gz MERFLCRAXFRJTA-GCJKJVERSA-N 0 1 387.524 3.231 10 0 GGAEMN C[C@@]1(CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2F)CCC[N@H+]1Cc1ccccc1 ZINC000908958648 939361232 /nfs/dbraw/zinc/36/12/32/939361232.db2.gz AILMOCKXNLTPGC-KNQAVFIVSA-N 0 1 399.466 3.305 10 0 GGAEMN C[C@]1(CNC(=O)N[C@@H](C(=O)[O-])c2ccccc2F)CCC[N@H+]1Cc1ccccc1 ZINC000908958647 939361254 /nfs/dbraw/zinc/36/12/54/939361254.db2.gz AILMOCKXNLTPGC-DENIHFKCSA-N 0 1 399.466 3.305 10 0 GGAEMN C[C@]1(CNC(=O)N[C@H](C(=O)[O-])C2CCCCC2)CCC[N@H+]1Cc1ccccc1 ZINC000908960359 939361991 /nfs/dbraw/zinc/36/19/91/939361991.db2.gz RKVIQQUGCKWTRH-SIKLNZKXSA-N 0 1 387.524 3.374 10 0 GGAEMN C[C@H](CNC(=O)N[C@@H](C(=O)[O-])C1CCCCCC1)[N@@H+](C)Cc1ccccc1 ZINC000908990423 939367123 /nfs/dbraw/zinc/36/71/23/939367123.db2.gz RPKGSNARRZVKSG-VQIMIIECSA-N 0 1 375.513 3.230 10 0 GGAEMN C[C@@H](CNC(=O)N[C@H](C(=O)[O-])C1CCCCCC1)[N@@H+](C)Cc1ccccc1 ZINC000908990421 939367242 /nfs/dbraw/zinc/36/72/42/939367242.db2.gz RPKGSNARRZVKSG-LPHOPBHVSA-N 0 1 375.513 3.230 10 0 GGAEMN O=C([O-])[C@@H](NC(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1)C1CCCCCC1 ZINC000908998795 939369092 /nfs/dbraw/zinc/36/90/92/939369092.db2.gz UTONDPNOGUYMRU-UXHICEINSA-N 0 1 387.524 3.374 10 0 GGAEMN Cc1[nH+]ccn1CCCCNC(=O)N[C@@H](C(=O)[O-])c1ccc2ccccc2c1 ZINC000909053877 939374969 /nfs/dbraw/zinc/37/49/69/939374969.db2.gz BAHAUUXTLXLPRY-LJQANCHMSA-N 0 1 380.448 3.250 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@H](C(=O)[O-])c1ccc(OC)c(Cl)c1 ZINC000909795218 939733287 /nfs/dbraw/zinc/73/32/87/939733287.db2.gz JYFZCODOMYDJTA-DIFFPNOSSA-N 0 1 379.844 3.001 10 0 GGAEMN CCc1[nH+]ccn1[C@@H](C)CC(=O)N[C@@H](C(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000910379497 939755076 /nfs/dbraw/zinc/75/50/76/939755076.db2.gz IPQUSSNPEJSJOG-MEDUHNTESA-N 0 1 383.370 3.358 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@H](C(=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000911062331 939768517 /nfs/dbraw/zinc/76/85/17/939768517.db2.gz VKWQUKPQCDHQLC-BZNIZROVSA-N 0 1 383.370 3.358 10 0 GGAEMN CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@@H](C(=O)[O-])c1ccc(C(F)(F)F)cc1 ZINC000911062330 939768633 /nfs/dbraw/zinc/76/86/33/939768633.db2.gz VKWQUKPQCDHQLC-BDJLRTHQSA-N 0 1 383.370 3.358 10 0 GGAEMN O=C([O-])[C@H](NC(=O)[C@H]1CCC[N@@H+](CCc2ccccc2)C1)C1CCCCCC1 ZINC000911780710 939781715 /nfs/dbraw/zinc/78/17/15/939781715.db2.gz CUFOTPXIERCXTF-LEWJYISDSA-N 0 1 386.536 3.481 10 0 GGAEMN C[N@@H+]1CCc2[nH]c3ccc(C(=O)N[C@H](C(=O)[O-])C4CCCCCC4)cc3c2C1 ZINC000911781053 939781731 /nfs/dbraw/zinc/78/17/31/939781731.db2.gz HKIWXYLIRMLDLJ-FQEVSTJZSA-N 0 1 383.492 3.309 10 0 GGAEMN C[N@H+]1CCc2[nH]c3ccc(C(=O)N[C@H](C(=O)[O-])C4CCCCCC4)cc3c2C1 ZINC000911781053 939781733 /nfs/dbraw/zinc/78/17/33/939781733.db2.gz HKIWXYLIRMLDLJ-FQEVSTJZSA-N 0 1 383.492 3.309 10 0 GGAEMN O=C([O-])[C@H](NC(=O)[C@@H]1CCC[N@@H+](CCc2ccccc2)C1)C1CCCCCC1 ZINC000911780711 939781761 /nfs/dbraw/zinc/78/17/61/939781761.db2.gz CUFOTPXIERCXTF-NHCUHLMSSA-N 0 1 386.536 3.481 10 0 GGAEMN C[N@@H+]1CCc2[nH]c3ccc(C(=O)N[C@@H](C(=O)[O-])C4CCCCCC4)cc3c2C1 ZINC000911781054 939781770 /nfs/dbraw/zinc/78/17/70/939781770.db2.gz HKIWXYLIRMLDLJ-HXUWFJFHSA-N 0 1 383.492 3.309 10 0 GGAEMN C[N@H+]1CCc2[nH]c3ccc(C(=O)N[C@@H](C(=O)[O-])C4CCCCCC4)cc3c2C1 ZINC000911781054 939781771 /nfs/dbraw/zinc/78/17/71/939781771.db2.gz HKIWXYLIRMLDLJ-HXUWFJFHSA-N 0 1 383.492 3.309 10 0 GGAEMN C[C@H](NC(=O)N[C@]1(C(=O)[O-])CCCC(C)(C)C1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000929041076 939798819 /nfs/dbraw/zinc/79/88/19/939798819.db2.gz MJFGWUVRRQGIHT-GCKMJXCFSA-N 0 1 379.545 3.362 10 0 GGAEMN O=C([O-])[C@@]1(NC(=O)c2coc(C(F)F)c2)CCC[N@@H+](Cc2ccccc2)C1 ZINC001123277880 939819245 /nfs/dbraw/zinc/81/92/45/939819245.db2.gz OPGKLQLDYBGIGP-LJQANCHMSA-N 0 1 378.375 3.066 10 0 GGAEMN CC[C@@](NC(=O)NCCC[N@@H+](C)CC(C)C)(C(=O)[O-])c1ccc(Cl)cc1 ZINC000649529099 939833844 /nfs/dbraw/zinc/83/38/44/939833844.db2.gz DXDJWRPXUHSJJL-IBGZPJMESA-N 0 1 383.920 3.307 10 0 GGAEMN COc1ccccc1C[C@](C)(CO)NCc1nc(C)c(Br)s1 ZINC000922304282 1126134618 /nfs/dbraw/zinc/13/46/18/1126134618.db2.gz OTYJUGOWXYILOH-MRXNPFEDSA-N 0 1 385.327 3.306 10 0 GGAEMN C[C@@](CO)(Cc1ccccc1F)NCc1cn2cc(Br)ccc2n1 ZINC001198219911 1126154991 /nfs/dbraw/zinc/15/49/91/1126154991.db2.gz TWPUHBWIWOANIY-SFHVURJKSA-N 0 1 392.272 3.319 10 0 GGAEMN C[C@@](CO)(Cc1ccc(F)cc1)NCc1csc(-c2ccc(C(N)=O)cc2)n1 ZINC001460858183 1126192448 /nfs/dbraw/zinc/19/24/48/1126192448.db2.gz AOICJINDXKDFAC-NRFANRHFSA-N 0 1 399.491 3.131 10 0 GGAEMN CCc1cc2c(C[NH2+][C@@](C)(CO)Cc3ccc(OC)cc3)cc(=O)oc2cc1[O-] ZINC001473839107 1126199596 /nfs/dbraw/zinc/19/95/96/1126199596.db2.gz RXDTUJQVKQUXIW-HSZRJFAPSA-N 0 1 397.471 3.153 10 0 GGAEMN C[C@@](CO)(Cc1ccc(F)cc1)NCc1cc2c(cc1Br)OCO2 ZINC001473839653 1126199773 /nfs/dbraw/zinc/19/97/73/1126199773.db2.gz GGRWKSSWMOIBSS-SFHVURJKSA-N 0 1 396.256 3.400 10 0 GGAEMN C[C@](CO)(Cc1ccc(F)cc1)NCc1cc2c(cc1Br)OCO2 ZINC001473839652 1126199853 /nfs/dbraw/zinc/19/98/53/1126199853.db2.gz GGRWKSSWMOIBSS-GOSISDBHSA-N 0 1 396.256 3.400 10 0 GGAEMN CCc1cc2c(C[NH2+][C@](C)(CO)Cc3ccccc3F)cc(=O)oc2cc1[O-] ZINC001620624571 1126241715 /nfs/dbraw/zinc/24/17/15/1126241715.db2.gz ZYHLCPDPKUQOAA-QFIPXVFZSA-N 0 1 385.435 3.283 10 0 GGAEMN CCc1cc2c(C[NH2+][C@](C)(CO)Cc3ccccc3OC)cc(=O)oc2cc1[O-] ZINC001620536936 1126240861 /nfs/dbraw/zinc/24/08/61/1126240861.db2.gz IDTRTUSGARFEHX-QHCPKHFHSA-N 0 1 397.471 3.153 10 0 GGAEMN C[C@](CO)(Cc1ccccc1F)NCc1ccn(-c2ccc(F)cc2F)n1 ZINC001648467065 1126250712 /nfs/dbraw/zinc/25/07/12/1126250712.db2.gz VFKYGLHFYOZGRR-HXUWFJFHSA-N 0 1 375.394 3.373 10 0 GGAEMN O=c1cc(C[NH2+][C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c2ccc([O-])cc2o1 ZINC001654629484 1126253970 /nfs/dbraw/zinc/25/39/70/1126253970.db2.gz GFDRAGNQWINNIG-LPHOPBHVSA-N 0 1 393.361 3.123 10 0 GGAEMN O=c1cc(C[NH2+][C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c2ccc([O-])cc2o1 ZINC001654629483 1126254020 /nfs/dbraw/zinc/25/40/20/1126254020.db2.gz GFDRAGNQWINNIG-APWZRJJASA-N 0 1 393.361 3.123 10 0 GGAEMN O=c1cc(C[NH2+][C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c2ccc([O-])cc2o1 ZINC001654629486 1126254053 /nfs/dbraw/zinc/25/40/53/1126254053.db2.gz GFDRAGNQWINNIG-VQIMIIECSA-N 0 1 393.361 3.123 10 0 GGAEMN COC(=O)c1ccc(-c2nc(CN[C@](C)(CO)Cc3ccc(F)cc3)co2)cc1 ZINC001654940689 1126254818 /nfs/dbraw/zinc/25/48/18/1126254818.db2.gz OUNMFZDGFRVUIG-QFIPXVFZSA-N 0 1 398.434 3.351 10 0 GGAEMN COC(=O)c1sccc1CN[C@@](C)(CO)Cc1ccc(Br)cc1 ZINC001655736988 1126256305 /nfs/dbraw/zinc/25/63/05/1126256305.db2.gz YEMCLXNWLCAQMP-QGZVFWFLSA-N 0 1 398.322 3.381 10 0 GGAEMN COc1ccc(C[C@@](C)(CO)NCc2nccc(Cl)c2Cl)cc1OC ZINC001655740470 1126256336 /nfs/dbraw/zinc/25/63/36/1126256336.db2.gz URHCARRQTYSVDD-SFHVURJKSA-N 0 1 385.291 3.489 10 0 GGAEMN C[C@](CO)(Cc1ccc(F)cc1)NCc1nc2c3ccccc3oc2c(=O)[nH]1 ZINC001656293392 1126257364 /nfs/dbraw/zinc/25/73/64/1126257364.db2.gz LPBBFHUVLVVWMT-OAQYLSRUSA-N 0 1 381.407 3.304 10 0 GGAEMN C[C@@](CO)(Cc1ccc(F)cc1)NCc1nc2c3ccccc3oc2c(=O)[nH]1 ZINC001656293391 1126257376 /nfs/dbraw/zinc/25/73/76/1126257376.db2.gz LPBBFHUVLVVWMT-NRFANRHFSA-N 0 1 381.407 3.304 10 0 GGAEMN CN(C[C@@H]1COc2ccccc2O1)C(=O)CN(C)[C@H]1CCCc2ccccc21 ZINC000241588405 529957517 /nfs/dbraw/zinc/95/75/17/529957517.db2.gz PCXQMOCMSIGFOQ-QUCCMNQESA-N 0 1 380.488 3.294 10 0 GGAEMN CC(C)(C)NS(=O)(=O)c1sc(Br)cc1Br ZINC000001039591 212208704 /nfs/dbraw/zinc/20/87/04/212208704.db2.gz TZXXLPHZONLLPD-UHFFFAOYSA-N 0 1 377.123 3.350 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@@H]1CCCN(C(=O)c2cccc(OCc3ccccc3)c2)CC1 ZINC000186655920 212197470 /nfs/dbraw/zinc/19/74/70/212197470.db2.gz OEVYIQXGZAYPME-HXUWFJFHSA-N 0 1 396.487 3.277 10 0 GGAEMN Cc1c(C(=O)N2CCC[C@H]([N@@H+](C)CC(=O)[O-])CC2)sc2cccc(F)c12 ZINC000186656785 212197149 /nfs/dbraw/zinc/19/71/49/212197149.db2.gz HZBKZHNGQAMSMG-ZDUSSCGKSA-N 0 1 378.469 3.360 10 0 GGAEMN CC[C@H](C(=O)O[C@H](COCC(C)C)CN1CCN(C)CC1)c1ccccc1 ZINC000022463045 212153853 /nfs/dbraw/zinc/15/38/53/212153853.db2.gz JAHOJXDGNNONSL-SFTDATJTSA-N 0 1 376.541 3.012 10 0 in-man GGAEMN CC[C@@H](C(=O)O[C@H](COCC(C)C)CN1CCN(C)CC1)c1ccccc1 ZINC000022860106 212152939 /nfs/dbraw/zinc/15/29/39/212152939.db2.gz JAHOJXDGNNONSL-LEWJYISDSA-N 0 1 376.541 3.012 10 0 in-man GGAEMN CCOC(=O)C1C(CN2C[C@H](C)C[C@@H](C)C2)=NC(=O)N[C@H]1c1ccc(C)cc1 ZINC000245258106 212134063 /nfs/dbraw/zinc/13/40/63/212134063.db2.gz JOAZBEZPXLZMIT-QINHECLXSA-N 0 1 385.508 3.144 10 0 GGAEMN Cc1ccc(CN2CCN(Cc3nc4ccccc4nc3C)C[C@H]2CCO)cc1 ZINC000036385739 212119142 /nfs/dbraw/zinc/11/91/42/212119142.db2.gz IEXPYEPNUFXFNY-OAQYLSRUSA-N 0 1 390.531 3.315 10 0 GGAEMN COC(=O)c1sc2[nH]c(CN[C@@H]3CCCc4ccccc43)nc(=O)c2c1C ZINC000003328008 220628715 /nfs/dbraw/zinc/62/87/15/220628715.db2.gz HVXWHFCYQXTGKE-CQSZACIVSA-N 0 1 383.473 3.247 10 0 GGAEMN O=C(CSc1nc(-c2ccccc2)n[nH]1)Nc1ccccc1C(=O)NC1CC1 ZINC000007472882 220999354 /nfs/dbraw/zinc/99/93/54/220999354.db2.gz BVGQFFIZSVDQCO-UHFFFAOYSA-N 0 1 393.472 3.095 10 0 GGAEMN C[C@@H](NC(=O)CSc1nc(-c2cccs2)n[nH]1)c1ccc2c(c1)OCO2 ZINC000007984879 221018676 /nfs/dbraw/zinc/01/86/76/221018676.db2.gz RMJHSLSAAZORKQ-SNVBAGLBSA-N 0 1 388.474 3.231 10 0 GGAEMN O=C(C[C@H]1Sc2ccccc2NC1=O)NC[C@H](c1ccco1)N1CCCC1 ZINC000008777804 221058477 /nfs/dbraw/zinc/05/84/77/221058477.db2.gz HKTDSCAIXANXNJ-CRAIPNDOSA-N 0 1 385.489 3.036 10 0 GGAEMN COc1cn(CC(=O)Nc2cc(C)cc(C)c2)c(CN2CCCCC2)cc1=O ZINC000008602115 221044929 /nfs/dbraw/zinc/04/49/29/221044929.db2.gz HLRSQMNJXHJFIB-UHFFFAOYSA-N 0 1 383.492 3.098 10 0 GGAEMN C[C@@H](NC(=O)CSc1nc(-c2ccccc2)n[nH]1)c1nc2ccccc2n1C ZINC000008614436 221047358 /nfs/dbraw/zinc/04/73/58/221047358.db2.gz CCUHJTBJGPJFRS-CYBMUJFWSA-N 0 1 392.488 3.328 10 0 GGAEMN CCc1ccc(-c2cc(C)no2)cc1S(=O)(=O)NCCN1CCC(C)CC1 ZINC000009269125 221076344 /nfs/dbraw/zinc/07/63/44/221076344.db2.gz HRBZYGPOEKSWLW-UHFFFAOYSA-N 0 1 391.537 3.223 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2cccc(F)c2)c1C(=O)N1CCCCC1 ZINC000009684414 221089120 /nfs/dbraw/zinc/08/91/20/221089120.db2.gz AKZRYIDKOAIDIM-UHFFFAOYSA-N 0 1 379.457 3.198 10 0 GGAEMN CSc1cccc(NS(=O)(=O)c2c(C)[nH]c(C)c2C(=O)N2CCCC2)c1 ZINC000009684206 221089235 /nfs/dbraw/zinc/08/92/35/221089235.db2.gz VUFXRVZJVFBPBS-UHFFFAOYSA-N 0 1 393.534 3.390 10 0 GGAEMN Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)Nc2ccc(F)cc2C)c(C)n1C ZINC000009684852 221089263 /nfs/dbraw/zinc/08/92/63/221089263.db2.gz XGWPBZVTCKVJKF-UHFFFAOYSA-N 0 1 393.484 3.126 10 0 GGAEMN COc1cccc([C@H]2CCCN2CC(=O)N2CCN(c3ccccc3)CC2)c1 ZINC000010227858 221099193 /nfs/dbraw/zinc/09/91/93/221099193.db2.gz ZKOBAMJEYSMKEL-JOCHJYFZSA-N 0 1 379.504 3.181 10 0 GGAEMN O=C(C[C@H]1C(=O)NCCN1CC1CCCCC1)N1CC=C(c2ccccc2)CC1 ZINC000011842924 221132409 /nfs/dbraw/zinc/13/24/09/221132409.db2.gz DJXRRCHXRBYHEX-QFIPXVFZSA-N 0 1 395.547 3.073 10 0 GGAEMN CCNC(=O)NC(=O)[C@H](Sc1nc(CC2CCCC2)n[nH]1)c1ccccc1 ZINC000011885675 221134931 /nfs/dbraw/zinc/13/49/31/221134931.db2.gz OXKKBFGCDAXUJY-MRXNPFEDSA-N 0 1 387.509 3.217 10 0 GGAEMN CCNC(=O)NC(=O)[C@H](Sc1n[nH]c(CC2CCCC2)n1)c1ccccc1 ZINC000011885675 221134932 /nfs/dbraw/zinc/13/49/32/221134932.db2.gz OXKKBFGCDAXUJY-MRXNPFEDSA-N 0 1 387.509 3.217 10 0 GGAEMN COCc1ccc([C@@H]2C[C@H]3CN(Cc4ccc(OC)cc4)C(=O)[C@]34CCCN24)o1 ZINC000012027201 221142936 /nfs/dbraw/zinc/14/29/36/221142936.db2.gz DDKKGFBXMYFOBN-NYDSKATKSA-N 0 1 396.487 3.373 10 0 GGAEMN COc1ccc(C(C)(C)C)cc1NS(=O)(=O)c1ccc(CNC(C)=O)cc1 ZINC000012508552 221200014 /nfs/dbraw/zinc/20/00/14/221200014.db2.gz JRFCGNRHMOEYGI-UHFFFAOYSA-N 0 1 390.505 3.430 10 0 GGAEMN COCCNC(=O)c1cccc(OC2CCN(Cc3cc(C)c(C)o3)CC2)c1 ZINC000012713755 221221307 /nfs/dbraw/zinc/22/13/07/221221307.db2.gz WLHBYXVNEOROJE-UHFFFAOYSA-N 0 1 386.492 3.316 10 0 GGAEMN Cc1ccc(NC(=O)CN(C)C(=O)[C@@H](C)N[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000012755370 221225946 /nfs/dbraw/zinc/22/59/46/221225946.db2.gz WPISHCYFKVOVJQ-HUUCEWRRSA-N 0 1 389.446 3.409 10 0 GGAEMN CN1CCN(c2ccc(NC(=O)c3ccc(COc4ccccc4)o3)cn2)CC1 ZINC000012767039 221228232 /nfs/dbraw/zinc/22/82/32/221228232.db2.gz BTHPEWKZDQLKIM-UHFFFAOYSA-N 0 1 392.459 3.258 10 0 GGAEMN O=C(Nc1ccccc1)[C@H]1CCC[N@@H+](Cc2cc(=O)oc3cc([O-])ccc23)C1 ZINC000012777349 221230321 /nfs/dbraw/zinc/23/03/21/221230321.db2.gz MWTTZDAKYPVJHN-HNNXBMFYSA-N 0 1 378.428 3.349 10 0 GGAEMN O=C(Nc1ccccc1)[C@H]1CCC[N@H+](Cc2cc(=O)oc3cc([O-])ccc23)C1 ZINC000012777349 221230324 /nfs/dbraw/zinc/23/03/24/221230324.db2.gz MWTTZDAKYPVJHN-HNNXBMFYSA-N 0 1 378.428 3.349 10 0 GGAEMN COc1ccc([C@H]2CCCCCN2CC(=O)Nc2ccc(C(N)=O)cc2)cc1 ZINC000012879463 221241659 /nfs/dbraw/zinc/24/16/59/221241659.db2.gz RHYRMHDYLGNLKD-HXUWFJFHSA-N 0 1 381.476 3.350 10 0 GGAEMN COc1ccc([C@H](C)NCC(=O)Nc2ccccc2C(=O)NC2CC2)cc1F ZINC000012895213 221242514 /nfs/dbraw/zinc/24/25/14/221242514.db2.gz JPBUVMRDOQZTNM-ZDUSSCGKSA-N 0 1 385.439 3.016 10 0 GGAEMN CC(C)c1n[nH]c(S[C@H]2CCCCN(C(=O)c3ccc(F)cc3)C2=O)n1 ZINC000012984493 221252863 /nfs/dbraw/zinc/25/28/63/221252863.db2.gz IILMSQZQNNGSES-AWEZNQCLSA-N 0 1 376.457 3.381 10 0 GGAEMN CC(C)c1nc(S[C@H]2CCCCN(C(=O)c3ccc(F)cc3)C2=O)n[nH]1 ZINC000012984493 221252865 /nfs/dbraw/zinc/25/28/65/221252865.db2.gz IILMSQZQNNGSES-AWEZNQCLSA-N 0 1 376.457 3.381 10 0 GGAEMN CC(C)c1n[nH]c(S[C@@H]2CCCCN(C(=O)c3ccc(F)cc3)C2=O)n1 ZINC000012984491 221253038 /nfs/dbraw/zinc/25/30/38/221253038.db2.gz IILMSQZQNNGSES-CQSZACIVSA-N 0 1 376.457 3.381 10 0 GGAEMN CC(C)c1nc(S[C@@H]2CCCCN(C(=O)c3ccc(F)cc3)C2=O)n[nH]1 ZINC000012984491 221253040 /nfs/dbraw/zinc/25/30/40/221253040.db2.gz IILMSQZQNNGSES-CQSZACIVSA-N 0 1 376.457 3.381 10 0 GGAEMN C[C@@H](NCC(=O)N(C)CC(=O)NCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000012996603 221254088 /nfs/dbraw/zinc/25/40/88/221254088.db2.gz HVVARTMJTUIQAF-GFCCVEGCSA-N 0 1 398.290 3.012 10 0 GGAEMN CC(C)CCn1c2n[nH]c(=S)n2c2cc(C(=O)NCC(C)C)ccc2c1=O ZINC000013363173 221266909 /nfs/dbraw/zinc/26/69/09/221266909.db2.gz IYCQEFMQLMQJDA-UHFFFAOYSA-N 0 1 387.509 3.139 10 0 GGAEMN CC[C@@H](C)NC(=O)c1ccc2c(c1)n1c(=S)[nH]nc1n(CCC(C)C)c2=O ZINC000013363175 221266974 /nfs/dbraw/zinc/26/69/74/221266974.db2.gz PZKUPTNMKSDINX-GFCCVEGCSA-N 0 1 387.509 3.281 10 0 GGAEMN CCOc1ccccc1NC(=O)CSc1nc(O)cc(=O)n1C1CCCC1 ZINC000013139783 221262452 /nfs/dbraw/zinc/26/24/52/221262452.db2.gz UFEVMJUUIFMRGQ-UHFFFAOYSA-N 0 1 389.477 3.194 10 0 GGAEMN c1ccc2c(c1)C=C(CN(CCCN1CCOCC1)Cc1cccnc1)CO2 ZINC000013569053 221274992 /nfs/dbraw/zinc/27/49/92/221274992.db2.gz VALDOBOWDNJXPC-UHFFFAOYSA-N 0 1 379.504 3.082 10 0 GGAEMN COc1cc2c(cc1CNCc1ccc(CN3CCOCC3)cc1)O[C@H](C)C2 ZINC000014115776 221300032 /nfs/dbraw/zinc/30/00/32/221300032.db2.gz PSANIQYRWNURTN-QGZVFWFLSA-N 0 1 382.504 3.141 10 0 GGAEMN COc1ccccc1-n1cc(C(=O)c2cc(C)ccc2O)cc(C(C)=O)c1=O ZINC000014235640 221305647 /nfs/dbraw/zinc/30/56/47/221305647.db2.gz QSNFNRHPRBYXLX-UHFFFAOYSA-N 0 1 377.396 3.294 10 0 GGAEMN CCOc1ccc(OCC)c(NS(=O)(=O)c2ccc3c(c2)N(C)CCO3)c1 ZINC000015674711 221338553 /nfs/dbraw/zinc/33/85/53/221338553.db2.gz GDJOPJQIWRHIFQ-UHFFFAOYSA-N 0 1 392.477 3.113 10 0 GGAEMN O=C(c1ccco1)N1Cc2[nH]cnc2C[C@H]1c1nc(-c2ccc(F)cc2)no1 ZINC000015676051 221338810 /nfs/dbraw/zinc/33/88/10/221338810.db2.gz FOOYEEOTPSLHNQ-HNNXBMFYSA-N 0 1 379.351 3.132 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1ccc2c(c1)NC(=O)CCS2 ZINC000015728428 221340993 /nfs/dbraw/zinc/34/09/93/221340993.db2.gz VBZDMLACFOFIBM-UHFFFAOYSA-N 0 1 378.475 3.239 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)C[C@H](C)S2 ZINC000015730549 221342179 /nfs/dbraw/zinc/34/21/79/221342179.db2.gz IFZBJJFYYBVDCO-NSHDSACASA-N 0 1 378.475 3.319 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@H](C)CS2 ZINC000015730837 221342364 /nfs/dbraw/zinc/34/23/64/221342364.db2.gz SHGKVWWJFGJIEB-LLVKDONJSA-N 0 1 378.475 3.176 10 0 GGAEMN Cc1cccc(NC(=O)N2CCN(c3nc(C)cc(N4CCCCC4)n3)CC2)c1 ZINC000015825133 221345841 /nfs/dbraw/zinc/34/58/41/221345841.db2.gz XGDURBMYFIDDGH-UHFFFAOYSA-N 0 1 394.523 3.438 10 0 GGAEMN C[C@@H](NCC(=O)N(Cc1ccco1)CC(F)(F)F)c1ccc2c(c1)OCCO2 ZINC000016695466 221369548 /nfs/dbraw/zinc/36/95/48/221369548.db2.gz SINZCCGPRBSBKZ-CYBMUJFWSA-N 0 1 398.381 3.293 10 0 GGAEMN Cc1cc(N2CCN(C(=O)Nc3cccc(C)c3C)CC2)nc(N2CCCC2)n1 ZINC000064800074 136157640 /nfs/dbraw/zinc/15/76/40/136157640.db2.gz HWZKYISYARELCW-UHFFFAOYSA-N 0 1 394.523 3.356 10 0 GGAEMN Cc1ccc(C)c(NC(=O)N2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)c1 ZINC000064800355 136157926 /nfs/dbraw/zinc/15/79/26/136157926.db2.gz JQZQKUNQJKIUOM-UHFFFAOYSA-N 0 1 394.523 3.356 10 0 GGAEMN COc1cc(/C=C\C(=O)Nc2ccc(N3CCN(C)CC3)c(C)c2)cc(OC)c1 ZINC000096926451 136187741 /nfs/dbraw/zinc/18/77/41/136187741.db2.gz UBZZUGYTSVYAJK-YVMONPNESA-N 0 1 395.503 3.416 10 0 GGAEMN CC(C)OC[C@H](O)CN(Cc1ccccc1)C[C@@H]1CC(c2ccccc2)=NO1 ZINC000036146440 221844552 /nfs/dbraw/zinc/84/45/52/221844552.db2.gz ZQETZVZWMILIOS-YADHBBJMSA-N 0 1 382.504 3.468 10 0 GGAEMN Cc1noc(-c2ccccc2NS(=O)(=O)c2ccc3c(c2)OCCCO3)n1 ZINC000036394702 221856659 /nfs/dbraw/zinc/85/66/59/221856659.db2.gz UAGWMSPURFCHNC-UHFFFAOYSA-N 0 1 387.417 3.007 10 0 GGAEMN Cc1c(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)sc2nc(C)nc(C)c12 ZINC000036392634 221857438 /nfs/dbraw/zinc/85/74/38/221857438.db2.gz ZSZKINJVADPBJV-UHFFFAOYSA-N 0 1 396.520 3.016 10 0 GGAEMN C[C@@H](NC(=O)c1ccc2c(=O)[nH]c(=S)[nH]c2c1)c1ccc(F)c(Cl)c1 ZINC000055745853 222023928 /nfs/dbraw/zinc/02/39/28/222023928.db2.gz JAJNHIFOKFMUQT-MRVPVSSYSA-N 0 1 377.828 3.495 10 0 GGAEMN C[C@H](NC(=O)c1ccc2c(=O)[nH]c(=S)[nH]c2c1)c1ccc(F)c(Cl)c1 ZINC000055745852 222024771 /nfs/dbraw/zinc/02/47/71/222024771.db2.gz JAJNHIFOKFMUQT-QMMMGPOBSA-N 0 1 377.828 3.495 10 0 GGAEMN COc1ccc(NC(C)=O)cc1NC(=O)CN[C@@H](C)c1ccc(F)c(F)c1 ZINC000057407788 222032292 /nfs/dbraw/zinc/03/22/92/222032292.db2.gz JRJJSXNBYOJVOV-NSHDSACASA-N 0 1 377.391 3.221 10 0 GGAEMN CC[C@H](NCC(=O)Nc1sccc1C(N)=O)c1ccc(Br)cc1 ZINC000057456005 222033344 /nfs/dbraw/zinc/03/33/44/222033344.db2.gz SOXFFHASXJXXMI-ZDUSSCGKSA-N 0 1 396.310 3.289 10 0 GGAEMN Cc1cc(Br)c(O)c(C(=O)N(C)C[C@H]2COc3ccccc3O2)c1 ZINC000047827673 221978699 /nfs/dbraw/zinc/97/86/99/221978699.db2.gz LQRBRVGFIIZOAN-LBPRGKRZSA-N 0 1 392.249 3.375 10 0 GGAEMN Cc1cccnc1NC(=O)[C@H]1CCCN(C[C@H](O)c2ccc(F)c(F)c2)C1 ZINC000051424122 222005682 /nfs/dbraw/zinc/00/56/82/222005682.db2.gz BEIQDRWUQSYACO-YJBOKZPZSA-N 0 1 375.419 3.052 10 0 GGAEMN O=C([O-])c1cc(C[N@H+](Cc2cccnc2)Cc2ccc3c(c2)OCO3)ccc1O ZINC000055307118 222020985 /nfs/dbraw/zinc/02/09/85/222020985.db2.gz QGAKZMJVIAMVGD-UHFFFAOYSA-N 0 1 392.411 3.417 10 0 GGAEMN O=C([O-])c1cc(C[N@@H+](Cc2cccnc2)Cc2ccc3c(c2)OCO3)ccc1O ZINC000055307118 222020989 /nfs/dbraw/zinc/02/09/89/222020989.db2.gz QGAKZMJVIAMVGD-UHFFFAOYSA-N 0 1 392.411 3.417 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cn(C(C)C)c3ncccc23)cc1OC ZINC000065242185 222113705 /nfs/dbraw/zinc/11/37/05/222113705.db2.gz HENNBFFADJOCJL-UHFFFAOYSA-N 0 1 375.450 3.435 10 0 GGAEMN Cc1nnc(-c2c(C)c(S(=O)(=O)Nc3ccc(C)c(F)c3)c(C)n2C)o1 ZINC000065186498 222108436 /nfs/dbraw/zinc/10/84/36/222108436.db2.gz WDKGYKNFFCAQPW-UHFFFAOYSA-N 0 1 378.429 3.249 10 0 GGAEMN O=C(c1cc2c(s1)CN(C1CCCC1)C2)N1CCCN(c2ncccn2)CC1 ZINC000065239004 222114127 /nfs/dbraw/zinc/11/41/27/222114127.db2.gz ABCUXQUEUVYBHW-UHFFFAOYSA-N 0 1 397.548 3.149 10 0 GGAEMN CCc1nnc(-c2c(C)c(S(=O)(=O)Nc3cccc(OC)c3)c(C)n2C)o1 ZINC000065186501 222109110 /nfs/dbraw/zinc/10/91/10/222109110.db2.gz UKOAFPRHRRECIP-UHFFFAOYSA-N 0 1 390.465 3.064 10 0 GGAEMN CCC(=O)N1CCc2sc(S(=O)(=O)Nc3cc(C)ccc3F)cc2C1 ZINC000065196187 222109663 /nfs/dbraw/zinc/10/96/63/222109663.db2.gz XMJPSWMGNJTYIK-UHFFFAOYSA-N 0 1 382.482 3.291 10 0 GGAEMN Cc1ccc(F)c(NS(=O)(=O)c2cc3c(s2)CCN(C(=O)C2CC2)C3)c1 ZINC000065196247 222110387 /nfs/dbraw/zinc/11/03/87/222110387.db2.gz SSEDHKOSNIYRAT-UHFFFAOYSA-N 0 1 394.493 3.291 10 0 GGAEMN CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC(=O)N[C@@H](C)c2ccc(F)cc2)C1 ZINC000058184607 222044122 /nfs/dbraw/zinc/04/41/22/222044122.db2.gz UPJGJCFDZFADIK-SOLBZPMBSA-N 0 1 377.504 3.020 10 0 GGAEMN CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)c2nccn2C)cc1)c1cccs1 ZINC000058331403 222049829 /nfs/dbraw/zinc/04/98/29/222049829.db2.gz ISGSUTBBZQAIIX-INIZCTEOSA-N 0 1 397.504 3.137 10 0 GGAEMN Cc1cc(Br)c(O)c(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1 ZINC000058394085 222051318 /nfs/dbraw/zinc/05/13/18/222051318.db2.gz ADCLJZFLPMONOP-UHFFFAOYSA-N 0 1 399.285 3.156 10 0 GGAEMN O=C(Cc1n[nH]c(Cc2ccc(Cl)cc2)n1)NCc1cc(F)cc(F)c1 ZINC000065232824 222112688 /nfs/dbraw/zinc/11/26/88/222112688.db2.gz XHMXPMJJAVLREZ-UHFFFAOYSA-N 0 1 376.794 3.186 10 0 GGAEMN COc1cccc(CNC(=O)C2=CCN(Cc3ccc(F)cc3)CC2)c1OC ZINC000064818045 222083895 /nfs/dbraw/zinc/08/38/95/222083895.db2.gz JIUDPNQCLMVHLZ-UHFFFAOYSA-N 0 1 384.451 3.291 10 0 GGAEMN O=c1[nH]c2cc(Cl)c(S(=O)(=O)Nc3cccc(C(F)(F)F)c3)cc2[nH]1 ZINC000064976602 222090530 /nfs/dbraw/zinc/09/05/30/222090530.db2.gz JOLTUOSDUOYFHD-UHFFFAOYSA-N 0 1 391.758 3.329 10 0 GGAEMN CCCc1ccc(S(=O)(=O)NCCc2nnc(-c3ccc(F)cc3)[nH]2)cc1 ZINC000064969560 222090676 /nfs/dbraw/zinc/09/06/76/222090676.db2.gz FHHJFOGCCIOJBC-UHFFFAOYSA-N 0 1 388.468 3.084 10 0 GGAEMN CCCc1ccc(S(=O)(=O)NCCc2n[nH]c(Cc3cccc(C)c3)n2)cc1 ZINC000064969803 222090849 /nfs/dbraw/zinc/09/08/49/222090849.db2.gz NARBPCYPQZVPLD-UHFFFAOYSA-N 0 1 398.532 3.177 10 0 GGAEMN CCc1ccccc1S(=O)(=O)NCCc1nnc(-c2ccc(Cl)cc2)[nH]1 ZINC000064969559 222091010 /nfs/dbraw/zinc/09/10/10/222091010.db2.gz FCNGYHYJPZDMEZ-UHFFFAOYSA-N 0 1 390.896 3.209 10 0 GGAEMN C[C@H](C(=O)Nc1ccccn1)N1CCc2n[nH]c(-c3ccc(F)c(F)c3)c2C1 ZINC000067650744 222152820 /nfs/dbraw/zinc/15/28/20/222152820.db2.gz VCYRXFNDOQKICX-GFCCVEGCSA-N 0 1 383.402 3.135 10 0 GGAEMN Cc1ncc(CN2CCC[C@H](C(=O)Nc3ccc(-c4cc[nH]n4)cc3)C2)cn1 ZINC000067833700 222161199 /nfs/dbraw/zinc/16/11/99/222161199.db2.gz LNSQDMDRKRHMCW-SFHVURJKSA-N 0 1 376.464 3.026 10 0 GGAEMN CCCCN(C)C(=O)[C@H]1C[C@@](CC)(C(=O)[O-])[N@@H+](C)[C@H]1c1ccc(OC)cc1 ZINC000067820956 222161384 /nfs/dbraw/zinc/16/13/84/222161384.db2.gz CQBWEXWOANDJGN-WFXMLNOXSA-N 0 1 376.497 3.180 10 0 GGAEMN O=C([C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)N1CCN2CCCC[C@@H]2C1 ZINC000069421036 222172603 /nfs/dbraw/zinc/17/26/03/222172603.db2.gz RKFPLJBINYJPPP-HUUCEWRRSA-N 0 1 396.318 3.043 10 0 GGAEMN Cc1ccccc1NC(=O)[C@@H]1CCCN(C(=O)c2cc(-c3ccncc3)[nH]n2)C1 ZINC000085690500 222325717 /nfs/dbraw/zinc/32/57/17/222325717.db2.gz HDIFAYAWEAKLBX-QGZVFWFLSA-N 0 1 389.459 3.271 10 0 GGAEMN COc1cc2c(cc1OC)C(=O)[C@H]([C@@H](O)C1=CCN(Cc3ccccc3)CC1)C2 ZINC000095080115 222329348 /nfs/dbraw/zinc/32/93/48/222329348.db2.gz CCNWYZVPJNRXDT-REWPJTCUSA-N 0 1 393.483 3.252 10 0 GGAEMN O=C([O-])COc1nc(-c2ccc(F)cc2)nc2c1C[N@H+](Cc1ccccc1)CC2 ZINC000073696652 222270320 /nfs/dbraw/zinc/27/03/20/222270320.db2.gz UODABIAJNVTVGD-UHFFFAOYSA-N 0 1 393.418 3.304 10 0 GGAEMN O=C([O-])COc1nc(-c2ccc(F)cc2)nc2c1C[N@@H+](Cc1ccccc1)CC2 ZINC000073696652 222270324 /nfs/dbraw/zinc/27/03/24/222270324.db2.gz UODABIAJNVTVGD-UHFFFAOYSA-N 0 1 393.418 3.304 10 0 GGAEMN O=C(NC[C@@H](c1ccco1)N1CCCC1)[C@H]1CCCN1C(=O)C1CCCCC1 ZINC000084429548 222316868 /nfs/dbraw/zinc/31/68/68/222316868.db2.gz QQYXVBUNTMCGOP-MOPGFXCFSA-N 0 1 387.524 3.104 10 0 GGAEMN CCO[C@@H]1C[C@@H](N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)C12CCC2 ZINC000096009199 222371535 /nfs/dbraw/zinc/37/15/35/222371535.db2.gz YMCHAQPYLNQVNX-RTBURBONSA-N 0 1 376.928 3.374 10 0 GGAEMN CCn1nnc2cc(C(=O)NC[C@H](c3ccc(OC)cc3)N3CCCC3)ccc21 ZINC000008231396 523761564 /nfs/dbraw/zinc/76/15/64/523761564.db2.gz LQNKRTZVLHUXFE-OAQYLSRUSA-N 0 1 393.491 3.027 10 0 GGAEMN Cc1ccc(-n2nnc(C[N@H+]3CCC[C@@H](C(=O)[O-])C3)c2-c2ccncc2)cc1F ZINC000057345478 525935161 /nfs/dbraw/zinc/93/51/61/525935161.db2.gz NLTWIGBDXWVWCZ-MRXNPFEDSA-N 0 1 395.438 3.073 10 0 GGAEMN CCOc1cc(C(=O)N(C)C)ccc1NCc1cn(-c2ccncc2)nc1C ZINC000253419063 528206515 /nfs/dbraw/zinc/20/65/15/528206515.db2.gz SFPIJNJCLCIIJT-UHFFFAOYSA-N 0 1 379.464 3.288 10 0 GGAEMN CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)Nc2ncc(C)o2)CC1 ZINC000072309691 535746297 /nfs/dbraw/zinc/74/62/97/535746297.db2.gz AKPYEZYZYOHQGT-CQSZACIVSA-N 0 1 375.448 3.147 10 0 GGAEMN COc1cc(CN[C@@H]2CCCN(c3ccccc3Cl)C2=O)cc2c1OCO2 ZINC000097009650 536807963 /nfs/dbraw/zinc/80/79/63/536807963.db2.gz WAKSCCUJWXNUQR-OAHLLOKOSA-N 0 1 388.851 3.363 10 0 GGAEMN OC[C@H]1CCC[C@@H](NCc2ncc(Br)cc2Br)C1 ZINC000310710414 565579549 /nfs/dbraw/zinc/57/95/49/565579549.db2.gz CBSKYMXGNFCZPA-GXSJLCMTSA-N 0 1 378.108 3.247 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1cc(Cl)c(Cl)n1C ZINC000116252356 564206209 /nfs/dbraw/zinc/20/62/09/564206209.db2.gz WWQPIQWWVDLGQW-DOMZBBRYSA-N 0 1 381.307 3.367 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)c1coc(Br)c1 ZINC000116246059 564206550 /nfs/dbraw/zinc/20/65/50/564206550.db2.gz SFYYDWJYGGISPQ-WFASDCNBSA-N 0 1 378.270 3.078 10 0 GGAEMN Cn1cc([C@H]2CCN(Cc3nnc(-c4ccccc4Br)o3)C2)cn1 ZINC000116320039 564207291 /nfs/dbraw/zinc/20/72/91/564207291.db2.gz ZQVLHHUZVQSJEN-LBPRGKRZSA-N 0 1 388.269 3.222 10 0 GGAEMN Cc1ccc(NC(=O)CCC2=Nc3ccccc3S(=O)(=O)N2)cc1Cl ZINC000006546793 564225498 /nfs/dbraw/zinc/22/54/98/564225498.db2.gz KFTKDXKPZUIRRV-UHFFFAOYSA-N 0 1 377.853 3.389 10 0 GGAEMN COc1ccc(C)cc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2 ZINC000006779315 564227270 /nfs/dbraw/zinc/22/72/70/564227270.db2.gz CFYXDOGIFLBAFR-LLVKDONJSA-N 0 1 378.475 3.237 10 0 GGAEMN CC[C@H]1CN(C(=O)Nc2ccc(Br)cc2F)CCN1CCOC ZINC000117435021 564227481 /nfs/dbraw/zinc/22/74/81/564227481.db2.gz GTZUBARUCPRQIZ-ZDUSSCGKSA-N 0 1 388.281 3.163 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2ccc(Br)cc2F)CCN1CCOC ZINC000117435017 564227694 /nfs/dbraw/zinc/22/76/94/564227694.db2.gz GTZUBARUCPRQIZ-CYBMUJFWSA-N 0 1 388.281 3.163 10 0 GGAEMN CC[C@@H]1CN(C(=O)Nc2cc(Br)ccc2F)CCN1CCOC ZINC000117457487 564227849 /nfs/dbraw/zinc/22/78/49/564227849.db2.gz NKTITVQNTLHZLB-CYBMUJFWSA-N 0 1 388.281 3.163 10 0 GGAEMN Cc1ccc(NS(=O)(=O)c2cc(Br)cnc2N)cc1Cl ZINC000006800732 564228163 /nfs/dbraw/zinc/22/81/63/564228163.db2.gz OQMOIPSGCPCEQA-UHFFFAOYSA-N 0 1 376.663 3.189 10 0 GGAEMN CCOc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)CCS2 ZINC000006887651 564229359 /nfs/dbraw/zinc/22/93/59/564229359.db2.gz OCPQRBFHZRSOFT-UHFFFAOYSA-N 0 1 378.475 3.320 10 0 GGAEMN O=c1c2cc(I)ccc2[nH]c(=S)n1Cc1ccco1 ZINC000006953821 564229967 /nfs/dbraw/zinc/22/99/67/564229967.db2.gz ATSMVPVQDHUHDY-UHFFFAOYSA-N 0 1 384.198 3.305 10 0 GGAEMN CCCS(=O)(=O)NC[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000117932123 564235068 /nfs/dbraw/zinc/23/50/68/564235068.db2.gz NNVCZMCAOGFAJB-GDBMZVCRSA-N 0 1 378.460 3.418 10 0 GGAEMN CC(=O)N(C)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1 ZINC000118302291 564238596 /nfs/dbraw/zinc/23/85/96/564238596.db2.gz GLHNSIOQRYJKOE-UHFFFAOYSA-N 0 1 383.267 3.233 10 0 GGAEMN Cc1cc(C(=O)Nc2ccc3[nH]nc(C(N)=O)c3c2)c(C)cc1Br ZINC000119486225 564273003 /nfs/dbraw/zinc/27/30/03/564273003.db2.gz KBEJFUANSWJSJR-UHFFFAOYSA-N 0 1 387.237 3.293 10 0 GGAEMN Cc1cc(CCC(=O)Nc2cc(-c3nccn3C)n[nH]2)ccc1Br ZINC000119519443 564274995 /nfs/dbraw/zinc/27/49/95/564274995.db2.gz TWEJEIMGLIAKHT-UHFFFAOYSA-N 0 1 388.269 3.452 10 0 GGAEMN CCOCCN1CCN(C(=O)Nc2ccccc2Br)C[C@@H]1CC ZINC000119649642 564281209 /nfs/dbraw/zinc/28/12/09/564281209.db2.gz DFMOXUWONKMLAZ-AWEZNQCLSA-N 0 1 384.318 3.414 10 0 GGAEMN O=C(NC[C@H](O)CN1CCc2ccccc2C1)c1c(Cl)cccc1Cl ZINC000119664672 564282105 /nfs/dbraw/zinc/28/21/05/564282105.db2.gz QSCAWCLXZYREKP-HNNXBMFYSA-N 0 1 379.287 3.142 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2ccc(Br)c(Cl)c2)[nH]n1 ZINC000119778061 564287693 /nfs/dbraw/zinc/28/76/93/564287693.db2.gz BIFCSDXQDFSCSK-UHFFFAOYSA-N 0 1 380.633 3.478 10 0 GGAEMN Cc1nc([C@H](NC(=O)Nc2cccnc2Br)c2ccccc2)n[nH]1 ZINC000119993332 564298973 /nfs/dbraw/zinc/29/89/73/564298973.db2.gz FOFYEWVCDLAENL-CYBMUJFWSA-N 0 1 387.241 3.182 10 0 GGAEMN Nc1ncc(Br)cc1S(=O)(=O)Nc1ccc(C(F)(F)F)cc1 ZINC000020467655 564306325 /nfs/dbraw/zinc/30/63/25/564306325.db2.gz FGXHHZOJWNCYPO-UHFFFAOYSA-N 0 1 396.188 3.246 10 0 GGAEMN CC(C)c1n[nH]c(SCC(=O)N(C)Cc2ccccc2Br)n1 ZINC000021234142 564310273 /nfs/dbraw/zinc/31/02/73/564310273.db2.gz UKLSAVYRROCGKY-UHFFFAOYSA-N 0 1 383.315 3.441 10 0 GGAEMN CC(C)c1nc(SCC(=O)N(C)Cc2ccccc2Br)n[nH]1 ZINC000021234142 564310275 /nfs/dbraw/zinc/31/02/75/564310275.db2.gz UKLSAVYRROCGKY-UHFFFAOYSA-N 0 1 383.315 3.441 10 0 GGAEMN C[C@@H]1CCCN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000120521290 564323650 /nfs/dbraw/zinc/32/36/50/564323650.db2.gz REFBMFREWYAQBS-LLVKDONJSA-N 0 1 378.274 3.176 10 0 GGAEMN C[C@@H]1CCCN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000120521290 564323654 /nfs/dbraw/zinc/32/36/54/564323654.db2.gz REFBMFREWYAQBS-LLVKDONJSA-N 0 1 378.274 3.176 10 0 GGAEMN CCc1[nH]nc(NC(=O)[C@H]2CCc3[nH]c(C(C)C)nc3C2)c1Br ZINC000476187193 564329651 /nfs/dbraw/zinc/32/96/51/564329651.db2.gz GZNPWLSJQALBHI-VIFPVBQESA-N 0 1 380.290 3.325 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(-n3cncn3)c(F)c2)c(Cl)cc1F ZINC000120984946 564347154 /nfs/dbraw/zinc/34/71/54/564347154.db2.gz AOJHFWZSQUCNBO-UHFFFAOYSA-N 0 1 384.795 3.308 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NC[C@@H](C)Oc2ccccc2Br)n[nH]1 ZINC000121162238 564357266 /nfs/dbraw/zinc/35/72/66/564357266.db2.gz NZJRYJZICXUBBN-WCQYABFASA-N 0 1 395.301 3.178 10 0 GGAEMN COc1ccc([C@H](C)NCC(=O)Nc2ccc(Br)cn2)cc1F ZINC000121524363 564372977 /nfs/dbraw/zinc/37/29/77/564372977.db2.gz ZCZLIZHBCBUTPX-JTQLQIEISA-N 0 1 382.233 3.281 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)c2ccc(Cl)c(Br)c2)[nH]n1 ZINC000511628916 564378535 /nfs/dbraw/zinc/37/85/35/564378535.db2.gz OJNDMYLTCUAPFY-UHFFFAOYSA-N 0 1 380.633 3.478 10 0 GGAEMN CCc1ccc(S(=O)(=O)Nc2ncccc2I)s1 ZINC000121721465 564383563 /nfs/dbraw/zinc/38/35/63/564383563.db2.gz RJATVECBNQKPES-UHFFFAOYSA-N 0 1 394.259 3.111 10 0 GGAEMN Brc1csc(-c2noc(CN3CCCC[C@@H]3c3nnc[nH]3)n2)c1 ZINC000121737222 564384231 /nfs/dbraw/zinc/38/42/31/564384231.db2.gz JXDYTMNNHQCXTA-SNVBAGLBSA-N 0 1 395.286 3.406 10 0 GGAEMN Cc1sc(Br)cc1S(=O)(=O)Nc1cccc(-c2nc[nH]n2)c1 ZINC000122838426 564429806 /nfs/dbraw/zinc/42/98/06/564429806.db2.gz JBXZKXHNVBJKKH-UHFFFAOYSA-N 0 1 399.295 3.405 10 0 GGAEMN C[C@H]1C[C@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)CCN1C ZINC000123440429 564448414 /nfs/dbraw/zinc/44/84/14/564448414.db2.gz OPHMSWANQMJLNS-GXTWGEPZSA-N 0 1 379.353 3.182 10 0 GGAEMN CNC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)c3cccnc23)cc1 ZINC000042676972 564449252 /nfs/dbraw/zinc/44/92/52/564449252.db2.gz RBCYNZGHDXSGAY-UHFFFAOYSA-N 0 1 375.837 3.049 10 0 GGAEMN Cc1ncc(CN[C@H](C)c2ccc(S(=O)(=O)N3CCCCC3)cc2)s1 ZINC000123747637 564460432 /nfs/dbraw/zinc/46/04/32/564460432.db2.gz BFIONNSBJUCGTD-CQSZACIVSA-N 0 1 379.551 3.477 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1)c1ccc(Br)s1 ZINC000123957983 564467371 /nfs/dbraw/zinc/46/73/71/564467371.db2.gz BYAMZTKHCORCRN-SSDOTTSWSA-N 0 1 393.266 3.228 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(Br)cc3)cc21 ZINC000123972970 564467570 /nfs/dbraw/zinc/46/75/70/564467570.db2.gz WFUNVDCHIIBBGZ-STQMWFEESA-N 0 1 399.248 3.167 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)[C@H]3C[C@@H]3c3cccc(Br)c3)cc21 ZINC000124078670 564471011 /nfs/dbraw/zinc/47/10/11/564471011.db2.gz QFZIILLGNZYRCW-OLZOCXBDSA-N 0 1 399.248 3.167 10 0 GGAEMN CC[N@H+]1CCC[C@@H]1CN(C)C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000124194130 564474169 /nfs/dbraw/zinc/47/41/69/564474169.db2.gz NBSLGYYMXMASMW-OAHLLOKOSA-N 0 1 378.314 3.416 10 0 GGAEMN Cc1sc2ncnc(SCC(=O)N(C)[C@H]3CC[N@@H+](C)[C@H](C)C3)c2c1C ZINC000124224925 564475274 /nfs/dbraw/zinc/47/52/74/564475274.db2.gz SQYSOTWYDDVWBA-RISCZKNCSA-N 0 1 378.567 3.341 10 0 GGAEMN Cc1cc(NC(=O)N2CCC(N3CCO[C@@H](C)C3)CC2)ccc1Br ZINC000124267925 564477004 /nfs/dbraw/zinc/47/70/04/564477004.db2.gz HVWDKGQLMYGCTL-AWEZNQCLSA-N 0 1 396.329 3.475 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3cc(Cl)ccc3Br)cc21 ZINC000124564659 564485888 /nfs/dbraw/zinc/48/58/88/564485888.db2.gz DIMIMSFCGHGKOD-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN NC(=O)c1n[nH]c2ccc(NC(=O)c3ccc(Br)cc3Cl)cc21 ZINC000124543184 564485933 /nfs/dbraw/zinc/48/59/33/564485933.db2.gz CMLQNFZRZGDFMO-UHFFFAOYSA-N 0 1 393.628 3.330 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000124570068 564486774 /nfs/dbraw/zinc/48/67/74/564486774.db2.gz GELKHIHCKZNXQZ-BONVTDFDSA-N 0 1 393.285 3.235 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H]2CCc3c2cccc3Br)n[nH]1 ZINC000124759800 564492270 /nfs/dbraw/zinc/49/22/70/564492270.db2.gz BFKCPHHKMRBVAB-HWPZZCPQSA-N 0 1 377.286 3.398 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H]2CCc3c2cccc3Br)n[nH]1 ZINC000124759989 564492670 /nfs/dbraw/zinc/49/26/70/564492670.db2.gz BFKCPHHKMRBVAB-QFYYESIMSA-N 0 1 377.286 3.398 10 0 GGAEMN O[C@@H](COC[C@@H]1CCCO1)CN(Cc1csc(Br)c1)C1CC1 ZINC000125344662 564512196 /nfs/dbraw/zinc/51/21/96/564512196.db2.gz OMUZSKNMLCCJLF-CABCVRRESA-N 0 1 390.343 3.032 10 0 GGAEMN CN(C)[C@H](CNC(=O)NCc1cn2cc(Cl)ccc2n1)c1cccs1 ZINC000047832286 564527152 /nfs/dbraw/zinc/52/71/52/564527152.db2.gz UCADGPAXKJFDBQ-CQSZACIVSA-N 0 1 377.901 3.151 10 0 GGAEMN COCCN1CCCN(C(=O)COc2cc(Cl)c(Cl)cc2Cl)CC1 ZINC000048428675 564539645 /nfs/dbraw/zinc/53/96/45/564539645.db2.gz DIKIIUOKFLJFRL-UHFFFAOYSA-N 0 1 395.714 3.206 10 0 GGAEMN CN(C)[C@@H](CNC(=O)NCc1cn2cc(Cl)ccc2n1)c1ccsc1 ZINC000048486218 564541078 /nfs/dbraw/zinc/54/10/78/564541078.db2.gz CYRQRNJHPPBQRD-HNNXBMFYSA-N 0 1 377.901 3.151 10 0 GGAEMN CN(C)C[C@@H](NC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 ZINC000049379371 564551149 /nfs/dbraw/zinc/55/11/49/564551149.db2.gz MLLYDFALIPRSKH-MRXNPFEDSA-N 0 1 380.275 3.351 10 0 GGAEMN CN(C)C[C@H](NC(=O)C(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000049379201 564551358 /nfs/dbraw/zinc/55/13/58/564551358.db2.gz JWDNVQPILJYAQC-INIZCTEOSA-N 0 1 380.275 3.351 10 0 GGAEMN O=C(CSc1nc(C(F)(F)F)cc(=O)[nH]1)N1CCC[C@H](C(F)(F)F)C1 ZINC000126993913 564569787 /nfs/dbraw/zinc/56/97/87/564569787.db2.gz OHMRWKDUBAOXDI-ZETCQYMHSA-N 0 1 389.321 3.094 10 0 GGAEMN Cc1cc(C(=O)N2[C@@H](C)CN(C)C[C@@H]2C)c2cc(Br)ccc2n1 ZINC000127235376 564578105 /nfs/dbraw/zinc/57/81/05/564578105.db2.gz XZLDNAIVYLJBQN-STQMWFEESA-N 0 1 376.298 3.470 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)Nc2cc(Br)c(F)cc2F)[nH]n1 ZINC000519549932 564580607 /nfs/dbraw/zinc/58/06/07/564580607.db2.gz GMZWCDDCWZIMEC-UHFFFAOYSA-N 0 1 397.183 3.495 10 0 GGAEMN O[C@H](COC1CCOCC1)CN1CCC[C@H]1c1ccc(Br)cc1 ZINC000127404352 564582956 /nfs/dbraw/zinc/58/29/56/564582956.db2.gz DLOWSNSHVQZJBL-WMZOPIPTSA-N 0 1 384.314 3.143 10 0 GGAEMN CC(C)Cc1ncc(CNCCNS(=O)(=O)c2ccc(Cl)s2)s1 ZINC000127875160 564598699 /nfs/dbraw/zinc/59/86/99/564598699.db2.gz IPJWGGRIMIFJDY-UHFFFAOYSA-N 0 1 393.987 3.125 10 0 GGAEMN COC[C@H](O)CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C ZINC000127919213 564600663 /nfs/dbraw/zinc/60/06/63/564600663.db2.gz XKNDWIUVZAPHAW-GFCCVEGCSA-N 0 1 382.810 3.015 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)NCC1(C2CC2)CC1 ZINC000128156833 564608554 /nfs/dbraw/zinc/60/85/54/564608554.db2.gz LRHQOJZNVWPPOU-UHFFFAOYSA-N 0 1 390.285 3.224 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)NCC1(C2CC2)CC1 ZINC000128156833 564608557 /nfs/dbraw/zinc/60/85/57/564608557.db2.gz LRHQOJZNVWPPOU-UHFFFAOYSA-N 0 1 390.285 3.224 10 0 GGAEMN O=C(N[C@H]1CCOc2ccc(Br)cc21)N1CCN(CC2CC2)CC1 ZINC000054815311 564610226 /nfs/dbraw/zinc/61/02/26/564610226.db2.gz HRGJSAUSJCNDJL-INIZCTEOSA-N 0 1 394.313 3.010 10 0 GGAEMN COc1cc(Br)c(CN2CC[C@H](c3cnn(C)c3)C2)c(OC)c1 ZINC000128397227 564617188 /nfs/dbraw/zinc/61/71/88/564617188.db2.gz HSDBCUOYPZFGPG-LBPRGKRZSA-N 0 1 380.286 3.189 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000128441571 564619427 /nfs/dbraw/zinc/61/94/27/564619427.db2.gz ZEDPLJCYNNPSJG-APWZRJJASA-N 0 1 395.341 3.035 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@@H](C)c1ccc(CC(C)C)cc1 ZINC000128540346 564621929 /nfs/dbraw/zinc/62/19/29/564621929.db2.gz JFBHKWPCKDNCGF-LBPRGKRZSA-N 0 1 382.507 3.168 10 0 GGAEMN CCCOc1cccc(NS(=O)(=O)c2ccc(S(=O)(=O)CC)cc2)c1 ZINC000055587360 564625249 /nfs/dbraw/zinc/62/52/49/564625249.db2.gz PFUSEGIRXZPLLX-UHFFFAOYSA-N 0 1 383.491 3.070 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(I)c1)N1CCCSCC1 ZINC000129352756 564646229 /nfs/dbraw/zinc/64/62/29/564646229.db2.gz YGEKICUAMTUQCR-LLVKDONJSA-N 0 1 390.290 3.057 10 0 GGAEMN CCCCn1c(=O)[nH]nc1S(=O)(=O)[C@@H](C)c1cccc(Br)c1 ZINC000129525803 564651242 /nfs/dbraw/zinc/65/12/42/564651242.db2.gz UCIXPQZCAZGMCO-JTQLQIEISA-N 0 1 388.287 3.081 10 0 GGAEMN O=C(Nc1c[nH]cc(Br)c1=O)c1cccc(CN2CCCC2)c1 ZINC000129769174 564660331 /nfs/dbraw/zinc/66/03/31/564660331.db2.gz BJWHOWMDXLBBIP-UHFFFAOYSA-N 0 1 376.254 3.398 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)NCc2nc3cccc(C)c3[nH]2)c1 ZINC000129929088 564664867 /nfs/dbraw/zinc/66/48/67/564664867.db2.gz JVVHYDWHQVSVIL-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)C(=O)Nc1cc(-c2nccn2C)n[nH]1 ZINC000130435744 564681393 /nfs/dbraw/zinc/68/13/93/564681393.db2.gz BATYIEKNLZIUIZ-LLVKDONJSA-N 0 1 388.269 3.390 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)n[nH]1 ZINC000130597809 564686748 /nfs/dbraw/zinc/68/67/48/564686748.db2.gz GCGALUBPDOOQKE-SSDOTTSWSA-N 0 1 389.670 3.364 10 0 GGAEMN CC1CCN([C@@H](CNS(=O)(=O)N2CCC[C@H](C)C2)c2cccs2)CC1 ZINC000058723692 564688006 /nfs/dbraw/zinc/68/80/06/564688006.db2.gz YDJMMRLQHWLCNQ-IRXDYDNUSA-N 0 1 385.599 3.087 10 0 GGAEMN C[C@H](N[C@@H](C)c1cccc(Br)c1)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000130923013 564695679 /nfs/dbraw/zinc/69/56/79/564695679.db2.gz ZYARFRGLULVFIW-RYUDHWBXSA-N 0 1 390.281 3.226 10 0 GGAEMN CC(C)(C)OC(=O)CSCC(=O)NC[C@@H](c1cccs1)N1CCCC1 ZINC000130937612 564696391 /nfs/dbraw/zinc/69/63/91/564696391.db2.gz JHRMLFIRKSHCFZ-AWEZNQCLSA-N 0 1 384.567 3.076 10 0 GGAEMN CN1CCC(N(Cc2ccco2)S(=O)(=O)c2c(F)cccc2Cl)CC1 ZINC000131074789 564700297 /nfs/dbraw/zinc/70/02/97/564700297.db2.gz MYROETLQZWKLEV-UHFFFAOYSA-N 0 1 386.876 3.357 10 0 GGAEMN COc1cc(CN[C@@H]2CCN(C3CCCCC3)C2=O)cc(Br)c1O ZINC000131671755 564719324 /nfs/dbraw/zinc/71/93/24/564719324.db2.gz SAAYXCVWPMEIGC-OAHLLOKOSA-N 0 1 397.313 3.187 10 0 GGAEMN Cc1cccc2nc(CNC(=O)NCc3ccc(O)c(Br)c3)[nH]c21 ZINC000132007894 564731258 /nfs/dbraw/zinc/73/12/58/564731258.db2.gz JOUGSKYVNJUXDV-UHFFFAOYSA-N 0 1 389.253 3.339 10 0 GGAEMN O=C(NCCc1nc[nH]n1)C1(c2cccc(Br)c2)CCCCC1 ZINC000132048376 564732471 /nfs/dbraw/zinc/73/24/71/564732471.db2.gz VZEXETOWVDAAKA-UHFFFAOYSA-N 0 1 377.286 3.128 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000065297722 564742009 /nfs/dbraw/zinc/74/20/09/564742009.db2.gz GHUHREAHBONCCM-HOCLYGCPSA-N 0 1 389.323 3.066 10 0 GGAEMN Cc1ccc(NC(=O)c2ccc(Br)c(O)c2)cc1S(C)(=O)=O ZINC000132558678 564747057 /nfs/dbraw/zinc/74/70/57/564747057.db2.gz PRWNZSDFECFCAL-UHFFFAOYSA-N 0 1 384.251 3.119 10 0 GGAEMN CSc1cc(C(=O)N2CCO[C@@H](c3n[nH]c(C)n3)C2)c(Cl)cc1Cl ZINC000133108864 564763163 /nfs/dbraw/zinc/76/31/63/564763163.db2.gz HZXROBNBUMICQM-GFCCVEGCSA-N 0 1 387.292 3.356 10 0 GGAEMN O=S(=O)(c1c(F)cccc1Cl)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 ZINC000133209916 564766809 /nfs/dbraw/zinc/76/68/09/564766809.db2.gz IMEMPHYZSSRYNJ-NSHDSACASA-N 0 1 384.864 3.043 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(C(=O)N3CCSCC3)c2)c(C)s1 ZINC000133280487 564768675 /nfs/dbraw/zinc/76/86/75/564768675.db2.gz NKAVRMCXOSXNOG-UHFFFAOYSA-N 0 1 396.559 3.355 10 0 GGAEMN O=S(=O)([N-]CC1CCN(c2cc[nH+]cc2)CC1)c1c(F)cccc1Cl ZINC000133297572 564769313 /nfs/dbraw/zinc/76/93/13/564769313.db2.gz NCOYIQLUYMAZHE-UHFFFAOYSA-N 0 1 383.876 3.069 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCO[C@H](c2cccc(Br)c2)C1 ZINC000134147623 564795375 /nfs/dbraw/zinc/79/53/75/564795375.db2.gz JPSYAKVECNBLRH-PBHICJAKSA-N 0 1 390.281 3.192 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCO[C@H](c2ccccc2Br)C1 ZINC000134220771 564796395 /nfs/dbraw/zinc/79/63/95/564796395.db2.gz JVPGRNJMHGOUFD-PXAZEXFGSA-N 0 1 390.281 3.192 10 0 GGAEMN Cn1ccnc1[C@H](O)[C@@H]1CCCN(C(=O)c2c(O)cc(Cl)cc2Cl)C1 ZINC000134331755 564800094 /nfs/dbraw/zinc/80/00/94/564800094.db2.gz IMENGQZHRFESPZ-MEBBXXQBSA-N 0 1 384.263 3.018 10 0 GGAEMN Cn1ccnc1[C@@H](O)[C@@H]1CCCN(C(=O)c2c(O)cc(Cl)cc2Cl)C1 ZINC000134331783 564800143 /nfs/dbraw/zinc/80/01/43/564800143.db2.gz IMENGQZHRFESPZ-BMIGLBTASA-N 0 1 384.263 3.018 10 0 GGAEMN OCCn1nccc1C1CCN(C[C@@H](O)c2ccc(Cl)cc2Cl)CC1 ZINC000134314268 564800400 /nfs/dbraw/zinc/80/04/00/564800400.db2.gz MHWHRQBEKRNGDJ-GOSISDBHSA-N 0 1 384.307 3.095 10 0 GGAEMN O=C(Nc1c[nH]cc(Br)c1=O)c1ccc(Br)c(O)c1 ZINC000134357957 564801148 /nfs/dbraw/zinc/80/11/48/564801148.db2.gz VVBLVFRGJHJOOI-UHFFFAOYSA-N 0 1 388.015 3.270 10 0 GGAEMN O=C(NCCCc1ccc(Br)cc1F)[C@@H]1CCCc2[nH]ncc21 ZINC000134364303 564801252 /nfs/dbraw/zinc/80/12/52/564801252.db2.gz WLOVHOGNBVXTGJ-CYBMUJFWSA-N 0 1 380.261 3.480 10 0 GGAEMN C[C@@H](CNC(=O)[C@H]1CCCc2[nH]ncc21)Oc1ccccc1Br ZINC000134468018 564804566 /nfs/dbraw/zinc/80/45/66/564804566.db2.gz ICSANHWQQAOALP-RYUDHWBXSA-N 0 1 378.270 3.176 10 0 GGAEMN CC(C)(C)N(Cc1ccccc1Br)C[C@H](O)CN1CCCC1=O ZINC000134865649 564817344 /nfs/dbraw/zinc/81/73/44/564817344.db2.gz GVNDGWNEVMWNEJ-OAHLLOKOSA-N 0 1 383.330 3.033 10 0 GGAEMN Cc1nn(CCS(C)(=O)=O)c(C)c1[C@@H](C)N[C@H]1CCCc2sccc21 ZINC000134965640 564820340 /nfs/dbraw/zinc/82/03/40/564820340.db2.gz NWXONNBYYKNETP-WBMJQRKESA-N 0 1 381.567 3.334 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cccc3ncccc32)cc1Cl ZINC000135730882 564839145 /nfs/dbraw/zinc/83/91/45/564839145.db2.gz XZZRDKFFBLSDAY-UHFFFAOYSA-N 0 1 376.821 3.476 10 0 GGAEMN O=S(=O)(Nc1cccc2ncccc21)c1cc2c(cc1Cl)OCCO2 ZINC000135740261 564840023 /nfs/dbraw/zinc/84/00/23/564840023.db2.gz YSXIHAMAAMIOCL-UHFFFAOYSA-N 0 1 376.821 3.460 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1cnc(-c2ccccc2Cl)s1 ZINC000069502345 564840903 /nfs/dbraw/zinc/84/09/03/564840903.db2.gz ZDANBFHFRMKHLB-CYBMUJFWSA-N 0 1 379.913 3.304 10 0 GGAEMN O=C(Nc1nc(-c2ccccn2)n[nH]1)c1c[nH]c2cccc(Br)c12 ZINC000136272384 564846899 /nfs/dbraw/zinc/84/68/99/564846899.db2.gz URTNVNKJRGZVHS-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN C[C@@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1nnc2ccccn21 ZINC000070869435 564852283 /nfs/dbraw/zinc/85/22/83/564852283.db2.gz APGGXUAUCBOGQD-NEPJUHHUSA-N 0 1 381.263 3.127 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1Br ZINC000136889539 564856311 /nfs/dbraw/zinc/85/63/11/564856311.db2.gz KLCJHIXLHWOUIM-JQWIXIFHSA-N 0 1 395.301 3.481 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1Br ZINC000136889570 564856360 /nfs/dbraw/zinc/85/63/60/564856360.db2.gz KLCJHIXLHWOUIM-ZYHUDNBSSA-N 0 1 395.301 3.481 10 0 GGAEMN C[C@@H]1CN(C2CCN(C(=O)c3cc(F)c(Cl)cc3Cl)CC2)CCO1 ZINC000072013548 564860279 /nfs/dbraw/zinc/86/02/79/564860279.db2.gz VLRZEBYDMRFLDN-LLVKDONJSA-N 0 1 375.271 3.458 10 0 GGAEMN C[C@@H]1CN(CCCNC(=O)CCOc2cccc(Cl)c2Cl)C[C@H](C)O1 ZINC000072012745 564860304 /nfs/dbraw/zinc/86/03/04/564860304.db2.gz ZUDHGWQPVOOIHA-OKILXGFUSA-N 0 1 389.323 3.378 10 0 GGAEMN C[C@H](Cc1ccc(O)cc1)N(C)CC(=O)Nc1ccc(Br)cn1 ZINC000138357792 564865816 /nfs/dbraw/zinc/86/58/16/564865816.db2.gz HCTSGTMXOBEKSA-GFCCVEGCSA-N 0 1 378.270 3.051 10 0 GGAEMN CCc1ccc(CNCC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)cc1 ZINC000083823681 564867683 /nfs/dbraw/zinc/86/76/83/564867683.db2.gz ZPSNWNDREDFYHO-UHFFFAOYSA-N 0 1 380.897 3.034 10 0 GGAEMN Cc1cc(C)n(C[C@@H](C)CNC(=O)c2cc(C)cc(Br)c2O)n1 ZINC000084074620 564868912 /nfs/dbraw/zinc/86/89/12/564868912.db2.gz CWLXPRVFVGCPSX-NSHDSACASA-N 0 1 380.286 3.343 10 0 GGAEMN Cc1nc(CNC(=O)[C@H](C)Oc2ccccc2Br)c2ccccn12 ZINC000089708971 564870116 /nfs/dbraw/zinc/87/01/16/564870116.db2.gz GERODQVDXGXUNR-LBPRGKRZSA-N 0 1 388.265 3.489 10 0 GGAEMN CN1C(=O)C[C@@H](NC(=O)c2ccc(O)c(Cl)c2)[C@H]1c1ccc(Cl)cc1 ZINC000091770772 564872515 /nfs/dbraw/zinc/87/25/15/564872515.db2.gz CNWCZXHKOKOBIL-RHSMWYFYSA-N 0 1 379.243 3.401 10 0 GGAEMN CCn1c2ccc(Br)cc2[nH]c1=NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000092104472 564874200 /nfs/dbraw/zinc/87/42/00/564874200.db2.gz ISOVJEDKSABKET-LLVKDONJSA-N 0 1 388.269 3.022 10 0 GGAEMN CCn1c2ccc(Br)cc2nc1NC(=O)c1nc(C)ncc1Cl ZINC000092117251 564875132 /nfs/dbraw/zinc/87/51/32/564875132.db2.gz FKHYLZIMYXJCTK-UHFFFAOYSA-N 0 1 394.660 3.245 10 0 GGAEMN NC(=O)C[C@@H]1CCCCN1Cc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000092588332 564878033 /nfs/dbraw/zinc/87/80/33/564878033.db2.gz LAPWTAVQSUIUSW-AWEZNQCLSA-N 0 1 377.286 3.069 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1Cc1nc(-c2cccc(Br)c2)c[nH]1 ZINC000092588331 564878785 /nfs/dbraw/zinc/87/87/85/564878785.db2.gz LAPWTAVQSUIUSW-CQSZACIVSA-N 0 1 377.286 3.069 10 0 GGAEMN COc1ccc(Br)c(CN2CCC(c3ccnn3CCO)CC2)c1 ZINC000092811198 564880517 /nfs/dbraw/zinc/88/05/17/564880517.db2.gz ZMMZLENWRFVAHM-UHFFFAOYSA-N 0 1 394.313 3.026 10 0 GGAEMN CCN(CC)C(=O)C1CCN(CCOc2ccccc2Br)CC1 ZINC000093548702 564887681 /nfs/dbraw/zinc/88/76/81/564887681.db2.gz AZPPEZWYAAAFCM-UHFFFAOYSA-N 0 1 383.330 3.408 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccc3c(C)[nH]nc3c2)ccc1Br ZINC000093909464 564892748 /nfs/dbraw/zinc/89/27/48/564892748.db2.gz KUINWACJHUFJLV-UHFFFAOYSA-N 0 1 396.266 3.443 10 0 GGAEMN CC(C)CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccccc2F)s1 ZINC000093906581 564892784 /nfs/dbraw/zinc/89/27/84/564892784.db2.gz KNEMFQSVZYSLOE-UHFFFAOYSA-N 0 1 384.498 3.393 10 0 GGAEMN CCc1nnc(-c2cc(S(=O)(=O)Nc3cccc(Br)c3)c[nH]2)o1 ZINC000096321620 564900935 /nfs/dbraw/zinc/90/09/35/564900935.db2.gz NORORSSIYRMRPZ-UHFFFAOYSA-N 0 1 397.254 3.190 10 0 GGAEMN C[C@@H](NC[C@@H]1CCC(=O)N1)c1ccc(Br)cc1Br ZINC000096715539 564903004 /nfs/dbraw/zinc/90/30/04/564903004.db2.gz AZYOCPZPCRVNCH-SCZZXKLOSA-N 0 1 376.092 3.141 10 0 GGAEMN Cc1noc(NC(=O)CSc2nc(-c3cc(Cl)cc(Cl)c3)n[nH]2)n1 ZINC000151087438 564904653 /nfs/dbraw/zinc/90/46/53/564904653.db2.gz ZPWQVOVITPDEHU-UHFFFAOYSA-N 0 1 385.236 3.201 10 0 GGAEMN C[C@H](NC[C@@H]1CN(C)CCO1)c1ccc(Br)cc1Br ZINC000097996894 564911198 /nfs/dbraw/zinc/91/11/98/564911198.db2.gz MCLNXQFCCWIQIU-CMPLNLGQSA-N 0 1 392.135 3.193 10 0 GGAEMN CN1CCN(Cc2cccc(NC(=O)c3coc(Br)c3)c2)CC1 ZINC000098050742 564912663 /nfs/dbraw/zinc/91/26/63/564912663.db2.gz LSOPSERUGHIKBA-UHFFFAOYSA-N 0 1 378.270 3.042 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000101563211 564917624 /nfs/dbraw/zinc/91/76/24/564917624.db2.gz NMGDLKKGEDSELS-CABCVRRESA-N 0 1 389.323 3.114 10 0 GGAEMN Cc1ncc(Cl)c(C(=O)Nc2cc(Cl)ccc2N2CCN(C)CC2)n1 ZINC000151707651 564933643 /nfs/dbraw/zinc/93/36/43/564933643.db2.gz YYEPQSYIOWYPQA-UHFFFAOYSA-N 0 1 380.279 3.096 10 0 GGAEMN CC(C)(O)CN1CCN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000151746454 564934913 /nfs/dbraw/zinc/93/49/13/564934913.db2.gz BRNQZHMKQMKOAT-OAHLLOKOSA-N 0 1 386.323 3.079 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)CSCc1cc(-c2cccs2)on1 ZINC000102786058 564935729 /nfs/dbraw/zinc/93/57/29/564935729.db2.gz NGUGDDKWHIRSFU-UHFFFAOYSA-N 0 1 376.507 3.417 10 0 GGAEMN Cc1ncc(CNCc2ccc(OCCN3CCOCC3)c(Cl)c2)s1 ZINC000151776304 564936603 /nfs/dbraw/zinc/93/66/03/564936603.db2.gz ZQKGWLCHGVELLZ-UHFFFAOYSA-N 0 1 381.929 3.106 10 0 GGAEMN NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2C(F)(F)F)cc1Cl ZINC000103058387 564941864 /nfs/dbraw/zinc/94/18/64/564941864.db2.gz ZPKXCOIWTCYIIO-UHFFFAOYSA-N 0 1 396.749 3.398 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)CCC(=O)c1cc(Cl)sc1Cl ZINC000151963233 564942606 /nfs/dbraw/zinc/94/26/06/564942606.db2.gz FJRNQMMPTSCFOF-LLVKDONJSA-N 0 1 393.336 3.245 10 0 GGAEMN Cc1ccc(C(=O)NCc2ccc(F)c(CN(C)C)c2)c(Br)n1 ZINC000152029565 564944849 /nfs/dbraw/zinc/94/48/49/564944849.db2.gz QSXFMLMNTRXMAI-UHFFFAOYSA-N 0 1 380.261 3.283 10 0 GGAEMN CC[C@@H](NCc1ccc(S(=O)(=O)N2CCOCC2)s1)c1ccccc1 ZINC000152140491 564947498 /nfs/dbraw/zinc/94/74/98/564947498.db2.gz YBFOOACIDSHBOH-QGZVFWFLSA-N 0 1 380.535 3.010 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)CN1CC[C@H](Oc2cccnc2)C1 ZINC000152300063 564953486 /nfs/dbraw/zinc/95/34/86/564953486.db2.gz VKVSTWYCGJAFPR-ZFWWWQNUSA-N 0 1 383.275 3.281 10 0 GGAEMN C[C@@H](C(=O)Nc1ccc2[nH]nc(C(N)=O)c2c1)c1ccc(Br)cc1 ZINC000152361341 564956619 /nfs/dbraw/zinc/95/66/19/564956619.db2.gz BWLZQXHVHTWWGG-SECBINFHSA-N 0 1 387.237 3.167 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@@]3(C)CC3(Cl)Cl)cc2)C[C@H](C)O1 ZINC000105722806 564973302 /nfs/dbraw/zinc/97/33/02/564973302.db2.gz XWCNEOOMLOPCRM-QWQRMKEZSA-N 0 1 385.335 3.496 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)C[C@H]1CC ZINC000106119424 564977761 /nfs/dbraw/zinc/97/77/61/564977761.db2.gz PMCQTPVEXDLIPG-OAHLLOKOSA-N 0 1 388.339 3.365 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2ccc(Cl)c(Cl)c2)C[C@H]1CC ZINC000106119327 564978019 /nfs/dbraw/zinc/97/80/19/564978019.db2.gz UEQMLTFELBLJCW-OAHLLOKOSA-N 0 1 388.339 3.365 10 0 GGAEMN COc1cc(OC)c(NC(=O)[C@H]2CCCc3[nH]ncc32)cc1Br ZINC000152938842 564978059 /nfs/dbraw/zinc/97/80/59/564978059.db2.gz IWTHLFLWMOPXJV-VIFPVBQESA-N 0 1 380.242 3.248 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2ccc(Cl)cc2Cl)C[C@H]1CC ZINC000106119088 564978172 /nfs/dbraw/zinc/97/81/72/564978172.db2.gz LYVKDVHFKDHJAJ-OAHLLOKOSA-N 0 1 388.339 3.365 10 0 GGAEMN CCOCCN1CCN(CC(=O)Nc2cccc(Cl)c2Cl)C[C@@H]1CC ZINC000106119097 564978236 /nfs/dbraw/zinc/97/82/36/564978236.db2.gz NQGOLLZRMFOFTI-AWEZNQCLSA-N 0 1 388.339 3.365 10 0 GGAEMN CC[C@H]1CN([C@@H](C)C(=O)Nc2ccc(Cl)cc2Cl)CCN1CCOC ZINC000106116454 564978467 /nfs/dbraw/zinc/97/84/67/564978467.db2.gz UETBPNDQZBJCSU-ZFWWWQNUSA-N 0 1 388.339 3.363 10 0 GGAEMN CC[C@@H]1CN([C@@H](C)C(=O)Nc2ccc(Cl)cc2Cl)CCN1CCOC ZINC000106116452 564978509 /nfs/dbraw/zinc/97/85/09/564978509.db2.gz UETBPNDQZBJCSU-DZGCQCFKSA-N 0 1 388.339 3.363 10 0 GGAEMN Cn1cc(CN2CCCN(Cc3ccc(F)cc3Br)CC2)cn1 ZINC000106157935 564979533 /nfs/dbraw/zinc/97/95/33/564979533.db2.gz LBKNCVILUNILGK-UHFFFAOYSA-N 0 1 381.293 3.030 10 0 GGAEMN Cn1cc(CN2CCCN(CCOc3ccc(Cl)cc3Cl)CC2)cn1 ZINC000106157456 564979565 /nfs/dbraw/zinc/97/95/65/564979565.db2.gz OYEPPNBLMGQBBG-UHFFFAOYSA-N 0 1 383.323 3.314 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2C(F)(F)F)cc1 ZINC000152976732 564980071 /nfs/dbraw/zinc/98/00/71/564980071.db2.gz MUXPVWKCXOQSNA-UHFFFAOYSA-N 0 1 377.315 3.432 10 0 GGAEMN C[C@@H]1C[N@@H+](C[C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@H](C)O1 ZINC000106460528 564983464 /nfs/dbraw/zinc/98/34/64/564983464.db2.gz VLTAWFTUTFLLOA-XQQFMLRXSA-N 0 1 387.307 3.413 10 0 GGAEMN C[C@@H]1C[N@H+](C[C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@H](C)O1 ZINC000106460528 564983470 /nfs/dbraw/zinc/98/34/70/564983470.db2.gz VLTAWFTUTFLLOA-XQQFMLRXSA-N 0 1 387.307 3.413 10 0 GGAEMN C[C@@H]1C[NH+](C[C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@@H](C)O1 ZINC000106460530 564983863 /nfs/dbraw/zinc/98/38/63/564983863.db2.gz VLTAWFTUTFLLOA-UPJWGTAASA-N 0 1 387.307 3.413 10 0 GGAEMN COCCC1(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CCC1 ZINC000153085583 564984260 /nfs/dbraw/zinc/98/42/60/564984260.db2.gz VUMBVIFUBQNVAS-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN COCCC1(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CCC1 ZINC000153085583 564984264 /nfs/dbraw/zinc/98/42/64/564984264.db2.gz VUMBVIFUBQNVAS-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN C[C@@H](CN1CCN(C)CC1)NC(=O)N[C@@H](C)c1c(Cl)ccc(F)c1Cl ZINC000106539694 564984893 /nfs/dbraw/zinc/98/48/93/564984893.db2.gz MVCQQFSOSLFRIY-RYUDHWBXSA-N 0 1 391.318 3.129 10 0 GGAEMN CC(C)COC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000153235450 564989444 /nfs/dbraw/zinc/98/94/44/564989444.db2.gz AVNCILOISSAQRV-KRWDZBQOSA-N 0 1 389.367 3.187 10 0 GGAEMN CC(C)COC[C@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000153235340 564989476 /nfs/dbraw/zinc/98/94/76/564989476.db2.gz AVNCILOISSAQRV-QGZVFWFLSA-N 0 1 389.367 3.187 10 0 GGAEMN CCN1CCN([C@H]2CCN(C(=O)c3sc4ccccc4c3Cl)C2)CC1 ZINC000106799057 564989448 /nfs/dbraw/zinc/98/94/48/564989448.db2.gz DMFCVVJQMCSYES-AWEZNQCLSA-N 0 1 377.941 3.407 10 0 GGAEMN CN(C)[C@H](Cc1ccccc1)C(=O)NCc1ccc(Br)c(F)c1 ZINC000106912432 564991955 /nfs/dbraw/zinc/99/19/55/564991955.db2.gz AIOAUKFNPHJLPE-QGZVFWFLSA-N 0 1 379.273 3.377 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000153451567 564996156 /nfs/dbraw/zinc/99/61/56/564996156.db2.gz ZBVVZFNLAIATCL-LLVKDONJSA-N 0 1 385.295 3.160 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N(CCO)Cc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000153451676 564996329 /nfs/dbraw/zinc/99/63/29/564996329.db2.gz ZBVVZFNLAIATCL-NSHDSACASA-N 0 1 385.295 3.160 10 0 GGAEMN O=C(Cc1c(F)ccc(Br)c1F)Nc1ccn(-c2ccncc2)n1 ZINC000503599420 565024273 /nfs/dbraw/zinc/02/42/73/565024273.db2.gz KWBAMEYBEIQTAL-UHFFFAOYSA-N 0 1 393.191 3.489 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)Nc1ccccc1N1C(=O)CCC1=O ZINC000110592327 565042250 /nfs/dbraw/zinc/04/22/50/565042250.db2.gz ZEIXYNHMTZKGBH-UHFFFAOYSA-N 0 1 378.837 3.103 10 0 GGAEMN CCc1c(NC(=O)[C@@H]2C[C@H]2C(=O)OC)[nH]nc1-c1ccc(Br)cc1 ZINC000111148507 565050990 /nfs/dbraw/zinc/05/09/90/565050990.db2.gz SQCCFNYKGNECQB-CHWSQXEVSA-N 0 1 392.253 3.149 10 0 GGAEMN C[C@@]1(CNC(=O)CSc2n[n-]c(=S)s2)CCC[N@H+]1Cc1ccccc1 ZINC000154838050 565054486 /nfs/dbraw/zinc/05/44/86/565054486.db2.gz JHTUFAITIUYECR-KRWDZBQOSA-N 0 1 394.591 3.090 10 0 GGAEMN O=C(C[C@@H]1CSCCS1)N1CCC(c2ncc(C(F)(F)F)[nH]2)CC1 ZINC000155443871 565067644 /nfs/dbraw/zinc/06/76/44/565067644.db2.gz RTYHGBQPBTXMEP-LLVKDONJSA-N 0 1 379.473 3.373 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@H]1COc2ccccc21 ZINC000113165699 565068101 /nfs/dbraw/zinc/06/81/01/565068101.db2.gz CYPNQZZORUZZDQ-AWEZNQCLSA-N 0 1 399.248 3.027 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1COc2ccccc21 ZINC000113165699 565068103 /nfs/dbraw/zinc/06/81/03/565068103.db2.gz CYPNQZZORUZZDQ-AWEZNQCLSA-N 0 1 399.248 3.027 10 0 GGAEMN Brc1cccc(-c2nc(CN[C@@H]3CCc4ncnn4C3)cs2)c1 ZINC000113338467 565069224 /nfs/dbraw/zinc/06/92/24/565069224.db2.gz GCCXHMMOUGPOCW-CYBMUJFWSA-N 0 1 390.310 3.269 10 0 GGAEMN C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000113305626 565069382 /nfs/dbraw/zinc/06/93/82/565069382.db2.gz PJCXYTLMKSCUNS-WDEREUQCSA-N 0 1 382.835 3.216 10 0 GGAEMN CCCOc1c(Br)cc(C(=O)N2[C@H](C)CN(C)C[C@@H]2C)cc1OC ZINC000155772378 565071601 /nfs/dbraw/zinc/07/16/01/565071601.db2.gz QIFQVDLVRFTSIP-BETUJISGSA-N 0 1 399.329 3.411 10 0 GGAEMN Cc1nc([C@H](NC(=O)Cc2ccc(Br)s2)c2ccccc2)n[nH]1 ZINC000114327430 565073993 /nfs/dbraw/zinc/07/39/93/565073993.db2.gz DRGUNNLASHXUCI-OAHLLOKOSA-N 0 1 391.294 3.385 10 0 GGAEMN O=C(Nc1cccc(-c2nnc[nH]2)c1)c1csc(I)c1 ZINC000114393519 565074122 /nfs/dbraw/zinc/07/41/22/565074122.db2.gz GEOSQPIBMXPEDM-UHFFFAOYSA-N 0 1 396.213 3.390 10 0 GGAEMN O=C(Nc1c[nH]nc1-c1ccccn1)c1cc(Br)cc2nc[nH]c21 ZINC000369214769 565080902 /nfs/dbraw/zinc/08/09/02/565080902.db2.gz MKURPIDGKLGRJQ-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN Cn1cnnc1-c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000369227243 565082661 /nfs/dbraw/zinc/08/26/61/565082661.db2.gz YLTZABZICWXJAH-UHFFFAOYSA-N 0 1 397.236 3.373 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)N1CCCC[C@H]1c1nnc(C2CCC2)o1 ZINC000291899020 565084903 /nfs/dbraw/zinc/08/49/03/565084903.db2.gz PTSIEHJUQFFPEG-JTQLQIEISA-N 0 1 397.551 3.323 10 0 GGAEMN COc1ccc(Br)cc1CN(C)C(=O)CCSc1nnc(C)[nH]1 ZINC000266745457 565090219 /nfs/dbraw/zinc/09/02/19/565090219.db2.gz AUFKVZAKCSRPQN-UHFFFAOYSA-N 0 1 399.314 3.025 10 0 GGAEMN Cc1nnc(SCCC(=O)NCc2c(C)cc(Br)cc2C)[nH]1 ZINC000266802122 565091345 /nfs/dbraw/zinc/09/13/45/565091345.db2.gz DEVRQCKFEZLHSC-UHFFFAOYSA-N 0 1 383.315 3.291 10 0 GGAEMN O=C(c1csc(I)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000369406413 565091317 /nfs/dbraw/zinc/09/13/17/565091317.db2.gz JRFPWCOMRNABOX-UHFFFAOYSA-N 0 1 387.246 3.096 10 0 GGAEMN Cc1nc2ccc(Br)cn2c1C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000369525973 565096413 /nfs/dbraw/zinc/09/64/13/565096413.db2.gz DWJCTOCOKVKHJV-UHFFFAOYSA-N 0 1 388.269 3.148 10 0 GGAEMN CC1(C)CN(Cc2nc3ccc(Br)cc3[nH]2)C[C@@]2(CCOC2)O1 ZINC000369537577 565096512 /nfs/dbraw/zinc/09/65/12/565096512.db2.gz RZPNDAQSEYJFNX-QGZVFWFLSA-N 0 1 380.286 3.095 10 0 GGAEMN Cc1cc(NC(=O)[C@H](C)N2CCC(n3cncn3)CC2)ccc1Br ZINC000156585116 565096852 /nfs/dbraw/zinc/09/68/52/565096852.db2.gz TVIGLCRJZZNKLP-ZDUSSCGKSA-N 0 1 392.301 3.013 10 0 GGAEMN C[C@@H]1CN(c2ccccc2NC(=O)CSc2n[nH]c(=S)s2)C[C@@H](C)O1 ZINC000266970189 565098757 /nfs/dbraw/zinc/09/87/57/565098757.db2.gz BHEFJBXTRQRYOO-GHMZBOCLSA-N 0 1 396.563 3.171 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000292129493 565099548 /nfs/dbraw/zinc/09/95/48/565099548.db2.gz XQYMGNYAMSAWPH-QMMMGPOBSA-N 0 1 392.911 3.001 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@@H](C(=O)NCc1ccc(O)c(Br)c1)C2 ZINC000369577196 565100741 /nfs/dbraw/zinc/10/07/41/565100741.db2.gz FXSYQSCOMGLQIC-GFCCVEGCSA-N 0 1 392.297 3.423 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)NCCc1ccccc1Br ZINC000267011799 565101042 /nfs/dbraw/zinc/10/10/42/565101042.db2.gz NLETYHNFVMUDKJ-UHFFFAOYSA-N 0 1 390.353 3.040 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)Cc2ccc(F)cc2)[C@@H]1c1cccs1 ZINC000369674717 565104520 /nfs/dbraw/zinc/10/45/20/565104520.db2.gz YMFMQBOEEJENJA-MAUKXSAKSA-N 0 1 382.526 3.390 10 0 GGAEMN O=C1O[C@H](CN[C@@H](CO)c2cccc(Br)c2)CN1c1ccccc1 ZINC000183918498 565104694 /nfs/dbraw/zinc/10/46/94/565104694.db2.gz VWCQBPMXULXCPT-SJORKVTESA-N 0 1 391.265 3.098 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000183958587 565107174 /nfs/dbraw/zinc/10/71/74/565107174.db2.gz RHMLANBXCFPULO-GFCCVEGCSA-N 0 1 379.291 3.485 10 0 GGAEMN Cc1nc2ccc(Br)cn2c1C(=O)Nc1cccc(-c2nnc[nH]2)c1 ZINC000369876016 565117381 /nfs/dbraw/zinc/11/73/81/565117381.db2.gz XZQDOOHJZBQIJA-UHFFFAOYSA-N 0 1 397.236 3.443 10 0 GGAEMN COc1ccc(OC)c([C@@H]2CCCN2C(=O)CSc2n[nH]c(=S)s2)c1 ZINC000369968009 565120501 /nfs/dbraw/zinc/12/05/01/565120501.db2.gz VPEXHMNHSOWCCG-LBPRGKRZSA-N 0 1 397.547 3.300 10 0 GGAEMN Cc1ccc(NC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)nc1 ZINC000184240608 565121460 /nfs/dbraw/zinc/12/14/60/565121460.db2.gz IOYKNZPIWXUKDZ-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN Cc1ccc(NC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)nc1 ZINC000184240608 565121463 /nfs/dbraw/zinc/12/14/63/565121463.db2.gz IOYKNZPIWXUKDZ-UHFFFAOYSA-N 0 1 387.241 3.259 10 0 GGAEMN O=C(CN[C@@H](c1nnc[nH]1)c1ccccc1)Nc1c(Cl)cccc1Cl ZINC000370070997 565126978 /nfs/dbraw/zinc/12/69/78/565126978.db2.gz FCEHOEYHNRXBFQ-OAHLLOKOSA-N 0 1 376.247 3.429 10 0 GGAEMN O=C(NCCNc1ncc(Cl)cc1Cl)N1CCC(c2cnc[nH]2)CC1 ZINC000370218865 565133042 /nfs/dbraw/zinc/13/30/42/565133042.db2.gz IBTPXQLVESESIJ-UHFFFAOYSA-N 0 1 383.283 3.113 10 0 GGAEMN CC[C@@H](CO)N1CCN(C(=O)Nc2cccc(C3SCCS3)c2)CC1 ZINC000267991325 565136678 /nfs/dbraw/zinc/13/66/78/565136678.db2.gz RLKLBNGIWAJFAE-INIZCTEOSA-N 0 1 381.567 3.086 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)Cc3csc4ccc(Cl)cc34)CCO2)n[nH]1 ZINC000157582486 565137269 /nfs/dbraw/zinc/13/72/69/565137269.db2.gz XAYOIQCAMAKYAO-CQSZACIVSA-N 0 1 376.869 3.124 10 0 GGAEMN COC(=O)c1cc(Cl)cc(S(=O)(=O)Nc2ccc3oc(C)nc3c2)c1 ZINC000157576294 565137586 /nfs/dbraw/zinc/13/75/86/565137586.db2.gz LSKXCSHMFKGLNM-UHFFFAOYSA-N 0 1 380.809 3.377 10 0 GGAEMN O=C1CCCN1C[C@H](O)CN1CCC(=Cc2cc(Cl)ccc2Cl)CC1 ZINC000157628373 565138615 /nfs/dbraw/zinc/13/86/15/565138615.db2.gz PYWOHCHTOJCKKY-QGZVFWFLSA-N 0 1 383.319 3.456 10 0 GGAEMN COc1ccc(Cl)c(S(=O)(=O)N[C@@H](c2nccs2)C(F)(F)F)c1 ZINC000292892238 565141095 /nfs/dbraw/zinc/14/10/95/565141095.db2.gz VGGCZAZOKQOCGN-JTQLQIEISA-N 0 1 386.804 3.387 10 0 GGAEMN Cc1nn(C)c(CNCCc2cccc(C(F)(F)F)n2)c1Br ZINC000292893523 565141185 /nfs/dbraw/zinc/14/11/85/565141185.db2.gz GBXNWWHJOBHZIP-UHFFFAOYSA-N 0 1 377.208 3.237 10 0 GGAEMN COc1ccc(Br)cc1CN(C)C(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000268191630 565143297 /nfs/dbraw/zinc/14/32/97/565143297.db2.gz ZUXMKAQEHRQWBP-CYBMUJFWSA-N 0 1 378.270 3.259 10 0 GGAEMN Cc1c(I)cccc1C(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184586997 565146733 /nfs/dbraw/zinc/14/67/33/565146733.db2.gz DOVYYBLAPJDJML-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN Cc1c(I)cccc1C(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184586997 565146735 /nfs/dbraw/zinc/14/67/35/565146735.db2.gz DOVYYBLAPJDJML-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN CC(C)C[C@@H](CO)N(C)C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000184619951 565147683 /nfs/dbraw/zinc/14/76/83/565147683.db2.gz MLHPFGIUWNXVDW-ZDUSSCGKSA-N 0 1 380.286 3.318 10 0 GGAEMN Cc1ccc(I)cc1C(=O)Nc1nc(C2CCC2)n[nH]1 ZINC000184622119 565148189 /nfs/dbraw/zinc/14/81/89/565148189.db2.gz GYDYXVLQAHZHGW-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN Cc1ccc(I)cc1C(=O)Nc1n[nH]c(C2CCC2)n1 ZINC000184622119 565148192 /nfs/dbraw/zinc/14/81/92/565148192.db2.gz GYDYXVLQAHZHGW-UHFFFAOYSA-N 0 1 382.205 3.238 10 0 GGAEMN O=C(c1ccc(F)c(I)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000370559198 565148914 /nfs/dbraw/zinc/14/89/14/565148914.db2.gz WWUYYRQGSRYQCX-UHFFFAOYSA-N 0 1 399.207 3.173 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(CCC(=O)Nc3cccc(Br)c3)[C@@H]2C1 ZINC000157904698 565149005 /nfs/dbraw/zinc/14/90/05/565149005.db2.gz XDGHEFYRFBJDRY-ZACQAIPSSA-N 0 1 397.313 3.046 10 0 GGAEMN O=C(Nc1nc(C2CCC2)n[nH]1)c1cnn(-c2ccc(Br)cc2)c1 ZINC000184643684 565150139 /nfs/dbraw/zinc/15/01/39/565150139.db2.gz QXBYMFBMKNCILS-UHFFFAOYSA-N 0 1 387.241 3.273 10 0 GGAEMN O=C(Nc1n[nH]c(C2CCC2)n1)c1cnn(-c2ccc(Br)cc2)c1 ZINC000184643684 565150142 /nfs/dbraw/zinc/15/01/42/565150142.db2.gz QXBYMFBMKNCILS-UHFFFAOYSA-N 0 1 387.241 3.273 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)NC(=O)CCSc1nnc(C)[nH]1 ZINC000268485144 565155170 /nfs/dbraw/zinc/15/51/70/565155170.db2.gz FOTXVVVPZMUODP-ZDUSSCGKSA-N 0 1 397.342 3.495 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Nc2ccccc2I)n[nH]1 ZINC000158153792 565158637 /nfs/dbraw/zinc/15/86/37/565158637.db2.gz TUEFYEPYTYCGOT-VIFPVBQESA-N 0 1 384.221 3.075 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)Nc2ccccc2I)n[nH]1 ZINC000158153633 565159066 /nfs/dbraw/zinc/15/90/66/565159066.db2.gz TUEFYEPYTYCGOT-SECBINFHSA-N 0 1 384.221 3.075 10 0 GGAEMN O=C(Nc1ccc(Br)cc1)C1CCN(C[C@H](O)C(F)(F)F)CC1 ZINC000158190601 565160079 /nfs/dbraw/zinc/16/00/79/565160079.db2.gz ZTUSTUNORKHHBA-ZDUSSCGKSA-N 0 1 395.219 3.023 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cnn(-c2ccc(Cl)cc2Cl)c1 ZINC000370814440 565162544 /nfs/dbraw/zinc/16/25/44/565162544.db2.gz KQWJGXZCUGWTCA-GFCCVEGCSA-N 0 1 376.247 3.190 10 0 GGAEMN O=C(N[C@H]1CCCc2sc(Cl)cc21)N1CCN(C2CCOCC2)CC1 ZINC000293338657 565163321 /nfs/dbraw/zinc/16/33/21/565163321.db2.gz JHVRLQSNETVGBQ-HNNXBMFYSA-N 0 1 383.945 3.285 10 0 GGAEMN Brc1ccc2nc(CN3CCN(Cc4ccccn4)CC3)[nH]c2c1 ZINC000184936879 565166495 /nfs/dbraw/zinc/16/64/95/565166495.db2.gz AWQDCZVUWLWIOW-UHFFFAOYSA-N 0 1 386.297 3.038 10 0 GGAEMN CC(C)(C)C(=O)N1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000184935255 565166733 /nfs/dbraw/zinc/16/67/33/565166733.db2.gz KRSKNXYDOGMZGS-UHFFFAOYSA-N 0 1 379.302 3.016 10 0 GGAEMN CNC(=O)c1ccc(CN(C)Cc2nc3ccc(Br)cc3[nH]2)cc1 ZINC000184936779 565166780 /nfs/dbraw/zinc/16/67/80/565166780.db2.gz HSVXSRDURHRXOC-UHFFFAOYSA-N 0 1 387.281 3.317 10 0 GGAEMN CO[C@@H]1CC[C@@H]2OCCN(CCC(=O)Nc3ccc(Br)cc3)[C@@H]2C1 ZINC000158353587 565167268 /nfs/dbraw/zinc/16/72/68/565167268.db2.gz PUIQHKHDDUOGET-ZACQAIPSSA-N 0 1 397.313 3.046 10 0 GGAEMN CO[C@@H]1CC[C@H]2OCCN(CCC(=O)Nc3ccc(Br)cc3)[C@@H]2C1 ZINC000158353301 565167285 /nfs/dbraw/zinc/16/72/85/565167285.db2.gz PUIQHKHDDUOGET-BRWVUGGUSA-N 0 1 397.313 3.046 10 0 GGAEMN O=C1C[C@H](c2ccccc2)N(Cc2nc3ccc(Br)cc3[nH]2)CCN1 ZINC000184961353 565167702 /nfs/dbraw/zinc/16/77/02/565167702.db2.gz PFUJTZZMAXNGCW-QGZVFWFLSA-N 0 1 399.292 3.389 10 0 GGAEMN CCO[C@H]1C[C@H](O)C12CCN(Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000184974133 565168785 /nfs/dbraw/zinc/16/87/85/565168785.db2.gz VNTZVAFLDONMOC-HOTGVXAUSA-N 0 1 394.313 3.077 10 0 GGAEMN Cc1nc(C[C@@H]2CCCN(Cc3nc4ccc(Br)cc4[nH]3)C2)no1 ZINC000184964895 565169082 /nfs/dbraw/zinc/16/90/82/565169082.db2.gz VPAYIQCKLKEDMQ-LBPRGKRZSA-N 0 1 390.285 3.472 10 0 GGAEMN Cn1ccnc1CC1CCN(C[C@@H](O)c2ccc(F)c(Br)c2)CC1 ZINC000185004070 565170150 /nfs/dbraw/zinc/17/01/50/565170150.db2.gz UVKNYRVDKOCLJF-QGZVFWFLSA-N 0 1 396.304 3.310 10 0 GGAEMN Fc1cc(CNCc2cnc(N3CCOCC3)c(F)c2)ccc1Br ZINC000185068895 565176614 /nfs/dbraw/zinc/17/66/14/565176614.db2.gz ISIAHMPXQWWDGA-UHFFFAOYSA-N 0 1 398.251 3.249 10 0 GGAEMN Fc1cc(CNCc2cc(Br)cs2)cnc1N1CCOCC1 ZINC000185076370 565176697 /nfs/dbraw/zinc/17/66/97/565176697.db2.gz HSISZVLMNJFYKJ-UHFFFAOYSA-N 0 1 386.290 3.171 10 0 GGAEMN Fc1ccc(CNCc2cnc(N3CCOCC3)c(F)c2)cc1Br ZINC000185080235 565176723 /nfs/dbraw/zinc/17/67/23/565176723.db2.gz XFXLXZHVJUPGCF-UHFFFAOYSA-N 0 1 398.251 3.249 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N(C)CCOc2ccc(Br)cc2)n[nH]1 ZINC000269041292 565176875 /nfs/dbraw/zinc/17/68/75/565176875.db2.gz WVPJBFIAGXHVBM-GFCCVEGCSA-N 0 1 395.301 3.132 10 0 GGAEMN Cc1c(Br)scc1C(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000185094005 565177704 /nfs/dbraw/zinc/17/77/04/565177704.db2.gz NUSZYBLMRYFBLL-NSHDSACASA-N 0 1 387.343 3.144 10 0 GGAEMN Cc1cc(N2CC[C@H](NCc3cnn4ccccc34)C2=O)ccc1Br ZINC000185189379 565185362 /nfs/dbraw/zinc/18/53/62/565185362.db2.gz FKGMGTOUQDMHNM-KRWDZBQOSA-N 0 1 399.292 3.300 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)[C@H](O)c2c(Cl)cccc2Cl)n[nH]1 ZINC000269324471 565185452 /nfs/dbraw/zinc/18/54/52/565185452.db2.gz MPUPUILKWLOFEW-QEKSWQHZSA-N 0 1 385.295 3.377 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371362439 565188190 /nfs/dbraw/zinc/18/81/90/565188190.db2.gz WDTDAFFWGGPQSQ-CMPLNLGQSA-N 0 1 380.261 3.164 10 0 GGAEMN C[C@@H](Sc1ccc(Br)cc1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000371358679 565188372 /nfs/dbraw/zinc/18/83/72/565188372.db2.gz CKBJYJHGFBROHN-PWSUYJOCSA-N 0 1 380.311 3.327 10 0 GGAEMN C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000371362441 565188571 /nfs/dbraw/zinc/18/85/71/565188571.db2.gz WDTDAFFWGGPQSQ-PWSUYJOCSA-N 0 1 380.261 3.164 10 0 GGAEMN C[C@@H](Sc1ccc(Br)cc1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371358680 565188660 /nfs/dbraw/zinc/18/86/60/565188660.db2.gz CKBJYJHGFBROHN-ZYHUDNBSSA-N 0 1 380.311 3.327 10 0 GGAEMN C[C@H](Sc1ccc(Br)cc1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371358677 565188929 /nfs/dbraw/zinc/18/89/29/565188929.db2.gz CKBJYJHGFBROHN-CMPLNLGQSA-N 0 1 380.311 3.327 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc(Br)cc(C(F)(F)F)c1 ZINC000371358784 565188989 /nfs/dbraw/zinc/18/89/89/565188989.db2.gz DGUHOLJGNROPDX-LLVKDONJSA-N 0 1 388.187 3.478 10 0 GGAEMN C[C@@H]1CN(C(=O)c2c[nH]c3ccc(I)cc3c2=O)[C@@H]1C ZINC000293901721 565189393 /nfs/dbraw/zinc/18/93/93/565189393.db2.gz CAKMEYAWRMWICP-RKDXNWHRSA-N 0 1 382.201 3.025 10 0 GGAEMN CCN1CC[C@H]2OCCN(C(=O)c3cc4cc(Br)ccc4o3)[C@H]2C1 ZINC000293948509 565191740 /nfs/dbraw/zinc/19/17/40/565191740.db2.gz ROYTYJPFAAVNMC-GOEBONIOSA-N 0 1 393.281 3.131 10 0 GGAEMN CN(C)[C@H](CNC(=O)N[C@@H]1CCOC2(CCSCC2)C1)c1ccsc1 ZINC000269555901 565194126 /nfs/dbraw/zinc/19/41/26/565194126.db2.gz ZEPWOGPJBHVFOM-HZPDHXFCSA-N 0 1 383.583 3.095 10 0 GGAEMN O=C(Cc1cscc1Br)NC1CCN(Cc2cccnc2)CC1 ZINC000294028006 565194971 /nfs/dbraw/zinc/19/49/71/565194971.db2.gz FHKUUNKHBNIDEJ-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN CCc1ncnc(NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1F ZINC000159179321 565196349 /nfs/dbraw/zinc/19/63/49/565196349.db2.gz AWLPWIJCLCZWBV-UHFFFAOYSA-N 0 1 377.221 3.338 10 0 GGAEMN CCc1ncnc(NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1F ZINC000159179321 565196354 /nfs/dbraw/zinc/19/63/54/565196354.db2.gz AWLPWIJCLCZWBV-UHFFFAOYSA-N 0 1 377.221 3.338 10 0 GGAEMN O=C(NC[C@@H](O)CN1CCc2ccccc2C1)c1cc(Cl)sc1Cl ZINC000159151005 565196696 /nfs/dbraw/zinc/19/66/96/565196696.db2.gz MTRJQZUOQXOSDH-CYBMUJFWSA-N 0 1 385.316 3.204 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCc2cc(Br)cc(F)c2C1 ZINC000371541818 565198822 /nfs/dbraw/zinc/19/88/22/565198822.db2.gz FNWPTCKKYXTGHZ-GFCCVEGCSA-N 0 1 378.245 3.316 10 0 GGAEMN O=C(COc1ccc(Cl)cc1Cl)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000371559860 565199438 /nfs/dbraw/zinc/19/94/38/565199438.db2.gz BGSCGSFKQZDBNI-MRXNPFEDSA-N 0 1 377.231 3.396 10 0 GGAEMN O=C(COc1ccc(Cl)cc1Cl)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000371559854 565199889 /nfs/dbraw/zinc/19/98/89/565199889.db2.gz BGSCGSFKQZDBNI-INIZCTEOSA-N 0 1 377.231 3.396 10 0 GGAEMN O=C(NC[C@H](O)CN1CCc2ccccc2C1)c1ccc(Cl)cc1Cl ZINC000159321930 565201720 /nfs/dbraw/zinc/20/17/20/565201720.db2.gz IJUAZSGBIIKICU-INIZCTEOSA-N 0 1 379.287 3.142 10 0 GGAEMN Cc1cccc2nc(CNC(=O)C(=O)Nc3ccc(Cl)c(Cl)c3)[nH]c21 ZINC000159340689 565203442 /nfs/dbraw/zinc/20/34/42/565203442.db2.gz CALCMGYTBJFUJQ-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(Cl)c(F)cc1Br ZINC000294298401 565206544 /nfs/dbraw/zinc/20/65/44/565206544.db2.gz BYVFZOGCJYKLMS-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN Cn1ncc2c1ncnc2SCc1nc2ccc(Br)cc2[nH]1 ZINC000185510759 565206703 /nfs/dbraw/zinc/20/67/03/565206703.db2.gz CKOOOLFYIGRRHK-UHFFFAOYSA-N 0 1 375.255 3.294 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2[N@H+]1Cc1cc2c(cc1Br)OCCO2 ZINC000294310468 565207547 /nfs/dbraw/zinc/20/75/47/565207547.db2.gz YBSLFNBEDQGEFS-UGFHNGPFSA-N 0 1 396.281 3.438 10 0 GGAEMN O=C(Nc1cc(-c2ccc(Br)s2)[nH]n1)[C@@H]1CCc2[nH]cnc2C1 ZINC000616798597 565208682 /nfs/dbraw/zinc/20/86/82/565208682.db2.gz FDBUMGCEXXGSRW-MRVPVSSYSA-N 0 1 392.282 3.367 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000371840259 565211776 /nfs/dbraw/zinc/21/17/76/565211776.db2.gz GAWSEOSBMLRNPJ-LSDHHAIUSA-N 0 1 377.231 3.051 10 0 GGAEMN CCCn1c(CO)nnc1SCc1nc2ccc(Br)cc2[nH]1 ZINC000185630062 565212300 /nfs/dbraw/zinc/21/23/00/565212300.db2.gz YZAJCEZBALOYMM-UHFFFAOYSA-N 0 1 382.287 3.112 10 0 GGAEMN O=C(NCCCCN1CCOCC1)c1cc(Cl)c(Br)cc1F ZINC000294516319 565215215 /nfs/dbraw/zinc/21/52/15/565215215.db2.gz ORILNVZADHUAOK-UHFFFAOYSA-N 0 1 393.684 3.084 10 0 GGAEMN CN(Cc1cc(Br)cc(Br)c1N)C[C@H]1CCCO1 ZINC000185719680 565217874 /nfs/dbraw/zinc/21/78/74/565217874.db2.gz PNJGYBFZPHIWOD-LLVKDONJSA-N 0 1 378.108 3.405 10 0 GGAEMN Cc1nn(-c2ccc(Br)cc2)cc1CNCc1n[nH]c(C2CC2)n1 ZINC000294681419 565223933 /nfs/dbraw/zinc/22/39/33/565223933.db2.gz BPONTUCRFMTVPX-UHFFFAOYSA-N 0 1 387.285 3.229 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@@H](C2CCOCC2)C1 ZINC000372206325 565225599 /nfs/dbraw/zinc/22/55/99/565225599.db2.gz OVGXALWHXQAMOF-GFCCVEGCSA-N 0 1 378.270 3.214 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000270769926 565228299 /nfs/dbraw/zinc/22/82/99/565228299.db2.gz RQCASKXMFJZKIT-JOYOIKCWSA-N 0 1 394.273 3.014 10 0 GGAEMN O=C(NCCc1nc[nH]n1)C1(c2ccccc2Br)CCCCC1 ZINC000294853305 565231929 /nfs/dbraw/zinc/23/19/29/565231929.db2.gz FSFOHEYILNWBTR-UHFFFAOYSA-N 0 1 377.286 3.128 10 0 GGAEMN O=S(=O)(Nc1cccc(-c2nc[nH]n2)c1)c1ccccc1Br ZINC000372606223 565246011 /nfs/dbraw/zinc/24/60/11/565246011.db2.gz OKYIEYWFLNJUMG-UHFFFAOYSA-N 0 1 379.239 3.035 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000160457219 565247209 /nfs/dbraw/zinc/24/72/09/565247209.db2.gz CQEJMJIFKJPUST-SNVBAGLBSA-N 0 1 376.092 3.036 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CCc3c(Br)ccc(F)c3C2)[nH]1 ZINC000186225046 565248840 /nfs/dbraw/zinc/24/88/40/565248840.db2.gz GWICLTFSIDTQEB-UHFFFAOYSA-N 0 1 399.289 3.082 10 0 GGAEMN O=S1(=O)CC[C@@H](N[C@@H]2CCN(c3ccc(Cl)cc3)C2)c2ccccc21 ZINC000186310008 565254376 /nfs/dbraw/zinc/25/43/76/565254376.db2.gz NPCVLKSQUQFYMP-CRAIPNDOSA-N 0 1 376.909 3.427 10 0 GGAEMN O=S1(=O)CC[C@@H](N[C@H]2CCN(c3ccc(Cl)cc3)C2)c2ccccc21 ZINC000186310051 565254821 /nfs/dbraw/zinc/25/48/21/565254821.db2.gz NPCVLKSQUQFYMP-MAUKXSAKSA-N 0 1 376.909 3.427 10 0 GGAEMN O=S(=O)(N[C@@H]1CCO[C@@H](c2cccnc2)C1)c1c(Cl)ccc(F)c1F ZINC000295269134 565256846 /nfs/dbraw/zinc/25/68/46/565256846.db2.gz APCGTHCGIADVKC-BXUZGUMPSA-N 0 1 388.823 3.212 10 0 GGAEMN Cc1nc(NC(=O)N[C@H](c2nnc[nH]2)c2ccccc2)ccc1Br ZINC000372904047 565260545 /nfs/dbraw/zinc/26/05/45/565260545.db2.gz JDAWRGGLJNPEBR-AWEZNQCLSA-N 0 1 387.241 3.182 10 0 GGAEMN CN(Cc1cc(-c2cnn(C)c2)no1)C[C@@H](O)c1ccccc1Br ZINC000295362882 565261179 /nfs/dbraw/zinc/26/11/79/565261179.db2.gz PEJALYKQVJMNEW-QGZVFWFLSA-N 0 1 391.269 3.003 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@H]2CCCc3[nH]ncc32)ccc1Br ZINC000271655298 565262441 /nfs/dbraw/zinc/26/24/41/565262441.db2.gz IYWGXYCMUPTFEJ-JTQLQIEISA-N 0 1 378.226 3.017 10 0 GGAEMN COC(=O)[C@@H]1CCCCC[C@@H]1NCc1nnc(-c2ccc(Br)o2)o1 ZINC000295431203 565266050 /nfs/dbraw/zinc/26/60/50/565266050.db2.gz DBSMJSTZLDVKAI-MNOVXSKESA-N 0 1 398.257 3.304 10 0 GGAEMN CO[C@@H]1COCC[C@H]1CC(=O)Nc1cc(Br)cc(Cl)c1O ZINC000295477201 565267960 /nfs/dbraw/zinc/26/79/60/565267960.db2.gz JANOVLVPTKMSJC-QPUJVOFHSA-N 0 1 378.650 3.188 10 0 GGAEMN CO[C@H]1COCC[C@H]1CC(=O)Nc1cc(Br)cc(Cl)c1O ZINC000295477214 565268365 /nfs/dbraw/zinc/26/83/65/565268365.db2.gz JANOVLVPTKMSJC-UFBFGSQYSA-N 0 1 378.650 3.188 10 0 GGAEMN C[C@H](NC(=O)c1cn[nH]c1-c1ccc(Cl)s1)c1nnc2n1CCCC2 ZINC000186580428 565269822 /nfs/dbraw/zinc/26/98/22/565269822.db2.gz LNRVAVCIMNHYNF-VIFPVBQESA-N 0 1 376.873 3.210 10 0 GGAEMN C[C@@H](NC(=O)c1cn[nH]c1-c1ccc(Cl)s1)c1nnc2n1CCCC2 ZINC000186580444 565269891 /nfs/dbraw/zinc/26/98/91/565269891.db2.gz LNRVAVCIMNHYNF-SECBINFHSA-N 0 1 376.873 3.210 10 0 GGAEMN C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCC([N@@H+](C)CC(=O)[O-])CC1 ZINC000186620836 565271815 /nfs/dbraw/zinc/27/18/15/565271815.db2.gz NAWZMMKOQOVXRZ-LBPRGKRZSA-N 0 1 387.307 3.179 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2csc(-c3ccc(Cl)s3)n2)CC1 ZINC000186619893 565271879 /nfs/dbraw/zinc/27/18/79/565271879.db2.gz RANDAINEXPTHOV-UHFFFAOYSA-N 0 1 399.925 3.146 10 0 GGAEMN O=c1ccc2c([nH]1)CCC[C@H]2NCc1cc2c(cc1Br)OCO2 ZINC000271917189 565272053 /nfs/dbraw/zinc/27/20/53/565272053.db2.gz MWMKXZKHZYVNCC-CYBMUJFWSA-N 0 1 377.238 3.446 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC2(CCC(O)CC2)CC1 ZINC000295665010 565279491 /nfs/dbraw/zinc/27/94/91/565279491.db2.gz WIHUMDICXUFRKK-UHFFFAOYSA-N 0 1 392.297 3.483 10 0 GGAEMN CCOC(=O)c1cc(CN[C@H](CO)c2cccc(Br)c2)[nH]c1C ZINC000295667789 565280412 /nfs/dbraw/zinc/28/04/12/565280412.db2.gz JWNHICFIHCDDLN-MRXNPFEDSA-N 0 1 381.270 3.086 10 0 GGAEMN CCOC(=O)c1cc(CN[C@@H](CO)c2cccc(Br)c2)[nH]c1C ZINC000295667787 565280550 /nfs/dbraw/zinc/28/05/50/565280550.db2.gz JWNHICFIHCDDLN-INIZCTEOSA-N 0 1 381.270 3.086 10 0 GGAEMN C[C@H](c1ccc(CN2CCC(N(C)S(C)(=O)=O)CC2)cc1)C(F)(F)F ZINC000295685746 565281299 /nfs/dbraw/zinc/28/12/99/565281299.db2.gz NAOICPOSXNPELB-CYBMUJFWSA-N 0 1 378.460 3.208 10 0 GGAEMN CCC1(CC)CN(C(=O)c2cc(-c3ccc(Cl)cc3)[nH]n2)CC[S@]1=O ZINC000186764404 565284021 /nfs/dbraw/zinc/28/40/21/565284021.db2.gz BDTBJMHSDLSWKP-RUZDIDTESA-N 0 1 379.913 3.493 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)CSCc2cc(-c3cccs3)on2)n[nH]1 ZINC000161541822 565287502 /nfs/dbraw/zinc/28/75/02/565287502.db2.gz OOJLLVKLOMSAHM-NSHDSACASA-N 0 1 376.507 3.415 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCSC2(CCOCC2)C1 ZINC000186859541 565291180 /nfs/dbraw/zinc/29/11/80/565291180.db2.gz DQBRERKBBXEUTI-UHFFFAOYSA-N 0 1 396.310 3.064 10 0 GGAEMN CCOC(=O)C1(COC)CCN(C(=O)c2c(O)cc(Cl)cc2Cl)CC1 ZINC000373627029 565294738 /nfs/dbraw/zinc/29/47/38/565294738.db2.gz FGWVLENJUADFEG-UHFFFAOYSA-N 0 1 390.263 3.131 10 0 GGAEMN O=C(Cc1sccc1Br)NC1CCN(Cc2cccnc2)CC1 ZINC000295975721 565296611 /nfs/dbraw/zinc/29/66/11/565296611.db2.gz WAYKOQKJZJGQRG-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN O=C(NCc1ccc(Br)cc1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000373686857 565298493 /nfs/dbraw/zinc/29/84/93/565298493.db2.gz BPLSDCRNUYJQIX-OAHLLOKOSA-N 0 1 386.253 3.156 10 0 GGAEMN Cc1ccc(CC(=O)N[C@H](c2nnc[nH]2)c2ccccc2)cc1Br ZINC000373688610 565298704 /nfs/dbraw/zinc/29/87/04/565298704.db2.gz UMFQEPNBBFFXDB-KRWDZBQOSA-N 0 1 385.265 3.324 10 0 GGAEMN C[C@H](NC1CCN(c2ncccn2)CC1)c1ncc(Br)cc1F ZINC000187004723 565301320 /nfs/dbraw/zinc/30/13/20/565301320.db2.gz VJXUYOMNGIPIMS-NSHDSACASA-N 0 1 380.265 3.093 10 0 GGAEMN C[C@H](N[C@@H]1CCCN(c2ncccn2)C1)c1ncc(Br)cc1F ZINC000187023922 565302459 /nfs/dbraw/zinc/30/24/59/565302459.db2.gz RGTXICGEHJZEEJ-WCQYABFASA-N 0 1 380.265 3.093 10 0 GGAEMN O=S(=O)(NCCN[C@@H]1CCCOc2ccc(Cl)cc21)c1ccccc1 ZINC000162456236 565317859 /nfs/dbraw/zinc/31/78/59/565317859.db2.gz LUKFESGDIHCAAA-QGZVFWFLSA-N 0 1 380.897 3.122 10 0 GGAEMN COCCN1CCN(Cc2cc(Br)cc3cccnc32)C[C@H]1C ZINC000162559835 565321301 /nfs/dbraw/zinc/32/13/01/565321301.db2.gz SFFUOZVIBCEZFL-CQSZACIVSA-N 0 1 378.314 3.150 10 0 GGAEMN CSc1ccc(Cl)cc1NC(=O)C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000374211197 565325499 /nfs/dbraw/zinc/32/54/99/565325499.db2.gz JIABWXZXNWODAR-UHFFFAOYSA-N 0 1 378.885 3.130 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)N[C@H](c2nccs2)C(F)(F)F)n[nH]1 ZINC000296721053 565332181 /nfs/dbraw/zinc/33/21/81/565332181.db2.gz BPIOPIMLCTUOQA-DJLDLDEBSA-N 0 1 376.408 3.439 10 0 GGAEMN CC(C)c1nnc2n1C[C@@H](N[C@@H](C)c1ncc(Br)cc1F)CC2 ZINC000187446256 565333628 /nfs/dbraw/zinc/33/36/28/565333628.db2.gz QAPNNZPSUJWOCX-JQWIXIFHSA-N 0 1 382.281 3.364 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccc(F)c(Cl)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000163056216 565334831 /nfs/dbraw/zinc/33/48/31/565334831.db2.gz MHMRNQHHJNLSIL-LLVKDONJSA-N 0 1 384.860 3.172 10 0 GGAEMN C[C@@H](N[C@H](C)c1ccc(S(C)(=O)=O)cc1)C(=O)Nc1cccc(Cl)c1 ZINC000163142126 565337302 /nfs/dbraw/zinc/33/73/02/565337302.db2.gz KEYVTGOFYQBUGH-CHWSQXEVSA-N 0 1 380.897 3.421 10 0 GGAEMN Cc1ccc(I)c(C(=O)N[C@@H]2CCCc3cn[nH]c32)c1 ZINC000374459162 565339915 /nfs/dbraw/zinc/33/99/15/565339915.db2.gz BRVHUUAEVSPJSX-CYBMUJFWSA-N 0 1 381.217 3.130 10 0 GGAEMN COc1ccc(Br)c(CC(=O)N2CCC(c3cnc[nH]3)CC2)c1 ZINC000374450252 565340572 /nfs/dbraw/zinc/34/05/72/565340572.db2.gz KFOUDHJXWRXCGS-UHFFFAOYSA-N 0 1 378.270 3.130 10 0 GGAEMN CCC1(CC)CN(Cc2nc3ccc(Br)cc3[nH]2)CC[S@]1=O ZINC000187562006 565341798 /nfs/dbraw/zinc/34/17/98/565341798.db2.gz WKTBAOYPOFWJSY-JOCHJYFZSA-N 0 1 384.343 3.449 10 0 GGAEMN Cc1ccc2c(=O)c(C(=O)N(C)Cc3cc(Br)cn3C)c[n-]c2[nH+]1 ZINC000163494457 565347286 /nfs/dbraw/zinc/34/72/86/565347286.db2.gz CPXYPOACTJXFBH-UHFFFAOYSA-N 0 1 389.253 3.017 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(Br)s1 ZINC000163735738 565351261 /nfs/dbraw/zinc/35/12/61/565351261.db2.gz UPVOEARFYDKDDD-UHFFFAOYSA-N 0 1 377.267 3.268 10 0 GGAEMN O=C(N[C@H](c1nnc[nH]1)c1ccccc1)c1cc(F)ccc1Br ZINC000374827020 565355793 /nfs/dbraw/zinc/35/57/93/565355793.db2.gz MQLPCKPPNVMEQG-AWEZNQCLSA-N 0 1 375.201 3.226 10 0 GGAEMN CC(C)(NCc1cn2cccnc2n1)[C@@H](O)c1ccc(Br)cc1 ZINC000297312799 565367919 /nfs/dbraw/zinc/36/79/19/565367919.db2.gz BTXAXGJFRNRTPY-HNNXBMFYSA-N 0 1 375.270 3.094 10 0 GGAEMN CCOc1cc(CN[C@@H](CC(N)=O)c2ccccc2)cc(Br)c1O ZINC000297370016 565370214 /nfs/dbraw/zinc/37/02/14/565370214.db2.gz HOMYCHMYRSAECM-HNNXBMFYSA-N 0 1 393.281 3.260 10 0 GGAEMN C[C@H]1N(Cc2nnc(-c3ccc(Br)o3)o2)CCC12CCOCC2 ZINC000375237800 565376540 /nfs/dbraw/zinc/37/65/40/565376540.db2.gz PIFBPNDGONGVGV-LLVKDONJSA-N 0 1 382.258 3.483 10 0 GGAEMN Cc1[nH]ncc1CNC(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000274676341 565377297 /nfs/dbraw/zinc/37/72/97/565377297.db2.gz YXXJDRWWQOJWFV-UHFFFAOYSA-N 0 1 391.191 3.499 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC[C@@]2(C1)CCCOC2 ZINC000375266972 565378358 /nfs/dbraw/zinc/37/83/58/565378358.db2.gz HOILDFLGDPMQDU-GOSISDBHSA-N 0 1 390.281 3.482 10 0 GGAEMN CO[C@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)CC[C@@H]1C ZINC000188106388 565379023 /nfs/dbraw/zinc/37/90/23/565379023.db2.gz JBLKAOYAODNRPK-AAEUAGOBSA-N 0 1 378.270 3.336 10 0 GGAEMN O=S(=O)(Nc1ncccc1F)c1cc(Cl)ccc1OC[C@@H]1CCOC1 ZINC000188153604 565383847 /nfs/dbraw/zinc/38/38/47/565383847.db2.gz BCFWNBIIDDNZPC-LLVKDONJSA-N 0 1 386.832 3.090 10 0 GGAEMN COc1cc(Br)c(CN2CCC[C@@H]2Cn2ccnc2)cc1OC ZINC000188399734 565399128 /nfs/dbraw/zinc/39/91/28/565399128.db2.gz BRFYPWOVZMLCHY-CQSZACIVSA-N 0 1 380.286 3.327 10 0 GGAEMN COc1cc(C)c(S(=O)(=O)Nc2cccc3c2OCC[C@@H]3O)cc1Cl ZINC000375648543 565399292 /nfs/dbraw/zinc/39/92/92/565399292.db2.gz XOGZYBHTZFEFMP-AWEZNQCLSA-N 0 1 383.853 3.274 10 0 GGAEMN O=C(NCc1ccsc1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000170933219 565399511 /nfs/dbraw/zinc/39/95/11/565399511.db2.gz YNINWOSDCOBOPQ-UHFFFAOYSA-N 0 1 392.282 3.295 10 0 GGAEMN O=C(NCc1ccsc1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000170933219 565399515 /nfs/dbraw/zinc/39/95/15/565399515.db2.gz YNINWOSDCOBOPQ-UHFFFAOYSA-N 0 1 392.282 3.295 10 0 GGAEMN CCOc1cc(CNCc2cccc(C(=O)NC)c2)cc(Br)c1O ZINC000298282579 565407668 /nfs/dbraw/zinc/40/76/68/565407668.db2.gz CYVYOLPVNRQJLB-UHFFFAOYSA-N 0 1 393.281 3.203 10 0 GGAEMN O=C(CCN1CCC[C@@H]1c1cc[nH]n1)Nc1ccc(Br)cc1F ZINC000298470377 565415679 /nfs/dbraw/zinc/41/56/79/565415679.db2.gz IQCWFUGBARAEFS-OAHLLOKOSA-N 0 1 381.249 3.477 10 0 GGAEMN C[C@@H]1CN(C(=O)C(C)(C)c2cccc(Br)c2)CCN1CC(C)(C)O ZINC000188678022 565416916 /nfs/dbraw/zinc/41/69/16/565416916.db2.gz FOKQEUKXDIQAAL-CQSZACIVSA-N 0 1 397.357 3.030 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc(F)cc1F ZINC000171223576 565418620 /nfs/dbraw/zinc/41/86/20/565418620.db2.gz BKDNYELQHIBITP-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc(F)cc1F ZINC000171223576 565418624 /nfs/dbraw/zinc/41/86/24/565418624.db2.gz BKDNYELQHIBITP-UHFFFAOYSA-N 0 1 393.191 3.442 10 0 GGAEMN O=C(Cc1cccc(F)c1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223327 565419191 /nfs/dbraw/zinc/41/91/91/565419191.db2.gz RMCWNKSCIPHFAS-UHFFFAOYSA-N 0 1 389.228 3.232 10 0 GGAEMN O=C(Cc1cccc(F)c1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223327 565419195 /nfs/dbraw/zinc/41/91/95/565419195.db2.gz RMCWNKSCIPHFAS-UHFFFAOYSA-N 0 1 389.228 3.232 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc(Cl)o1 ZINC000171222977 565419395 /nfs/dbraw/zinc/41/93/95/565419395.db2.gz COSRCCTWSDMDKZ-UHFFFAOYSA-N 0 1 381.617 3.411 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc(Cl)o1 ZINC000171222977 565419400 /nfs/dbraw/zinc/41/94/00/565419400.db2.gz COSRCCTWSDMDKZ-UHFFFAOYSA-N 0 1 381.617 3.411 10 0 GGAEMN Cc1cccc(CC(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000171222344 565419528 /nfs/dbraw/zinc/41/95/28/565419528.db2.gz GQCMUMJHPKITSJ-UHFFFAOYSA-N 0 1 385.265 3.402 10 0 GGAEMN Cc1cccc(CC(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000171222344 565419532 /nfs/dbraw/zinc/41/95/32/565419532.db2.gz GQCMUMJHPKITSJ-UHFFFAOYSA-N 0 1 385.265 3.402 10 0 GGAEMN O=C(Cc1ccccc1F)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223787 565419672 /nfs/dbraw/zinc/41/96/72/565419672.db2.gz UGRDTUWCYDHILJ-UHFFFAOYSA-N 0 1 389.228 3.232 10 0 GGAEMN O=C(Cc1ccccc1F)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223787 565419677 /nfs/dbraw/zinc/41/96/77/565419677.db2.gz UGRDTUWCYDHILJ-UHFFFAOYSA-N 0 1 389.228 3.232 10 0 GGAEMN COc1ccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1 ZINC000171223420 565419783 /nfs/dbraw/zinc/41/97/83/565419783.db2.gz DQYRXOKWGGPMGZ-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN COc1ccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cc1 ZINC000171223420 565419784 /nfs/dbraw/zinc/41/97/84/565419784.db2.gz DQYRXOKWGGPMGZ-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN COc1ccccc1C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000171223594 565419792 /nfs/dbraw/zinc/41/97/92/565419792.db2.gz UDYJFSCLSIWSLA-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN COc1ccccc1C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000171223594 565419793 /nfs/dbraw/zinc/41/97/93/565419793.db2.gz UDYJFSCLSIWSLA-UHFFFAOYSA-N 0 1 387.237 3.173 10 0 GGAEMN CC(C)c1nc2c([nH]1)CC[C@H](C(=O)Nc1cc(Br)c[nH]c1=O)C2 ZINC000376056609 565420487 /nfs/dbraw/zinc/42/04/87/565420487.db2.gz OBIGDYDFZGJNSR-VIFPVBQESA-N 0 1 379.258 3.140 10 0 GGAEMN CN(Cc1ccco1)C(=O)CN[C@@H]1CCOc2c(Br)cccc21 ZINC000298556556 565420741 /nfs/dbraw/zinc/42/07/41/565420741.db2.gz OUDSQIYVZYWJGI-OAHLLOKOSA-N 0 1 379.254 3.114 10 0 GGAEMN Cc1csc(C(=O)N[C@H](c2nnc[nH]2)c2ccccc2)c1Br ZINC000376095164 565421946 /nfs/dbraw/zinc/42/19/46/565421946.db2.gz HSNODXAZDQJJBQ-LBPRGKRZSA-N 0 1 377.267 3.457 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000188883407 565429661 /nfs/dbraw/zinc/42/96/61/565429661.db2.gz PDXTWBBVEQAPSC-MFKMUULPSA-N 0 1 378.270 3.478 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)N2CCN3CCCC[C@@H]3C2)cc1Br ZINC000171597644 565439344 /nfs/dbraw/zinc/43/93/44/565439344.db2.gz KLTXYHGGSAANST-UKRRQHHQSA-N 0 1 396.329 3.398 10 0 GGAEMN CCOc1cc(CNCc2ccc(CO)c(F)c2)cc(Br)c1O ZINC000299179848 565442879 /nfs/dbraw/zinc/44/28/79/565442879.db2.gz VRVGOLAFDPPTEA-UHFFFAOYSA-N 0 1 384.245 3.475 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)c1ccc2[nH]nnc2c1 ZINC000189151542 565447733 /nfs/dbraw/zinc/44/77/33/565447733.db2.gz NDCQJGBLAGNPAQ-SECBINFHSA-N 0 1 375.226 3.220 10 0 GGAEMN CN(CCCCO)Cc1coc(-c2ccc(I)cc2)n1 ZINC000276449262 565449731 /nfs/dbraw/zinc/44/97/31/565449731.db2.gz VPERACMNFJSOOB-UHFFFAOYSA-N 0 1 386.233 3.151 10 0 GGAEMN CN(Cc1ccc2c(c1)OCO2)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000171771366 565449906 /nfs/dbraw/zinc/44/99/06/565449906.db2.gz XQOMNFMOJIEUMK-UHFFFAOYSA-N 0 1 388.221 3.326 10 0 GGAEMN COCCN(Cc1cccnc1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000171776569 565451047 /nfs/dbraw/zinc/45/10/47/565451047.db2.gz XCXFSKSVSUDUQU-UHFFFAOYSA-N 0 1 389.253 3.009 10 0 GGAEMN Cc1nc(C)c(CCNC(=O)c2n[nH]c3ccc(Br)cc32)s1 ZINC000171826763 565453057 /nfs/dbraw/zinc/45/30/57/565453057.db2.gz NBYWLBASJHGPFG-UHFFFAOYSA-N 0 1 379.283 3.371 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3n[nH]c4ccc(Br)cc43)cn21 ZINC000171836552 565454139 /nfs/dbraw/zinc/45/41/39/565454139.db2.gz ODCSZZYHUZGYMN-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)[C@H](Cc1ccccc1)N(C)C ZINC000189290876 565456819 /nfs/dbraw/zinc/45/68/19/565456819.db2.gz XNBVTNVJWJGNHS-KRWDZBQOSA-N 0 1 391.309 3.247 10 0 GGAEMN O=C(NCC[C@H]1C(=O)Nc2ccccc21)c1n[nH]c2ccc(Br)cc21 ZINC000171948538 565458990 /nfs/dbraw/zinc/45/89/90/565458990.db2.gz GKZRLHOXZFQPDF-GFCCVEGCSA-N 0 1 399.248 3.181 10 0 GGAEMN COc1cc(Br)c(CN2CC[C@H](c3cnn(C)c3)C2)cc1OC ZINC000172057413 565463765 /nfs/dbraw/zinc/46/37/65/565463765.db2.gz ONXIQDBOCXBZAW-LBPRGKRZSA-N 0 1 380.286 3.189 10 0 GGAEMN C[C@@H](NC(=O)N1CCC(c2cnc[nH]2)CC1)c1ccc(Br)cn1 ZINC000377075254 565465410 /nfs/dbraw/zinc/46/54/10/565465410.db2.gz YCFWOMSOWDSVGZ-LLVKDONJSA-N 0 1 378.274 3.217 10 0 GGAEMN CCc1c(NS(=O)(=O)c2ccnn2CC)cnn1-c1ccccc1Cl ZINC000276951921 565467418 /nfs/dbraw/zinc/46/74/18/565467418.db2.gz SYKGOXFDIGSBDZ-UHFFFAOYSA-N 0 1 379.873 3.105 10 0 GGAEMN O=S(=O)(c1cc(F)ccc1N1CCC(c2ccn[nH]2)CC1)C(F)(F)F ZINC000301158839 565468248 /nfs/dbraw/zinc/46/82/48/565468248.db2.gz GRZDWENNARSJQN-UHFFFAOYSA-N 0 1 377.363 3.226 10 0 GGAEMN CCN1CCN(c2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)CC1 ZINC000301153257 565468397 /nfs/dbraw/zinc/46/83/97/565468397.db2.gz OLUGYASTQDBOGX-UHFFFAOYSA-N 0 1 377.279 3.240 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NC1CCN(Cc2ccncc2)CC1 ZINC000172164393 565469553 /nfs/dbraw/zinc/46/95/53/565469553.db2.gz MUXKYOAGQVQJLC-UHFFFAOYSA-N 0 1 394.338 3.229 10 0 GGAEMN Cn1ncc(NC[C@H]2CCCCN2Cc2ccccc2)c(Br)c1=O ZINC000301222776 565472927 /nfs/dbraw/zinc/47/29/27/565472927.db2.gz CSHFXPPOZWMENN-OAHLLOKOSA-N 0 1 391.313 3.009 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cccc(Cl)c2Br)CCN1C ZINC000277135207 565477736 /nfs/dbraw/zinc/47/77/36/565477736.db2.gz ZCJWJRXNJHFRLV-MNOVXSKESA-N 0 1 395.750 3.206 10 0 GGAEMN Cc1noc(C)c1C[C@H](C)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000172409002 565483195 /nfs/dbraw/zinc/48/31/95/565483195.db2.gz RWGSCYCKHZGTDS-QMMMGPOBSA-N 0 1 377.242 3.291 10 0 GGAEMN O=C(c1c(Cl)cc(F)cc1Cl)N1CCC(CN2CCOCC2)CC1 ZINC000277256679 565484603 /nfs/dbraw/zinc/48/46/03/565484603.db2.gz QCXJSECMAKDFKG-UHFFFAOYSA-N 0 1 375.271 3.317 10 0 GGAEMN CCn1cc(Br)cc1C(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000189797851 565488857 /nfs/dbraw/zinc/48/88/57/565488857.db2.gz WQIHVCWAKSJHGF-UHFFFAOYSA-N 0 1 388.269 3.028 10 0 GGAEMN O[C@@H](COC[C@H]1CCCO1)CN1CCC(c2ccccc2Br)CC1 ZINC000189807347 565489257 /nfs/dbraw/zinc/48/92/57/565489257.db2.gz NLKJVWQSFZYTEO-IAGOWNOFSA-N 0 1 398.341 3.185 10 0 GGAEMN COC(=O)c1coc(C(=O)Nc2nnc(Cc3ccc(Cl)cc3)s2)c1 ZINC000189805614 565489408 /nfs/dbraw/zinc/48/94/08/565489408.db2.gz GVBJYKZELWXXJL-UHFFFAOYSA-N 0 1 377.809 3.414 10 0 GGAEMN Brc1c(CNC2CCN(c3ccccn3)CC2)nc2ccccn21 ZINC000377658177 565491706 /nfs/dbraw/zinc/49/17/06/565491706.db2.gz UDJVLKUOLDVQGA-UHFFFAOYSA-N 0 1 386.297 3.250 10 0 GGAEMN CN1CC[C@H](N[C@@H](C(N)=O)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000377730295 565495906 /nfs/dbraw/zinc/49/59/06/565495906.db2.gz XUNCVBUGRDDVCA-KSZLIROESA-N 0 1 388.309 3.011 10 0 GGAEMN CN1CC[C@H](N[C@H](C(N)=O)c2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000377730296 565496003 /nfs/dbraw/zinc/49/60/03/565496003.db2.gz XUNCVBUGRDDVCA-OKZBNKHCSA-N 0 1 388.309 3.011 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)N[C@@H](C)C(=O)NCC(F)(F)F ZINC000189971385 565499414 /nfs/dbraw/zinc/49/94/14/565499414.db2.gz VWXDGHHHNIZWNG-BDAKNGLRSA-N 0 1 383.208 3.175 10 0 GGAEMN CCOc1ccc(NC(=O)N[C@@H]2CCc3nc[nH]c3C2)cc1Br ZINC000377808174 565499742 /nfs/dbraw/zinc/49/97/42/565499742.db2.gz XDJZRXWDDZSCGF-LLVKDONJSA-N 0 1 379.258 3.250 10 0 GGAEMN CCN1CCN(c2ccc(CNc3ncc(Br)cc3C)cn2)CC1 ZINC000301635644 565500580 /nfs/dbraw/zinc/50/05/80/565500580.db2.gz WKGJNFAGBXMYQZ-UHFFFAOYSA-N 0 1 390.329 3.302 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@@H]1CCN(CC(F)(F)F)C1=O ZINC000189976201 565500572 /nfs/dbraw/zinc/50/05/72/565500572.db2.gz DMNQYOWXADCVLD-JOYOIKCWSA-N 0 1 395.219 3.272 10 0 GGAEMN Cc1cc(C[C@@H](C)N2C(=O)N[C@H](Cc3cc(Cl)cc(Cl)c3)C2=O)n[nH]1 ZINC000277563346 565506951 /nfs/dbraw/zinc/50/69/51/565506951.db2.gz ZXYILDRSQKXAOT-MEBBXXQBSA-N 0 1 381.263 3.119 10 0 GGAEMN CCN(Cc1cc(Br)ccc1F)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000378067465 565510108 /nfs/dbraw/zinc/51/01/08/565510108.db2.gz HRKUESVRRNOCDH-ZDUSSCGKSA-N 0 1 395.276 3.400 10 0 GGAEMN O=C(N[C@H]1CCc2c1cccc2Br)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378051247 565510296 /nfs/dbraw/zinc/51/02/96/565510296.db2.gz HJDXFQKBAHAHPT-YGRLFVJLSA-N 0 1 375.270 3.016 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)NC1(c2cccc(Br)c2)CCC1 ZINC000378121239 565512657 /nfs/dbraw/zinc/51/26/57/565512657.db2.gz WDGKEOJFVKJEFI-CQSZACIVSA-N 0 1 389.297 3.408 10 0 GGAEMN COCCN(Cc1sccc1Br)C(=O)c1ccc2[nH]nnc2c1 ZINC000190158486 565512691 /nfs/dbraw/zinc/51/26/91/565512691.db2.gz HFLMYLIDJVMNSM-UHFFFAOYSA-N 0 1 395.282 3.071 10 0 GGAEMN Cc1cc(S(=O)(=O)NCCc2nnc(-c3ccccc3)[nH]2)sc1Cl ZINC000190182669 565513800 /nfs/dbraw/zinc/51/38/00/565513800.db2.gz DPCHFHKLVCBZBD-UHFFFAOYSA-N 0 1 382.898 3.016 10 0 GGAEMN O=C(CCC1CCOCC1)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000172996926 565518252 /nfs/dbraw/zinc/51/82/52/565518252.db2.gz WYPAIHRAOOHSER-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN O=C(CCC1CCOCC1)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000172996926 565518254 /nfs/dbraw/zinc/51/82/54/565518254.db2.gz WYPAIHRAOOHSER-UHFFFAOYSA-N 0 1 393.285 3.057 10 0 GGAEMN Cc1c(Br)cccc1CC(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000190265465 565519167 /nfs/dbraw/zinc/51/91/67/565519167.db2.gz PXUBIKVLSQNHLU-UHFFFAOYSA-N 0 1 399.292 3.444 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000378310075 565521201 /nfs/dbraw/zinc/52/12/01/565521201.db2.gz NZDHCKOLPYZBGF-TZMCWYRMSA-N 0 1 376.298 3.415 10 0 GGAEMN Cn1cc(NS(=O)(=O)c2ccc(Cl)c(F)c2Cl)cc(Cl)c1=O ZINC000190324390 565521861 /nfs/dbraw/zinc/52/18/61/565521861.db2.gz OZDAANLPESEIKS-UHFFFAOYSA-N 0 1 385.631 3.285 10 0 GGAEMN OCCCN1CCN(c2ccc3c(Br)ccc(Cl)c3n2)CC1 ZINC000301994826 565524405 /nfs/dbraw/zinc/52/44/05/565524405.db2.gz OWGBPMCUDDKCIK-UHFFFAOYSA-N 0 1 384.705 3.155 10 0 GGAEMN CC(C)(C)c1nc2ccc(S(=O)(=O)N3CCN4CCC[C@@H]4C3)cc2s1 ZINC000173135047 565529918 /nfs/dbraw/zinc/52/99/18/565529918.db2.gz WRLHTBFLNOJYED-CYBMUJFWSA-N 0 1 379.551 3.063 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NCCCS(=O)(=O)C(C)C ZINC000190429535 565532380 /nfs/dbraw/zinc/53/23/80/565532380.db2.gz IGAPIFNNBYLYMA-LBPRGKRZSA-N 0 1 378.332 3.322 10 0 GGAEMN O=C(N[C@@H](c1nnc[nH]1)c1ccccc1)c1ccc(F)cc1Br ZINC000378532603 565532576 /nfs/dbraw/zinc/53/25/76/565532576.db2.gz YRAQPQLRDZJMTF-CQSZACIVSA-N 0 1 375.201 3.226 10 0 GGAEMN COc1cccc([C@@H](C)N2CCC(NS(=O)(=O)c3cccs3)CC2)c1 ZINC000173187012 565535327 /nfs/dbraw/zinc/53/53/27/565535327.db2.gz YEYGLYHTQNBLJX-CQSZACIVSA-N 0 1 380.535 3.261 10 0 GGAEMN C[C@@H]1CN(c2ccc3c(Br)ccc(Cl)c3n2)CCN1CCO ZINC000302414844 565540654 /nfs/dbraw/zinc/54/06/54/565540654.db2.gz LZLAKRWAOPPGKH-LLVKDONJSA-N 0 1 384.705 3.154 10 0 GGAEMN C[C@H]1CN(c2ccc3c(Br)ccc(Cl)c3n2)CCN1CCO ZINC000302414848 565540761 /nfs/dbraw/zinc/54/07/61/565540761.db2.gz LZLAKRWAOPPGKH-NSHDSACASA-N 0 1 384.705 3.154 10 0 GGAEMN C[C@@H]1CN(C2CCN(C(=O)COc3cc(Cl)cc(Cl)c3)CC2)CCO1 ZINC000173252795 565541169 /nfs/dbraw/zinc/54/11/69/565541169.db2.gz WJPDDZSGVGONRO-CYBMUJFWSA-N 0 1 387.307 3.084 10 0 GGAEMN C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Br)cc2Cl)CCN1C ZINC000173269817 565541743 /nfs/dbraw/zinc/54/17/43/565541743.db2.gz PUBOOBQSTJJYGJ-CMPLNLGQSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Br)ccc2Cl)CCN1C ZINC000173274348 565542922 /nfs/dbraw/zinc/54/29/22/565542922.db2.gz YPEKDPPJPOXVOI-JQWIXIFHSA-N 0 1 395.750 3.206 10 0 GGAEMN C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C ZINC000173277370 565543035 /nfs/dbraw/zinc/54/30/35/565543035.db2.gz RWRDONOSFZFZRU-JQWIXIFHSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CCN1C ZINC000173278818 565543165 /nfs/dbraw/zinc/54/31/65/565543165.db2.gz XVZJLDHDASLCKC-GHMZBOCLSA-N 0 1 384.851 3.462 10 0 GGAEMN C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1C ZINC000173277356 565543257 /nfs/dbraw/zinc/54/32/57/565543257.db2.gz RWRDONOSFZFZRU-PWSUYJOCSA-N 0 1 384.851 3.462 10 0 GGAEMN Cc1cc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(C)cc1Br ZINC000173280376 565543370 /nfs/dbraw/zinc/54/33/70/565543370.db2.gz JQQGGNMIDLDMAU-KGLIPLIRSA-N 0 1 389.359 3.169 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2ccc(Cl)nc2)[C@@H]1c1cccs1 ZINC000173323458 565548012 /nfs/dbraw/zinc/54/80/12/565548012.db2.gz FBVGAWAHKHZRQB-RHSMWYFYSA-N 0 1 399.969 3.299 10 0 GGAEMN CN1CCC[C@@H](CNS(=O)(=O)c2cc(F)ccc2F)[C@@H]1c1cccs1 ZINC000173324972 565549079 /nfs/dbraw/zinc/54/90/79/565549079.db2.gz JWFYOMSIABNIJA-YVEFUNNKSA-N 0 1 386.489 3.388 10 0 GGAEMN Cc1cc(C(=O)N2CCC[C@H]2c2ccc(I)cc2)n[nH]1 ZINC000173326425 565549235 /nfs/dbraw/zinc/54/92/35/565549235.db2.gz QXAIIAQHGWTHFB-AWEZNQCLSA-N 0 1 381.217 3.300 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cccc(Cl)c2-n2cccn2)ccc1F ZINC000190731448 565555424 /nfs/dbraw/zinc/55/54/24/565555424.db2.gz KGHFYSAPAZKKOM-UHFFFAOYSA-N 0 1 381.816 3.474 10 0 GGAEMN Cc1csc(C(C)(C)NC[C@H](O)COc2cccc(Br)c2)n1 ZINC000173425677 565557207 /nfs/dbraw/zinc/55/72/07/565557207.db2.gz GDNAUFAGFICONY-ZDUSSCGKSA-N 0 1 385.327 3.479 10 0 GGAEMN CCNC(=O)CCN1CCC[C@H]1c1nc(-c2ccccc2Br)no1 ZINC000190784423 565558951 /nfs/dbraw/zinc/55/89/51/565558951.db2.gz FNUDAUIYFYPGKI-AWEZNQCLSA-N 0 1 393.285 3.162 10 0 GGAEMN CC(=O)NCCCN1CCC[C@@H]1c1nc(-c2ccccc2Br)no1 ZINC000190783696 565558975 /nfs/dbraw/zinc/55/89/75/565558975.db2.gz DIBUYQZQCKCDDB-OAHLLOKOSA-N 0 1 393.285 3.162 10 0 GGAEMN CC[C@@H](NC(=O)CCSc1nnc(C)[nH]1)c1nc(C(F)(F)F)cs1 ZINC000173497082 565561828 /nfs/dbraw/zinc/56/18/28/565561828.db2.gz GHVQHCSRTONGMO-MRVPVSSYSA-N 0 1 379.433 3.338 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2cccc3ccn(C)c32)cc1Cl ZINC000190851644 565564260 /nfs/dbraw/zinc/56/42/60/565564260.db2.gz AJECBLWHCIPWLH-UHFFFAOYSA-N 0 1 378.837 3.419 10 0 GGAEMN C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[C@@]2(CNC(=O)C2)C1 ZINC000278833848 565580047 /nfs/dbraw/zinc/58/00/47/565580047.db2.gz IPIQRURKKQRXFV-BMLIUANNSA-N 0 1 381.263 3.316 10 0 GGAEMN Brc1cccnc1N1CCO[C@H]2CCN(Cc3ccccc3)C[C@H]21 ZINC000404170414 565583210 /nfs/dbraw/zinc/58/32/10/565583210.db2.gz XOTKQUYJINJMDN-MSOLQXFVSA-N 0 1 388.309 3.324 10 0 GGAEMN C[C@H]1C[C@@H](NC(=O)c2nscc2Br)CN1Cc1ccccc1 ZINC000404817787 565584409 /nfs/dbraw/zinc/58/44/09/565584409.db2.gz QSQGLRDVJSCFBY-WCQYABFASA-N 0 1 380.311 3.298 10 0 GGAEMN C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2nscc2Br)C1 ZINC000404700915 565584468 /nfs/dbraw/zinc/58/44/68/565584468.db2.gz FDWZUCSWQFCEEK-CYBMUJFWSA-N 0 1 394.338 3.500 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC([C@@H]2CCCO2)CC1 ZINC000191130637 565584833 /nfs/dbraw/zinc/58/48/33/565584833.db2.gz GYUDBBCKNSAGRO-HNNXBMFYSA-N 0 1 378.270 3.357 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC([C@H]2CCCO2)CC1 ZINC000191130655 565585035 /nfs/dbraw/zinc/58/50/35/565585035.db2.gz GYUDBBCKNSAGRO-OAHLLOKOSA-N 0 1 378.270 3.357 10 0 GGAEMN C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CC[C@]2(CNC(=O)C2)C1 ZINC000278933341 565586623 /nfs/dbraw/zinc/58/66/23/565586623.db2.gz SYOKJCMQEKXZHI-BTDLBPIBSA-N 0 1 381.263 3.316 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2ccc(C)c(Br)c2)n[nH]1 ZINC000407976560 565588310 /nfs/dbraw/zinc/58/83/10/565588310.db2.gz LOIFVJTXIASHHC-AWEZNQCLSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1cc([C@H]2CCCN(S(=O)(=O)c3cccc(C)c3Br)C2)n[nH]1 ZINC000407978390 565589584 /nfs/dbraw/zinc/58/95/84/565589584.db2.gz XWBHTSJPCMROAY-ZDUSSCGKSA-N 0 1 398.326 3.357 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2S(=O)(=O)c2cccc(Br)c2C)n[nH]1 ZINC000407977392 565589892 /nfs/dbraw/zinc/58/98/92/565589892.db2.gz RIPDVHJSHBLEQG-ZDUSSCGKSA-N 0 1 399.314 3.100 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)c2ccccc2I)n[nH]1 ZINC000407982302 565589903 /nfs/dbraw/zinc/58/99/03/565589903.db2.gz XRGPJSATJLLDMM-ZDUSSCGKSA-N 0 1 396.232 3.085 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCC[C@H]1[C@H]1CCCO1 ZINC000408091802 565594721 /nfs/dbraw/zinc/59/47/21/565594721.db2.gz XLTXUFRGNBXATC-JKSUJKDBSA-N 0 1 391.265 3.074 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2Br)c1 ZINC000318494396 565596568 /nfs/dbraw/zinc/59/65/68/565596568.db2.gz MKYPVTUSXZKCBE-UHFFFAOYSA-N 0 1 398.204 3.485 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCO[C@H]2CCCC[C@H]21 ZINC000408195147 565597710 /nfs/dbraw/zinc/59/77/10/565597710.db2.gz LLBWBDYYDHMLGI-CVEARBPZSA-N 0 1 391.265 3.074 10 0 GGAEMN O=C(CCCN1CC[C@](O)(C(F)(F)F)C1)c1ccc(Br)cc1 ZINC000319389752 565599079 /nfs/dbraw/zinc/59/90/79/565599079.db2.gz KTKPDZZOVTZNRY-CQSZACIVSA-N 0 1 380.204 3.411 10 0 GGAEMN O=S(=O)(N[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(Br)o1 ZINC000408216060 565599216 /nfs/dbraw/zinc/59/92/16/565599216.db2.gz SSORVSRBCOVDGG-JGVFFNPUSA-N 0 1 376.194 3.442 10 0 GGAEMN C[C@H](O)CN1CCN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)C[C@H]1C ZINC000408209898 565599227 /nfs/dbraw/zinc/59/92/27/565599227.db2.gz WSPZDXSLCJDRFQ-WQGACYEGSA-N 0 1 386.323 3.077 10 0 GGAEMN C[C@@H]1[C@H](C)N(C)CCN1C(=O)Nc1cnn(-c2ncc(Cl)cc2Cl)c1 ZINC000408209363 565599687 /nfs/dbraw/zinc/59/96/87/565599687.db2.gz ZXYYGNVUBYELFC-WDEREUQCSA-N 0 1 383.283 3.130 10 0 GGAEMN Cc1nc([C@H]2CN(Cc3cc(Br)c(Cl)s3)CCO2)n[nH]1 ZINC000191425776 565602942 /nfs/dbraw/zinc/60/29/42/565602942.db2.gz MTFPNVGIRNWBPB-SNVBAGLBSA-N 0 1 377.695 3.164 10 0 GGAEMN CO[C@@]1(C)CCCN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC1 ZINC000408325256 565604412 /nfs/dbraw/zinc/60/44/12/565604412.db2.gz YIDANZASLQDRSF-SFHVURJKSA-N 0 1 393.281 3.322 10 0 GGAEMN Cc1c(Br)cccc1CC(=O)N1CCC(N2CCO[C@@H](C)C2)CC1 ZINC000191516175 565610580 /nfs/dbraw/zinc/61/05/80/565610580.db2.gz RCKHEJMMEFRLLD-AWEZNQCLSA-N 0 1 395.341 3.012 10 0 GGAEMN CC[C@@H](O)CN1CCN(Cc2csc(Cc3ccc(Cl)cc3)n2)CC1 ZINC000174083072 565611747 /nfs/dbraw/zinc/61/17/47/565611747.db2.gz SABVYIMIVPBGJV-GOSISDBHSA-N 0 1 379.957 3.276 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)CN1CCC(C(F)(F)F)CC1 ZINC000174191192 565619949 /nfs/dbraw/zinc/61/99/49/565619949.db2.gz CDLZNYQCVBSKNG-ZDUSSCGKSA-N 0 1 382.220 3.463 10 0 GGAEMN CCOC(=O)c1csc(CCNC(=O)c2c(O)cc(Cl)cc2Cl)n1 ZINC000191761938 565629052 /nfs/dbraw/zinc/62/90/52/565629052.db2.gz BXEGRJNXPBAREJ-UHFFFAOYSA-N 0 1 389.260 3.305 10 0 GGAEMN Cc1nc([C@@H]2CCCCN2C(=O)[C@@H]2COc3ccc(Br)cc32)n[nH]1 ZINC000328664204 565637137 /nfs/dbraw/zinc/63/71/37/565637137.db2.gz BKQYKYZVHJADKI-KGLIPLIRSA-N 0 1 391.269 3.105 10 0 GGAEMN Cc1nnc(SCCC(=O)N[C@H]2CCc3c2cccc3Br)[nH]1 ZINC000174562399 565642862 /nfs/dbraw/zinc/64/28/62/565642862.db2.gz HDKMBZCGGZDASW-ZDUSSCGKSA-N 0 1 381.299 3.162 10 0 GGAEMN COC[C@H](NC(=O)c1n[nH]c2ccc(Br)cc21)c1ccc(C)o1 ZINC000174616721 565646898 /nfs/dbraw/zinc/64/68/98/565646898.db2.gz QYQWGZVAWGQECT-ZDUSSCGKSA-N 0 1 378.226 3.344 10 0 GGAEMN Cc1c(Br)ccc(C(=O)N2CCN(C3CCOCC3)C[C@H]2C)c1F ZINC000280043038 565648170 /nfs/dbraw/zinc/64/81/70/565648170.db2.gz GPYHKCWPSTYSKP-GFCCVEGCSA-N 0 1 399.304 3.222 10 0 GGAEMN Cc1nnc(SCCC(=O)NCC(C)(C)c2cccc(Br)c2)[nH]1 ZINC000174688895 565652326 /nfs/dbraw/zinc/65/23/26/565652326.db2.gz DVVRTLWGVSWSRQ-UHFFFAOYSA-N 0 1 397.342 3.452 10 0 GGAEMN O=C1[C@H](N2CC[C@]3(O)CCCC[C@@H]3C2)CCN1c1cccc(Br)c1 ZINC000192074481 565655767 /nfs/dbraw/zinc/65/57/67/565655767.db2.gz PSBOXSRWWJMZMH-LSBZLQRGSA-N 0 1 393.325 3.181 10 0 GGAEMN CC[N@H+]1CC[C@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)[C@H](C)C1 ZINC000174774049 565657693 /nfs/dbraw/zinc/65/76/93/565657693.db2.gz WNKKKCAEURTFFP-CJNGLKHVSA-N 0 1 393.380 3.429 10 0 GGAEMN CC[N@H+]1CCC[C@H](NC(=O)C(=O)Nc2cccc(Cl)c2SC(C)C)C1 ZINC000174768289 565657788 /nfs/dbraw/zinc/65/77/88/565657788.db2.gz PKTIYEVMKPLLPO-ZDUSSCGKSA-N 0 1 383.945 3.380 10 0 GGAEMN CCN1CCC[C@H](NC(=O)C(=O)Nc2cccc(Cl)c2SC(C)C)C1 ZINC000174768289 565657793 /nfs/dbraw/zinc/65/77/93/565657793.db2.gz PKTIYEVMKPLLPO-ZDUSSCGKSA-N 0 1 383.945 3.380 10 0 GGAEMN C[C@H](NCCc1ccccc1O)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000280231429 565659725 /nfs/dbraw/zinc/65/97/25/565659725.db2.gz VIDLFPNUAJPMHM-JTQLQIEISA-N 0 1 389.304 3.240 10 0 GGAEMN C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000329299958 565661725 /nfs/dbraw/zinc/66/17/25/565661725.db2.gz VHWFPNVSFPFBDZ-DOMZBBRYSA-N 0 1 397.953 3.321 10 0 GGAEMN COC(=O)c1ccc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000192159511 565664883 /nfs/dbraw/zinc/66/48/83/565664883.db2.gz YUHFTMJAUTTYFD-WMLDXEAASA-N 0 1 378.881 3.250 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1cccc(Br)c1F ZINC000192211325 565670608 /nfs/dbraw/zinc/67/06/08/565670608.db2.gz WSTKNWFOTNGAMR-UHFFFAOYSA-N 0 1 389.228 3.346 10 0 GGAEMN Cc1ccccc1CN[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280441589 565672964 /nfs/dbraw/zinc/67/29/64/565672964.db2.gz CBAHYXFSCVPKPC-GFCCVEGCSA-N 0 1 383.311 3.256 10 0 GGAEMN O=C(NCC1CCN(Cc2ccccc2Cl)CC1)c1ncncc1Cl ZINC000175208874 565685032 /nfs/dbraw/zinc/68/50/32/565685032.db2.gz HOFJEBPAINXSSG-UHFFFAOYSA-N 0 1 379.291 3.425 10 0 GGAEMN Cc1ccc(N2CCCN(C(=O)c3c(O)cc(Cl)cc3Cl)CC2)nn1 ZINC000175222401 565686452 /nfs/dbraw/zinc/68/64/52/565686452.db2.gz YKEZRGWSBAQVJK-UHFFFAOYSA-N 0 1 381.263 3.150 10 0 GGAEMN O=C1[C@@H](N2CCC[C@H](c3nc[nH]n3)C2)CCN1c1ccc(Cl)cc1Cl ZINC000330023672 565689907 /nfs/dbraw/zinc/68/99/07/565689907.db2.gz JBDFIASMUHDYAK-NHYWBVRUSA-N 0 1 380.279 3.096 10 0 GGAEMN Cc1nc([C@H]2CN(C(=O)N[C@@H](C)c3ccc(Cl)cc3Cl)CCO2)n[nH]1 ZINC000175300358 565691467 /nfs/dbraw/zinc/69/14/67/565691467.db2.gz JQBZLGYYDMKZAT-LKFCYVNXSA-N 0 1 384.267 3.264 10 0 GGAEMN CC[C@@H]1CN(C[C@H](O)COc2c(Cl)cccc2Cl)C[C@@]2(CCOC2)O1 ZINC000330083012 565692192 /nfs/dbraw/zinc/69/21/92/565692192.db2.gz BEZAHNRFVXMCCA-PMUMKWKESA-N 0 1 390.307 3.003 10 0 GGAEMN C[C@@H]1CN(C[C@H](O)COc2ccc(Cl)cc2Cl)C[C@@]2(CCCOC2)O1 ZINC000330100332 565692342 /nfs/dbraw/zinc/69/23/42/565692342.db2.gz DVDQAUWWXZQLNK-QIIPPGSGSA-N 0 1 390.307 3.003 10 0 GGAEMN CC[C@H](N[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1)c1ccncc1 ZINC000280764584 565694983 /nfs/dbraw/zinc/69/49/83/565694983.db2.gz QYQOJJQYSWATJY-NHYWBVRUSA-N 0 1 398.326 3.293 10 0 GGAEMN C[C@H](N[C@@H]1CCc2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280826908 565698879 /nfs/dbraw/zinc/69/88/79/565698879.db2.gz XGFFOULUESMQPB-MEDUHNTESA-N 0 1 395.322 3.435 10 0 GGAEMN C[C@@H](N[C@@H]1CCc2ccccc21)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000280826902 565698895 /nfs/dbraw/zinc/69/88/95/565698895.db2.gz XGFFOULUESMQPB-BDJLRTHQSA-N 0 1 395.322 3.435 10 0 GGAEMN CN1CC[C@@H](NS(=O)(=O)Cc2ccc(Cl)c(F)c2)[C@@H]1c1ccccc1 ZINC000192817949 565712392 /nfs/dbraw/zinc/71/23/92/565712392.db2.gz XJSQZEDWIKEDPF-MSOLQXFVSA-N 0 1 382.888 3.344 10 0 GGAEMN O=C(CSc1n[nH]c(=S)s1)NC1(c2noc(C3CC3)n2)CCCC1 ZINC000175702470 565718425 /nfs/dbraw/zinc/71/84/25/565718425.db2.gz QRZUBEUEVADYND-UHFFFAOYSA-N 0 1 383.524 3.139 10 0 GGAEMN Cc1nn(C)c(C)c1[C@@H](NS(=O)(=O)c1ccc(C)cc1F)C(F)(F)F ZINC000330702506 565718932 /nfs/dbraw/zinc/71/89/32/565718932.db2.gz IJSSVLBNYIEALO-CQSZACIVSA-N 0 1 379.379 3.066 10 0 GGAEMN O[C@@H](COc1cccc(Br)c1)CN1CCC[C@H](C(F)(F)F)C1 ZINC000192924786 565719927 /nfs/dbraw/zinc/71/99/27/565719927.db2.gz OKAREKGZLZOYPS-WCQYABFASA-N 0 1 382.220 3.463 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)CN1CCC[C@H](C(F)(F)F)C1 ZINC000192924796 565719958 /nfs/dbraw/zinc/71/99/58/565719958.db2.gz OKAREKGZLZOYPS-AAEUAGOBSA-N 0 1 382.220 3.463 10 0 GGAEMN O=S(=O)([N-]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1c(F)cccc1Cl ZINC000192979681 565722253 /nfs/dbraw/zinc/72/22/53/565722253.db2.gz VEQVWFUDCVVBFU-HNNXBMFYSA-N 0 1 382.888 3.280 10 0 GGAEMN O=S(=O)([N-]C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(F)cccc1Cl ZINC000192979681 565722260 /nfs/dbraw/zinc/72/22/60/565722260.db2.gz VEQVWFUDCVVBFU-HNNXBMFYSA-N 0 1 382.888 3.280 10 0 GGAEMN CCOC(=O)CN(CCC(=O)Nc1ccccc1Br)C(C)(C)C ZINC000411323744 565725207 /nfs/dbraw/zinc/72/52/07/565725207.db2.gz LTILMUOOZKPHFQ-UHFFFAOYSA-N 0 1 385.302 3.441 10 0 GGAEMN CC(C)(C(=O)N1CCN(C2CCOCC2)CC1)c1cccc(Br)c1 ZINC000175833354 565725988 /nfs/dbraw/zinc/72/59/88/565725988.db2.gz MHOUTOTUTLXWSU-UHFFFAOYSA-N 0 1 395.341 3.050 10 0 GGAEMN C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(C2CCOCC2)CC1 ZINC000175859852 565728385 /nfs/dbraw/zinc/72/83/85/565728385.db2.gz XEXCKSLXDTVHGP-CYBMUJFWSA-N 0 1 387.307 3.084 10 0 GGAEMN Cc1ccc([C@H](CN2CCOCC2)NCc2ccc(Br)cn2)cc1 ZINC000411447176 565730416 /nfs/dbraw/zinc/73/04/16/565730416.db2.gz BGIGQQOUJBCMGF-IBGZPJMESA-N 0 1 390.325 3.316 10 0 GGAEMN COc1cc([C@@H](C)NCc2ccc(Br)cn2)ccc1OCCO ZINC000411464996 565730914 /nfs/dbraw/zinc/73/09/14/565730914.db2.gz ZQALDFGZTHPSNI-GFCCVEGCSA-N 0 1 381.270 3.075 10 0 GGAEMN COc1cc([C@H](C)NCc2ccc(Br)cn2)ccc1OCCO ZINC000411464999 565731126 /nfs/dbraw/zinc/73/11/26/565731126.db2.gz ZQALDFGZTHPSNI-LBPRGKRZSA-N 0 1 381.270 3.075 10 0 GGAEMN COC(=O)c1cc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cs1 ZINC000411630801 565740927 /nfs/dbraw/zinc/74/09/27/565740927.db2.gz KFIOUBAJEBMCCR-RHSMWYFYSA-N 0 1 378.881 3.250 10 0 GGAEMN COC(=O)c1cc(CN[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)cs1 ZINC000411630805 565741367 /nfs/dbraw/zinc/74/13/67/565741367.db2.gz KFIOUBAJEBMCCR-YOEHRIQHSA-N 0 1 378.881 3.250 10 0 GGAEMN O=C(NCC1CCN(C(=O)c2csc(Br)c2)CC1)C(F)(F)F ZINC000281684357 565742014 /nfs/dbraw/zinc/74/20/14/565742014.db2.gz KUROBXZPZJALFT-UHFFFAOYSA-N 0 1 399.232 3.041 10 0 GGAEMN CN1CC[C@@H](NCc2ccc(S(C)(=O)=O)o2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000411747576 565749201 /nfs/dbraw/zinc/74/92/01/565749201.db2.gz LGLGREWARWBRII-NVXWUHKLSA-N 0 1 386.876 3.011 10 0 GGAEMN O=C(CCc1cnc[nH]1)N1CCC[C@H]1c1ccc(I)cc1 ZINC000193395579 565749656 /nfs/dbraw/zinc/74/96/56/565749656.db2.gz WWXFNTBSQBIRQX-HNNXBMFYSA-N 0 1 395.244 3.311 10 0 GGAEMN CN1CC[C@H](NCc2ccc(S(C)(=O)=O)o2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000411747577 565749745 /nfs/dbraw/zinc/74/97/45/565749745.db2.gz LGLGREWARWBRII-RDJZCZTQSA-N 0 1 386.876 3.011 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@H]2CCOc3c(Br)cccc32)n[nH]1 ZINC000281813013 565750339 /nfs/dbraw/zinc/75/03/39/565750339.db2.gz GZNOUWDIOVHPBC-BONVTDFDSA-N 0 1 393.285 3.235 10 0 GGAEMN O=C(CCN1CCO[C@@H](C2CCC2)C1)Nc1ccc(Br)cc1F ZINC000411870329 565759355 /nfs/dbraw/zinc/75/93/55/565759355.db2.gz GEZCSLNREBWBAN-MRXNPFEDSA-N 0 1 385.277 3.418 10 0 GGAEMN CC(C)N(CC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)C[C@H]1CCC(=O)N1 ZINC000412095603 565771306 /nfs/dbraw/zinc/77/13/06/565771306.db2.gz YAJRBCOGUNDIIJ-TZMCWYRMSA-N 0 1 386.323 3.160 10 0 GGAEMN O=C(CCc1cnc[nH]1)N1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000193721689 565771682 /nfs/dbraw/zinc/77/16/82/565771682.db2.gz KSQCNMGKKJCDAZ-UHFFFAOYSA-N 0 1 381.307 3.036 10 0 GGAEMN O=C(CCc1cnc[nH]1)NCc1ccc(Br)cc1C(F)(F)F ZINC000193717198 565771923 /nfs/dbraw/zinc/77/19/23/565771923.db2.gz FKVROUQQEIGATD-UHFFFAOYSA-N 0 1 376.176 3.440 10 0 GGAEMN C[C@H](NCC(=O)N(C)Cc1ccc(Cl)s1)c1ccc2c(c1)OCCO2 ZINC000176486607 565776975 /nfs/dbraw/zinc/77/69/75/565776975.db2.gz HZVKBYCMPYJPLG-LBPRGKRZSA-N 0 1 380.897 3.482 10 0 GGAEMN CN(C[C@@H](c1cccs1)N1CCOCC1)C(=O)c1ccc(O)c(Cl)c1 ZINC000176527703 565781178 /nfs/dbraw/zinc/78/11/78/565781178.db2.gz WYEGDQFVQBRPHE-HNNXBMFYSA-N 0 1 380.897 3.253 10 0 GGAEMN Cc1ccc([C@@H](CNC(=O)c2ccc(O)c(Cl)c2)N2CCOCC2)s1 ZINC000176556995 565784288 /nfs/dbraw/zinc/78/42/88/565784288.db2.gz QDWZMUZVRUXJHO-OAHLLOKOSA-N 0 1 380.897 3.219 10 0 GGAEMN O=C(N[C@H]1CCCC12CCOCC2)c1cc(Br)cc2nc[nH]c21 ZINC000282585224 565787650 /nfs/dbraw/zinc/78/76/50/565787650.db2.gz SSTQEKGAMDPSCH-AWEZNQCLSA-N 0 1 378.270 3.405 10 0 GGAEMN CS(=O)(=O)N1CCC[C@H](CN2CCC[C@@H]2c2nc3ccccc3s2)C1 ZINC000176624004 565789870 /nfs/dbraw/zinc/78/98/70/565789870.db2.gz DRRRQPXORHBYNR-GDBMZVCRSA-N 0 1 379.551 3.105 10 0 GGAEMN CS(=O)(=O)N1CCC[C@@H](CN2CCC[C@@H]2c2nc3ccccc3s2)C1 ZINC000176624023 565789951 /nfs/dbraw/zinc/78/99/51/565789951.db2.gz DRRRQPXORHBYNR-GOEBONIOSA-N 0 1 379.551 3.105 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)[C@@H]1CCCc2[nH]ncc21 ZINC000282719362 565794182 /nfs/dbraw/zinc/79/41/82/565794182.db2.gz HDUUFISUNNLTGQ-QMTHXVAHSA-N 0 1 376.254 3.232 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)N2CCC=C(Br)C2)CC1 ZINC000282760751 565795753 /nfs/dbraw/zinc/79/57/53/565795753.db2.gz QGGIWCSMJGACDG-UHFFFAOYSA-N 0 1 393.329 3.345 10 0 GGAEMN CCN1CCC[C@@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)C1 ZINC000194150299 565796809 /nfs/dbraw/zinc/79/68/09/565796809.db2.gz FGESROSODDHAGQ-SECBINFHSA-N 0 1 378.687 3.186 10 0 GGAEMN COc1csc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000176725893 565798808 /nfs/dbraw/zinc/79/88/08/565798808.db2.gz HSZGPSOPFGILCY-UHFFFAOYSA-N 0 1 393.266 3.234 10 0 GGAEMN COc1csc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000176725893 565798811 /nfs/dbraw/zinc/79/88/11/565798811.db2.gz HSZGPSOPFGILCY-UHFFFAOYSA-N 0 1 393.266 3.234 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2c(Cl)cccc2Br)CCN1C ZINC000282963996 565805510 /nfs/dbraw/zinc/80/55/10/565805510.db2.gz KSBOMDGOCRZBKC-GHMZBOCLSA-N 0 1 395.750 3.206 10 0 GGAEMN Cc1ccc(I)c(C(=O)Nc2cc(CN(C)C)ccn2)c1 ZINC000176915015 565813444 /nfs/dbraw/zinc/81/34/44/565813444.db2.gz WGYGHWSMCDUGFW-UHFFFAOYSA-N 0 1 395.244 3.309 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCOc2ccc(Br)cc2C1 ZINC000283388846 565818451 /nfs/dbraw/zinc/81/84/51/565818451.db2.gz DQJNOZNFMYZSTP-ZDUSSCGKSA-N 0 1 376.254 3.013 10 0 GGAEMN CN(CCNC(=O)Cc1ccc(Br)s1)Cc1ccc(F)cc1 ZINC000177065239 565826388 /nfs/dbraw/zinc/82/63/88/565826388.db2.gz ZOFLWYMWDURABX-UHFFFAOYSA-N 0 1 385.302 3.440 10 0 GGAEMN CCNC(=O)c1ccc(=NCc2cc(Cl)cc(Cl)c2OC(F)F)[nH]n1 ZINC000413177528 565838479 /nfs/dbraw/zinc/83/84/79/565838479.db2.gz AYGPPPYSUBCIPM-UHFFFAOYSA-N 0 1 391.205 3.169 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)[C@H]2CCCc3[nH]ncc32)cc1Br ZINC000177280424 565840813 /nfs/dbraw/zinc/84/08/13/565840813.db2.gz NDVGXUFTDAKEOJ-PWSUYJOCSA-N 0 1 378.270 3.478 10 0 GGAEMN CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc(Br)cc(Cl)c1[O-] ZINC000177423172 565850444 /nfs/dbraw/zinc/85/04/44/565850444.db2.gz CWNHCJQBZQVVMR-LLVKDONJSA-N 0 1 375.694 3.364 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)C(=O)NC1(c2nn[nH]n2)CCCC1 ZINC000413466767 565853341 /nfs/dbraw/zinc/85/33/41/565853341.db2.gz ANGHQRYIVSYYSL-LBPRGKRZSA-N 0 1 392.301 3.117 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)C(=O)NC1(c2nn[nH]n2)CCCC1 ZINC000413466766 565853764 /nfs/dbraw/zinc/85/37/64/565853764.db2.gz ANGHQRYIVSYYSL-GFCCVEGCSA-N 0 1 392.301 3.117 10 0 GGAEMN O=C(N[C@H](c1cncc(Br)c1)C1CC1)[C@H]1CCCc2[nH]ncc21 ZINC000284522489 565857381 /nfs/dbraw/zinc/85/73/81/565857381.db2.gz BYNIRFDQBGSWEB-BBRMVZONSA-N 0 1 375.270 3.255 10 0 GGAEMN O=C(N[C@H]1CCc2cc(Br)ccc21)N[C@H]1CCc2nc[nH]c2C1 ZINC000332902624 565858287 /nfs/dbraw/zinc/85/82/87/565858287.db2.gz WLLSANWQKMSXFI-JSGCOSHPSA-N 0 1 375.270 3.016 10 0 GGAEMN O=C(N[C@@H]1CCc2cc(Br)ccc21)N[C@H]1CCc2nc[nH]c2C1 ZINC000332902619 565858425 /nfs/dbraw/zinc/85/84/25/565858425.db2.gz WLLSANWQKMSXFI-GXTWGEPZSA-N 0 1 375.270 3.016 10 0 GGAEMN CCCCOC[C@@H](O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 ZINC000195206851 565866103 /nfs/dbraw/zinc/86/61/03/565866103.db2.gz SVSKWSUTRNUHIX-KRWDZBQOSA-N 0 1 389.367 3.331 10 0 GGAEMN COc1cc(Br)cc(C)c1NC(=O)N1CCN2CCCC[C@@H]2C1 ZINC000195221903 565867201 /nfs/dbraw/zinc/86/72/01/565867201.db2.gz JBRZOOJXGHEMHK-CQSZACIVSA-N 0 1 382.302 3.468 10 0 GGAEMN Cc1csc([C@@H]2CCCN(Cc3cccc(S(=O)(=O)N(C)C)c3)C2)n1 ZINC000195335538 565876346 /nfs/dbraw/zinc/87/63/46/565876346.db2.gz HMZJHSIFRAGQFX-MRXNPFEDSA-N 0 1 379.551 3.081 10 0 GGAEMN Cn1ccnc1-c1cc(NC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)[nH]n1 ZINC000629974381 565878176 /nfs/dbraw/zinc/87/81/76/565878176.db2.gz ILIANUCEILJKFU-IUIKQTSFSA-N 0 1 398.264 3.097 10 0 GGAEMN O=C([C@H]1CCc2[nH]nnc2C1)N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000285053015 565886135 /nfs/dbraw/zinc/88/61/35/565886135.db2.gz JNDJWPPOOFJZNT-ZBEGNZNMSA-N 0 1 393.260 3.175 10 0 GGAEMN O=C([C@H]1CCc2nn[nH]c2C1)N1CCC[C@H]1c1ccc(Br)c(F)c1 ZINC000285053015 565886140 /nfs/dbraw/zinc/88/61/40/565886140.db2.gz JNDJWPPOOFJZNT-ZBEGNZNMSA-N 0 1 393.260 3.175 10 0 GGAEMN Cc1ccc(NC(=O)CN2CCC(c3ccn[nH]3)CC2)c(Br)c1 ZINC000195506828 565888904 /nfs/dbraw/zinc/88/89/04/565888904.db2.gz DFOSQVSZXBABBB-UHFFFAOYSA-N 0 1 377.286 3.299 10 0 GGAEMN C[N@H+]1CCC[C@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000213361267 565895925 /nfs/dbraw/zinc/89/59/25/565895925.db2.gz LDENQQOOMWPGKL-LBPRGKRZSA-N 0 1 376.092 3.036 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000213361267 565895928 /nfs/dbraw/zinc/89/59/28/565895928.db2.gz LDENQQOOMWPGKL-LBPRGKRZSA-N 0 1 376.092 3.036 10 0 GGAEMN COc1cccc(Cl)c1CN[C@H](C)Cn1cc(Br)ccc1=O ZINC000414143143 565898911 /nfs/dbraw/zinc/89/89/11/565898911.db2.gz SIATXZIMPZBFCH-LLVKDONJSA-N 0 1 385.689 3.451 10 0 GGAEMN Cc1nc([C@H](C)S(=O)(=O)c2nc3cccc(Br)c3s2)n[nH]1 ZINC000414217184 565904056 /nfs/dbraw/zinc/90/40/56/565904056.db2.gz BSKNOMHHBJYIEM-LURJTMIESA-N 0 1 387.284 3.020 10 0 GGAEMN C[C@@H](N[C@@H](C)c1cccs1)c1cccc(S(=O)(=O)N2CCOCC2)c1 ZINC000178174009 565904130 /nfs/dbraw/zinc/90/41/30/565904130.db2.gz NDEQQIFEUSLADM-CABCVRRESA-N 0 1 380.535 3.181 10 0 GGAEMN CCN(C)C(=O)CCN1CCC[C@H]1c1ccc(I)cc1 ZINC000178206814 565905412 /nfs/dbraw/zinc/90/54/12/565905412.db2.gz BJIPSVVLHVESPK-HNNXBMFYSA-N 0 1 386.277 3.297 10 0 GGAEMN COC[C@@H](CCO)N[C@@H](C)c1ccc(Br)cc1Br ZINC000223952430 565910377 /nfs/dbraw/zinc/91/03/77/565910377.db2.gz JDRMLIAEIPQKDJ-GXSJLCMTSA-N 0 1 381.108 3.260 10 0 GGAEMN CCCS(=O)(=O)NC1CCN(Cc2ccc(C(F)(F)F)c(C)c2)CC1 ZINC000414366096 565916454 /nfs/dbraw/zinc/91/64/54/565916454.db2.gz BAQZMLOZCUFJOD-UHFFFAOYSA-N 0 1 378.460 3.308 10 0 GGAEMN COC(C)(C)CS(=O)(=O)Nc1ccc(Cl)cc1NC(=O)c1ccco1 ZINC000414374267 565916853 /nfs/dbraw/zinc/91/68/53/565916853.db2.gz UQNOJGUHFDKENZ-UHFFFAOYSA-N 0 1 386.857 3.352 10 0 GGAEMN COCCOc1cc(C)ccc1NS(=O)(=O)c1ccc(Cl)c(OC)c1 ZINC000414378639 565917897 /nfs/dbraw/zinc/91/78/97/565917897.db2.gz HDTWDUBLZLEIQG-UHFFFAOYSA-N 0 1 385.869 3.483 10 0 GGAEMN CSCc1cc(F)ccc1CNCc1ccc(S(N)(=O)=O)c(Cl)c1 ZINC000414379124 565918738 /nfs/dbraw/zinc/91/87/38/565918738.db2.gz MAGGWOXYGZRPGZ-UHFFFAOYSA-N 0 1 388.917 3.279 10 0 GGAEMN C[C@@H](CC(=O)c1ccco1)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000178448673 565919126 /nfs/dbraw/zinc/91/91/26/565919126.db2.gz LTPNDHNWASROMK-VIFPVBQESA-N 0 1 376.210 3.310 10 0 GGAEMN CNC(=O)Cc1nc(CSc2nc(-c3ccc(Cl)cc3)n[nH]2)cs1 ZINC000178469579 565920562 /nfs/dbraw/zinc/92/05/62/565920562.db2.gz CHRPZAPBMDIYMX-UHFFFAOYSA-N 0 1 379.898 3.162 10 0 GGAEMN C[C@@H]1CN(C(C)(C)CNC(=O)/C=C\c2cccc(Br)c2)C[C@@H](C)O1 ZINC000227106937 565921941 /nfs/dbraw/zinc/92/19/41/565921941.db2.gz JOOOJPWXZZWYQJ-SFRZCGLPSA-N 0 1 395.341 3.466 10 0 GGAEMN Cc1nc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c(C)s1 ZINC000178492653 565922318 /nfs/dbraw/zinc/92/23/18/565922318.db2.gz XNAFAOAHJZLQAM-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN Cc1nc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c(C)s1 ZINC000178492653 565922322 /nfs/dbraw/zinc/92/23/22/565922322.db2.gz XNAFAOAHJZLQAM-UHFFFAOYSA-N 0 1 392.282 3.238 10 0 GGAEMN CCS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2SC)cc1 ZINC000414399698 565923515 /nfs/dbraw/zinc/92/35/15/565923515.db2.gz VSQNVRNGRREVEC-UHFFFAOYSA-N 0 1 385.532 3.311 10 0 GGAEMN Cc1cccc(S(=O)(=O)Nc2ccc(F)cc2N2CCOCC2)c1Cl ZINC000414397969 565923590 /nfs/dbraw/zinc/92/35/90/565923590.db2.gz SLNIMRLFADFFNF-UHFFFAOYSA-N 0 1 384.860 3.425 10 0 GGAEMN O=S(=O)(Nc1ccc(F)cc1N1CCOCC1)c1cc(F)cc(Cl)c1 ZINC000414393307 565923757 /nfs/dbraw/zinc/92/37/57/565923757.db2.gz HOYKGCYUBOVENA-UHFFFAOYSA-N 0 1 388.823 3.256 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3cc(Br)cc(F)c32)n[nH]1 ZINC000178528035 565924596 /nfs/dbraw/zinc/92/45/96/565924596.db2.gz MYDZJEKXKILGEX-SECBINFHSA-N 0 1 381.249 3.323 10 0 GGAEMN Cc1nn(C)c(S(=O)(=O)Nc2nc(C)c(Cl)cc2Cl)c1C(F)F ZINC000414443591 565933116 /nfs/dbraw/zinc/93/31/16/565933116.db2.gz NVKKDSHBYTUSED-UHFFFAOYSA-N 0 1 385.223 3.477 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@H](C)Cc2ccc(Br)cc2)n[nH]1 ZINC000178688759 565933713 /nfs/dbraw/zinc/93/37/13/565933713.db2.gz VMQOLTYELVGVOV-VXGBXAGGSA-N 0 1 379.302 3.342 10 0 GGAEMN COc1ccc(CN(C)C(=O)c2[nH]nc3ccc(Br)cc32)cc1O ZINC000178711296 565933981 /nfs/dbraw/zinc/93/39/81/565933981.db2.gz XVRWIOWTQYVRRC-UHFFFAOYSA-N 0 1 390.237 3.312 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)Cc2cccc(Br)c2)n[nH]1 ZINC000178697796 565934132 /nfs/dbraw/zinc/93/41/32/565934132.db2.gz XIPJPVJHQQYSEY-RYUDHWBXSA-N 0 1 379.302 3.342 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N[C@@H](C)Cc2cccc(Br)c2)n[nH]1 ZINC000178697785 565934313 /nfs/dbraw/zinc/93/43/13/565934313.db2.gz XIPJPVJHQQYSEY-NWDGAFQWSA-N 0 1 379.302 3.342 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)CCc2cccc(Cl)c2)c1Br ZINC000414466302 565937570 /nfs/dbraw/zinc/93/75/70/565937570.db2.gz BBQGKZOLLMYFKI-UHFFFAOYSA-N 0 1 378.679 3.118 10 0 GGAEMN CC(C)Cc1ncc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)s1 ZINC000178783014 565938017 /nfs/dbraw/zinc/93/80/17/565938017.db2.gz GQPJXOFELWRTNM-AWEZNQCLSA-N 0 1 381.567 3.443 10 0 GGAEMN COc1cc(C)c(S(=O)(=O)Nc2n[nH]c(C)c2Br)cc1Cl ZINC000414471134 565939248 /nfs/dbraw/zinc/93/92/48/565939248.db2.gz OAPJVPWNBQIZOV-UHFFFAOYSA-N 0 1 394.678 3.252 10 0 GGAEMN Cc1[nH]nc(NS(=O)(=O)c2ccc(OCC(C)C)cc2)c1Br ZINC000414473615 565940202 /nfs/dbraw/zinc/94/02/02/565940202.db2.gz WGHYETNDECHKNT-UHFFFAOYSA-N 0 1 388.287 3.316 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)CCN1C ZINC000286097182 565942640 /nfs/dbraw/zinc/94/26/40/565942640.db2.gz UNYBOMMDCSWUSE-ZYHUDNBSSA-N 0 1 384.851 3.462 10 0 GGAEMN CCN(CCc1nccs1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000178908360 565945313 /nfs/dbraw/zinc/94/53/13/565945313.db2.gz AOQGZZGJPVHFBC-UHFFFAOYSA-N 0 1 379.283 3.487 10 0 GGAEMN CC(C)(NC(=O)NCCCCN1CCOCC1)c1ccccc1Br ZINC000178930855 565947807 /nfs/dbraw/zinc/94/78/07/565947807.db2.gz HAOZIDCITCLEHW-UHFFFAOYSA-N 0 1 398.345 3.096 10 0 GGAEMN C[C@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc2c(c1)OCC(=O)N2 ZINC000286215840 565948140 /nfs/dbraw/zinc/94/81/40/565948140.db2.gz SAXWUMHTNRPKQL-ZBEGNZNMSA-N 0 1 391.265 3.164 10 0 GGAEMN C[C@@H](N[C@@H](CO)c1cccc(Br)c1)c1ccc2c(c1)OCC(=O)N2 ZINC000286215834 565948262 /nfs/dbraw/zinc/94/82/62/565948262.db2.gz SAXWUMHTNRPKQL-BZNIZROVSA-N 0 1 391.265 3.164 10 0 GGAEMN C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1ccc2c(c1)OCC(=O)N2 ZINC000286215831 565948342 /nfs/dbraw/zinc/94/83/42/565948342.db2.gz SAXWUMHTNRPKQL-BDJLRTHQSA-N 0 1 391.265 3.164 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)Cc2ccc(F)c(Cl)c2)[C@@H]1c1ccccc1 ZINC000178947739 565948787 /nfs/dbraw/zinc/94/87/87/565948787.db2.gz URGDFFSEGCLVJQ-ROUUACIJSA-N 0 1 382.888 3.344 10 0 GGAEMN COC(=O)[C@@H]1CSCCN(Cc2ccc(OCC(F)(F)F)c(F)c2)C1 ZINC000414583374 565951450 /nfs/dbraw/zinc/95/14/50/565951450.db2.gz LXUQUHAEGSBFRF-LBPRGKRZSA-N 0 1 381.391 3.105 10 0 GGAEMN COC(=O)C1(N(C)C(=O)c2[nH]nc3ccc(Br)cc32)CCCCC1 ZINC000179010266 565952349 /nfs/dbraw/zinc/95/23/49/565952349.db2.gz REGCJEILKAGOHR-UHFFFAOYSA-N 0 1 394.269 3.273 10 0 GGAEMN Cc1nc([C@H](C)NC(=O)Cn2c(C)c(Br)c3ccccc32)n[nH]1 ZINC000286317125 565953790 /nfs/dbraw/zinc/95/37/90/565953790.db2.gz JLADNBFZKHGJCM-VIFPVBQESA-N 0 1 376.258 3.016 10 0 GGAEMN CO[C@@H]1[C@H]2C[C@H]3CN(Cc4nnc(-c5ccccc5Br)o4)[C@H]1[C@H]3C2 ZINC000286376838 565956125 /nfs/dbraw/zinc/95/61/25/565956125.db2.gz GMFWVTHBOGRLGY-SKRAFVOUSA-N 0 1 390.281 3.354 10 0 GGAEMN CN1CCN(c2ccc(Cl)cc2NC(=O)c2nc3c(s2)CCC3)CC1 ZINC000414720710 565956502 /nfs/dbraw/zinc/95/65/02/565956502.db2.gz ZMUOYNKYQNLSFZ-UHFFFAOYSA-N 0 1 376.913 3.289 10 0 GGAEMN CN(c1ccc(S(C)(=O)=O)cc1C(F)(F)F)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000286432814 565959155 /nfs/dbraw/zinc/95/91/55/565959155.db2.gz QSVMYPKYQMDEKH-FUNVUKJBSA-N 0 1 376.444 3.170 10 0 GGAEMN CN(c1ccc(S(C)(=O)=O)cc1C(F)(F)F)C1C[C@H]2CC[C@@H](C1)N2C ZINC000286432814 565959158 /nfs/dbraw/zinc/95/91/58/565959158.db2.gz QSVMYPKYQMDEKH-FUNVUKJBSA-N 0 1 376.444 3.170 10 0 GGAEMN CCOc1c(Br)cc(Cl)cc1NC(=O)N1CCN[C@H](C)C1 ZINC000414764812 565959090 /nfs/dbraw/zinc/95/90/90/565959090.db2.gz BAUQSPVNBCLHBI-SECBINFHSA-N 0 1 376.682 3.327 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)c2c[nH]c3cccc(Br)c23)C1 ZINC000179264959 565969143 /nfs/dbraw/zinc/96/91/43/565969143.db2.gz SBEZUENWSOECFS-CYBMUJFWSA-N 0 1 394.313 3.017 10 0 GGAEMN O=C([C@@H]1COc2ccc(Br)cc21)N1CCC(c2cnc[nH]2)CC1 ZINC000361790912 565973023 /nfs/dbraw/zinc/97/30/23/565973023.db2.gz WKWGDGMOLJIFJJ-CQSZACIVSA-N 0 1 376.254 3.054 10 0 GGAEMN Brc1ccc2c(c1)C=C(CN1CCC[C@@H](n3cncn3)C1)CO2 ZINC000179469190 565982794 /nfs/dbraw/zinc/98/27/94/565982794.db2.gz LXDPTBUYIBXWSO-MRXNPFEDSA-N 0 1 375.270 3.154 10 0 GGAEMN Brc1ccc2c(c1)C=C(CN1CCC[C@H](n3cncn3)C1)CO2 ZINC000179469180 565983155 /nfs/dbraw/zinc/98/31/55/565983155.db2.gz LXDPTBUYIBXWSO-INIZCTEOSA-N 0 1 375.270 3.154 10 0 GGAEMN O=C(Nc1cc(Br)ccc1N1CCCC1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000415299033 565985731 /nfs/dbraw/zinc/98/57/31/565985731.db2.gz MKIICXBUNZJQHC-GASCZTMLSA-N 0 1 393.329 3.408 10 0 GGAEMN CCCC(=O)N[C@@H]1CCC[N@@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000245199129 565987089 /nfs/dbraw/zinc/98/70/89/565987089.db2.gz BLGRZGASDWCLAB-ZIAGYGMSSA-N 0 1 389.323 3.114 10 0 GGAEMN CCCC(=O)N[C@@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000245199129 565987095 /nfs/dbraw/zinc/98/70/95/565987095.db2.gz BLGRZGASDWCLAB-ZIAGYGMSSA-N 0 1 389.323 3.114 10 0 GGAEMN O=C(N[C@H]1COc2c1ccc(Cl)c2Cl)N1CCC[C@@H](c2nc[nH]n2)C1 ZINC000363136573 565992434 /nfs/dbraw/zinc/99/24/34/565992434.db2.gz KLCFPMUDZUGRQX-SKDRFNHKSA-N 0 1 382.251 3.134 10 0 GGAEMN Cc1nc([C@H]2CN([C@@H]3CCCc4ccc(Br)cc43)CCO2)n[nH]1 ZINC000179614102 565992458 /nfs/dbraw/zinc/99/24/58/565992458.db2.gz FOQIGJBOHZANBX-HZPDHXFCSA-N 0 1 377.286 3.327 10 0 GGAEMN Cn1cc([C@H]2CCN([C@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)C2)cn1 ZINC000245539721 565994637 /nfs/dbraw/zinc/99/46/37/565994637.db2.gz HVFNRBFNKWTDSH-SJCJKPOMSA-N 0 1 379.291 3.322 10 0 GGAEMN CN1CC[C@@H](CNC(=O)COCC(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245642258 565999948 /nfs/dbraw/zinc/99/99/48/565999948.db2.gz AOQFVHKUASXWKO-XHDPSFHLSA-N 0 1 382.785 3.167 10 0 GGAEMN O=S(=O)(c1c(Cl)cccc1C(F)(F)F)N1CCCC[C@H]1c1nnc[nH]1 ZINC000179680749 566000328 /nfs/dbraw/zinc/00/03/28/566000328.db2.gz VQPOBZSPGGVDHK-NSHDSACASA-N 0 1 394.806 3.393 10 0 GGAEMN O=C(NCc1cc(F)ccc1Br)N1CCC(c2cnc[nH]2)CC1 ZINC000363318274 566000724 /nfs/dbraw/zinc/00/07/24/566000724.db2.gz NEHPJKGZGDVJNE-UHFFFAOYSA-N 0 1 381.249 3.401 10 0 GGAEMN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(OC(F)F)c(Br)c1 ZINC000179720023 566002370 /nfs/dbraw/zinc/00/23/70/566002370.db2.gz RFLXHKOCEMXALA-MWLCHTKSSA-N 0 1 377.229 3.136 10 0 GGAEMN O[C@H](CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1)c1cccc(Br)c1 ZINC000245717485 566002877 /nfs/dbraw/zinc/00/28/77/566002877.db2.gz GWSAQKOWNZXYIJ-GDBMZVCRSA-N 0 1 391.313 3.358 10 0 GGAEMN COCc1cc(C(=O)Nc2nnc(SCc3ccc(F)cc3)s2)no1 ZINC000608116259 566004994 /nfs/dbraw/zinc/00/49/94/566004994.db2.gz PLUZSSPDLIQYQF-UHFFFAOYSA-N 0 1 380.426 3.356 10 0 GGAEMN CC(C)c1cccc(S(=O)(=O)Nc2ccc(F)cc2NS(C)(=O)=O)c1 ZINC000179765423 566006451 /nfs/dbraw/zinc/00/64/51/566006451.db2.gz GBXQLXQYDVDWCE-UHFFFAOYSA-N 0 1 386.470 3.121 10 0 GGAEMN Cc1nc(C[C@H]2CCCN(C[C@@H](O)c3cccc(Br)c3)C2)no1 ZINC000245835307 566007598 /nfs/dbraw/zinc/00/75/98/566007598.db2.gz CPSGIXYQQLFILT-CZUORRHYSA-N 0 1 380.286 3.129 10 0 GGAEMN O[C@H](CN1CCC(n2cc(Br)cn2)CC1)c1cc(F)ccc1F ZINC000363495444 566008796 /nfs/dbraw/zinc/00/87/96/566008796.db2.gz JQBVWQSKRUHUGG-MRXNPFEDSA-N 0 1 386.240 3.294 10 0 GGAEMN O[C@@H](CN1CCC(n2cc(Br)cn2)CC1)c1cc(F)ccc1F ZINC000363495443 566009134 /nfs/dbraw/zinc/00/91/34/566009134.db2.gz JQBVWQSKRUHUGG-INIZCTEOSA-N 0 1 386.240 3.294 10 0 GGAEMN CC[C@@H]1CN(C(=O)C[C@H](C)c2ccc(Br)cc2)CCN1C[C@@H](C)O ZINC000245990837 566013983 /nfs/dbraw/zinc/01/39/83/566013983.db2.gz LVVYDSMNKZIQEA-HDMKZQKVSA-N 0 1 397.357 3.246 10 0 GGAEMN COc1ccc(S(=O)(=O)NC[C@H]2CCCN(C)[C@@H]2c2cccs2)cc1 ZINC000246058082 566015253 /nfs/dbraw/zinc/01/52/53/566015253.db2.gz DCHVOPQXYLWAPM-KDOFPFPSSA-N 0 1 380.535 3.118 10 0 GGAEMN CC[C@H]1CN(C(=O)c2ccc(Br)c(Cl)c2)CCN1C[C@H](C)O ZINC000246082763 566015972 /nfs/dbraw/zinc/01/59/72/566015972.db2.gz UBNMJJJWNJMNTF-AAEUAGOBSA-N 0 1 389.721 3.020 10 0 GGAEMN CN(C)C(=O)C1CCN(Cc2ccc(Br)c3cccnc23)CC1 ZINC000179886802 566016012 /nfs/dbraw/zinc/01/60/12/566016012.db2.gz APHVPGKDMSBGJB-UHFFFAOYSA-N 0 1 376.298 3.298 10 0 GGAEMN C[N@H+]1CCC[C@@H](C[N-]S(=O)(=O)c2c(F)cccc2F)[C@H]1c1cccs1 ZINC000246098571 566016493 /nfs/dbraw/zinc/01/64/93/566016493.db2.gz HGEYYVPZRDKFAH-LRDDRELGSA-N 0 1 386.489 3.388 10 0 GGAEMN C[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000246147904 566018781 /nfs/dbraw/zinc/01/87/81/566018781.db2.gz FFYFYKIWYKILCF-QWRGUYRKSA-N 0 1 382.835 3.216 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)c2cc(F)ccc2F)[C@H]1c1cccs1 ZINC000246135490 566019026 /nfs/dbraw/zinc/01/90/26/566019026.db2.gz JWFYOMSIABNIJA-PXAZEXFGSA-N 0 1 386.489 3.388 10 0 GGAEMN C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000246147895 566019050 /nfs/dbraw/zinc/01/90/50/566019050.db2.gz FFYFYKIWYKILCF-MNOVXSKESA-N 0 1 382.835 3.216 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)Cc2ccccc2F)[C@H]1c1cccs1 ZINC000246188120 566020197 /nfs/dbraw/zinc/02/01/97/566020197.db2.gz NUZYQAJNQJEFER-KDOFPFPSSA-N 0 1 382.526 3.390 10 0 GGAEMN Cc1nc([C@H](C)NC(=O)Nc2cc(C(F)(F)F)cc(Br)n2)n[nH]1 ZINC000287487113 566021127 /nfs/dbraw/zinc/02/11/27/566021127.db2.gz GQTYQCWTGOWMSH-YFKPBYRVSA-N 0 1 393.167 3.172 10 0 GGAEMN Cc1cc(S(=O)(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)cc1F ZINC000246256256 566023713 /nfs/dbraw/zinc/02/37/13/566023713.db2.gz FVMKKDVETITROC-SUMWQHHRSA-N 0 1 386.920 3.425 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H](C)N2CC[N@H+]3CCCC[C@H]3C2)c(Br)c1 ZINC000246262925 566024033 /nfs/dbraw/zinc/02/40/33/566024033.db2.gz YUDYCWNXCVQZRN-CABCVRRESA-N 0 1 380.330 3.255 10 0 GGAEMN Cc1ccc(NC(=O)[C@@H](C)N2CCN3CCCC[C@H]3C2)c(Br)c1 ZINC000246262925 566024035 /nfs/dbraw/zinc/02/40/35/566024035.db2.gz YUDYCWNXCVQZRN-CABCVRRESA-N 0 1 380.330 3.255 10 0 GGAEMN Cc1cc(S(=O)(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c(Cl)cc1F ZINC000246256249 566024385 /nfs/dbraw/zinc/02/43/85/566024385.db2.gz FVMKKDVETITROC-GUYCJALGSA-N 0 1 386.920 3.425 10 0 GGAEMN O[C@H](COc1ccc(Br)cc1)CN1CCCC[C@H]1c1cn[nH]c1 ZINC000246438914 566029425 /nfs/dbraw/zinc/02/94/25/566029425.db2.gz WJIYOWPRNHXPGG-RDJZCZTQSA-N 0 1 380.286 3.139 10 0 GGAEMN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CC[C@H](Oc2cccnc2)C1 ZINC000246759164 566040009 /nfs/dbraw/zinc/04/00/09/566040009.db2.gz PZXBMLBEAPFEHP-ZBFHGGJFSA-N 0 1 383.275 3.281 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@H]1CC[N@@H+](C)C[C@H]1C ZINC000246753294 566040219 /nfs/dbraw/zinc/04/02/19/566040219.db2.gz ZOFCRKUNBCOGQP-CPUCHLNUSA-N 0 1 382.346 3.362 10 0 GGAEMN C[C@H](C(=O)Nc1ccc(Br)cc1)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000246817611 566042543 /nfs/dbraw/zinc/04/25/43/566042543.db2.gz JRJAOBQKJAFUMI-GLJUWKHASA-N 0 1 381.314 3.403 10 0 GGAEMN O=C(NCCc1ccc(Br)s1)N1CCC(c2cnc[nH]2)CC1 ZINC000364294360 566043515 /nfs/dbraw/zinc/04/35/15/566043515.db2.gz FTZGIUBEFUGCMO-UHFFFAOYSA-N 0 1 383.315 3.365 10 0 GGAEMN O=C(Nc1cccc(I)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000364295514 566043536 /nfs/dbraw/zinc/04/35/36/566043536.db2.gz LABAUMAVHJZDEJ-UHFFFAOYSA-N 0 1 396.232 3.426 10 0 GGAEMN COc1ccc(Br)cc1S(=O)(=O)Nc1ncccc1Cl ZINC000180199317 566044300 /nfs/dbraw/zinc/04/43/00/566044300.db2.gz ZGWDHWSASWBJHK-UHFFFAOYSA-N 0 1 377.647 3.307 10 0 GGAEMN CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)CCN1C[C@H](C)O ZINC000246843078 566044296 /nfs/dbraw/zinc/04/42/96/566044296.db2.gz MMQLCUWDJVDUPZ-LCGIIJARSA-N 0 1 385.335 3.401 10 0 GGAEMN Cc1cc(NC(=O)[C@@H](C)N2CC[C@@H](c3cnn(C)c3)C2)ccc1Br ZINC000246914918 566045503 /nfs/dbraw/zinc/04/55/03/566045503.db2.gz HPHNWMOYNKRFCQ-ZIAGYGMSSA-N 0 1 391.313 3.308 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1Br ZINC000246930544 566046758 /nfs/dbraw/zinc/04/67/58/566046758.db2.gz IHVIXMBSAQMEJX-RDTXWAMCSA-N 0 1 388.309 3.485 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1ccccc1Br ZINC000246930544 566046762 /nfs/dbraw/zinc/04/67/62/566046762.db2.gz IHVIXMBSAQMEJX-RDTXWAMCSA-N 0 1 388.309 3.485 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc(Br)ccc1Br ZINC000364368555 566047987 /nfs/dbraw/zinc/04/79/87/566047987.db2.gz IIXQCLPSSWZMHG-SECBINFHSA-N 0 1 399.086 3.222 10 0 GGAEMN COc1cc(F)c(Br)cc1NC(=O)c1ccc(CN(C)C)nc1 ZINC000416270015 566049661 /nfs/dbraw/zinc/04/96/61/566049661.db2.gz JODFKEDGOMMBDM-UHFFFAOYSA-N 0 1 382.233 3.306 10 0 GGAEMN C[C@@H]1CN(C(=O)CCCc2cc(Cl)sc2Cl)[C@@H](C)CN1CCO ZINC000416285055 566050532 /nfs/dbraw/zinc/05/05/32/566050532.db2.gz BLVJEDHDLUQGOY-NEPJUHHUSA-N 0 1 379.353 3.291 10 0 GGAEMN O=C(N[C@H]1CCCc2cn[nH]c21)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000364461519 566052802 /nfs/dbraw/zinc/05/28/02/566052802.db2.gz WEELRMOCUCOFRW-AWEZNQCLSA-N 0 1 387.237 3.233 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1nc(Cl)ccc1Cl ZINC000247137551 566053330 /nfs/dbraw/zinc/05/33/30/566053330.db2.gz HOHKIEURMVTEJJ-IUODEOHRSA-N 0 1 379.291 3.424 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)c3ccc(Br)cc3-n3cncn3)ccc12 ZINC000180319697 566054608 /nfs/dbraw/zinc/05/46/08/566054608.db2.gz MQYNSZSTFLGDDJ-UHFFFAOYSA-N 0 1 397.236 3.467 10 0 GGAEMN C[C@@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1cccc(Br)c1 ZINC000247260724 566055832 /nfs/dbraw/zinc/05/58/32/566055832.db2.gz QIDJAHGNKWXSIN-RDTXWAMCSA-N 0 1 388.309 3.485 10 0 GGAEMN Cc1[nH]nc2cc(NC(=O)c3cncc(I)c3)ccc12 ZINC000180335611 566056359 /nfs/dbraw/zinc/05/63/59/566056359.db2.gz WPLSDQHWAMUKEE-UHFFFAOYSA-N 0 1 378.173 3.123 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)c(O)c2)[C@H]1c1ccccc1 ZINC000247268236 566056562 /nfs/dbraw/zinc/05/65/62/566056562.db2.gz KDYYLYQZTSXTMI-NVXWUHKLSA-N 0 1 375.266 3.330 10 0 GGAEMN C[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)c([O-])c2)[C@H]1c1ccccc1 ZINC000247268236 566056569 /nfs/dbraw/zinc/05/65/69/566056569.db2.gz KDYYLYQZTSXTMI-NVXWUHKLSA-N 0 1 375.266 3.330 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1cccc(Br)c1 ZINC000247259198 566056771 /nfs/dbraw/zinc/05/67/71/566056771.db2.gz QIDJAHGNKWXSIN-KBXCAEBGSA-N 0 1 388.309 3.485 10 0 GGAEMN Cc1nc(-c2ccc(S(=O)(=O)N[C@H]3CN(C(C)C)C[C@H]3C)s2)cs1 ZINC000247240723 566056797 /nfs/dbraw/zinc/05/67/97/566056797.db2.gz YYICOWIDRPWKOG-YPMHNXCESA-N 0 1 385.580 3.187 10 0 GGAEMN Cc1nc(-c2ccc(S(=O)(=O)N[C@@H]3CN(C(C)C)C[C@H]3C)s2)cs1 ZINC000247240706 566056825 /nfs/dbraw/zinc/05/68/25/566056825.db2.gz YYICOWIDRPWKOG-DGCLKSJQSA-N 0 1 385.580 3.187 10 0 GGAEMN C[C@H]1CN(Cc2ccccn2)CC[C@H]1NC(=O)c1coc(Br)c1 ZINC000247281585 566057591 /nfs/dbraw/zinc/05/75/91/566057591.db2.gz SFYYDWJYGGISPQ-SWLSCSKDSA-N 0 1 378.270 3.078 10 0 GGAEMN C[C@@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000247400553 566060617 /nfs/dbraw/zinc/06/06/17/566060617.db2.gz PJCXYTLMKSCUNS-MNOVXSKESA-N 0 1 382.835 3.216 10 0 GGAEMN COC(=O)c1ncsc1S(=O)(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000180438218 566063036 /nfs/dbraw/zinc/06/30/36/566063036.db2.gz BIGQDXTYCYHRGW-LBPRGKRZSA-N 0 1 386.882 3.013 10 0 GGAEMN C[C@H](NC[C@H](O)COC(C)(C)C)c1cc2c(cc1Br)OCCO2 ZINC000180482629 566066531 /nfs/dbraw/zinc/06/65/31/566066531.db2.gz ZIHHPEAYIWYZEZ-RYUDHWBXSA-N 0 1 388.302 3.047 10 0 GGAEMN C[C@@H]1C[N@@H+](C[C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@H](C)O1 ZINC000247813135 566066712 /nfs/dbraw/zinc/06/67/12/566066712.db2.gz VLTAWFTUTFLLOA-FRRDWIJNSA-N 0 1 387.307 3.413 10 0 GGAEMN C[C@@H]1C[N@H+](C[C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2[O-])C[C@H](C)O1 ZINC000247813135 566066715 /nfs/dbraw/zinc/06/67/15/566066715.db2.gz VLTAWFTUTFLLOA-FRRDWIJNSA-N 0 1 387.307 3.413 10 0 GGAEMN C[C@@H](NC[C@H](O)COC(C)(C)C)c1cc2c(cc1Br)OCCO2 ZINC000180482645 566066728 /nfs/dbraw/zinc/06/67/28/566066728.db2.gz ZIHHPEAYIWYZEZ-NEPJUHHUSA-N 0 1 388.302 3.047 10 0 GGAEMN Cc1nc(C)n(C[C@@H]2CCCN(C[C@@H](O)c3cccc(Br)c3)C2)n1 ZINC000247879124 566067862 /nfs/dbraw/zinc/06/78/62/566067862.db2.gz ZCXGIWFRXQVMFS-CRAIPNDOSA-N 0 1 393.329 3.103 10 0 GGAEMN Cc1nc(C)n(C[C@H]2CCCN(C[C@@H](O)c3cccc(Br)c3)C2)n1 ZINC000247879128 566068461 /nfs/dbraw/zinc/06/84/61/566068461.db2.gz ZCXGIWFRXQVMFS-MAUKXSAKSA-N 0 1 393.329 3.103 10 0 GGAEMN CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2ncc(Br)s2)ncn1 ZINC000180573585 566073306 /nfs/dbraw/zinc/07/33/06/566073306.db2.gz CIXJEMWBFYPHMG-WDEREUQCSA-N 0 1 397.346 3.057 10 0 GGAEMN O=S(=O)(NCc1ccc(Cl)cn1)c1cc(F)c(Br)cc1F ZINC000180596260 566075940 /nfs/dbraw/zinc/07/59/40/566075940.db2.gz HLPLKBYHDOQEAG-UHFFFAOYSA-N 0 1 397.628 3.254 10 0 GGAEMN O[C@H](CN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000248388598 566076031 /nfs/dbraw/zinc/07/60/31/566076031.db2.gz FHRZRRFTKTYTTE-DGCLKSJQSA-N 0 1 375.778 3.493 10 0 GGAEMN O=C(c1s[n-]c(=O)c1Cl)N1CC[C@]2(CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000288530977 566077715 /nfs/dbraw/zinc/07/77/15/566077715.db2.gz UPJPOTZOJJHIRT-SFHVURJKSA-N 0 1 377.897 3.240 10 0 GGAEMN CCc1nc2n(n1)C[C@@H](N[C@@H]1CCc3c1c(Br)ccc3F)CC2 ZINC000180621825 566078308 /nfs/dbraw/zinc/07/83/08/566078308.db2.gz QKUNKMDRXDNEOB-IINYFYTJSA-N 0 1 379.277 3.334 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000248498562 566079642 /nfs/dbraw/zinc/07/96/42/566079642.db2.gz OKAREKGZLZOYPS-YPMHNXCESA-N 0 1 382.220 3.463 10 0 GGAEMN O[C@H](COc1cccc(Br)c1)CN1CCC[C@@H](C(F)(F)F)C1 ZINC000248498562 566079645 /nfs/dbraw/zinc/07/96/45/566079645.db2.gz OKAREKGZLZOYPS-YPMHNXCESA-N 0 1 382.220 3.463 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000248494795 566080065 /nfs/dbraw/zinc/08/00/65/566080065.db2.gz CKHSMYFKNWSPAA-DGCLKSJQSA-N 0 1 382.220 3.463 10 0 GGAEMN O[C@@H](COc1ccc(Br)cc1)CN1CCC[C@@H](C(F)(F)F)C1 ZINC000248494795 566080072 /nfs/dbraw/zinc/08/00/72/566080072.db2.gz CKHSMYFKNWSPAA-DGCLKSJQSA-N 0 1 382.220 3.463 10 0 GGAEMN COC(C)(C)CS(=O)(=O)N1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000416536907 566083479 /nfs/dbraw/zinc/08/34/79/566083479.db2.gz RDLJLBCDEBVJSR-HNNXBMFYSA-N 0 1 385.917 3.498 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1ncsc1Br ZINC000288677915 566085661 /nfs/dbraw/zinc/08/56/61/566085661.db2.gz QBSKSAOLQFPQKA-UHFFFAOYSA-N 0 1 395.326 3.218 10 0 GGAEMN COc1cc(S(=O)(=O)N(CCN(C)C)Cc2ccsc2)ccc1Cl ZINC000416553414 566085848 /nfs/dbraw/zinc/08/58/48/566085848.db2.gz IQQSZJWZXLXOQW-UHFFFAOYSA-N 0 1 388.942 3.163 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN2CCCC[C@H]2C1 ZINC000248705615 566086121 /nfs/dbraw/zinc/08/61/21/566086121.db2.gz OKYOLVPNMFWWKX-HIFRSBDPSA-N 0 1 396.329 3.398 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)N1CCN2CCCC[C@H]2C1 ZINC000248705616 566086706 /nfs/dbraw/zinc/08/67/06/566086706.db2.gz OKYOLVPNMFWWKX-ZFWWWQNUSA-N 0 1 396.329 3.398 10 0 GGAEMN C[C@@H](NC(=O)NCCCN1C[C@@H](C)O[C@@H](C)C1)c1cccc(Br)c1 ZINC000248877991 566091066 /nfs/dbraw/zinc/09/10/66/566091066.db2.gz OIUDCXTYNLGYMK-QLFBSQMISA-N 0 1 398.345 3.309 10 0 GGAEMN CCS(=O)(=O)C[C@H](C)N[C@@H]1CCCOc2ccc(Br)cc21 ZINC000180821663 566091243 /nfs/dbraw/zinc/09/12/43/566091243.db2.gz VMJABMSBSTWEDD-SMDDNHRTSA-N 0 1 376.316 3.076 10 0 GGAEMN O[C@H](CN1CCC[C@H](c2nncn2C2CC2)C1)c1ccccc1Br ZINC000180871500 566095608 /nfs/dbraw/zinc/09/56/08/566095608.db2.gz BMDQYOQWMWXIAO-SUMWQHHRSA-N 0 1 391.313 3.289 10 0 GGAEMN C[N@@H+](CC(=O)[O-])C1CCN(C(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)CC1 ZINC000249135884 566098256 /nfs/dbraw/zinc/09/82/56/566098256.db2.gz UKBZBBYRWGGZDH-GJZGRUSLSA-N 0 1 385.291 3.104 10 0 GGAEMN COc1cc(Br)ccc1CNCc1cnc2c(c1)c(C)nn2C ZINC000180925185 566100108 /nfs/dbraw/zinc/10/01/08/566100108.db2.gz HGEORELEMLQZHX-UHFFFAOYSA-N 0 1 375.270 3.338 10 0 GGAEMN Cc1cc(S(=O)(=O)N2CCCC[C@H]2c2nnc[nH]2)c(C)cc1Br ZINC000180933529 566101031 /nfs/dbraw/zinc/10/10/31/566101031.db2.gz ZVULMUNLLBHHKG-ZDUSSCGKSA-N 0 1 399.314 3.100 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)cc(Cl)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000180940537 566101051 /nfs/dbraw/zinc/10/10/51/566101051.db2.gz YDQKJXWUATWZNQ-ZDUSSCGKSA-N 0 1 375.281 3.169 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)cc(Cl)c1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000180940520 566101190 /nfs/dbraw/zinc/10/11/90/566101190.db2.gz YDQKJXWUATWZNQ-CYBMUJFWSA-N 0 1 375.281 3.169 10 0 GGAEMN O=S(=O)(C=Cc1ccc(Br)cc1)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000180934714 566101314 /nfs/dbraw/zinc/10/13/14/566101314.db2.gz AEHPAKPFBYJEIW-QSYFUGGGSA-N 0 1 397.298 3.095 10 0 GGAEMN Cc1nc(-c2ccc(S(=O)(=O)N3CCCC[C@H]3c3nnc[nH]3)s2)cs1 ZINC000180935373 566101678 /nfs/dbraw/zinc/10/16/78/566101678.db2.gz KUXYBVQAEPCYBY-LBPRGKRZSA-N 0 1 395.535 3.214 10 0 GGAEMN CC[C@@H]1CN(C(=O)c2cc(Cl)cc(C(F)(F)F)c2)CCN1C[C@H](C)O ZINC000249534728 566103936 /nfs/dbraw/zinc/10/39/36/566103936.db2.gz CBURVFWDBTXUMF-XHDPSFHLSA-N 0 1 378.822 3.276 10 0 GGAEMN C[C@H](C(=O)NCc1ccccc1Cl)N1C[C@@H](c2ccsc2)[C@H](CO)C1 ZINC000249585280 566104845 /nfs/dbraw/zinc/10/48/45/566104845.db2.gz SSJUTXBBKAJERH-COXVUDFISA-N 0 1 378.925 3.114 10 0 GGAEMN CN1CC[C@H](CNC(=O)CCOCC(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000249712182 566106489 /nfs/dbraw/zinc/10/64/89/566106489.db2.gz YTPSPHKFGBYBJF-SJKOYZFVSA-N 0 1 378.822 3.260 10 0 GGAEMN CCN(CC)C(=O)[C@@H]1CCCN1C[C@@H](O)COc1cc(Cl)ccc1Cl ZINC000250243779 566108964 /nfs/dbraw/zinc/10/89/64/566108964.db2.gz UWRRZQNQZFVPFP-ZBFHGGJFSA-N 0 1 389.323 3.066 10 0 GGAEMN Cc1csc([C@@H]2CCCN(CC(=O)N3CCC[C@@H](C(F)(F)F)C3)C2)n1 ZINC000249883936 566109049 /nfs/dbraw/zinc/10/90/49/566109049.db2.gz OIHAZIKBYVFLMN-ZIAGYGMSSA-N 0 1 375.460 3.432 10 0 GGAEMN Cc1csc([C@H]2CCCN(CC(=O)N3CCC[C@@H](C(F)(F)F)C3)C2)n1 ZINC000249883934 566109206 /nfs/dbraw/zinc/10/92/06/566109206.db2.gz OIHAZIKBYVFLMN-UONOGXRCSA-N 0 1 375.460 3.432 10 0 GGAEMN C[C@@H]1CN(C(=O)Nc2ccc(Cl)c(Br)c2)[C@@H](C)CN1CCO ZINC000416929190 566113076 /nfs/dbraw/zinc/11/30/76/566113076.db2.gz ZXHVPFNHUYRREX-MNOVXSKESA-N 0 1 390.709 3.021 10 0 GGAEMN C[C@@H]1CN(CCO)[C@@H](C)CN1C(=O)Nc1ccc(Cl)c(Br)c1 ZINC000416929192 566113853 /nfs/dbraw/zinc/11/38/53/566113853.db2.gz ZXHVPFNHUYRREX-WDEREUQCSA-N 0 1 390.709 3.021 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)Nc3ccc(Br)cc3F)cn21 ZINC000416940726 566114275 /nfs/dbraw/zinc/11/42/75/566114275.db2.gz GPRDGAQZAPGKKK-SECBINFHSA-N 0 1 388.262 3.483 10 0 GGAEMN COC(=O)c1cccc(NS(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)c1Cl ZINC000416951697 566114459 /nfs/dbraw/zinc/11/44/59/566114459.db2.gz FZSJKJZXRXIHHX-JTQLQIEISA-N 0 1 383.857 3.021 10 0 GGAEMN COc1cc(NS(=O)(=O)c2cn3c(n2)CCC[C@H]3C)c(Cl)c(OC)c1 ZINC000416945631 566114969 /nfs/dbraw/zinc/11/49/69/566114969.db2.gz AFOBYMWLVTTZKW-SNVBAGLBSA-N 0 1 385.873 3.252 10 0 GGAEMN C[C@H](NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccc(Br)cc1 ZINC000181106534 566115527 /nfs/dbraw/zinc/11/55/27/566115527.db2.gz MNOSYDKOSNNVPQ-RRQGHBQHSA-N 0 1 381.314 3.270 10 0 GGAEMN Cn1cc([C@@H]2CCN([C@@H]3CCN(c4ccc(Cl)c(Cl)c4)C3=O)C2)cn1 ZINC000181115105 566117200 /nfs/dbraw/zinc/11/72/00/566117200.db2.gz HVFNRBFNKWTDSH-SJKOYZFVSA-N 0 1 379.291 3.322 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc(-c3ncn(C)n3)c2)c(Cl)cc1F ZINC000181157802 566120579 /nfs/dbraw/zinc/12/05/79/566120579.db2.gz CLAAMECGIRAPCF-UHFFFAOYSA-N 0 1 380.832 3.384 10 0 GGAEMN CCOCc1nc([C@H](C)NS(=O)(=O)c2cc(Cl)sc2Cl)no1 ZINC000289417752 566121025 /nfs/dbraw/zinc/12/10/25/566121025.db2.gz BNYJJJLNEUOFMN-LURJTMIESA-N 0 1 386.282 3.014 10 0 GGAEMN CC(=O)c1ccc(NS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1Cl ZINC000181205044 566123905 /nfs/dbraw/zinc/12/39/05/566123905.db2.gz NDRGYPSWBZVGBK-UHFFFAOYSA-N 0 1 399.255 3.491 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)C[N@@H+]1[C@@H]2CCCC[C@@H]2C[C@H]1C(=O)[O-] ZINC000261599566 566124971 /nfs/dbraw/zinc/12/49/71/566124971.db2.gz AUPHMBQDDDKJIB-WQVCFCJDSA-N 0 1 395.297 3.414 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)C[N@H+]1[C@H](C(=O)[O-])C[C@H]2CCCC[C@@H]21 ZINC000261599562 566125229 /nfs/dbraw/zinc/12/52/29/566125229.db2.gz AUPHMBQDDDKJIB-KCXAZCMYSA-N 0 1 395.297 3.414 10 0 GGAEMN O=C1OCC[C@H]1CCN1CCC[C@@H]1c1ccccc1I ZINC000365919032 566125819 /nfs/dbraw/zinc/12/58/19/566125819.db2.gz JDQPQTOXICAPGA-IUODEOHRSA-N 0 1 385.245 3.381 10 0 GGAEMN Cc1c(C[S@@](C)=O)cccc1NS(=O)(=O)c1ccc(C(F)(F)F)nc1 ZINC000181264217 566128427 /nfs/dbraw/zinc/12/84/27/566128427.db2.gz YHKULDLJANPLTI-XMMPIXPASA-N 0 1 392.424 3.088 10 0 GGAEMN Cc1nn(C)cc1[C@H](C)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000181275841 566129454 /nfs/dbraw/zinc/12/94/54/566129454.db2.gz HABRZJIWTDDDBK-JTQLQIEISA-N 0 1 375.274 3.127 10 0 GGAEMN Cc1nn(C)cc1[C@H](C)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000181275841 566129457 /nfs/dbraw/zinc/12/94/57/566129457.db2.gz HABRZJIWTDDDBK-JTQLQIEISA-N 0 1 375.274 3.127 10 0 GGAEMN CCn1cc([C@@H](C)NCc2nc(-c3ccc(Br)cc3)n[nH]2)cn1 ZINC000181278506 566129753 /nfs/dbraw/zinc/12/97/53/566129753.db2.gz YTOXPMFLHFZMCF-LLVKDONJSA-N 0 1 375.274 3.301 10 0 GGAEMN CCOCc1nc([C@H](C)NS(=O)(=O)c2c(Cl)cc(F)cc2Cl)no1 ZINC000289572554 566130534 /nfs/dbraw/zinc/13/05/34/566130534.db2.gz ONCJRNPBDMKUSI-ZETCQYMHSA-N 0 1 398.243 3.092 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CC(=O)Nc1ccc(Br)cc1 ZINC000261718310 566130629 /nfs/dbraw/zinc/13/06/29/566130629.db2.gz LTRWAYPJCACANA-DFBGVHRSSA-N 0 1 381.270 3.105 10 0 GGAEMN Cc1ccc(NC(=O)C[N@@H+]2[C@@H]3CCCC[C@H]3C[C@H]2C(=O)[O-])c(Br)c1 ZINC000261751602 566132167 /nfs/dbraw/zinc/13/21/67/566132167.db2.gz UWAFPJDWEDZSSU-MAZHCROVSA-N 0 1 395.297 3.414 10 0 GGAEMN Cc1ccc(NC(=O)C[N@H+]2[C@H](C(=O)[O-])C[C@H]3CCCC[C@@H]32)c(Br)c1 ZINC000261751600 566132379 /nfs/dbraw/zinc/13/23/79/566132379.db2.gz UWAFPJDWEDZSSU-KCXAZCMYSA-N 0 1 395.297 3.414 10 0 GGAEMN CN(Cc1cc(F)ccc1Br)C1CCN(c2cnccn2)CC1 ZINC000366105554 566135292 /nfs/dbraw/zinc/13/52/92/566135292.db2.gz VSKXEHHQQDLVAF-UHFFFAOYSA-N 0 1 379.277 3.479 10 0 GGAEMN C[C@@](N)(C(=O)N1CCC[C@]2(CCCOC2)C1)c1ccc(Br)cc1 ZINC000261823911 566136095 /nfs/dbraw/zinc/13/60/95/566136095.db2.gz SWYNYPHQOSQXLO-ROUUACIJSA-N 0 1 381.314 3.042 10 0 GGAEMN C[C@H](CCc1ccc(Br)cc1)NC(=O)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417212851 566136165 /nfs/dbraw/zinc/13/61/65/566136165.db2.gz BPAAJTCRSYODLH-XYPHTWIQSA-N 0 1 380.330 3.306 10 0 GGAEMN Cc1ccc(I)cc1C(=O)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181367964 566136995 /nfs/dbraw/zinc/13/69/95/566136995.db2.gz LKCNJCOIFMPTIB-ZDUSSCGKSA-N 0 1 396.232 3.085 10 0 GGAEMN Cc1ccc(OCCC(=O)N2CCCC[C@@H]2c2nnc[nH]2)c(Br)c1 ZINC000181369575 566137052 /nfs/dbraw/zinc/13/70/52/566137052.db2.gz TVOKVMMSVRGCBX-CQSZACIVSA-N 0 1 393.285 3.398 10 0 GGAEMN O=C(Cc1c[nH]c2cc(Br)ccc12)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181378797 566137298 /nfs/dbraw/zinc/13/72/98/566137298.db2.gz JFONYPDCEGSYFT-OAHLLOKOSA-N 0 1 388.269 3.345 10 0 GGAEMN C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1ccc(-n2cncn2)cc1 ZINC000181394095 566138503 /nfs/dbraw/zinc/13/85/03/566138503.db2.gz GPSZLEXPPVCATL-FZKQIMNGSA-N 0 1 387.281 3.414 10 0 GGAEMN C[C@@H](Cc1ccc(Br)cc1)C(=O)N1CCCC[C@@H]1c1nnc[nH]1 ZINC000181388942 566138567 /nfs/dbraw/zinc/13/85/67/566138567.db2.gz RHYCIUAWMTYYAV-SWLSCSKDSA-N 0 1 377.286 3.500 10 0 GGAEMN O=C(CCCOc1cccc(Br)c1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181399295 566138576 /nfs/dbraw/zinc/13/85/76/566138576.db2.gz CCABJXHVZGPONR-HNNXBMFYSA-N 0 1 393.285 3.480 10 0 GGAEMN C[C@@H](N[C@H](CO)c1cccc(Br)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000181395141 566138638 /nfs/dbraw/zinc/13/86/38/566138638.db2.gz FABNXGLBRWBCKW-SJKOYZFVSA-N 0 1 398.322 3.237 10 0 GGAEMN C[C@H](Cc1ccc(Br)cc1)C(=O)N1CCCC[C@H]1c1nnc[nH]1 ZINC000181389002 566138649 /nfs/dbraw/zinc/13/86/49/566138649.db2.gz RHYCIUAWMTYYAV-DOMZBBRYSA-N 0 1 377.286 3.500 10 0 GGAEMN COCCc1nc(C)c([C@H](C)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)s1 ZINC000181395218 566138761 /nfs/dbraw/zinc/13/87/61/566138761.db2.gz IYNVTRMDDCJGER-STQMWFEESA-N 0 1 382.551 3.456 10 0 GGAEMN COc1ccccc1CCN(C)C(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261883676 566138990 /nfs/dbraw/zinc/13/89/90/566138990.db2.gz ZKJXBGKNNZBHBU-IBGZPJMESA-N 0 1 391.309 3.333 10 0 GGAEMN C[C@@](N)(C(=O)N1CCO[C@H](c2ccsc2)C1)c1ccc(Br)cc1 ZINC000261869034 566139496 /nfs/dbraw/zinc/13/94/96/566139496.db2.gz XSJVGOASXGNYLD-RDJZCZTQSA-N 0 1 395.322 3.285 10 0 GGAEMN CNC(=O)c1ccc(CN[C@H]2CCOc3c(Br)cccc32)cc1 ZINC000366270824 566144218 /nfs/dbraw/zinc/14/42/18/566144218.db2.gz OMEFJGSHTLWEDS-INIZCTEOSA-N 0 1 375.266 3.422 10 0 GGAEMN COc1cc([C@H](C)NCCNS(=O)(=O)c2cc(C)sc2C)ccc1F ZINC000181505397 566145287 /nfs/dbraw/zinc/14/52/87/566145287.db2.gz GVRQTCVJADWVTA-LBPRGKRZSA-N 0 1 386.514 3.142 10 0 GGAEMN Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@@H](c1cccs1)N(C)C ZINC000366278854 566145818 /nfs/dbraw/zinc/14/58/18/566145818.db2.gz JQAAFYUKSFPDOQ-KGLIPLIRSA-N 0 1 379.551 3.440 10 0 GGAEMN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ncsc1Br ZINC000289912081 566146691 /nfs/dbraw/zinc/14/66/91/566146691.db2.gz NKBGPCFBOLJDBX-YPMHNXCESA-N 0 1 380.311 3.156 10 0 GGAEMN C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ncsc1Br ZINC000289912068 566146727 /nfs/dbraw/zinc/14/67/27/566146727.db2.gz NKBGPCFBOLJDBX-AAEUAGOBSA-N 0 1 380.311 3.156 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCCN[C@@H]2CCCOc3ccc(C)cc32)s1 ZINC000181511970 566146850 /nfs/dbraw/zinc/14/68/50/566146850.db2.gz DMQRKCJMJYPXGE-MRXNPFEDSA-N 0 1 380.535 3.147 10 0 GGAEMN CC(C)(C)OC(=O)CCCCN1CCN(c2ccc(Br)cn2)CC1 ZINC000181524542 566147636 /nfs/dbraw/zinc/14/76/36/566147636.db2.gz OLPNSASXROYYJE-UHFFFAOYSA-N 0 1 398.345 3.478 10 0 GGAEMN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1ccc(Br)nc1 ZINC000289953982 566150592 /nfs/dbraw/zinc/15/05/92/566150592.db2.gz WQGADJJXLDLLCI-CZUORRHYSA-N 0 1 376.298 3.194 10 0 GGAEMN Cc1nc2c(s1)[C@@H](N[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)CCC2 ZINC000366477816 566154182 /nfs/dbraw/zinc/15/41/82/566154182.db2.gz OEUQBSSOSQTWCS-WFASDCNBSA-N 0 1 379.551 3.444 10 0 GGAEMN Cc1nccc(CN2CCC(C(=O)Nc3ccccc3Br)CC2)n1 ZINC000366487283 566155329 /nfs/dbraw/zinc/15/53/29/566155329.db2.gz MXPKXIPJYLHZMK-UHFFFAOYSA-N 0 1 389.297 3.398 10 0 GGAEMN CC[C@H]1CN(C(=O)c2cn[nH]c2-c2ccc(Cl)s2)C[C@@]2(CCOC2)O1 ZINC000366520716 566155702 /nfs/dbraw/zinc/15/57/02/566155702.db2.gz KIOSJKHKUMYLQP-APPDUMDISA-N 0 1 381.885 3.202 10 0 GGAEMN Cc1cc(Br)ccc1CC(=O)N1CCC(N2CCO[C@H](C)C2)CC1 ZINC000181671765 566157163 /nfs/dbraw/zinc/15/71/63/566157163.db2.gz KPAFHZIBOHMZKZ-OAHLLOKOSA-N 0 1 395.341 3.012 10 0 GGAEMN COC[C@@H](NCC(=O)N(C)Cc1ccccc1Br)c1ccccc1 ZINC000181697325 566159179 /nfs/dbraw/zinc/15/91/79/566159179.db2.gz HMISKEZECLMPJI-GOSISDBHSA-N 0 1 391.309 3.385 10 0 GGAEMN COC[C@H](NCC(=O)N(C)Cc1cc(Br)cs1)c1ccccc1 ZINC000181695014 566159746 /nfs/dbraw/zinc/15/97/46/566159746.db2.gz UDJUFGZHNWFZOU-INIZCTEOSA-N 0 1 397.338 3.446 10 0 GGAEMN COc1cc(F)c(Br)cc1NC(=O)N[C@@H](C)Cc1cc(C)[nH]n1 ZINC000417593327 566165767 /nfs/dbraw/zinc/16/57/67/566165767.db2.gz ZLKXSTHOIPAIRJ-QMMMGPOBSA-N 0 1 385.237 3.381 10 0 GGAEMN Cn1cc([C@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Br)C(=O)[O-])cn1 ZINC000417596489 566166273 /nfs/dbraw/zinc/16/62/73/566166273.db2.gz QFESMOXGVPWGMZ-LBPRGKRZSA-N 0 1 392.175 3.117 10 0 GGAEMN O=C([O-])[C@@H]1C[N@H+](Cc2nc(-c3ccc(Cl)cc3)no2)C[C@H]1C(F)(F)F ZINC000262964249 566168345 /nfs/dbraw/zinc/16/83/45/566168345.db2.gz KZAGXKBYMXVWIX-GHMZBOCLSA-N 0 1 375.734 3.085 10 0 GGAEMN O=C([O-])[C@@H]1C[N@@H+](Cc2nc(-c3ccc(Cl)cc3)no2)C[C@H]1C(F)(F)F ZINC000262964249 566168353 /nfs/dbraw/zinc/16/83/53/566168353.db2.gz KZAGXKBYMXVWIX-GHMZBOCLSA-N 0 1 375.734 3.085 10 0 GGAEMN O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2[N@H+]1CCC(=O)Nc1ccccc1Br ZINC000263038415 566171239 /nfs/dbraw/zinc/17/12/39/566171239.db2.gz CAACWKFHAWRTPR-WQVCFCJDSA-N 0 1 395.297 3.495 10 0 GGAEMN C[C@@H](CNC(=O)c1sc2ccccc2c1Br)N1CCN(C)CC1 ZINC000290453249 566173189 /nfs/dbraw/zinc/17/31/89/566173189.db2.gz JVVVQQOGMAZEQZ-LBPRGKRZSA-N 0 1 396.354 3.030 10 0 GGAEMN C[C@H](CNC(=O)c1sc2ccccc2c1Br)N1CCN(C)CC1 ZINC000290453237 566173306 /nfs/dbraw/zinc/17/33/06/566173306.db2.gz JVVVQQOGMAZEQZ-GFCCVEGCSA-N 0 1 396.354 3.030 10 0 GGAEMN O=C(NCC1(c2ccccc2Br)CC1)N1C[C@H]2CCC[C@@H](C1)N2 ZINC000417730981 566174459 /nfs/dbraw/zinc/17/44/59/566174459.db2.gz NEBWLXCGILTDOR-OKILXGFUSA-N 0 1 378.314 3.017 10 0 GGAEMN Fc1ccc(CN2CCC[C@@H]3COCC[C@@H]32)c(I)c1 ZINC000417778733 566175104 /nfs/dbraw/zinc/17/51/04/566175104.db2.gz GENWLBXLYRBCHG-DOMZBBRYSA-N 0 1 375.225 3.431 10 0 GGAEMN Fc1ccc(CN2CCC[C@@H]3COCC[C@H]32)c(I)c1 ZINC000417778735 566175112 /nfs/dbraw/zinc/17/51/12/566175112.db2.gz GENWLBXLYRBCHG-IUODEOHRSA-N 0 1 375.225 3.431 10 0 GGAEMN O=C(Nc1cccc(-c2nc[nH]n2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000367094663 566186154 /nfs/dbraw/zinc/18/61/54/566186154.db2.gz ZNPSBMCADIMMIU-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN C[C@H](NC[C@@H]1CCC2(CCOCC2)[C@H]1O)c1ncc(Br)s1 ZINC000367125307 566186851 /nfs/dbraw/zinc/18/68/51/566186851.db2.gz DNULMKWJKNFREZ-GVXVVHGQSA-N 0 1 375.332 3.124 10 0 GGAEMN C[C@H](NC[C@H]1CCC2(CCOCC2)[C@@H]1O)c1ncc(Br)s1 ZINC000367125305 566187168 /nfs/dbraw/zinc/18/71/68/566187168.db2.gz DNULMKWJKNFREZ-DMDPSCGWSA-N 0 1 375.332 3.124 10 0 GGAEMN COC(=O)c1ccc(C[N@H+]2[C@H](C(=O)[O-])C[C@@H]3CCCC[C@@H]32)c(Br)c1 ZINC000263534640 566188414 /nfs/dbraw/zinc/18/84/14/566188414.db2.gz YMZZANZDMXZTON-UVBJJODRSA-N 0 1 396.281 3.453 10 0 GGAEMN C[C@@H](NCc1cnc(N2CCOCC2)c(F)c1)c1ccc(Br)nc1 ZINC000290786848 566188774 /nfs/dbraw/zinc/18/87/74/566188774.db2.gz UJMYTXWHYACBEE-GFCCVEGCSA-N 0 1 395.276 3.066 10 0 GGAEMN COc1cc(Br)c(C[N@H+]2[C@@H]3CCCC[C@@H]3C[C@H]2C(=O)[O-])cc1O ZINC000263521393 566188941 /nfs/dbraw/zinc/18/89/41/566188941.db2.gz RDTHQTSWWNUHHN-HONMWMINSA-N 0 1 384.270 3.381 10 0 GGAEMN C[N@@H+](CC(=O)[O-])[C@H]1CCCN(c2nccc3cc(Br)ccc32)CC1 ZINC000263546587 566190041 /nfs/dbraw/zinc/19/00/41/566190041.db2.gz HLDCYPHAELCZOD-HNNXBMFYSA-N 0 1 392.297 3.373 10 0 GGAEMN C[C@@](CO)(NCc1cc(-c2cccnc2)n[nH]1)c1ccc(Br)cc1 ZINC000367228466 566192205 /nfs/dbraw/zinc/19/22/05/566192205.db2.gz AXVAYNPCWCAJED-SFHVURJKSA-N 0 1 387.281 3.232 10 0 GGAEMN Cn1cc([C@@H]2CCN(Cc3cc4c(cc3Br)OCCCO4)C2)cn1 ZINC000182313521 566196737 /nfs/dbraw/zinc/19/67/37/566196737.db2.gz ZZEITEKCDQKMOT-CYBMUJFWSA-N 0 1 392.297 3.333 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](n2cc(Cl)cn2)C1 ZINC000290934790 566197242 /nfs/dbraw/zinc/19/72/42/566197242.db2.gz LEVYFVOUFOAWMS-NSHDSACASA-N 0 1 394.660 3.263 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@H](C)c3ccc(Br)s3)C2=O)n(C)n1 ZINC000182346040 566198094 /nfs/dbraw/zinc/19/80/94/566198094.db2.gz JPPHHHJZWLVMMF-VXGBXAGGSA-N 0 1 397.342 3.399 10 0 GGAEMN Cc1cc(N2CCC[C@H](N[C@@H](C)c3ccc(Br)s3)C2=O)n(C)n1 ZINC000182345984 566198194 /nfs/dbraw/zinc/19/81/94/566198194.db2.gz JPPHHHJZWLVMMF-RYUDHWBXSA-N 0 1 397.342 3.399 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc(OC)c(OC)c2OC)cc1Cl ZINC000263929796 566201182 /nfs/dbraw/zinc/20/11/82/566201182.db2.gz YCAGIZUEJQHOFI-UHFFFAOYSA-N 0 1 387.841 3.175 10 0 GGAEMN CNS(=O)(=O)c1cccc(CN[C@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000367730093 566213784 /nfs/dbraw/zinc/21/37/84/566213784.db2.gz WJGOBPJWDPOBIC-KRWDZBQOSA-N 0 1 380.897 3.252 10 0 GGAEMN COCCC1(C)CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)C1 ZINC000291301013 566213855 /nfs/dbraw/zinc/21/38/55/566213855.db2.gz SIXJXPWMHSOVGQ-UHFFFAOYSA-N 0 1 378.270 3.338 10 0 GGAEMN CS(=O)(=O)c1ccc([C@@H](O)CN2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000264750128 566223419 /nfs/dbraw/zinc/22/34/19/566223419.db2.gz VFTLUMGSTSRRBY-APWZRJJASA-N 0 1 379.909 3.266 10 0 GGAEMN CC[C@H](O)CN1CCN(CCSc2ccnc3cc(Cl)ccc32)CC1 ZINC000182813965 566225651 /nfs/dbraw/zinc/22/56/51/566225651.db2.gz WNCHPNKGYZNBCL-INIZCTEOSA-N 0 1 379.957 3.369 10 0 GGAEMN Cc1cc(CN2CCC(NS(=O)(=O)c3cccs3)CC2)cc(C)c1O ZINC000291696480 566230821 /nfs/dbraw/zinc/23/08/21/566230821.db2.gz KDKBCQGIPAWEDW-UHFFFAOYSA-N 0 1 380.535 3.013 10 0 GGAEMN Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1CCCc2sc(Cl)cc21 ZINC000291733898 566232425 /nfs/dbraw/zinc/23/24/25/566232425.db2.gz OBTFGGBWXXWVJE-OAHLLOKOSA-N 0 1 380.945 3.447 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000368193050 566233403 /nfs/dbraw/zinc/23/34/03/566233403.db2.gz BBCQCYVXMKAIBP-CMPLNLGQSA-N 0 1 395.276 3.099 10 0 GGAEMN COCCOc1ccc(CNC(=O)CN[C@H](C)c2ccc(Cl)s2)cc1 ZINC000183005702 566234167 /nfs/dbraw/zinc/23/41/67/566234167.db2.gz BHFOCZYAXIBYBO-CYBMUJFWSA-N 0 1 382.913 3.394 10 0 GGAEMN O=C(Nc1ccc(I)cc1)N1CCCC[C@H]1c1nnc[nH]1 ZINC000183059989 566236415 /nfs/dbraw/zinc/23/64/15/566236415.db2.gz JWKNTBIHCYVMRQ-LBPRGKRZSA-N 0 1 397.220 3.168 10 0 GGAEMN Cc1nn(C(C)(C)C)cc1[C@@H](C)NCc1ccc(S(N)(=O)=O)c(Cl)c1 ZINC000419678446 566241228 /nfs/dbraw/zinc/24/12/28/566241228.db2.gz DUNSAPWJQPGWDR-LLVKDONJSA-N 0 1 384.933 3.098 10 0 GGAEMN O=S(=O)(C=Cc1cccc(Br)c1)N[C@@H]1CCCc2cn[nH]c21 ZINC000368562352 566241439 /nfs/dbraw/zinc/24/14/39/566241439.db2.gz GAAPLGQVMIURED-HSBSLETESA-N 0 1 382.283 3.140 10 0 GGAEMN COC(=O)c1cc(CN[C@@H]2CCOc3ccc(Br)cc32)cn1C ZINC000368569169 566242087 /nfs/dbraw/zinc/24/20/87/566242087.db2.gz UVLBTMDGXKMREV-CQSZACIVSA-N 0 1 379.254 3.188 10 0 GGAEMN Cc1nc([C@H]2CCCOC2)sc1C(=O)NC[C@H](c1ccsc1)N(C)C ZINC000368639175 566243367 /nfs/dbraw/zinc/24/33/67/566243367.db2.gz SNQVCYDXZLMKBQ-DZGCQCFKSA-N 0 1 379.551 3.440 10 0 GGAEMN Cn1ccnc1[C@@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000183339249 566244727 /nfs/dbraw/zinc/24/47/27/566244727.db2.gz UWTPNGMGTXDBAI-HNNXBMFYSA-N 0 1 387.285 3.209 10 0 GGAEMN Cn1ccnc1[C@@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000183339249 566244729 /nfs/dbraw/zinc/24/47/29/566244729.db2.gz UWTPNGMGTXDBAI-HNNXBMFYSA-N 0 1 387.285 3.209 10 0 GGAEMN COc1ccc(S(=O)(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)c(Cl)c1Cl ZINC000266195584 566246631 /nfs/dbraw/zinc/24/66/31/566246631.db2.gz NNIAQMSAQXFYKQ-GHMZBOCLSA-N 0 1 381.325 3.105 10 0 GGAEMN COc1ccc(S(=O)(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)c(Cl)c1Cl ZINC000266195589 566246897 /nfs/dbraw/zinc/24/68/97/566246897.db2.gz NNIAQMSAQXFYKQ-MNOVXSKESA-N 0 1 381.325 3.105 10 0 GGAEMN CCCOc1c(Br)cc(C(=O)N2CCN3CCC2CC3)cc1OC ZINC000368958778 566248183 /nfs/dbraw/zinc/24/81/83/566248183.db2.gz OFUONNUIQZTYDO-UHFFFAOYSA-N 0 1 397.313 3.167 10 0 GGAEMN O=C([C@H]1CCCN(CCOc2ccccc2Br)C1)N1CCCC1 ZINC000508915926 566250831 /nfs/dbraw/zinc/25/08/31/566250831.db2.gz VYVROEAPZZGKAR-HNNXBMFYSA-N 0 1 381.314 3.162 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000575114327 566251827 /nfs/dbraw/zinc/25/18/27/566251827.db2.gz FZZOLMWQYXGNKA-JHJVBQTASA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000575114327 566251834 /nfs/dbraw/zinc/25/18/34/566251834.db2.gz FZZOLMWQYXGNKA-JHJVBQTASA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(Cc1cscc1Br)NCCN1CCc2ccccc2C1 ZINC000575128839 566253040 /nfs/dbraw/zinc/25/30/40/566253040.db2.gz VGCYUVKSOZIZNK-UHFFFAOYSA-N 0 1 379.323 3.228 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCOC[C@@H]1CC1CCC1 ZINC000575156485 566254097 /nfs/dbraw/zinc/25/40/97/566254097.db2.gz WSLVEEBXGPGZHT-ZDUSSCGKSA-N 0 1 378.270 3.357 10 0 GGAEMN CN(Cc1cc(Br)ccc1F)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000575172623 566256171 /nfs/dbraw/zinc/25/61/71/566256171.db2.gz SWADFNIPKPIVIC-LBPRGKRZSA-N 0 1 381.249 3.010 10 0 GGAEMN CNC(=O)C[C@@H](NCc1cc(Br)c(O)c(OC)c1)c1ccccc1 ZINC000481826905 566256196 /nfs/dbraw/zinc/25/61/96/566256196.db2.gz WPPYKVDAIMTDDH-OAHLLOKOSA-N 0 1 393.281 3.130 10 0 GGAEMN CNC(=O)C[C@@H](NCc1ccc(OC)c(Br)c1)c1ccccc1 ZINC000481835453 566256215 /nfs/dbraw/zinc/25/62/15/566256215.db2.gz ZZZDGWSYMLTTHG-MRXNPFEDSA-N 0 1 377.282 3.425 10 0 GGAEMN CN(C)C(=O)N(C)[C@@H]1CCN(Cc2cc3cc(Br)ccc3o2)C1 ZINC000668689254 566256253 /nfs/dbraw/zinc/25/62/53/566256253.db2.gz VFRNFXGIQRCHOR-CQSZACIVSA-N 0 1 380.286 3.383 10 0 GGAEMN CN(C(=O)c1cc2c(cncc2Br)s1)[C@H]1CCN(C2CC2)C1 ZINC000648285024 566256766 /nfs/dbraw/zinc/25/67/66/566256766.db2.gz YHMCPNISFLIUPS-NSHDSACASA-N 0 1 380.311 3.368 10 0 GGAEMN Cc1ccc(S(=O)(=O)Nc2ncc(Br)cc2Br)o1 ZINC000509233220 566280679 /nfs/dbraw/zinc/28/06/79/566280679.db2.gz ANVOYYVHBPWKFL-UHFFFAOYSA-N 0 1 396.060 3.309 10 0 GGAEMN CCc1cc(C)cc(CC)c1NS(=O)(=O)c1ccccc1S(C)(=O)=O ZINC000481873541 566259631 /nfs/dbraw/zinc/25/96/31/566259631.db2.gz WIKSVJFUARIJDI-UHFFFAOYSA-N 0 1 381.519 3.324 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(CC)Cc1cc(Br)ccc1F ZINC000575220593 566261440 /nfs/dbraw/zinc/26/14/40/566261440.db2.gz NPHPLIVRDWSDCE-UHFFFAOYSA-N 0 1 395.338 3.082 10 0 GGAEMN O=S(=O)(NCc1cnn(-c2ccccc2)c1)c1c(Cl)ccc(F)c1F ZINC000555947207 566263448 /nfs/dbraw/zinc/26/34/48/566263448.db2.gz HYTFGJFQYMADFV-UHFFFAOYSA-N 0 1 383.807 3.282 10 0 GGAEMN COC(=O)[C@@H]1CN(Cc2ccncc2Br)C[C@@H]1c1ccccc1 ZINC000599437581 566265655 /nfs/dbraw/zinc/26/56/55/566265655.db2.gz PGXHQPFLSHWRBN-HZPDHXFCSA-N 0 1 375.266 3.233 10 0 GGAEMN Cc1ccc(I)cc1NC(=O)NCCN1CC=C(C)CC1 ZINC000481947077 566267790 /nfs/dbraw/zinc/26/77/90/566267790.db2.gz MBIGUDFDYYIHOW-UHFFFAOYSA-N 0 1 399.276 3.373 10 0 GGAEMN Cc1c(Br)cncc1C(=O)NCc1ccc(F)c(CN(C)C)c1 ZINC000668799230 566269727 /nfs/dbraw/zinc/26/97/27/566269727.db2.gz VIFWEOQEFCKPFU-UHFFFAOYSA-N 0 1 380.261 3.283 10 0 GGAEMN CN(Cc1cc(C(F)(F)F)ccc1Br)C1(CO)CCOCC1 ZINC000668803894 566269776 /nfs/dbraw/zinc/26/97/76/566269776.db2.gz AZTJHEVIPSQFLE-UHFFFAOYSA-N 0 1 382.220 3.441 10 0 GGAEMN O=C(NCCCc1ccc(Br)cc1F)[C@H]1CCc2[nH]cnc2C1 ZINC000668838873 566271068 /nfs/dbraw/zinc/27/10/68/566271068.db2.gz WXBLXUAOIICKBQ-LBPRGKRZSA-N 0 1 380.261 3.165 10 0 GGAEMN CC(C)[C@H](NCC(F)(F)F)C(=O)Nc1nc(-c2ccccc2Cl)n[nH]1 ZINC000668843237 566271457 /nfs/dbraw/zinc/27/14/57/566271457.db2.gz YBNVFQSPLFOGHT-NSHDSACASA-N 0 1 375.782 3.240 10 0 GGAEMN CN(Cc1ccco1)Cc1ccccc1CNc1ncncc1Br ZINC000481976805 566272376 /nfs/dbraw/zinc/27/23/76/566272376.db2.gz BPLFBQGGXXVEFD-UHFFFAOYSA-N 0 1 387.281 3.498 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)Nc2cc(I)ccc2C)n[nH]1 ZINC000481981048 566272454 /nfs/dbraw/zinc/27/24/54/566272454.db2.gz NJRLZMNRNONZFZ-JTQLQIEISA-N 0 1 398.248 3.384 10 0 GGAEMN Cc1n[nH]c(C(=O)NCc2ccc(Cl)cc2I)c1C ZINC000445216526 566273486 /nfs/dbraw/zinc/27/34/86/566273486.db2.gz FGIGSBPFFZXWRS-UHFFFAOYSA-N 0 1 389.624 3.215 10 0 GGAEMN Cc1c(Cl)cccc1S(=O)(=O)NCC1(N(C)C)Cc2ccccc2C1 ZINC000462317643 566281353 /nfs/dbraw/zinc/28/13/53/566281353.db2.gz CMBYAQOAEZHSNR-UHFFFAOYSA-N 0 1 378.925 3.026 10 0 GGAEMN NC(=O)NC(=O)CCCN1CCC[C@@H]1c1ccc(Br)cc1Cl ZINC000599637865 566282346 /nfs/dbraw/zinc/28/23/46/566282346.db2.gz WJHJLQBZUACGBK-CYBMUJFWSA-N 0 1 388.693 3.215 10 0 GGAEMN Cc1cc(S(=O)(=O)NCC2(N3CCSCC3)CCCCC2)c(C)s1 ZINC000482086606 566283702 /nfs/dbraw/zinc/28/37/02/566283702.db2.gz YBXXRYXKADAYRG-UHFFFAOYSA-N 0 1 388.624 3.395 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2cnc(C3CCCC3)s2)Oc2ccccc21 ZINC000575802850 566287320 /nfs/dbraw/zinc/28/73/20/566287320.db2.gz WNTTWFJCIIHCRX-CQSZACIVSA-N 0 1 378.519 3.125 10 0 GGAEMN CCCc1ccc(Cl)c(S(=O)(=O)Nc2ccc3c(c2)OCC(=O)N3)c1 ZINC000556347380 566288853 /nfs/dbraw/zinc/28/88/53/566288853.db2.gz WNWQOPQJYJHIFW-UHFFFAOYSA-N 0 1 380.853 3.424 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)CN(C)[C@H]2CCSC2)CC1 ZINC000648462871 566288973 /nfs/dbraw/zinc/28/89/73/566288973.db2.gz JDEGMIRRAJRVGI-ZDUSSCGKSA-N 0 1 399.354 3.000 10 0 GGAEMN C[C@H](NC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ncc(Br)cn1 ZINC000575851658 566292445 /nfs/dbraw/zinc/29/24/45/566292445.db2.gz HNZJJLVJAQXYDE-KBPBESRZSA-N 0 1 389.297 3.052 10 0 GGAEMN CCN([C@@H]1CCN([C@@H](C)c2ccccc2)C1)S(=O)(=O)CCC(F)(F)F ZINC000556378244 566293580 /nfs/dbraw/zinc/29/35/80/566293580.db2.gz KVCNGULTNOWLKL-GOEBONIOSA-N 0 1 378.460 3.426 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](C)c1nc2cc(Cl)c(Cl)cc2[nH]1 ZINC000625241203 566294884 /nfs/dbraw/zinc/29/48/84/566294884.db2.gz BGCDBQADQQKBKJ-JTQLQIEISA-N 0 1 393.340 3.192 10 0 GGAEMN C[C@@H]1C[C@H](N(C)S(=O)(=O)c2cc(Cl)ccc2OC(F)F)CCN1C ZINC000420674961 566296814 /nfs/dbraw/zinc/29/68/14/566296814.db2.gz NYXXLSUPLHZLDC-ZYHUDNBSSA-N 0 1 382.860 3.045 10 0 GGAEMN COC(=O)c1cc(NC(=O)[C@H]2CCc3[nH]cnc3C2)c(C)cc1Br ZINC000599941417 566306066 /nfs/dbraw/zinc/30/60/66/566306066.db2.gz VEYAJUYMPDEDIA-JTQLQIEISA-N 0 1 392.253 3.011 10 0 GGAEMN CS[C@@H]1CN(S(=O)(=O)c2ccc(C(C)(C)C)s2)C[C@H]1N1CCCC1 ZINC000445715674 566306495 /nfs/dbraw/zinc/30/64/95/566306495.db2.gz HMVGCJXRMLJZFB-ZIAGYGMSSA-N 0 1 388.624 3.246 10 0 GGAEMN O=C1Nc2ccc(Br)cc2CC[C@@H]1N[C@H](CO)c1ccsc1 ZINC000625328367 566307272 /nfs/dbraw/zinc/30/72/72/566307272.db2.gz NIOSUCONYNSJPK-LSDHHAIUSA-N 0 1 381.295 3.087 10 0 GGAEMN C[C@@H]1C[C@@H](CN(C)Cc2cn(-c3cccc(Br)c3)nn2)CCO1 ZINC000482435352 566307634 /nfs/dbraw/zinc/30/76/34/566307634.db2.gz HPWBWJBINJLMRV-KGLIPLIRSA-N 0 1 379.302 3.277 10 0 GGAEMN Cc1ccc(Cl)c(S(=O)(=O)N[C@@H](c2nnc[nH]2)c2ccccc2)c1Cl ZINC000445729384 566307930 /nfs/dbraw/zinc/30/79/30/566307930.db2.gz ATSPLNBEGJKXEE-CQSZACIVSA-N 0 1 397.287 3.488 10 0 GGAEMN C[C@H]1C[C@@H](CN(C)Cc2cn(-c3cccc(Br)c3)nn2)CCO1 ZINC000482435351 566307994 /nfs/dbraw/zinc/30/79/94/566307994.db2.gz HPWBWJBINJLMRV-KBPBESRZSA-N 0 1 379.302 3.277 10 0 GGAEMN Cc1ccc(Cl)c(S(=O)(=O)N[C@H](c2nnc[nH]2)c2ccccc2)c1Cl ZINC000445729383 566308355 /nfs/dbraw/zinc/30/83/55/566308355.db2.gz ATSPLNBEGJKXEE-AWEZNQCLSA-N 0 1 397.287 3.488 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)cc(Cl)c1)N[C@H](c1nnc[nH]1)c1ccccc1 ZINC000445757497 566310323 /nfs/dbraw/zinc/31/03/23/566310323.db2.gz NPMRZPSHTZQERA-HNNXBMFYSA-N 0 1 397.287 3.321 10 0 GGAEMN CCO[C@H](CN(CCNC(C)=O)Cc1ccc(Br)s1)C1CC1 ZINC000625398939 566316080 /nfs/dbraw/zinc/31/60/80/566316080.db2.gz XKJZJCFJEAOPTG-OAHLLOKOSA-N 0 1 389.359 3.264 10 0 GGAEMN C[C@H]1C[C@@H](NC(=O)c2cc3c(cncc3Br)s2)CN1C1CC1 ZINC000648819018 566317850 /nfs/dbraw/zinc/31/78/50/566317850.db2.gz UGSFIRKLBUWWGW-VHSXEESVSA-N 0 1 380.311 3.414 10 0 GGAEMN COC(=O)CC1(NCc2ccc(C(=O)OC)cc2Br)CCCC1 ZINC000556616863 566318621 /nfs/dbraw/zinc/31/86/21/566318621.db2.gz HNWNPHJLYBQSJI-UHFFFAOYSA-N 0 1 384.270 3.201 10 0 GGAEMN Cc1c[nH]c(CN2CC[C@H](Cc3cccc(I)c3)C2)n1 ZINC000600161978 566319043 /nfs/dbraw/zinc/31/90/43/566319043.db2.gz OAYCQUNWCRQJSA-CQSZACIVSA-N 0 1 381.261 3.387 10 0 GGAEMN CCN1CCN(c2ccc(Cl)cc2NC(=O)N2CCCSCC2)CC1 ZINC000509601505 566319254 /nfs/dbraw/zinc/31/92/54/566319254.db2.gz PERHKJOQLSEQEM-UHFFFAOYSA-N 0 1 382.961 3.453 10 0 GGAEMN CCc1nc([C@@H](C)NC(=O)c2cc3c(cncc3Br)s2)n[nH]1 ZINC000648844355 566320464 /nfs/dbraw/zinc/32/04/64/566320464.db2.gz AWLUQODKAUQPNT-SSDOTTSWSA-N 0 1 380.271 3.230 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)c2cc3c(cncc3Br)s2)n[nH]1 ZINC000648844356 566320948 /nfs/dbraw/zinc/32/09/48/566320948.db2.gz AWLUQODKAUQPNT-ZETCQYMHSA-N 0 1 380.271 3.230 10 0 GGAEMN CCN(C(=O)N=c1ncn(C)[nH]1)[C@H]1CCSc2ccc(Br)cc21 ZINC000556662669 566321556 /nfs/dbraw/zinc/32/15/56/566321556.db2.gz UOMXXQRIXMCLCN-LBPRGKRZSA-N 0 1 396.314 3.090 10 0 GGAEMN CCN(C(=O)N=c1ncn(C)[nH]1)[C@@H]1CCSc2ccc(Br)cc21 ZINC000556662668 566321568 /nfs/dbraw/zinc/32/15/68/566321568.db2.gz UOMXXQRIXMCLCN-GFCCVEGCSA-N 0 1 396.314 3.090 10 0 GGAEMN CC(C)[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)c1ccnn1C ZINC000669721336 566323683 /nfs/dbraw/zinc/32/36/83/566323683.db2.gz MTBZUCGHOZPZTG-CYBMUJFWSA-N 0 1 390.285 3.229 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CC(C2CCOCC2)C1 ZINC000669736590 566323958 /nfs/dbraw/zinc/32/39/58/566323958.db2.gz VSXQGPWYMZPCIK-UHFFFAOYSA-N 0 1 390.281 3.338 10 0 GGAEMN O=C(N[C@@H]1CCc2cc(O)ccc2C1)c1cc(Br)cc2nc[nH]c21 ZINC000669722251 566324207 /nfs/dbraw/zinc/32/42/07/566324207.db2.gz LHVQRIQLNYAMSR-CYBMUJFWSA-N 0 1 386.249 3.318 10 0 GGAEMN O=C(N[C@@H]1COc2cc(F)cc(F)c21)c1cc(Br)cc2nc[nH]c21 ZINC000669717285 566324654 /nfs/dbraw/zinc/32/46/54/566324654.db2.gz HKBFARZVNJNWEI-GFCCVEGCSA-N 0 1 394.175 3.467 10 0 GGAEMN O=C(NCCC[C@H]1CCCC[C@@H]1O)c1cc(Br)cc2nc[nH]c21 ZINC000669711750 566324800 /nfs/dbraw/zinc/32/48/00/566324800.db2.gz OHJIUGQVUDZEFY-ABAIWWIYSA-N 0 1 380.286 3.387 10 0 GGAEMN CN(CC(=O)Nc1ccc(Cl)c(F)c1)C1CCN(CC(F)(F)F)CC1 ZINC000625465078 566327537 /nfs/dbraw/zinc/32/75/37/566327537.db2.gz ZSPXTIMVYBYWAH-UHFFFAOYSA-N 0 1 381.801 3.376 10 0 GGAEMN CCCN1CCC[C@H]1C(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000482732958 566329742 /nfs/dbraw/zinc/32/97/42/566329742.db2.gz CRTVSKBPLPFNCH-HOTGVXAUSA-N 0 1 384.307 3.089 10 0 GGAEMN OC1([C@@H]2CCCCN2Cc2cc3c(cc2Br)OCCCO3)CC1 ZINC000556780443 566330720 /nfs/dbraw/zinc/33/07/20/566330720.db2.gz QEDNTPFGGHESDU-KRWDZBQOSA-N 0 1 382.298 3.490 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)c2cc3c(cncc3Br)s2)n[nH]1 ZINC000648927801 566331035 /nfs/dbraw/zinc/33/10/35/566331035.db2.gz JCJPQBDULFTGOD-UHFFFAOYSA-N 0 1 394.298 3.404 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)[C@H]1CCCc2[nH]ncc21 ZINC000482780740 566333093 /nfs/dbraw/zinc/33/30/93/566333093.db2.gz ZPFRWJLFOPEVGV-LBPRGKRZSA-N 0 1 394.269 3.256 10 0 GGAEMN Cc1ccc(C(=O)N2CCC[C@H](CN3CCOCC3)C2)c(C)c1Br ZINC000669859852 566333153 /nfs/dbraw/zinc/33/31/53/566333153.db2.gz OOVCLUXENTUSCT-MRXNPFEDSA-N 0 1 395.341 3.250 10 0 GGAEMN O=C(NC[C@@H](CO)C1CCCCC1)c1cc(Br)cc2nc[nH]c21 ZINC000509733227 566333381 /nfs/dbraw/zinc/33/33/81/566333381.db2.gz AAQZSTNXLJUTID-LBPRGKRZSA-N 0 1 380.286 3.244 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1ccc2scc(Br)c2c1 ZINC000648964423 566335770 /nfs/dbraw/zinc/33/57/70/566335770.db2.gz RHSPBRAOILZEFV-UHFFFAOYSA-N 0 1 392.282 3.376 10 0 GGAEMN COCCOc1ccc(Br)cc1NC(=O)CN1[C@H](C)CC[C@H]1C ZINC000482850460 566337758 /nfs/dbraw/zinc/33/77/58/566337758.db2.gz NZYDRHVFAGFMOX-CHWSQXEVSA-N 0 1 385.302 3.286 10 0 GGAEMN O=C(NC1(c2nn[nH]n2)CCCC1)c1cccc2cccc(Br)c21 ZINC000556843081 566337887 /nfs/dbraw/zinc/33/78/87/566337887.db2.gz MJFJBSJFCIYKIE-UHFFFAOYSA-N 0 1 386.253 3.315 10 0 GGAEMN COC(=O)c1coc(C(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)c1 ZINC000600474083 566340439 /nfs/dbraw/zinc/34/04/39/566340439.db2.gz WTARINMABZMHJB-CQSZACIVSA-N 0 1 385.247 3.406 10 0 GGAEMN COC(=O)CCCCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600473955 566340691 /nfs/dbraw/zinc/34/06/91/566340691.db2.gz VKPNMQIYTWNUPG-OAHLLOKOSA-N 0 1 375.296 3.446 10 0 GGAEMN COC(=O)C[C@H](C)CC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000600472274 566340772 /nfs/dbraw/zinc/34/07/72/566340772.db2.gz NQQRFMIBQLXSCT-IAQYHMDHSA-N 0 1 375.296 3.302 10 0 GGAEMN O=C(CSCC(=O)c1ccc(Cl)cc1)NC[C@@H]1CCN1C1CCCC1 ZINC000600472693 566340814 /nfs/dbraw/zinc/34/08/14/566340814.db2.gz OJBQUDSWMHSHTA-KRWDZBQOSA-N 0 1 380.941 3.389 10 0 GGAEMN O=C([C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)N1CCN(C2CCC2)CC1 ZINC000625597291 566341336 /nfs/dbraw/zinc/34/13/36/566341336.db2.gz WRUWXLBSAGFZDZ-CGTJXYLNSA-N 0 1 375.310 3.032 10 0 GGAEMN C[C@H](NCc1cnc(N2CCOCC2)c(F)c1)c1cncc(Br)c1 ZINC000576410417 566343806 /nfs/dbraw/zinc/34/38/06/566343806.db2.gz JYNUALHBXWSTHB-LBPRGKRZSA-N 0 1 395.276 3.066 10 0 GGAEMN C[C@H](NC[C@H]1CCCCN1S(C)(=O)=O)c1cc(Br)ccc1F ZINC000556921339 566345118 /nfs/dbraw/zinc/34/51/18/566345118.db2.gz OEGRGWBIBLDXAW-WCQYABFASA-N 0 1 393.322 3.053 10 0 GGAEMN C[C@@H](NC(=O)c1cc(Oc2cccc(Br)c2)ccn1)c1nnc[nH]1 ZINC000482969420 566346090 /nfs/dbraw/zinc/34/60/90/566346090.db2.gz BQAIVTKIAFBOSP-SNVBAGLBSA-N 0 1 388.225 3.246 10 0 GGAEMN CNS(=O)(=O)CCCN(C)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000482973688 566347917 /nfs/dbraw/zinc/34/79/17/566347917.db2.gz DXQGRXPMJOZRMA-GOSISDBHSA-N 0 1 384.904 3.440 10 0 GGAEMN CN(C)[C@@H](CNC(=O)NC[C@H]1CSc2ccccc2O1)c1cccs1 ZINC000576460798 566348605 /nfs/dbraw/zinc/34/86/05/566348605.db2.gz FBOZMFLDWFPMNC-KBPBESRZSA-N 0 1 377.535 3.203 10 0 GGAEMN CN(C)[C@H](CNC(=O)NC[C@H]1CSc2ccccc2O1)c1cccs1 ZINC000576460803 566348668 /nfs/dbraw/zinc/34/86/68/566348668.db2.gz FBOZMFLDWFPMNC-UONOGXRCSA-N 0 1 377.535 3.203 10 0 GGAEMN CCCCN(C(=O)CCSc1nnc(C)[nH]1)[C@@H]1CCc2ncsc2C1 ZINC000649161794 566348784 /nfs/dbraw/zinc/34/87/84/566348784.db2.gz HCCNUFGGCGRHAJ-CYBMUJFWSA-N 0 1 379.555 3.238 10 0 GGAEMN CCn1c(-c2ccccc2Br)nnc1N1CCN(CC)[C@H](C)C1 ZINC000670110893 566349933 /nfs/dbraw/zinc/34/99/33/566349933.db2.gz RAAGBZMXLISCAN-CYBMUJFWSA-N 0 1 378.318 3.258 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN1CC[C@@](F)(CO)C1 ZINC000670111265 566350096 /nfs/dbraw/zinc/35/00/96/566350096.db2.gz JUTWWULOPPLILP-KRWDZBQOSA-N 0 1 387.293 3.191 10 0 GGAEMN COC(=O)[C@H](N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1)c1cccnc1 ZINC000600615484 566350578 /nfs/dbraw/zinc/35/05/78/566350578.db2.gz WFIRMLDHKZKNTJ-DLBZAZTESA-N 0 1 382.291 3.495 10 0 GGAEMN C[C@H]1CCCCN1CCNS(=O)(=O)c1c(Cl)cccc1Br ZINC000509943589 566350712 /nfs/dbraw/zinc/35/07/12/566350712.db2.gz MWWDRHZPCWWPIB-NSHDSACASA-N 0 1 395.750 3.255 10 0 GGAEMN CNS(=O)(=O)C1CCN(C/C(C)=C/c2cccc(C(F)(F)F)c2)CC1 ZINC000576487226 566352078 /nfs/dbraw/zinc/35/20/78/566352078.db2.gz BRXJPKFMXBWNCD-JLHYYAGUSA-N 0 1 376.444 3.122 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)N(CCO)Cc1ccc(Br)s1 ZINC000483008196 566352402 /nfs/dbraw/zinc/35/24/02/566352402.db2.gz RCNZLILUKAOBEM-UHFFFAOYSA-N 0 1 386.315 3.300 10 0 GGAEMN O=C(NCc1ccc(Br)s1)N[C@@H](c1nnc[nH]1)c1ccccc1 ZINC000446499625 566352812 /nfs/dbraw/zinc/35/28/12/566352812.db2.gz YMMHLETUAYOVJI-CYBMUJFWSA-N 0 1 392.282 3.218 10 0 GGAEMN O=C(c1csc(=NC2CC2)[nH]1)N1CCO[C@@H](c2c(F)cccc2Cl)C1 ZINC000649204321 566353253 /nfs/dbraw/zinc/35/32/53/566353253.db2.gz BTFSJWOYCRKRSB-CQSZACIVSA-N 0 1 381.860 3.146 10 0 GGAEMN CC1(C)Oc2ccsc2[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)[C@@H]1O ZINC000576518154 566353785 /nfs/dbraw/zinc/35/37/85/566353785.db2.gz VDFSBRQLQFJHHZ-MJEQTWJJSA-N 0 1 383.897 3.004 10 0 GGAEMN O[C@H](COc1c(Cl)cccc1Cl)CN1CCC[C@@H]1[C@H](O)C(F)(F)F ZINC000600652146 566354330 /nfs/dbraw/zinc/35/43/30/566354330.db2.gz YUSZJEQNBVJIQV-BHYNMZESSA-N 0 1 388.213 3.121 10 0 GGAEMN O[C@H]([C@H]1CCCN1C[C@H](O)COc1c(Cl)cccc1Cl)C(F)(F)F ZINC000600652148 566354377 /nfs/dbraw/zinc/35/43/77/566354377.db2.gz YUSZJEQNBVJIQV-MRCXROJRSA-N 0 1 388.213 3.121 10 0 GGAEMN COC(=O)c1c(Cl)ccc(NS(=O)(=O)c2c[nH]c(C(C)C)n2)c1Cl ZINC000600662241 566355154 /nfs/dbraw/zinc/35/51/54/566355154.db2.gz HXPGYLSSWHCBAP-UHFFFAOYSA-N 0 1 392.264 3.427 10 0 GGAEMN CCn1c(CNC(=O)CN2CCC(C)CC2)nc2cc(Br)ccc21 ZINC000483057153 566355652 /nfs/dbraw/zinc/35/56/52/566355652.db2.gz GNCWSLJMATZCOG-UHFFFAOYSA-N 0 1 393.329 3.167 10 0 GGAEMN CCn1c(CNC(=O)[C@@H]2CCCCN2CC)nc2cc(Br)ccc21 ZINC000483053011 566355899 /nfs/dbraw/zinc/35/58/99/566355899.db2.gz VEFHDTVKQWRNAG-INIZCTEOSA-N 0 1 393.329 3.309 10 0 GGAEMN CCn1c(CNC(=O)c2[nH]nc(C)c2C)nc2cc(Br)ccc21 ZINC000483063044 566357283 /nfs/dbraw/zinc/35/72/83/566357283.db2.gz XCXDIHPJXJRJCD-UHFFFAOYSA-N 0 1 376.258 3.089 10 0 GGAEMN CN1CC[C@H](NS(=O)(=O)CCc2cccc(Cl)c2)[C@@H]1c1ccccc1 ZINC000510021036 566357694 /nfs/dbraw/zinc/35/76/94/566357694.db2.gz PRJCGARHEDZFJC-OALUTQOASA-N 0 1 378.925 3.247 10 0 GGAEMN COc1cc(Br)ccc1[C@H]1CCCN1CCCN1CCOCC1 ZINC000625795083 566358633 /nfs/dbraw/zinc/35/86/33/566358633.db2.gz QMTNVBULUHNLRB-QGZVFWFLSA-N 0 1 383.330 3.317 10 0 GGAEMN OC[C@]1(NCc2noc3c2CCCC3)CCc2cc(Br)ccc2C1 ZINC000625795456 566358867 /nfs/dbraw/zinc/35/88/67/566358867.db2.gz WIGUEVUIJPSNMP-IBGZPJMESA-N 0 1 391.309 3.326 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2ccc(SC)cc2OC)c(C)c1 ZINC000446621366 566358982 /nfs/dbraw/zinc/35/89/82/566358982.db2.gz ADTBMJJSZKKZDW-UHFFFAOYSA-N 0 1 381.475 3.313 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2ccc(I)cc2)[C@H]2CCC[C@H]21 ZINC000600675507 566359278 /nfs/dbraw/zinc/35/92/78/566359278.db2.gz PUXYYVWHDVSTPJ-ZNMIVQPWSA-N 0 1 385.245 3.366 10 0 GGAEMN CCn1cc(Br)cc1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000536264822 566361858 /nfs/dbraw/zinc/36/18/58/566361858.db2.gz QJKLVAIUMPBMPH-DOTOQJQBSA-N 0 1 376.298 3.446 10 0 GGAEMN Cc1ccc2nc(CNC[C@H](O)COc3c(Cl)cccc3Cl)cn2c1 ZINC000576627673 566364367 /nfs/dbraw/zinc/36/43/67/566364367.db2.gz AYSPZAQWOCJUCJ-AWEZNQCLSA-N 0 1 380.275 3.479 10 0 GGAEMN Cc1ccc(CN(CCO)CCC(=O)Nc2ccc(Br)cc2F)o1 ZINC000483198452 566364639 /nfs/dbraw/zinc/36/46/39/566364639.db2.gz MNAQWBVELYEPKI-UHFFFAOYSA-N 0 1 399.260 3.313 10 0 GGAEMN Cc1c(Cl)c(CNC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)nn1C ZINC000421337883 566366485 /nfs/dbraw/zinc/36/64/85/566366485.db2.gz CPYXGBNSQGWCLS-CYBMUJFWSA-N 0 1 375.822 3.342 10 0 GGAEMN C[C@@H]1OCC[C@@H]1N(CCO)Cc1cc(Br)ccc1OC(F)F ZINC000483269252 566369633 /nfs/dbraw/zinc/36/96/33/566369633.db2.gz RHCPCFKSLDWXRF-GWCFXTLKSA-N 0 1 380.229 3.022 10 0 GGAEMN C[C@H]1OCC[C@@H]1N(CCO)Cc1cc(Br)ccc1OC(F)F ZINC000483269258 566369752 /nfs/dbraw/zinc/36/97/52/566369752.db2.gz RHCPCFKSLDWXRF-MFKMUULPSA-N 0 1 380.229 3.022 10 0 GGAEMN Cc1c(Cl)c(CNC[C@@H](CO)Cc2cccc(Br)c2)nn1C ZINC000421402685 566370451 /nfs/dbraw/zinc/37/04/51/566370451.db2.gz WFLOSCVKZOTTCR-ZDUSSCGKSA-N 0 1 386.721 3.085 10 0 GGAEMN CC[C@H](c1ccc(Br)cc1)N1CCC(CNS(C)(=O)=O)CC1 ZINC000510265423 566373015 /nfs/dbraw/zinc/37/30/15/566373015.db2.gz FBFMUXKBFSPKLC-MRXNPFEDSA-N 0 1 389.359 3.161 10 0 GGAEMN O=C(CNC(=O)c1ccsc1)Nc1cc(Br)cc(Cl)c1O ZINC000536460344 566374012 /nfs/dbraw/zinc/37/40/12/566374012.db2.gz NXYYPPMMUGISDN-UHFFFAOYSA-N 0 1 389.658 3.238 10 0 GGAEMN Cc1cc(Br)ccc1[C@H]1CCCN1CCCS(=O)(=O)N(C)C ZINC000626009223 566375154 /nfs/dbraw/zinc/37/51/54/566375154.db2.gz BKZPWRHSGSETBH-MRXNPFEDSA-N 0 1 389.359 3.176 10 0 GGAEMN COC[C@H](C)OC[C@@H](O)CN1CCC[C@@H]1c1ccc(Br)cc1C ZINC000626010039 566376079 /nfs/dbraw/zinc/37/60/79/566376079.db2.gz CLNQOVOETNTDED-QILLFSRXSA-N 0 1 386.330 3.307 10 0 GGAEMN C[C@H](CNC(=O)c1nscc1Br)N1CCc2ccccc2C1 ZINC000649598741 566376433 /nfs/dbraw/zinc/37/64/33/566376433.db2.gz VKPRKECDMJWODM-LLVKDONJSA-N 0 1 380.311 3.082 10 0 GGAEMN CCS(=O)(=O)NCCCN1CCC[C@H]1c1ccc(Br)cc1C ZINC000626010619 566376752 /nfs/dbraw/zinc/37/67/52/566376752.db2.gz YRBOEFGTZYQUIX-INIZCTEOSA-N 0 1 389.359 3.224 10 0 GGAEMN CC1(C)[C@@H](C(F)(F)F)CCN1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649592102 566376915 /nfs/dbraw/zinc/37/69/15/566376915.db2.gz UQLPTZSZYSQHEZ-HNNXBMFYSA-N 0 1 376.444 3.290 10 0 GGAEMN CC[C@@H](CNC(=O)c1nscc1Br)N1CCc2ccccc2C1 ZINC000649602257 566377089 /nfs/dbraw/zinc/37/70/89/566377089.db2.gz USEKLMLXARBLCJ-AWEZNQCLSA-N 0 1 394.338 3.472 10 0 GGAEMN Cc1cc(NC(=O)CN2C[C@H](c3ccc(Br)cc3)C[C@H]2C)n(C)n1 ZINC000626039888 566377916 /nfs/dbraw/zinc/37/79/16/566377916.db2.gz RGWMKINTFLPHOD-UKRRQHHQSA-N 0 1 391.313 3.308 10 0 GGAEMN COC[C@@H](NS(=O)(=O)c1c(Cl)cccc1Br)c1ccco1 ZINC000510356788 566378468 /nfs/dbraw/zinc/37/84/68/566378468.db2.gz VAZKZXRKCKBKEJ-LLVKDONJSA-N 0 1 394.674 3.362 10 0 GGAEMN Cc1cc(NC(=O)CN2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)n(C)n1 ZINC000626039889 566378929 /nfs/dbraw/zinc/37/89/29/566378929.db2.gz RGWMKINTFLPHOD-ZFWWWQNUSA-N 0 1 391.313 3.308 10 0 GGAEMN O=C(c1cc(-c2ccoc2)[nH]n1)N(CCO)Cc1ccc(Br)s1 ZINC000576802665 566379623 /nfs/dbraw/zinc/37/96/23/566379623.db2.gz DAEZELDRMKOMLI-UHFFFAOYSA-N 0 1 396.266 3.128 10 0 GGAEMN C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2nscc2Br)C1 ZINC000649640999 566380501 /nfs/dbraw/zinc/38/05/01/566380501.db2.gz XHMVHBWXWQAEMS-DGCLKSJQSA-N 0 1 380.311 3.471 10 0 GGAEMN CC[C@H](C)N[C@@H](CNS(=O)(=O)c1ccc2ncsc2c1)c1ccco1 ZINC000510415647 566381872 /nfs/dbraw/zinc/38/18/72/566381872.db2.gz RAZYVVDNZKQIQE-WFASDCNBSA-N 0 1 379.507 3.297 10 0 GGAEMN CNC(=O)C[C@@H](NCc1nc2ccc(Br)cc2[nH]1)c1ccccc1 ZINC000483416947 566383048 /nfs/dbraw/zinc/38/30/48/566383048.db2.gz XGIYUQCBZGVERC-OAHLLOKOSA-N 0 1 387.281 3.292 10 0 GGAEMN C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CCC(C2(O)CC2)CC1 ZINC000649674684 566383563 /nfs/dbraw/zinc/38/35/63/566383563.db2.gz ZYNSZWUQEDMKCB-CQSZACIVSA-N 0 1 395.341 3.033 10 0 GGAEMN OCCCN(Cc1nc2ccc(Br)cc2[nH]1)Cc1ccccn1 ZINC000557444140 566387925 /nfs/dbraw/zinc/38/79/25/566387925.db2.gz BBPIIHRNDHETPM-UHFFFAOYSA-N 0 1 375.270 3.105 10 0 GGAEMN Brc1ccc2nc(CN3CCC(Cn4cnnc4)CC3)oc2c1 ZINC000649784776 566392534 /nfs/dbraw/zinc/39/25/34/566392534.db2.gz IZFVVWMSUOJSSJ-UHFFFAOYSA-N 0 1 376.258 3.094 10 0 GGAEMN CCCN(CC1CC1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000463225792 566393371 /nfs/dbraw/zinc/39/33/71/566393371.db2.gz QPTUNLYCQUUMRO-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN C[C@@H]1C[C@H](C)CN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000463241834 566394201 /nfs/dbraw/zinc/39/42/01/566394201.db2.gz FNLMAFVEMGCSSV-AOOOYVTPSA-N 0 1 383.233 3.286 10 0 GGAEMN CN(C)Cc1ccnc(NC(=O)[C@@H]2CCOc3ccc(Br)cc32)c1 ZINC000649807981 566394865 /nfs/dbraw/zinc/39/48/65/566394865.db2.gz MLIJYBFURPYAEO-CQSZACIVSA-N 0 1 390.281 3.411 10 0 GGAEMN COCc1cnc(CNC[C@H](c2ccccc2Cl)N2CCOCC2)s1 ZINC000536763211 566398950 /nfs/dbraw/zinc/39/89/50/566398950.db2.gz VRCFTLIKVJREON-QGZVFWFLSA-N 0 1 381.929 3.106 10 0 GGAEMN COCc1cnc(CNC[C@H](c2ccc(Cl)cc2)N2CCOCC2)s1 ZINC000536758048 566399364 /nfs/dbraw/zinc/39/93/64/566399364.db2.gz PTDBWKCCPRCIKS-QGZVFWFLSA-N 0 1 381.929 3.106 10 0 GGAEMN COCc1cnc(CNC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)s1 ZINC000536758043 566399471 /nfs/dbraw/zinc/39/94/71/566399471.db2.gz PTDBWKCCPRCIKS-KRWDZBQOSA-N 0 1 381.929 3.106 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1nc2cc(Br)ccc2o1 ZINC000510640056 566400584 /nfs/dbraw/zinc/40/05/84/566400584.db2.gz GVPDKULPRQRKPI-ZDUSSCGKSA-N 0 1 380.286 3.471 10 0 GGAEMN O=C(c1cccc2n[nH]cc21)N1CCN(Cc2ccc(Br)cc2)CC1 ZINC000483849046 566405076 /nfs/dbraw/zinc/40/50/76/566405076.db2.gz MAJCZVNETRRPHU-UHFFFAOYSA-N 0 1 399.292 3.283 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(I)cc21)c1ccccn1 ZINC000463456462 566412050 /nfs/dbraw/zinc/41/20/50/566412050.db2.gz RKUOVHPSMLQCEY-SECBINFHSA-N 0 1 392.200 3.054 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N(C)CC2(CO)CC2)C1=O ZINC000510775107 566412521 /nfs/dbraw/zinc/41/25/21/566412521.db2.gz BLPOCYOTPHQYGV-MRXNPFEDSA-N 0 1 395.341 3.266 10 0 GGAEMN Cc1ccc(CN(C)C(=O)c2[nH]nc3ccc(I)cc32)o1 ZINC000463459967 566412799 /nfs/dbraw/zinc/41/27/99/566412799.db2.gz AEXMYJRDFAYYRF-UHFFFAOYSA-N 0 1 395.200 3.341 10 0 GGAEMN Cc1cc(Br)cc(C)c1N1CCC[C@@H](N(C)CCCCO)C1=O ZINC000510813810 566414942 /nfs/dbraw/zinc/41/49/42/566414942.db2.gz ROABJFKDGOENNP-MRXNPFEDSA-N 0 1 383.330 3.266 10 0 GGAEMN C[C@H]1CCCN(C(=O)c2[nH]nc3ccc(I)cc32)CC1 ZINC000463511740 566415200 /nfs/dbraw/zinc/41/52/00/566415200.db2.gz HZXMDILPEMHDCN-JTQLQIEISA-N 0 1 383.233 3.430 10 0 GGAEMN COCCOCCN1CCC[C@@H]1c1ccccc1I ZINC000510873248 566417018 /nfs/dbraw/zinc/41/70/18/566417018.db2.gz SEIFCIFEPZTJNV-OAHLLOKOSA-N 0 1 375.250 3.091 10 0 GGAEMN COCCOCCN1CCC[C@H]1c1ccccc1I ZINC000510873247 566417454 /nfs/dbraw/zinc/41/74/54/566417454.db2.gz SEIFCIFEPZTJNV-HNNXBMFYSA-N 0 1 375.250 3.091 10 0 GGAEMN C[C@@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(F)(F)F ZINC000463552213 566418645 /nfs/dbraw/zinc/41/86/45/566418645.db2.gz SNMPIGHIAGMAME-ZETCQYMHSA-N 0 1 377.164 3.049 10 0 GGAEMN C[C@@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(F)(F)F ZINC000463552213 566418650 /nfs/dbraw/zinc/41/86/50/566418650.db2.gz SNMPIGHIAGMAME-ZETCQYMHSA-N 0 1 377.164 3.049 10 0 GGAEMN C[C@H](C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C(F)(F)F ZINC000463552212 566418668 /nfs/dbraw/zinc/41/86/68/566418668.db2.gz SNMPIGHIAGMAME-SSDOTTSWSA-N 0 1 377.164 3.049 10 0 GGAEMN C[C@H](C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C(F)(F)F ZINC000463552212 566418674 /nfs/dbraw/zinc/41/86/74/566418674.db2.gz SNMPIGHIAGMAME-SSDOTTSWSA-N 0 1 377.164 3.049 10 0 GGAEMN Cc1ccc2nc(NC(=O)CNC(=O)c3ccc(Br)cc3)[nH]c2c1 ZINC000557814124 566421742 /nfs/dbraw/zinc/42/17/42/566421742.db2.gz ANYFHSKZIFVKTO-UHFFFAOYSA-N 0 1 387.237 3.002 10 0 GGAEMN O[C@@H](CN(CCn1ccnc1)Cc1ccc(Br)o1)CC(F)(F)F ZINC000510952743 566422804 /nfs/dbraw/zinc/42/28/04/566422804.db2.gz PYPYJWMUFWNOSH-LLVKDONJSA-N 0 1 396.207 3.054 10 0 GGAEMN CCOC(=O)[C@H](NS(=O)(=O)c1cc(C)c(F)cc1Cl)c1ccccc1 ZINC000447761185 566426619 /nfs/dbraw/zinc/42/66/19/566426619.db2.gz TVXFVYOMUUJAFS-MRXNPFEDSA-N 0 1 385.844 3.370 10 0 GGAEMN C[C@@H](N[C@@H](CO)CC1CCCC1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000510994926 566426602 /nfs/dbraw/zinc/42/66/02/566426602.db2.gz CBBTZBJPEULNGY-ZYHUDNBSSA-N 0 1 395.352 3.233 10 0 GGAEMN NC(=O)[C@H](NC[C@H]1CC[C@H](c2ccccc2)O1)c1cccc(Br)c1 ZINC000650134743 566426617 /nfs/dbraw/zinc/42/66/17/566426617.db2.gz FRGILTZMRKULDX-KZNAEPCWSA-N 0 1 389.293 3.485 10 0 GGAEMN CN(C)CCN(Cc1cccc(F)c1)S(=O)(=O)c1c(F)cccc1Cl ZINC000463699529 566428726 /nfs/dbraw/zinc/42/87/26/566428726.db2.gz ZPFZPBHLWCYVLS-UHFFFAOYSA-N 0 1 388.867 3.371 10 0 GGAEMN C[C@@H]1CN(C)[C@H](C)[C@@H](C)N1C(=O)Cc1noc2ccc(Br)cc21 ZINC000650155723 566428725 /nfs/dbraw/zinc/42/87/25/566428725.db2.gz FSOVVZWTKCYMTA-IJLUTSLNSA-N 0 1 380.286 3.072 10 0 GGAEMN CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)NCCN1CC[C@H](O)C1 ZINC000626612638 566429314 /nfs/dbraw/zinc/42/93/14/566429314.db2.gz KMYJTLYACCALSR-VIFPVBQESA-N 0 1 397.850 3.269 10 0 GGAEMN CN(CC(=O)NC1(c2ccccc2Br)CCC1)[C@H]1CCSC1 ZINC000650165481 566430339 /nfs/dbraw/zinc/43/03/39/566430339.db2.gz GKPFIGFRKOYDRN-ZDUSSCGKSA-N 0 1 383.355 3.382 10 0 GGAEMN C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCC[C@H](S(=O)(=O)N(C)C)C1 ZINC000511059530 566432310 /nfs/dbraw/zinc/43/23/10/566432310.db2.gz MWROXYBSUAUXLV-WFASDCNBSA-N 0 1 380.432 3.002 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N(CC(F)F)C1CC1 ZINC000463779599 566433742 /nfs/dbraw/zinc/43/37/42/566433742.db2.gz UQOYRYCRJIBVQV-UHFFFAOYSA-N 0 1 391.159 3.037 10 0 GGAEMN COC1(CS(=O)(=O)Nc2ccccc2-c2csc(C)n2)CCOCC1 ZINC000650199516 566436540 /nfs/dbraw/zinc/43/65/40/566436540.db2.gz RBUDLWQQXMCHED-UHFFFAOYSA-N 0 1 382.507 3.056 10 0 GGAEMN CC1=CCN(CCNC(=O)NCc2cc(F)c(F)cc2Br)CC1 ZINC000557991839 566439644 /nfs/dbraw/zinc/43/96/44/566439644.db2.gz CTQZNIJUFJGCIY-UHFFFAOYSA-N 0 1 388.256 3.179 10 0 GGAEMN Cn1nccc1C1=CCN(C[C@@H](O)COc2c(Cl)cccc2Cl)CC1 ZINC000577520673 566442679 /nfs/dbraw/zinc/44/26/79/566442679.db2.gz KVESQFDTLYCCAE-CQSZACIVSA-N 0 1 382.291 3.256 10 0 GGAEMN C[C@@H]1C[C@@H]1N1C[C@@H](NCc2cccc(Br)c2OC(F)F)CC1=O ZINC000537431883 566444716 /nfs/dbraw/zinc/44/47/16/566444716.db2.gz KYEIXSNJMQQGOS-CDMKHQONSA-N 0 1 389.240 3.149 10 0 GGAEMN C[C@@H]1CO[C@H](C(F)(F)F)CN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000671714484 566444786 /nfs/dbraw/zinc/44/47/86/566444786.db2.gz WSEKPBWHHGIFOT-PELKAZGASA-N 0 1 378.192 3.477 10 0 GGAEMN Cc1nn(C)c(CN[C@H]2CCN(c3c(F)cccc3F)C2)c1Br ZINC000447894279 566445243 /nfs/dbraw/zinc/44/52/43/566445243.db2.gz CMNROQCNCHLHCB-NSHDSACASA-N 0 1 385.256 3.138 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 ZINC000577563462 566445780 /nfs/dbraw/zinc/44/57/80/566445780.db2.gz RNGDYWOLUSNKBZ-GOSISDBHSA-N 0 1 381.929 3.086 10 0 GGAEMN O=C(NCCc1ccc(Br)cc1Cl)N[C@H]1CCc2nc[nH]c2C1 ZINC000577581490 566447085 /nfs/dbraw/zinc/44/70/85/566447085.db2.gz ZQUNRWFRHRITCM-LBPRGKRZSA-N 0 1 397.704 3.225 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000484699264 566447547 /nfs/dbraw/zinc/44/75/47/566447547.db2.gz ZPQXEQAQUUVCED-PBHICJAKSA-N 0 1 393.325 3.173 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000484699266 566447743 /nfs/dbraw/zinc/44/77/43/566447743.db2.gz ZPQXEQAQUUVCED-WMLDXEAASA-N 0 1 393.325 3.173 10 0 GGAEMN C[C@@H](NC(=O)N1CCc2cc(Br)cc(F)c21)C1=CC[N@@H+](C)CC1 ZINC000511247900 566448146 /nfs/dbraw/zinc/44/81/46/566448146.db2.gz KZZCHKWKNQDRJW-LLVKDONJSA-N 0 1 382.277 3.311 10 0 GGAEMN COC(=O)[C@](C)(NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000602142076 566448219 /nfs/dbraw/zinc/44/82/19/566448219.db2.gz MEMJHHRRLJCRAD-CZIZLABSSA-N 0 1 382.247 3.025 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CN[C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000671769500 566449059 /nfs/dbraw/zinc/44/90/59/566449059.db2.gz CBPBMWFMNIDUSE-ZFWWWQNUSA-N 0 1 377.337 3.384 10 0 GGAEMN [NH3+][C@@H]1CN(C(=O)c2cc(Br)ccc2[O-])CC[C@H]1c1ccc(F)cc1 ZINC000577608799 566449607 /nfs/dbraw/zinc/44/96/07/566449607.db2.gz DVORMCNXDBPMRK-GOEBONIOSA-N 0 1 393.256 3.251 10 0 GGAEMN O=c1[nH]nc2n1CCN(Cc1nc(-c3cc(Cl)ccc3Cl)cs1)C2 ZINC000484730978 566450129 /nfs/dbraw/zinc/45/01/29/566450129.db2.gz CMXWIQJKERIKKC-UHFFFAOYSA-N 0 1 382.276 3.430 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCCCC[C@H]1CCO ZINC000671900815 566458398 /nfs/dbraw/zinc/45/83/98/566458398.db2.gz IVCAWZZLYLDXCL-ZDUSSCGKSA-N 0 1 393.281 3.058 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CCCCC[C@@H]1CCO ZINC000671900814 566458450 /nfs/dbraw/zinc/45/84/50/566458450.db2.gz IVCAWZZLYLDXCL-CYBMUJFWSA-N 0 1 393.281 3.058 10 0 GGAEMN C[C@@H](NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc2n(n1)CCC2 ZINC000577827687 566466801 /nfs/dbraw/zinc/46/68/01/566466801.db2.gz SEUYJEDXDXRZLK-LLVKDONJSA-N 0 1 387.285 3.228 10 0 GGAEMN C[C@@H](NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc2n(n1)CCC2 ZINC000577827687 566466805 /nfs/dbraw/zinc/46/68/05/566466805.db2.gz SEUYJEDXDXRZLK-LLVKDONJSA-N 0 1 387.285 3.228 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1ccsc1 ZINC000650643203 566469047 /nfs/dbraw/zinc/46/90/47/566469047.db2.gz YHBBKGJEVPDTFF-LBPRGKRZSA-N 0 1 379.423 3.427 10 0 GGAEMN Cc1cc(Br)cn2cc(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)nc12 ZINC000423031778 566469838 /nfs/dbraw/zinc/46/98/38/566469838.db2.gz DOFKYEBHXNCGTF-GFCCVEGCSA-N 0 1 388.313 3.418 10 0 GGAEMN Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](CCO)c1ccccc1Br ZINC000423026158 566469895 /nfs/dbraw/zinc/46/98/95/566469895.db2.gz ARZPODZQAPBEDE-SCLBCKFNSA-N 0 1 378.314 3.386 10 0 GGAEMN CNS(=O)(=O)C[C@H]1CCCN1C/C(C)=C/c1cccc(C(F)(F)F)c1 ZINC000558400561 566469868 /nfs/dbraw/zinc/46/98/68/566469868.db2.gz UJEOUPIEQOZGFI-LRFDDAOPSA-N 0 1 376.444 3.122 10 0 GGAEMN C[C@H]1CO[C@H](C(F)(F)F)CN1C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000672175256 566470162 /nfs/dbraw/zinc/47/01/62/566470162.db2.gz HKGZWQBHZOEYBH-CPCISQLKSA-N 0 1 392.175 3.117 10 0 GGAEMN CCN(C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)C1CCCCC1 ZINC000511556633 566470975 /nfs/dbraw/zinc/47/09/75/566470975.db2.gz RUYGWFQQRYGPCS-IBGZPJMESA-N 0 1 397.357 3.427 10 0 GGAEMN CCc1ccccc1NC(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511553392 566471201 /nfs/dbraw/zinc/47/12/01/566471201.db2.gz JIABGWAPAMCVGM-LJQANCHMSA-N 0 1 391.309 3.447 10 0 GGAEMN COc1cc2nccc(N3CCO[C@H](C(=O)C4CC4)C3)c2cc1Br ZINC000577860935 566471353 /nfs/dbraw/zinc/47/13/53/566471353.db2.gz DZKVWOHECYKOMG-KRWDZBQOSA-N 0 1 391.265 3.190 10 0 GGAEMN COC(=O)c1cccc(CN[C@@](C)(CO)c2ccc(Br)cc2)c1 ZINC000511558376 566471564 /nfs/dbraw/zinc/47/15/64/566471564.db2.gz XBOJZAMRTOCIHW-SFHVURJKSA-N 0 1 378.266 3.233 10 0 GGAEMN C[C@](CO)(NCc1ccc2c(c1)OCCO2)c1ccc(Br)cc1 ZINC000511548619 566472128 /nfs/dbraw/zinc/47/21/28/566472128.db2.gz ZGFQHWOJXJHADV-GOSISDBHSA-N 0 1 378.266 3.218 10 0 GGAEMN CC[C@H](CNC(=O)c1ncsc1Br)N1CCc2ccccc2C1 ZINC000577887743 566472923 /nfs/dbraw/zinc/47/29/23/566472923.db2.gz HGVNXXYWTMAOML-CQSZACIVSA-N 0 1 394.338 3.472 10 0 GGAEMN C[C@](CO)(NCC(=O)Nc1ccc(F)c(F)c1)c1ccc(Br)cc1 ZINC000511572076 566473900 /nfs/dbraw/zinc/47/39/00/566473900.db2.gz DBBQFFZPXKSHGP-QGZVFWFLSA-N 0 1 399.235 3.163 10 0 GGAEMN Cc1ccc(NC(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)cc1F ZINC000511605551 566474920 /nfs/dbraw/zinc/47/49/20/566474920.db2.gz KGVCHPPSYWEDLN-SFHVURJKSA-N 0 1 395.272 3.332 10 0 GGAEMN CC[C@H]1CCCCN1C(=O)CN[C@](C)(CO)c1ccc(Br)cc1 ZINC000511604413 566475309 /nfs/dbraw/zinc/47/53/09/566475309.db2.gz LRGVUPWTIWGGHA-FUHWJXTLSA-N 0 1 383.330 3.037 10 0 GGAEMN C[C@@](CO)(NCC(=O)NCCC1CCCCC1)c1ccc(Br)cc1 ZINC000511594559 566475541 /nfs/dbraw/zinc/47/55/41/566475541.db2.gz OWXJDYMUKAXBGQ-IBGZPJMESA-N 0 1 397.357 3.333 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NCc1ccc(-c2ccc(OC)cc2)s1 ZINC000558470653 566476179 /nfs/dbraw/zinc/47/61/79/566476179.db2.gz GQILAZKVDKYJSI-UHFFFAOYSA-N 0 1 382.551 3.185 10 0 GGAEMN C[C@H](C1CC1)N(C(=O)CN[C@@](C)(CO)c1ccc(Br)cc1)C1CC1 ZINC000511621606 566476424 /nfs/dbraw/zinc/47/64/24/566476424.db2.gz GGCZGCYYNKGEIN-YJYMSZOUSA-N 0 1 395.341 3.036 10 0 GGAEMN C[C@@H]1CCC[C@H](NC(=O)CN[C@](C)(CO)c2ccc(Br)cc2)[C@@H]1C ZINC000511609613 566476509 /nfs/dbraw/zinc/47/65/09/566476509.db2.gz IQTQYQMZAHKWRZ-XNWVLMOPSA-N 0 1 397.357 3.187 10 0 GGAEMN COC(=O)c1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc1F ZINC000511621481 566476869 /nfs/dbraw/zinc/47/68/69/566476869.db2.gz DVWUSOIUQCHCCK-SFHVURJKSA-N 0 1 396.256 3.372 10 0 GGAEMN C[C@@H]1CCC[C@H](NC(=O)CN[C@@](C)(CO)c2ccc(Br)cc2)[C@H]1C ZINC000511609607 566477349 /nfs/dbraw/zinc/47/73/49/566477349.db2.gz IQTQYQMZAHKWRZ-BDFQZXNOSA-N 0 1 397.357 3.187 10 0 GGAEMN C[C@H](C1CC1)N(C(=O)CN[C@](C)(CO)c1ccc(Br)cc1)C1CC1 ZINC000511621603 566477476 /nfs/dbraw/zinc/47/74/76/566477476.db2.gz GGCZGCYYNKGEIN-BFUOFWGJSA-N 0 1 395.341 3.036 10 0 GGAEMN CN(C(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1)[C@@H]1CN2CCC1CC2 ZINC000537896594 566479308 /nfs/dbraw/zinc/47/93/08/566479308.db2.gz GMOPVQJFYRNVFS-QGZVFWFLSA-N 0 1 379.291 3.345 10 0 GGAEMN COCCN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C(C)(C)C1 ZINC000650828325 566480463 /nfs/dbraw/zinc/48/04/63/566480463.db2.gz DEKAGOMFRGPZPQ-DLBZAZTESA-N 0 1 395.341 3.122 10 0 GGAEMN CCN1CCN(CC(=O)N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000511671218 566482121 /nfs/dbraw/zinc/48/21/21/566482121.db2.gz KJNPMZZLFRPVRY-UHFFFAOYSA-N 0 1 382.335 3.247 10 0 GGAEMN C[C@](O)(CNCc1ncc(I)s1)C1CCCCC1 ZINC000511765384 566486461 /nfs/dbraw/zinc/48/64/61/566486461.db2.gz PUTNRNCJFHBWHF-ZDUSSCGKSA-N 0 1 380.295 3.169 10 0 GGAEMN COc1cc(Br)c(F)cc1S(=O)(=O)N[C@@H]1CCCC1(F)F ZINC000672430606 566489849 /nfs/dbraw/zinc/48/98/49/566489849.db2.gz ACBPKQFVCSSUKN-LLVKDONJSA-N 0 1 388.205 3.063 10 0 GGAEMN Cc1cc(CCNCc2ncc(I)s2)cc(C)c1O ZINC000511959734 566499943 /nfs/dbraw/zinc/49/99/43/566499943.db2.gz GRLUGZCZMLKVIS-UHFFFAOYSA-N 0 1 388.274 3.402 10 0 GGAEMN CCSc1ccc(CC(=O)NCc2n[nH]c(C3CC3)n2)c(Br)c1 ZINC000627578144 566490959 /nfs/dbraw/zinc/49/09/59/566490959.db2.gz QHDIYCYVGMCMPF-UHFFFAOYSA-N 0 1 395.326 3.416 10 0 GGAEMN O=C([C@H]1CCOc2ccc(Br)cc21)N1CCN(C2CCCC2)CC1 ZINC000651072630 566494092 /nfs/dbraw/zinc/49/40/92/566494092.db2.gz YYAYZBCFQKOGLK-INIZCTEOSA-N 0 1 393.325 3.402 10 0 GGAEMN CC[C@H](C)N1CCN(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC1 ZINC000627663323 566494907 /nfs/dbraw/zinc/49/49/07/566494907.db2.gz YPVQOYUTPHCDOK-LGRHPFTQSA-N 0 1 377.326 3.278 10 0 GGAEMN Cc1[nH]nc2ncc(NS(=O)(=O)c3c(C)cc(Br)cc3C)cc12 ZINC000538131932 566495714 /nfs/dbraw/zinc/49/57/14/566495714.db2.gz ROZTWIGHDRLSKC-UHFFFAOYSA-N 0 1 395.282 3.446 10 0 GGAEMN O=C(NCc1n[nH]c(C2CC2)n1)NC1(c2ccccc2Br)CCC1 ZINC000651128698 566498302 /nfs/dbraw/zinc/49/83/02/566498302.db2.gz GNTAFWZMDCULQK-UHFFFAOYSA-N 0 1 390.285 3.323 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)N1CCNC[C@@H]1c1ccccc1 ZINC000423989414 566500874 /nfs/dbraw/zinc/50/08/74/566500874.db2.gz BNYRVHDFJDMPLO-QGZVFWFLSA-N 0 1 389.293 3.173 10 0 GGAEMN COC(=O)[C@H]1CCCN([C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000464736673 566501046 /nfs/dbraw/zinc/50/10/46/566501046.db2.gz OPMATOYHILSJOD-XQQFMLRXSA-N 0 1 387.307 3.444 10 0 GGAEMN COC(=O)[C@H]1CCCN([C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000464736670 566501240 /nfs/dbraw/zinc/50/12/40/566501240.db2.gz OPMATOYHILSJOD-AVGNSLFASA-N 0 1 387.307 3.444 10 0 GGAEMN COC(=O)[C@H]1CCCN([C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000464736668 566501368 /nfs/dbraw/zinc/50/13/68/566501368.db2.gz OPMATOYHILSJOD-AGIUHOORSA-N 0 1 387.307 3.444 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1C[C@@H]2C=C[C@H]1CC2 ZINC000651233890 566504351 /nfs/dbraw/zinc/50/43/51/566504351.db2.gz DZVWYEANVJJXSX-TYNCELHUSA-N 0 1 387.281 3.453 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1C[C@@H]2C=C[C@H]1CC2 ZINC000651233890 566504355 /nfs/dbraw/zinc/50/43/55/566504355.db2.gz DZVWYEANVJJXSX-TYNCELHUSA-N 0 1 387.281 3.453 10 0 GGAEMN CCN1CCN(c2ccc(Cl)cc2NC(=O)N[C@H]2CSC2(C)C)CC1 ZINC000558763985 566505778 /nfs/dbraw/zinc/50/57/78/566505778.db2.gz CBQSMPJDCNYERE-INIZCTEOSA-N 0 1 382.961 3.497 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1C[C@H]1C(F)(F)F ZINC000448874666 566507482 /nfs/dbraw/zinc/50/74/82/566507482.db2.gz OVFFFIZJJHZPNN-NXEZZACHSA-N 0 1 389.175 3.049 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1C[C@H]1C(F)(F)F ZINC000448874666 566507483 /nfs/dbraw/zinc/50/74/83/566507483.db2.gz OVFFFIZJJHZPNN-NXEZZACHSA-N 0 1 389.175 3.049 10 0 GGAEMN CN1CCN(CCNc2cc3nccc(Cl)c3cc2Br)CC1 ZINC000651296343 566507548 /nfs/dbraw/zinc/50/75/48/566507548.db2.gz MGCSTCKSNBLFMC-UHFFFAOYSA-N 0 1 383.721 3.310 10 0 GGAEMN CCOc1cccc(CCNCc2ncc(I)s2)c1 ZINC000512042756 566508823 /nfs/dbraw/zinc/50/88/23/566508823.db2.gz YWZDDJZJRJOASC-UHFFFAOYSA-N 0 1 388.274 3.479 10 0 GGAEMN CC1(C)CN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)CCN1CCO ZINC000672867268 566511098 /nfs/dbraw/zinc/51/10/98/566511098.db2.gz LXVXJWFDROAKAY-OAHLLOKOSA-N 0 1 386.323 3.079 10 0 GGAEMN C[C@@H](CNCc1cnc(-c2ccc(Br)cc2)s1)S(C)(=O)=O ZINC000538428376 566512078 /nfs/dbraw/zinc/51/20/78/566512078.db2.gz PIBABQGPWYJEFW-JTQLQIEISA-N 0 1 389.340 3.095 10 0 GGAEMN COCCN1CC[C@H](NC(=O)c2ccc3scc(Br)c3c2)C1 ZINC000448932628 566513827 /nfs/dbraw/zinc/51/38/27/566513827.db2.gz KKYZOKNWJKNDBC-LBPRGKRZSA-N 0 1 383.311 3.114 10 0 GGAEMN Cc1nn(C)c(OCC(F)(F)F)c1CNc1ccnc(C)c1Br ZINC000558924428 566514827 /nfs/dbraw/zinc/51/48/27/566514827.db2.gz SQUCONMBRHLAPT-UHFFFAOYSA-N 0 1 393.207 3.170 10 0 GGAEMN CN(C(=O)c1cc(Cl)c(F)cc1Br)[C@@H]1CN2CCC1CC2 ZINC000448957635 566515105 /nfs/dbraw/zinc/51/51/05/566515105.db2.gz WRHBFLKCXKMQFI-CQSZACIVSA-N 0 1 375.669 3.408 10 0 GGAEMN CN(C(=O)c1cc(Cl)c(F)cc1Br)[C@H]1CN2CCC1CC2 ZINC000448957634 566515423 /nfs/dbraw/zinc/51/54/23/566515423.db2.gz WRHBFLKCXKMQFI-AWEZNQCLSA-N 0 1 375.669 3.408 10 0 GGAEMN C[C@H](CNC(=O)c1ccc2scc(Br)c2c1)N1CCN(C)CC1 ZINC000448982215 566516599 /nfs/dbraw/zinc/51/65/99/566516599.db2.gz WPAQGGNMKKNJII-GFCCVEGCSA-N 0 1 396.354 3.030 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NC(=O)Nc2ccnc(C)c2Br)n[nH]1 ZINC000558955650 566516955 /nfs/dbraw/zinc/51/69/55/566516955.db2.gz BCZWALSFPCVWRS-PSASIEDQSA-N 0 1 381.278 3.089 10 0 GGAEMN CN1CCC[C@@H]1C(=O)NCCOc1c(Cl)cc(Br)cc1Cl ZINC000538499653 566517464 /nfs/dbraw/zinc/51/74/64/566517464.db2.gz DPBINBQKFWJJHL-GFCCVEGCSA-N 0 1 396.112 3.345 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)c3cc[nH]c(=O)c3Br)cccc21 ZINC000578385746 566517653 /nfs/dbraw/zinc/51/76/53/566517653.db2.gz ARHYACSLXUVMRA-ZDUSSCGKSA-N 0 1 392.253 3.187 10 0 GGAEMN Cc1cc(N2CC[C@@H](NCc3cncn3C(C)C)C2=O)ccc1Br ZINC000424179080 566518231 /nfs/dbraw/zinc/51/82/31/566518231.db2.gz SHDXCZWUHXSBNP-QGZVFWFLSA-N 0 1 391.313 3.430 10 0 GGAEMN C[C@H](NS(=O)(=O)c1cc(Br)cc2cccnc21)C(F)(F)F ZINC000424215727 566521944 /nfs/dbraw/zinc/52/19/44/566521944.db2.gz PGZDZJGKGLJRIZ-ZETCQYMHSA-N 0 1 383.189 3.226 10 0 GGAEMN O=C([C@H]1CCOc2ccc(Br)cc21)N1CCC(c2cnc[nH]2)CC1 ZINC000651462156 566523639 /nfs/dbraw/zinc/52/36/39/566523639.db2.gz SDUNUKSAYQFGIK-AWEZNQCLSA-N 0 1 390.281 3.445 10 0 GGAEMN COC[C@@H]1CCN1C(=O)c1ccsc1NC(=O)c1ccc(Cl)cc1O ZINC000578444745 566523658 /nfs/dbraw/zinc/52/36/58/566523658.db2.gz DLQXYYLRPYCISA-NSHDSACASA-N 0 1 380.853 3.220 10 0 GGAEMN CC[C@H]1C[C@H](C)CN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000465291600 566527135 /nfs/dbraw/zinc/52/71/35/566527135.db2.gz WJQYOPASDXMVRZ-ONGXEEELSA-N 0 1 383.233 3.428 10 0 GGAEMN CCO[C@@H]1C[C@H](NCc2ccc(Br)cc2OC)[C@H]1n1cccn1 ZINC000578502967 566528663 /nfs/dbraw/zinc/52/86/63/566528663.db2.gz YMGNTYMEOLSHDI-USXIJHARSA-N 0 1 380.286 3.163 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1c(F)ccc(C(F)(F)F)c1Br ZINC000628076711 566528997 /nfs/dbraw/zinc/52/89/97/566528997.db2.gz FSAFUNNKUNANEQ-UHFFFAOYSA-N 0 1 383.183 3.241 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000651537127 566530788 /nfs/dbraw/zinc/53/07/88/566530788.db2.gz UMBYJCQUGMOHSL-IINYFYTJSA-N 0 1 378.270 3.094 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651533140 566531117 /nfs/dbraw/zinc/53/11/17/566531117.db2.gz NASPLSUDNJUZRJ-TZMCWYRMSA-N 0 1 376.254 3.232 10 0 GGAEMN CN(C)C(=O)[C@H](Cc1ccccc1)NCc1cccc(Br)c1F ZINC000449122031 566531340 /nfs/dbraw/zinc/53/13/40/566531340.db2.gz KDRHOLSUTRJPSK-INIZCTEOSA-N 0 1 379.273 3.377 10 0 GGAEMN COC(=O)c1sccc1NC(=O)CN[C@@H](C)c1ccc2ncsc2c1 ZINC000485847462 566532776 /nfs/dbraw/zinc/53/27/76/566532776.db2.gz OSPUHJKTYRLTJS-JTQLQIEISA-N 0 1 375.475 3.434 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@H](C)[C@@H](C)CO ZINC000449165026 566532859 /nfs/dbraw/zinc/53/28/59/566532859.db2.gz SNUMPYMJAZTENQ-WDEREUQCSA-N 0 1 386.279 3.072 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@H](C)[C@H](C)CO ZINC000449165023 566533778 /nfs/dbraw/zinc/53/37/78/566533778.db2.gz SNUMPYMJAZTENQ-GHMZBOCLSA-N 0 1 386.279 3.072 10 0 GGAEMN C[C@@H]1CCC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)[C@@H]1C(=O)[O-] ZINC000424417936 566534504 /nfs/dbraw/zinc/53/45/04/566534504.db2.gz MPTBMNMDEFIZHV-ABAIWWIYSA-N 0 1 384.270 3.296 10 0 GGAEMN COCCc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2C(=O)OC)cc1 ZINC000603589962 566534618 /nfs/dbraw/zinc/53/46/18/566534618.db2.gz UCXYUMDVAZCADA-UHFFFAOYSA-N 0 1 383.853 3.116 10 0 GGAEMN O=C(NCCSCC(F)(F)F)c1n[nH]c2ccc(Br)cc21 ZINC000538808671 566537517 /nfs/dbraw/zinc/53/75/17/566537517.db2.gz INRDKLVGAOVUJM-UHFFFAOYSA-N 0 1 382.205 3.351 10 0 GGAEMN O=c1ccccn1Cc1ccc(CNCc2ccc(Br)cn2)cc1 ZINC000603720084 566539077 /nfs/dbraw/zinc/53/90/77/566539077.db2.gz JNNHTNPFJBGOHL-UHFFFAOYSA-N 0 1 384.277 3.344 10 0 GGAEMN C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ncsc2Br)C1 ZINC000512599155 566544699 /nfs/dbraw/zinc/54/46/99/566544699.db2.gz YSSDEGOVVYNGKG-AAEUAGOBSA-N 0 1 380.311 3.471 10 0 GGAEMN Cc1nc([C@](C)(NS(=O)(=O)c2c(Cl)cc(F)cc2Cl)C2CC2)no1 ZINC000578708682 566546832 /nfs/dbraw/zinc/54/68/32/566546832.db2.gz PCMWANMRLBREOQ-CQSZACIVSA-N 0 1 394.255 3.428 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CC[C@H](C2CC2)C1 ZINC000486012063 566548598 /nfs/dbraw/zinc/54/85/98/566548598.db2.gz BUTGLUAIWIXWOC-JTQLQIEISA-N 0 1 381.217 3.040 10 0 GGAEMN C[C@H](N[C@H]1CCc2c1ccc(F)c2Br)C1(S(C)(=O)=O)CC1 ZINC000449322029 566549278 /nfs/dbraw/zinc/54/92/78/566549278.db2.gz NXGZVMZRFAKUNX-ZANVPECISA-N 0 1 376.291 3.131 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@H](C)[C@H](C)OC ZINC000449333879 566550902 /nfs/dbraw/zinc/55/09/02/566550902.db2.gz HZEQYLNGFCQVFJ-MNOVXSKESA-N 0 1 386.279 3.479 10 0 GGAEMN CCNC(=O)c1ccc(=N[C@H](CC)c2cc(F)cc(Br)c2)[nH]n1 ZINC000486041527 566551377 /nfs/dbraw/zinc/55/13/77/566551377.db2.gz NMMVITWKEGLSDP-CYBMUJFWSA-N 0 1 381.249 3.113 10 0 GGAEMN COCc1cnc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)s1 ZINC000538967508 566551698 /nfs/dbraw/zinc/55/16/98/566551698.db2.gz LJZPJQVCQARSNS-UHFFFAOYSA-N 0 1 394.298 3.127 10 0 GGAEMN COCc1cnc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)s1 ZINC000538967508 566551703 /nfs/dbraw/zinc/55/17/03/566551703.db2.gz LJZPJQVCQARSNS-UHFFFAOYSA-N 0 1 394.298 3.127 10 0 GGAEMN O=S1(=O)C[C@@H](CNCc2cc(F)ccc2Br)c2ccccc21 ZINC000449362213 566552338 /nfs/dbraw/zinc/55/23/38/566552338.db2.gz ZVZHYAJZGDHZRR-GFCCVEGCSA-N 0 1 384.270 3.249 10 0 GGAEMN Cc1ccc(CNC[C@H]2CS(=O)(=O)c3ccccc32)c(Br)c1 ZINC000449359823 566552870 /nfs/dbraw/zinc/55/28/70/566552870.db2.gz RMOYARGCNZQJAB-AWEZNQCLSA-N 0 1 380.307 3.418 10 0 GGAEMN C[C@@H](CN[C@@H](C)c1ncc(Br)cn1)c1ccc(S(C)(=O)=O)cc1 ZINC000449340229 566552987 /nfs/dbraw/zinc/55/29/87/566552987.db2.gz NHKZXOIXRAYFSU-RYUDHWBXSA-N 0 1 398.326 3.097 10 0 GGAEMN COC[C@@](C)(O)CCNCc1csc(-c2cccc(Br)c2)n1 ZINC000449384420 566556764 /nfs/dbraw/zinc/55/67/64/566556764.db2.gz NHTJJGNWCGSRFV-INIZCTEOSA-N 0 1 385.327 3.450 10 0 GGAEMN Cn1ccnc1CN1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449389924 566557084 /nfs/dbraw/zinc/55/70/84/566557084.db2.gz FCKOCBFJJSCGHT-AWEZNQCLSA-N 0 1 381.261 3.089 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N3CCC([C@H](C)O)CC3)C2=O)ccc1Br ZINC000466198326 566558148 /nfs/dbraw/zinc/55/81/48/566558148.db2.gz BKTVCJKHWBEZBY-KBXCAEBGSA-N 0 1 395.341 3.346 10 0 GGAEMN CC1=CCN(CCNC(=O)[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651736026 566558190 /nfs/dbraw/zinc/55/81/90/566558190.db2.gz LBWYBTGGHHFSCC-OAHLLOKOSA-N 0 1 379.298 3.083 10 0 GGAEMN Cc1cc(N2CCC[C@H](N3CCC([C@@H](C)O)CC3)C2=O)ccc1Br ZINC000466198328 566558255 /nfs/dbraw/zinc/55/82/55/566558255.db2.gz BKTVCJKHWBEZBY-KDOFPFPSSA-N 0 1 395.341 3.346 10 0 GGAEMN Cn1ccc(CN2CC[C@H](Cc3cccc(I)c3)C2)n1 ZINC000449397672 566559194 /nfs/dbraw/zinc/55/91/94/566559194.db2.gz VNYXCOOKJOZBOX-CQSZACIVSA-N 0 1 381.261 3.089 10 0 GGAEMN O=C(Cc1noc2ccc(Br)cc12)N[C@H]1CCCc2cn[nH]c21 ZINC000578860934 566560772 /nfs/dbraw/zinc/56/07/72/566560772.db2.gz QUBRFZWSAIKHGU-LBPRGKRZSA-N 0 1 375.226 3.050 10 0 GGAEMN O=C(N[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1)c1cccc(Br)c1O ZINC000559616111 566562519 /nfs/dbraw/zinc/56/25/19/566562519.db2.gz MIOXJOVLLNWERX-OLZOCXBDSA-N 0 1 395.297 3.066 10 0 GGAEMN CNS(=O)(=O)C[C@@H]1CCCN(Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000628495170 566562698 /nfs/dbraw/zinc/56/26/98/566562698.db2.gz KBHUXVCLKOCXAF-CQSZACIVSA-N 0 1 382.913 3.361 10 0 GGAEMN CCCOc1c(Cl)cc(CN[C@@H](C)C2(S(C)(=O)=O)CC2)cc1OC ZINC000512852338 566563052 /nfs/dbraw/zinc/56/30/52/566563052.db2.gz UNZMJWOQPVFTBY-LBPRGKRZSA-N 0 1 375.918 3.193 10 0 GGAEMN C[S@](=O)c1ccc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000512869062 566564798 /nfs/dbraw/zinc/56/47/98/566564798.db2.gz MTRPOQJRROSOHO-JTSKRJEESA-N 0 1 382.323 3.184 10 0 GGAEMN C[C@H](NCc1ccc(OC(F)F)c(Br)c1)C1(S(C)(=O)=O)CC1 ZINC000512860744 566565025 /nfs/dbraw/zinc/56/50/25/566565025.db2.gz KGGLUICLDAPAIL-VIFPVBQESA-N 0 1 398.269 3.106 10 0 GGAEMN Cc1cc(C)n2c(CN[C@@](C)(CO)c3ccc(Br)cc3)cnc2n1 ZINC000512874010 566565681 /nfs/dbraw/zinc/56/56/81/566565681.db2.gz IWXOMWLORHOSHM-SFHVURJKSA-N 0 1 389.297 3.106 10 0 GGAEMN COCCOc1ccc(CN[C@](C)(CO)c2ccc(Br)cc2)cc1 ZINC000512873948 566565719 /nfs/dbraw/zinc/56/57/19/566565719.db2.gz HWZACZKXYKVSBY-LJQANCHMSA-N 0 1 394.309 3.472 10 0 GGAEMN Cc1nc2ccc(CNCc3cccc(S(=O)(=O)N(C)C)c3)cc2s1 ZINC000449467884 566566236 /nfs/dbraw/zinc/56/62/36/566566236.db2.gz CESYKLIDYVZXOA-UHFFFAOYSA-N 0 1 375.519 3.145 10 0 GGAEMN COc1cc(CN[C@@](C)(CO)c2ccc(Br)cc2)cc(OC)c1 ZINC000512885246 566566573 /nfs/dbraw/zinc/56/65/73/566566573.db2.gz MWHKHGOOVMHUSS-SFHVURJKSA-N 0 1 380.282 3.464 10 0 GGAEMN C[C@H](NCC1=Cc2cc(Cl)cc(Cl)c2OC1)C1(S(C)(=O)=O)CC1 ZINC000512874902 566566629 /nfs/dbraw/zinc/56/66/29/566566629.db2.gz VYHVOMPBKWIFTK-JTQLQIEISA-N 0 1 376.305 3.325 10 0 GGAEMN COc1cc(NC(=O)c2cc(=O)c3cc(Br)ccc3[nH]2)ccc1O ZINC000559667736 566567790 /nfs/dbraw/zinc/56/77/90/566567790.db2.gz VEWWHHKJNWEEKH-UHFFFAOYSA-N 0 1 389.205 3.257 10 0 GGAEMN CC(C)(C)C[C@H](O)CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000486210486 566568856 /nfs/dbraw/zinc/56/88/56/566568856.db2.gz OTFGPHCMOHPZNL-CYBMUJFWSA-N 0 1 395.301 3.038 10 0 GGAEMN CC(C)(C)C[C@H](O)CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000486210486 566568862 /nfs/dbraw/zinc/56/88/62/566568862.db2.gz OTFGPHCMOHPZNL-CYBMUJFWSA-N 0 1 395.301 3.038 10 0 GGAEMN COc1ccc(CNC(=O)CN[C@H]2CCc3sc(Br)cc32)cc1 ZINC000559742624 566568967 /nfs/dbraw/zinc/56/89/67/566568967.db2.gz CQSGHTHAXYTCPI-AWEZNQCLSA-N 0 1 395.322 3.413 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1ccc(Br)cc1 ZINC000539243891 566570187 /nfs/dbraw/zinc/57/01/87/566570187.db2.gz MNOSYDKOSNNVPQ-KBRIMQKVSA-N 0 1 381.314 3.270 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@@H]1CNCc1cc(Br)ccc1Cl ZINC000512968843 566571280 /nfs/dbraw/zinc/57/12/80/566571280.db2.gz ZLWFTJLZMRRBCJ-CYBMUJFWSA-N 0 1 395.750 3.006 10 0 GGAEMN CS(=O)(=O)N1CCCC[C@H]1CNCc1ccc(Cl)cc1Br ZINC000512967855 566571345 /nfs/dbraw/zinc/57/13/45/566571345.db2.gz UUERPEVWRPHFOC-ZDUSSCGKSA-N 0 1 395.750 3.006 10 0 GGAEMN O=C(NCC1(OCCO)CCC(F)(F)CC1)c1c(O)cc(Cl)cc1Cl ZINC000628661542 566572827 /nfs/dbraw/zinc/57/28/27/566572827.db2.gz HULGYHXXKCSIOS-UHFFFAOYSA-N 0 1 398.233 3.386 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CC3(CC3)c3ccc(Br)cc32)[nH]1 ZINC000628658514 566573206 /nfs/dbraw/zinc/57/32/06/566573206.db2.gz SPDWBJGLDTZYOT-UHFFFAOYSA-N 0 1 393.310 3.436 10 0 GGAEMN COc1cc(Br)c(CNC[C@]2(CO)CCc3ccccc32)cc1O ZINC000651885093 566573374 /nfs/dbraw/zinc/57/33/74/566573374.db2.gz YGVLSWAGPHHJKI-IBGZPJMESA-N 0 1 392.293 3.129 10 0 GGAEMN COC[C@@H](NC[C@H](O)COc1cccc(Br)c1)c1ccc(F)cc1 ZINC000539377161 566576767 /nfs/dbraw/zinc/57/67/67/566576767.db2.gz OVTUYJFGHUMKMK-FUHWJXTLSA-N 0 1 398.272 3.305 10 0 GGAEMN C[C@@H](Cn1ncc2ccccc2c1=O)N[C@@H](C)c1ccc(Br)cn1 ZINC000579066956 566577134 /nfs/dbraw/zinc/57/71/34/566577134.db2.gz RZVWHPBFXRMPMH-STQMWFEESA-N 0 1 387.281 3.293 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)N1CCCC12CCC2 ZINC000579075567 566577162 /nfs/dbraw/zinc/57/71/62/566577162.db2.gz YUKCOMNKWZZYKN-UHFFFAOYSA-N 0 1 390.285 3.462 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)N1CCCC12CCC2 ZINC000579075567 566577168 /nfs/dbraw/zinc/57/71/68/566577168.db2.gz YUKCOMNKWZZYKN-UHFFFAOYSA-N 0 1 390.285 3.462 10 0 GGAEMN CSCCN[C@H](CNS(=O)(=O)c1ccc(C)cc1C)c1ccccc1 ZINC000539357025 566577344 /nfs/dbraw/zinc/57/73/44/566577344.db2.gz QAGCMTVAKSJUTE-GOSISDBHSA-N 0 1 378.563 3.276 10 0 GGAEMN COC[C@@H]1C[C@@H](O)CN1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000651937349 566577952 /nfs/dbraw/zinc/57/79/52/566577952.db2.gz FHBALGRYEDRUEN-UONOGXRCSA-N 0 1 383.311 3.154 10 0 GGAEMN C[C@H]1Cc2cc(S(=O)(=O)Nc3cnc(CC4CC4)nc3)cc(Cl)c2O1 ZINC000559971822 566579675 /nfs/dbraw/zinc/57/96/75/566579675.db2.gz AGBWACFWSFXQOO-JTQLQIEISA-N 0 1 379.869 3.207 10 0 GGAEMN COCc1cnc(CNC[C@@H](CO)Cc2ccc(C)c(Br)c2)s1 ZINC000449599445 566580799 /nfs/dbraw/zinc/58/07/99/566580799.db2.gz KWHXAARILYSCQY-AWEZNQCLSA-N 0 1 399.354 3.301 10 0 GGAEMN CC[C@H](C)N1CCN(C(=O)Cc2noc3ccc(Br)cc32)CC1 ZINC000424868994 566582587 /nfs/dbraw/zinc/58/25/87/566582587.db2.gz IYGSPWIBTQHLAR-LBPRGKRZSA-N 0 1 380.286 3.076 10 0 GGAEMN COC(=O)[C@@H](NS(=O)(=O)c1c(F)cccc1Cl)c1ccc(F)c(C)c1 ZINC000466526029 566583371 /nfs/dbraw/zinc/58/33/71/566583371.db2.gz HQSRHYKUIIHQKN-AWEZNQCLSA-N 0 1 389.807 3.119 10 0 GGAEMN O=C([O-])CCCC[N@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000579128551 566583961 /nfs/dbraw/zinc/58/39/61/566583961.db2.gz BNEGVZUSDSCJBI-AWEZNQCLSA-N 0 1 387.261 3.411 10 0 GGAEMN COC1CCN(CCNC(=O)CSc2cccc(C(F)(F)F)c2)CC1 ZINC000674311864 566584554 /nfs/dbraw/zinc/58/45/54/566584554.db2.gz YQJGJVFLUYYKSC-UHFFFAOYSA-N 0 1 376.444 3.025 10 0 GGAEMN O=S(=O)(Nc1ncccc1Br)c1cccnc1C(F)(F)F ZINC000579156430 566584788 /nfs/dbraw/zinc/58/47/88/566584788.db2.gz CMFLKZPEQWOUPI-UHFFFAOYSA-N 0 1 382.161 3.059 10 0 GGAEMN COc1ccc(Br)c(CN[C@H]2CCCc3c2ccc(=O)n3C)c1 ZINC000652048000 566585957 /nfs/dbraw/zinc/58/59/57/566585957.db2.gz CPKVEEZTFWOUOJ-INIZCTEOSA-N 0 1 377.282 3.324 10 0 GGAEMN CCN(C)[C@H](C(=O)NCc1cc(Br)cnc1OC)c1ccccc1 ZINC000628794545 566587178 /nfs/dbraw/zinc/58/71/78/566587178.db2.gz LWGAPMSNIDNMAU-INIZCTEOSA-N 0 1 392.297 3.162 10 0 GGAEMN Brc1ccc(CN2CCC[C@@]3(CCOC3)C2)c(N2CCOCC2)c1 ZINC000449684064 566590955 /nfs/dbraw/zinc/59/09/55/566590955.db2.gz QJHUBUGUFAIQPM-LJQANCHMSA-N 0 1 395.341 3.288 10 0 GGAEMN FC(F)Oc1cc(CNCc2cc3c(c(Br)c2)OCO3)ccn1 ZINC000560070758 566595131 /nfs/dbraw/zinc/59/51/31/566595131.db2.gz BTHSIRSRRKGNMD-UHFFFAOYSA-N 0 1 387.180 3.464 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)N2CCc3ccc(Br)cc3C2)n[nH]1 ZINC000560110095 566598138 /nfs/dbraw/zinc/59/81/38/566598138.db2.gz CJKKQXAEJDSSON-LLVKDONJSA-N 0 1 377.286 3.180 10 0 GGAEMN CCn1c(CNC(=O)c2ccc3cncn3c2)nc2cc(Br)ccc21 ZINC000560099490 566598661 /nfs/dbraw/zinc/59/86/61/566598661.db2.gz GSZIWOCDGHSHQI-UHFFFAOYSA-N 0 1 398.264 3.396 10 0 GGAEMN CC(C)n1cnc(S(=O)(=O)Nc2cc(F)cc(Br)c2F)c1 ZINC000486566031 566598849 /nfs/dbraw/zinc/59/88/49/566598849.db2.gz NJFZYZVPEOGVSB-UHFFFAOYSA-N 0 1 380.214 3.306 10 0 GGAEMN Cc1cnc(COCC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)o1 ZINC000628969182 566600085 /nfs/dbraw/zinc/60/00/85/566600085.db2.gz PFMTVJFZCNLFQZ-HNNXBMFYSA-N 0 1 386.279 3.226 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CCc1ccc(=O)[nH]c1)c1ccc(Cl)c(Cl)c1 ZINC000628969129 566600255 /nfs/dbraw/zinc/60/02/55/566600255.db2.gz OAFFTFOZHJEFOU-MRXNPFEDSA-N 0 1 382.291 3.446 10 0 GGAEMN CN(C)C[C@H](NC(=O)CCOC[C@@H]1CCCO1)c1ccc(Cl)c(Cl)c1 ZINC000628968371 566600347 /nfs/dbraw/zinc/60/03/47/566600347.db2.gz HEGMZWONYWEQHC-YOEHRIQHSA-N 0 1 389.323 3.298 10 0 GGAEMN C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968154 566600443 /nfs/dbraw/zinc/60/04/43/566600443.db2.gz FATGPTMNNWACKJ-NHYWBVRUSA-N 0 1 388.339 3.263 10 0 GGAEMN CN(C)C[C@H](NC(=O)CCOC1CCOCC1)c1ccc(Cl)c(Cl)c1 ZINC000628969529 566600489 /nfs/dbraw/zinc/60/04/89/566600489.db2.gz UISMQQWMVNBCJJ-KRWDZBQOSA-N 0 1 389.323 3.298 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CCOC[C@H]1CCCO1)c1ccc(Cl)c(Cl)c1 ZINC000628968369 566600572 /nfs/dbraw/zinc/60/05/72/566600572.db2.gz HEGMZWONYWEQHC-RHSMWYFYSA-N 0 1 389.323 3.298 10 0 GGAEMN CN(C)C[C@H](NC(=O)CCCNC(=O)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000628968875 566600674 /nfs/dbraw/zinc/60/06/74/566600674.db2.gz UVYKEGOEMPWYQT-INIZCTEOSA-N 0 1 386.323 3.019 10 0 GGAEMN CN(C)C[C@@H](NC(=O)CC[C@]1(C)CCC(=O)N1)c1ccc(Cl)c(Cl)c1 ZINC000628968301 566600785 /nfs/dbraw/zinc/60/07/85/566600785.db2.gz DCQAQUQXBHJWLU-CRAIPNDOSA-N 0 1 386.323 3.161 10 0 GGAEMN COc1ccc(CC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000628969008 566600825 /nfs/dbraw/zinc/60/08/25/566600825.db2.gz KMMGXQAGKXIDDZ-QGZVFWFLSA-N 0 1 382.291 3.359 10 0 GGAEMN CN(C)C[C@H](NC(=O)CC[C@@]1(C)CCC(=O)N1)c1ccc(Cl)c(Cl)c1 ZINC000628968308 566600879 /nfs/dbraw/zinc/60/08/79/566600879.db2.gz DCQAQUQXBHJWLU-YJBOKZPZSA-N 0 1 386.323 3.161 10 0 GGAEMN COc1ccc(CC(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)nc1 ZINC000628969005 566600896 /nfs/dbraw/zinc/60/08/96/566600896.db2.gz KMMGXQAGKXIDDZ-KRWDZBQOSA-N 0 1 382.291 3.359 10 0 GGAEMN CCCNC(=O)CCCC(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968373 566600950 /nfs/dbraw/zinc/60/09/50/566600950.db2.gz HFQXWGJASLXDMC-MRXNPFEDSA-N 0 1 388.339 3.409 10 0 GGAEMN O=C(NCCCc1nc[nH]n1)Nc1ncc(Cc2cccc(Cl)c2)s1 ZINC000486578098 566600946 /nfs/dbraw/zinc/60/09/46/566600946.db2.gz HQFFSQZIUOQNOV-UHFFFAOYSA-N 0 1 376.873 3.260 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1cn(C2CCC2)nn1)c1ccc(Cl)c(Cl)c1 ZINC000628969144 566600971 /nfs/dbraw/zinc/60/09/71/566600971.db2.gz MKEHYUDVFQZCCY-HNNXBMFYSA-N 0 1 382.295 3.343 10 0 GGAEMN CN(C)C[C@@H](NC(=O)Cn1cc(Cl)cn1)c1ccc(Cl)c(Cl)c1 ZINC000628968403 566600988 /nfs/dbraw/zinc/60/09/88/566600988.db2.gz FGEHDRQFCBOEOE-CQSZACIVSA-N 0 1 375.687 3.262 10 0 GGAEMN C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000628968147 566601035 /nfs/dbraw/zinc/60/10/35/566601035.db2.gz FATGPTMNNWACKJ-IAQYHMDHSA-N 0 1 388.339 3.263 10 0 GGAEMN Cc1cnc(COCC(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)o1 ZINC000628969183 566601091 /nfs/dbraw/zinc/60/10/91/566601091.db2.gz PFMTVJFZCNLFQZ-OAHLLOKOSA-N 0 1 386.279 3.226 10 0 GGAEMN Cc1nn(CC(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)c(C)c1Cl ZINC000425084270 566601932 /nfs/dbraw/zinc/60/19/32/566601932.db2.gz QTYRHJYEYRAVLT-UHFFFAOYSA-N 0 1 381.933 3.405 10 0 GGAEMN COC(=O)c1ccc(C(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)s1 ZINC000425091366 566603325 /nfs/dbraw/zinc/60/33/25/566603325.db2.gz YQOZPJVJAHYIQZ-UHFFFAOYSA-N 0 1 379.507 3.400 10 0 GGAEMN CCNC(=O)C[C@@H]1CCCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000560181144 566605932 /nfs/dbraw/zinc/60/59/32/566605932.db2.gz RFAIPOVPLAPNTD-AWEZNQCLSA-N 0 1 397.313 3.101 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1Cc1cc2c(cc1Br)OCCO2 ZINC000560181145 566606099 /nfs/dbraw/zinc/60/60/99/566606099.db2.gz RFAIPOVPLAPNTD-CQSZACIVSA-N 0 1 397.313 3.101 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC(C)(C)Cc1ccc(C(F)(F)F)cc1 ZINC000579411249 566606137 /nfs/dbraw/zinc/60/61/37/566606137.db2.gz KVEKXIHQFHBHCH-UHFFFAOYSA-N 0 1 380.476 3.288 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(C)Cc1cc(Br)ccc1Cl ZINC000579411615 566606445 /nfs/dbraw/zinc/60/64/45/566606445.db2.gz WMSSZHMSCUHGNQ-UHFFFAOYSA-N 0 1 397.766 3.206 10 0 GGAEMN Cn1nc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)c2ccccc21 ZINC000674758588 566606816 /nfs/dbraw/zinc/60/68/16/566606816.db2.gz OGGVAIWJOUTHFA-UHFFFAOYSA-N 0 1 397.280 3.411 10 0 GGAEMN Cn1nc(CNCc2nc(-c3ccc(Br)cc3)n[nH]2)c2ccccc21 ZINC000674758588 566606822 /nfs/dbraw/zinc/60/68/22/566606822.db2.gz OGGVAIWJOUTHFA-UHFFFAOYSA-N 0 1 397.280 3.411 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cccc(Br)c3)[nH]c2c1 ZINC000466910910 566607262 /nfs/dbraw/zinc/60/72/62/566607262.db2.gz ZCVOCBIFAXWFBH-UHFFFAOYSA-N 0 1 380.267 3.112 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)c3cc(Br)ccc3F)[nH]c2c1 ZINC000466922841 566609391 /nfs/dbraw/zinc/60/93/91/566609391.db2.gz FBBQYNACBCSZQE-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCC(c3nc(C(F)(F)F)cs3)CC2)C1 ZINC000652418041 566610324 /nfs/dbraw/zinc/61/03/24/566610324.db2.gz PSUDGMCAJFLTPD-LBPRGKRZSA-N 0 1 376.448 3.145 10 0 GGAEMN CC(=O)Nc1ncccc1NS(=O)(=O)c1c(C)cc(Br)cc1C ZINC000466960222 566610609 /nfs/dbraw/zinc/61/06/09/566610609.db2.gz SWNZDSOEAYUPIV-UHFFFAOYSA-N 0 1 398.282 3.220 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)[C@@H]2CCOc3ccc(Br)cc32)n[nH]1 ZINC000652431650 566610809 /nfs/dbraw/zinc/61/08/09/566610809.db2.gz GRAROHYHWVNKBY-LLVKDONJSA-N 0 1 393.285 3.047 10 0 GGAEMN O=C(Cc1csc(-c2ccc(Cl)s2)n1)NC1(c2nn[nH]n2)CCCC1 ZINC000605529853 566612622 /nfs/dbraw/zinc/61/26/22/566612622.db2.gz BINFBAFDKVZVED-UHFFFAOYSA-N 0 1 394.913 3.166 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H]1CCc2cc(Br)ccc2NC1=O ZINC000629095411 566614579 /nfs/dbraw/zinc/61/45/79/566614579.db2.gz AONQLJCNPBUZQR-GFCCVEGCSA-N 0 1 397.298 3.202 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000629101093 566615647 /nfs/dbraw/zinc/61/56/47/566615647.db2.gz WAHFITUBQMRWAZ-GHMZBOCLSA-N 0 1 381.420 3.050 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000629101103 566616312 /nfs/dbraw/zinc/61/63/12/566616312.db2.gz WAHFITUBQMRWAZ-WDEREUQCSA-N 0 1 381.420 3.050 10 0 GGAEMN COc1cc2nccc(N3C[C@@H](C(N)=O)CC[C@@H]3C)c2cc1Br ZINC000425211507 566617033 /nfs/dbraw/zinc/61/70/33/566617033.db2.gz XDUVGYLXXHISAV-QWRGUYRKSA-N 0 1 378.270 3.096 10 0 GGAEMN Cc1cccnc1CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000579557044 566618693 /nfs/dbraw/zinc/61/86/93/566618693.db2.gz LUJQDVYWDFAVTI-MRXNPFEDSA-N 0 1 395.322 3.203 10 0 GGAEMN C[C@@H]1CN(CCCOc2cccc(I)c2)[C@@H](C)CO1 ZINC000513716722 566619334 /nfs/dbraw/zinc/61/93/34/566619334.db2.gz HEHWCOAKLZPJLE-QWHCGFSZSA-N 0 1 375.250 3.169 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CNc2cc(Cl)c(Cl)cc2F)C1 ZINC000486779189 566621904 /nfs/dbraw/zinc/62/19/04/566621904.db2.gz YNYDVWGQYLKDMQ-GFCCVEGCSA-N 0 1 392.302 3.017 10 0 GGAEMN COc1cc2nccc(N3CCN(C(C)=O)C[C@H]3C)c2cc1Br ZINC000425235863 566621826 /nfs/dbraw/zinc/62/18/26/566621826.db2.gz JEUNOKFXRVRFBL-LLVKDONJSA-N 0 1 378.270 3.063 10 0 GGAEMN CO[C@@H]1CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CC[C@H]1C ZINC000467078375 566623687 /nfs/dbraw/zinc/62/36/87/566623687.db2.gz HACLZOJRXCFLAG-BDJLRTHQSA-N 0 1 378.270 3.336 10 0 GGAEMN Cc1nc(S(=O)(=O)N[C@@H]2CCc3ccccc3C2)sc1Br ZINC000540039311 566624801 /nfs/dbraw/zinc/62/48/01/566624801.db2.gz MXMQHUNWDBXFEI-GFCCVEGCSA-N 0 1 387.324 3.050 10 0 GGAEMN C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc(Br)c(F)cc2[O-])C1 ZINC000450015761 566624785 /nfs/dbraw/zinc/62/47/85/566624785.db2.gz HVFYLLQWSGPOEY-LBPRGKRZSA-N 0 1 385.277 3.098 10 0 GGAEMN C[C@@H]1CN(C(=O)N=c2nc(-c3ccsc3)[n-]s2)CC[N@H+](C2CCC2)C1 ZINC000560424300 566625122 /nfs/dbraw/zinc/62/51/22/566625122.db2.gz HPRCGMHCEFXVSZ-LBPRGKRZSA-N 0 1 377.539 3.027 10 0 GGAEMN CCN(CCc1nnnn1-c1ccccc1)Cc1ccccc1Br ZINC000579628142 566625640 /nfs/dbraw/zinc/62/56/40/566625640.db2.gz KBSPDHFBFDVYFO-UHFFFAOYSA-N 0 1 386.297 3.489 10 0 GGAEMN COCc1cnc(CNC[C@H](c2cccc(Cl)c2)N2CCOCC2)s1 ZINC000540069393 566625745 /nfs/dbraw/zinc/62/57/45/566625745.db2.gz QIIVZTLCHVZMKJ-QGZVFWFLSA-N 0 1 381.929 3.106 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2ccc(OC(C)C)c(Cl)c2)cn1C ZINC000467089317 566625982 /nfs/dbraw/zinc/62/59/82/566625982.db2.gz JJBBMWSJHSGOBN-UHFFFAOYSA-N 0 1 386.857 3.053 10 0 GGAEMN C[C@H](NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1 ZINC000652724344 566626433 /nfs/dbraw/zinc/62/64/33/566626433.db2.gz WPVFVRGKXONBGZ-ONGXEEELSA-N 0 1 381.249 3.229 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCN(c2cc(Cl)ccc2Cl)CC1 ZINC000652747069 566628025 /nfs/dbraw/zinc/62/80/25/566628025.db2.gz LGQZABWRLYCJNY-ZDUSSCGKSA-N 0 1 379.291 3.485 10 0 GGAEMN COc1cc(Br)c(C(=O)N2CCC(c3cnc[nH]3)CC2)cc1OC ZINC000450062227 566628854 /nfs/dbraw/zinc/62/88/54/566628854.db2.gz OYKPQEVYCHQMDP-UHFFFAOYSA-N 0 1 394.269 3.209 10 0 GGAEMN C[C@@H](CC(=O)N1CCC(c2n[nH]c(=O)o2)CC1)c1ccc(Br)cc1 ZINC000425328173 566630450 /nfs/dbraw/zinc/63/04/50/566630450.db2.gz WUWIVAMYISZSMO-NSHDSACASA-N 0 1 394.269 3.438 10 0 GGAEMN O=C(c1c[nH]c2cccc(Br)c12)N1CCC(c2n[nH]c(=O)o2)CC1 ZINC000425329440 566630483 /nfs/dbraw/zinc/63/04/83/566630483.db2.gz ZNAJOZZVOJQHAV-UHFFFAOYSA-N 0 1 391.225 3.039 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1cc(F)c(Br)c(F)c1)C1CC1 ZINC000629292125 566636869 /nfs/dbraw/zinc/63/68/69/566636869.db2.gz ZVJKBOFMSIMSJF-GFCCVEGCSA-N 0 1 384.242 3.284 10 0 GGAEMN COC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1CCC(=O)Nc1cccc(Br)c1 ZINC000467283587 566637914 /nfs/dbraw/zinc/63/79/14/566637914.db2.gz KESGOSIDXYSDAV-PVUWLOKVSA-N 0 1 395.297 3.051 10 0 GGAEMN CCO[C@H](CS(=O)(=O)Nc1cnc(-c2ccc(Cl)s2)nc1)C1CC1 ZINC000629302043 566638746 /nfs/dbraw/zinc/63/87/46/566638746.db2.gz WFWXLUOPTMKONE-GFCCVEGCSA-N 0 1 387.914 3.415 10 0 GGAEMN CCN(Cc1ccccc1Br)C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000579776006 566638749 /nfs/dbraw/zinc/63/87/49/566638749.db2.gz JEJXIUAMGUYRTB-ZDUSSCGKSA-N 0 1 377.286 3.261 10 0 GGAEMN COC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1CCC(=O)Nc1ccc(Br)cc1 ZINC000467296864 566638776 /nfs/dbraw/zinc/63/87/76/566638776.db2.gz BGJAKFDDTOYOBO-MJEQTWJJSA-N 0 1 395.297 3.051 10 0 GGAEMN COc1ccc(Cl)cc1N1CC[C@H](NCc2c(Br)cnn2C)C1 ZINC000486970059 566639418 /nfs/dbraw/zinc/63/94/18/566639418.db2.gz LWYWAVZRXURQAP-LBPRGKRZSA-N 0 1 399.720 3.213 10 0 GGAEMN CC(C)(C)NC(=O)CN(Cc1cccc(Br)c1)C1CCOCC1 ZINC000467301179 566640131 /nfs/dbraw/zinc/64/01/31/566640131.db2.gz YIJDWCZILDOBIJ-UHFFFAOYSA-N 0 1 383.330 3.345 10 0 GGAEMN COc1ccc(Cl)cc1N1CC[C@@H](NCc2c(Br)cnn2C)C1 ZINC000486970058 566640374 /nfs/dbraw/zinc/64/03/74/566640374.db2.gz LWYWAVZRXURQAP-GFCCVEGCSA-N 0 1 399.720 3.213 10 0 GGAEMN CSc1ccc(NS(=O)(=O)c2cnc3n2CCC3)cc1Br ZINC000629313255 566641039 /nfs/dbraw/zinc/64/10/39/566641039.db2.gz DAYBWJIDXRUBRG-UHFFFAOYSA-N 0 1 388.312 3.115 10 0 GGAEMN Cc1nc(S(=O)(=O)NC[C@H]2CC23CCSCC3)sc1Br ZINC000579822261 566641871 /nfs/dbraw/zinc/64/18/71/566641871.db2.gz HYGRMCQDXQGVNN-SECBINFHSA-N 0 1 397.385 3.026 10 0 GGAEMN CCc1ccc(NS(=O)(=O)c2ccc(S(C)(=O)=O)c(F)c2)cc1CC ZINC000540293842 566642071 /nfs/dbraw/zinc/64/20/71/566642071.db2.gz ZBSQRWMRBRSDHT-UHFFFAOYSA-N 0 1 385.482 3.155 10 0 GGAEMN CC(=O)N[C@@H](Cc1nc([C@@H](N)CC(C)C)no1)c1ccc(Br)cc1 ZINC000579831822 566643030 /nfs/dbraw/zinc/64/30/30/566643030.db2.gz PCXXAKOGCXEMFN-GJZGRUSLSA-N 0 1 395.301 3.298 10 0 GGAEMN CC(=O)N[C@H](Cc1nc([C@H](N)CC(C)C)no1)c1ccc(Br)cc1 ZINC000579831823 566643194 /nfs/dbraw/zinc/64/31/94/566643194.db2.gz PCXXAKOGCXEMFN-HUUCEWRRSA-N 0 1 395.301 3.298 10 0 GGAEMN Cc1cn2cc([N-]S(=O)(=O)c3ccc(F)cc3Br)ccc2[nH+]1 ZINC000606754360 566643744 /nfs/dbraw/zinc/64/37/44/566643744.db2.gz UFQNESITVSWPAN-UHFFFAOYSA-N 0 1 384.230 3.345 10 0 GGAEMN C[C@@H](NCC(=O)Nc1ccc2c(c1)OCO2)c1ccc(Br)cc1 ZINC000540344998 566647441 /nfs/dbraw/zinc/64/74/41/566647441.db2.gz XRTFTRTUFXILRL-LLVKDONJSA-N 0 1 377.238 3.467 10 0 GGAEMN Cn1c(C[N@@H+]2CC[C@H](C(=O)[O-])[C@@H]3CCC[C@@H]32)nc2ccc(Br)cc21 ZINC000629377132 566652429 /nfs/dbraw/zinc/65/24/29/566652429.db2.gz LJHCRJHOWVNQPK-YDHLFZDLSA-N 0 1 392.297 3.411 10 0 GGAEMN Cn1c(C[N@H+]2CC[C@H](C(=O)[O-])[C@@H]3CCC[C@@H]32)nc2ccc(Br)cc21 ZINC000629377132 566652435 /nfs/dbraw/zinc/65/24/35/566652435.db2.gz LJHCRJHOWVNQPK-YDHLFZDLSA-N 0 1 392.297 3.411 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)[C@@H]2CCC[C@H]21 ZINC000629373933 566653214 /nfs/dbraw/zinc/65/32/14/566653214.db2.gz QFMCHYWFMDKALG-TTZDDIAXSA-N 0 1 388.291 3.308 10 0 GGAEMN O=C([O-])[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCCO3)[C@@H]2CCC[C@@H]21 ZINC000629372787 566653379 /nfs/dbraw/zinc/65/33/79/566653379.db2.gz HMBNWIMKHMABSM-UMVBOHGHSA-N 0 1 396.281 3.296 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(Br)c(F)c2)CC1 ZINC000629419149 566654446 /nfs/dbraw/zinc/65/44/46/566654446.db2.gz IKVCSFSADLALOP-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2cc(Br)oc2C)CC1 ZINC000629414062 566654791 /nfs/dbraw/zinc/65/47/91/566654791.db2.gz GRXCGGHILMPQRW-UHFFFAOYSA-N 0 1 385.302 3.068 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2c(F)cccc2Br)CC1 ZINC000629418512 566654881 /nfs/dbraw/zinc/65/48/81/566654881.db2.gz QJGLGSIWIQOYAN-UHFFFAOYSA-N 0 1 399.304 3.305 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2c(C)cccc2Br)CC1 ZINC000629414867 566654970 /nfs/dbraw/zinc/65/49/70/566654970.db2.gz IFQFDADDPRCNGW-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC1(N2CCOCC2)CCN(C(=O)c2ccc(Br)c(C)c2)CC1 ZINC000629418623 566655264 /nfs/dbraw/zinc/65/52/64/566655264.db2.gz QMVWIRZHGLWEGI-UHFFFAOYSA-N 0 1 395.341 3.475 10 0 GGAEMN CCC(=O)N[C@H]1CCCN(CCCC(=O)c2ccc(Br)cc2)C1 ZINC000450327854 566658479 /nfs/dbraw/zinc/65/84/79/566658479.db2.gz NHTIOBRSVJOEJI-INIZCTEOSA-N 0 1 381.314 3.403 10 0 GGAEMN C[C@@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)c1ncc(Br)cn1 ZINC000560788941 566659271 /nfs/dbraw/zinc/65/92/71/566659271.db2.gz LUZSGYWYDMXOHN-CZUORRHYSA-N 0 1 389.297 3.081 10 0 GGAEMN Cc1cc(F)ccc1N1CCC[C@H](NCc2c(Br)cnn2C)C1 ZINC000487299546 566662032 /nfs/dbraw/zinc/66/20/32/566662032.db2.gz MKFNNQGPXNRFPN-AWEZNQCLSA-N 0 1 381.293 3.389 10 0 GGAEMN O=C(NCCCOc1ccc(Cl)cc1Cl)N1CC[C@@H](c2nc[nH]n2)C1 ZINC000425666344 566664381 /nfs/dbraw/zinc/66/43/81/566664381.db2.gz XZWGBHGGAIJCRJ-LLVKDONJSA-N 0 1 384.267 3.080 10 0 GGAEMN O=C(Nc1cnc2c(Br)cccn12)N[C@@H]1CCCc2cn[nH]c21 ZINC000425671163 566665854 /nfs/dbraw/zinc/66/58/54/566665854.db2.gz HDIPATRPMHNSPL-LLVKDONJSA-N 0 1 375.230 3.019 10 0 GGAEMN Cc1ccc2nc(CNC(=O)C(=O)Nc3ccc(Cl)c(Cl)c3)[nH]c2c1 ZINC000467806719 566669409 /nfs/dbraw/zinc/66/94/09/566669409.db2.gz KIOUGMSGYRPKHJ-UHFFFAOYSA-N 0 1 377.231 3.433 10 0 GGAEMN O[C@@H](CNCc1ccc(Br)c(F)c1F)COc1ccccc1F ZINC000629597088 566671067 /nfs/dbraw/zinc/67/10/67/566671067.db2.gz FJQKVQUNRNWLSI-NSHDSACASA-N 0 1 390.199 3.396 10 0 GGAEMN C[C@H](O)CN(Cc1ccccc1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000607388058 566671252 /nfs/dbraw/zinc/67/12/52/566671252.db2.gz HCOGNRYGVXFXNT-LBPRGKRZSA-N 0 1 388.265 3.349 10 0 GGAEMN O[C@H](CNCc1ccc(Br)c(F)c1F)COCc1cccs1 ZINC000629597834 566671471 /nfs/dbraw/zinc/67/14/71/566671471.db2.gz PFUXBEAQEUDHIE-LLVKDONJSA-N 0 1 392.265 3.456 10 0 GGAEMN O[C@H](CNCc1cc(F)c(Br)cc1F)COCc1ccccc1 ZINC000629597847 566671446 /nfs/dbraw/zinc/67/14/46/566671446.db2.gz POPRMIKAVNQHIL-CQSZACIVSA-N 0 1 386.236 3.395 10 0 GGAEMN C[C@H]1C[C@H](C)CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000607416135 566671732 /nfs/dbraw/zinc/67/17/32/566671732.db2.gz WUNHFWFGSNJINY-RYUDHWBXSA-N 0 1 392.301 3.422 10 0 GGAEMN C[C@H]1C[C@H](C)CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000607416135 566671737 /nfs/dbraw/zinc/67/17/37/566671737.db2.gz WUNHFWFGSNJINY-RYUDHWBXSA-N 0 1 392.301 3.422 10 0 GGAEMN Cn1ccc(-c2cc(C(=O)N3CC(Cc4ccccc4Br)C3)n[nH]2)c1 ZINC000629603939 566672968 /nfs/dbraw/zinc/67/29/68/566672968.db2.gz QMQHWIUZNIOKFD-UHFFFAOYSA-N 0 1 399.292 3.492 10 0 GGAEMN O=S(=O)(CCNCc1ccccc1CC(F)(F)F)c1ccc(F)cc1 ZINC000629616350 566675294 /nfs/dbraw/zinc/67/52/94/566675294.db2.gz ABTMXBXBKHYGQR-UHFFFAOYSA-N 0 1 375.387 3.494 10 0 GGAEMN CCO[C@@H]1C[C@@H](NC(=O)c2n[nH]c3ccc(Br)cc32)C12CCC2 ZINC000607683074 566677532 /nfs/dbraw/zinc/67/75/32/566677532.db2.gz RMADLZRTVVZENZ-ZIAGYGMSSA-N 0 1 378.270 3.403 10 0 GGAEMN C[C@@H]1C[C@H](CO)CCN1C(=O)c1cc(-c2ccc(Br)cc2)[nH]n1 ZINC000629680720 566678291 /nfs/dbraw/zinc/67/82/91/566678291.db2.gz OLWILSRZPNUFMP-VXGBXAGGSA-N 0 1 378.270 3.072 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCc2cc(F)cc(Br)c2C1 ZINC000629739702 566680333 /nfs/dbraw/zinc/68/03/33/566680333.db2.gz HBZFLAKDRVQPEY-LLVKDONJSA-N 0 1 378.245 3.001 10 0 GGAEMN Cc1cc(C[C@@H](C)NCc2c(Br)cnn2C)n(-c2ccccc2)n1 ZINC000487549526 566680407 /nfs/dbraw/zinc/68/04/07/566680407.db2.gz IDCPXDQETBZQBX-CYBMUJFWSA-N 0 1 388.313 3.398 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)Nc1cnn(-c2ccncc2)c1 ZINC000607820674 566681746 /nfs/dbraw/zinc/68/17/46/566681746.db2.gz CXODXXJFWZBPBL-UHFFFAOYSA-N 0 1 387.237 3.220 10 0 GGAEMN O=C([C@H]1CCCc2[nH]ncc21)N1CCc2cc(F)cc(Br)c2C1 ZINC000629740671 566681939 /nfs/dbraw/zinc/68/19/39/566681939.db2.gz JRULVWKILXZIPJ-LBPRGKRZSA-N 0 1 378.245 3.316 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)C1 ZINC000607901024 566686420 /nfs/dbraw/zinc/68/64/20/566686420.db2.gz IRGJYACUXNUASW-LLVKDONJSA-N 0 1 381.263 3.400 10 0 GGAEMN CCN1C(=O)N=NC1C1CCN(Cc2ccc(Br)c(C)c2)CC1 ZINC000676353764 566686773 /nfs/dbraw/zinc/68/67/73/566686773.db2.gz JEURQXMHPRUCBK-UHFFFAOYSA-N 0 1 379.302 3.454 10 0 GGAEMN CCN1C(=O)N=NC1C1CCN(Cc2ccc(C)c(Br)c2)CC1 ZINC000676365726 566687775 /nfs/dbraw/zinc/68/77/75/566687775.db2.gz BUEVXRNNXWYJRG-UHFFFAOYSA-N 0 1 379.302 3.454 10 0 GGAEMN O=C(N[C@H]1CCCc2sc(Cl)cc21)N1CCN(C[C@H]2CCOC2)CC1 ZINC000426057954 566688649 /nfs/dbraw/zinc/68/86/49/566688649.db2.gz KODCVHOAJMPMNN-HIFRSBDPSA-N 0 1 383.945 3.143 10 0 GGAEMN COC(=O)c1ccc(CN2CCCC[C@@H]2c2n[nH]c(C)n2)c(Br)c1 ZINC000450616513 566690382 /nfs/dbraw/zinc/69/03/82/566690382.db2.gz QCHYVSJBTIXGSL-OAHLLOKOSA-N 0 1 393.285 3.389 10 0 GGAEMN Cc1c(Br)ccc(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c1F ZINC000468226165 566691083 /nfs/dbraw/zinc/69/10/83/566691083.db2.gz ZLDQTTVDBMPDTL-RYUDHWBXSA-N 0 1 387.293 3.126 10 0 GGAEMN O=C(NCC(F)(F)F)[C@H]1CCN(CCOc2c(Cl)cccc2Cl)C1 ZINC000426159743 566695098 /nfs/dbraw/zinc/69/50/98/566695098.db2.gz HKWZVMZGDCDRJX-JTQLQIEISA-N 0 1 385.213 3.373 10 0 GGAEMN O=S1(=O)CC[C@H](CN2CCC(c3ccc(OC(F)(F)F)cc3)CC2)C1 ZINC000515168172 566695521 /nfs/dbraw/zinc/69/55/21/566695521.db2.gz RSDXKOCRRGSIRW-CYBMUJFWSA-N 0 1 377.428 3.199 10 0 GGAEMN O=c1c2c([n-]n1-c1ccc(Br)cn1)CC[N@H+](Cc1ccccc1)C2 ZINC000629942606 566696286 /nfs/dbraw/zinc/69/62/86/566696286.db2.gz DJUBVNAYXGVMQR-OAHLLOKOSA-N 0 1 385.265 3.069 10 0 GGAEMN C[C@@H]1C[C@H]1N1C[C@@H](NCc2cc(Br)ccc2OC(F)F)CC1=O ZINC000608072786 566699717 /nfs/dbraw/zinc/69/97/17/566699717.db2.gz SMNOWZKIJUVWAD-JIMOISOXSA-N 0 1 389.240 3.149 10 0 GGAEMN CC[C@H](NS(=O)(=O)CCN(CC)CC)c1cc(F)cc(Br)c1 ZINC000515256168 566700805 /nfs/dbraw/zinc/70/08/05/566700805.db2.gz VYYRJDHKCXOYGP-HNNXBMFYSA-N 0 1 395.338 3.301 10 0 GGAEMN O[C@@H](Cn1cccn1)CN1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000653882017 566701029 /nfs/dbraw/zinc/70/10/29/566701029.db2.gz ZBMKXSZVNQMZJM-CYBMUJFWSA-N 0 1 389.714 3.026 10 0 GGAEMN O=S1(=O)NC(CN[C@@H](c2ccc(Cl)cc2)C2CC2)=Nc2ccccc21 ZINC000541205520 566703395 /nfs/dbraw/zinc/70/33/95/566703395.db2.gz DUWWVHHLIQIWAF-GOSISDBHSA-N 0 1 375.881 3.403 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCCN1C[C@H]2CC[C@@H](C1)O2 ZINC000450793508 566707668 /nfs/dbraw/zinc/70/76/68/566707668.db2.gz PTQAFOPETZQAFZ-PHIMTYICSA-N 0 1 380.208 3.138 10 0 GGAEMN CC(=O)Nc1ccc(CN(CCO)Cc2cc(Br)cs2)cc1 ZINC000426389465 566708035 /nfs/dbraw/zinc/70/80/35/566708035.db2.gz LLVZKISWBJOYCI-UHFFFAOYSA-N 0 1 383.311 3.464 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCc2ncccc2C1 ZINC000676775425 566708396 /nfs/dbraw/zinc/70/83/96/566708396.db2.gz CDCZNAAJRAJODF-UHFFFAOYSA-N 0 1 383.249 3.433 10 0 GGAEMN O=C(Nc1nc(-c2ccccc2Br)n[nH]1)c1cnn2c1CCCC2 ZINC000676775013 566708863 /nfs/dbraw/zinc/70/88/63/566708863.db2.gz ARIJFDOCKDXFJS-UHFFFAOYSA-N 0 1 387.241 3.019 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)N[C@@H]2CCCc3sc(Cl)cc32)C1 ZINC000488150731 566708920 /nfs/dbraw/zinc/70/89/20/566708920.db2.gz NTDKDIANELRQRS-DZGCQCFKSA-N 0 1 385.961 3.435 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)N[C@H]2CCCc3sc(Cl)cc32)C1 ZINC000488150732 566709442 /nfs/dbraw/zinc/70/94/42/566709442.db2.gz NTDKDIANELRQRS-HIFRSBDPSA-N 0 1 385.961 3.435 10 0 GGAEMN Cc1ccc2nc(CNS(=O)(=O)Cc3cccc(Br)c3)[nH]c2c1 ZINC000561517913 566712577 /nfs/dbraw/zinc/71/25/77/566712577.db2.gz HYBQNPYQSUDDBZ-UHFFFAOYSA-N 0 1 394.294 3.253 10 0 GGAEMN Cc1cc(Br)cc(C)c1S(=O)(=O)Nc1cnn(CC2CC2)c1 ZINC000608343575 566713216 /nfs/dbraw/zinc/71/32/16/566713216.db2.gz KWUMMFIEHDNRRW-UHFFFAOYSA-N 0 1 384.299 3.473 10 0 GGAEMN O=C(c1csc(=NC2CC2)[nH]1)N1CCc2cccc(Br)c2C1 ZINC000426460106 566714444 /nfs/dbraw/zinc/71/44/44/566714444.db2.gz OLMIZSHSWPCVCT-UHFFFAOYSA-N 0 1 378.295 3.100 10 0 GGAEMN COCCN(Cc1ccc(OC(F)F)c(Br)c1)[C@H]1CCOC1 ZINC000426508957 566715916 /nfs/dbraw/zinc/71/59/16/566715916.db2.gz QWFYUHUZRBMEFM-LBPRGKRZSA-N 0 1 380.229 3.288 10 0 GGAEMN COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](C2N=NC(=O)O2)C1 ZINC000450896727 566717059 /nfs/dbraw/zinc/71/70/59/566717059.db2.gz OBRKBXWTIKZPBI-TVQRCGJNSA-N 0 1 386.235 3.176 10 0 GGAEMN COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](c2n[nH]c(=O)o2)C1 ZINC000450896727 566717066 /nfs/dbraw/zinc/71/70/66/566717066.db2.gz OBRKBXWTIKZPBI-TVQRCGJNSA-N 0 1 386.235 3.176 10 0 GGAEMN COCc1n[n-]c(=NC2CC[NH+](Cc3cc(Cl)cc(Cl)c3)CC2)s1 ZINC000541332831 566718669 /nfs/dbraw/zinc/71/86/69/566718669.db2.gz VQXOUJCJLQIWMZ-UHFFFAOYSA-N 0 1 387.336 3.490 10 0 GGAEMN CN(CCc1nnnn1-c1ccccc1)Cc1ccc(Br)s1 ZINC000515539045 566718975 /nfs/dbraw/zinc/71/89/75/566718975.db2.gz DZRXWEJIWFGIDV-UHFFFAOYSA-N 0 1 378.299 3.161 10 0 GGAEMN CCN(Cc1cccc(Br)c1)[C@H]1CCN(c2cc(C)nn2C)C1=O ZINC000488283498 566719278 /nfs/dbraw/zinc/71/92/78/566719278.db2.gz USOMELKINPHKMT-INIZCTEOSA-N 0 1 391.313 3.118 10 0 GGAEMN O=C1N=NC(C2CCN(CC[S@](=O)c3cc(Cl)ccc3Cl)CC2)O1 ZINC000450915014 566720048 /nfs/dbraw/zinc/72/00/48/566720048.db2.gz OREDFMCAEUCERG-DEOSSOPVSA-N 0 1 390.292 3.069 10 0 GGAEMN COc1cc(F)c(Br)cc1S(=O)(=O)NC(C)(C)C(F)(F)F ZINC000580784786 566722847 /nfs/dbraw/zinc/72/28/47/566722847.db2.gz BFWDMBUTXNGSNV-UHFFFAOYSA-N 0 1 394.184 3.216 10 0 GGAEMN COc1ccc(C[NH2+][C@@H](C(=O)[O-])c2ccc(C)cc2)c(Br)c1O ZINC000426682275 566723524 /nfs/dbraw/zinc/72/35/24/566723524.db2.gz HEKXNPNCKWEKRT-OAHLLOKOSA-N 0 1 380.238 3.387 10 0 GGAEMN COC(=O)CCS(=O)(=O)Nc1ccccc1OCc1cccc(Cl)c1 ZINC000580806578 566724966 /nfs/dbraw/zinc/72/49/66/566724966.db2.gz WTNFLHABWIWQSB-UHFFFAOYSA-N 0 1 383.853 3.224 10 0 GGAEMN CCOC(=O)C[C@@H](NC(=O)c1[nH]nc(C)c1C)c1cccc(Br)c1 ZINC000541443959 566724871 /nfs/dbraw/zinc/72/48/71/566724871.db2.gz ZNPUNGBQDMOZPL-CQSZACIVSA-N 0 1 394.269 3.213 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000630403885 566726418 /nfs/dbraw/zinc/72/64/18/566726418.db2.gz YZLMTUYVSXXBAN-GVDBMIGSSA-N 0 1 389.297 3.051 10 0 GGAEMN COc1ccc(C[NH2+][C@@H](C(=O)[O-])c2cccc(F)c2)c(Br)c1O ZINC000426762730 566726871 /nfs/dbraw/zinc/72/68/71/566726871.db2.gz MUQLFZIXBVOEFN-CQSZACIVSA-N 0 1 384.201 3.218 10 0 GGAEMN CC[C@@H]1CN(C(=O)NCCc2cccc(Cl)c2Cl)CCN1C[C@@H](C)O ZINC000541496313 566728430 /nfs/dbraw/zinc/72/84/30/566728430.db2.gz QXMFENAESRCAOA-UKRRQHHQSA-N 0 1 388.339 3.023 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000515714299 566728570 /nfs/dbraw/zinc/72/85/70/566728570.db2.gz DKKJTFVXSVBWIC-KOMQPUFPSA-N 0 1 378.460 3.213 10 0 GGAEMN COc1cc(C(F)(F)F)cc(S(=O)(=O)Nc2ccc(OC)nc2C)c1 ZINC000450978929 566729297 /nfs/dbraw/zinc/72/92/97/566729297.db2.gz GWJDNKBXNBOROX-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN COC(=O)[C@@H](NS(=O)(=O)c1c(F)cccc1Cl)c1cc(C)cc(C)c1 ZINC000468815135 566732304 /nfs/dbraw/zinc/73/23/04/566732304.db2.gz DNRNDXRNHFVBRP-HNNXBMFYSA-N 0 1 385.844 3.289 10 0 GGAEMN COC(=O)[C@H](NS(=O)(=O)c1c(F)cccc1Cl)c1cc(C)cc(C)c1 ZINC000468815421 566732648 /nfs/dbraw/zinc/73/26/48/566732648.db2.gz DNRNDXRNHFVBRP-OAHLLOKOSA-N 0 1 385.844 3.289 10 0 GGAEMN OC[C@@H](CNCc1cn(-c2cccc(Cl)c2Cl)nn1)c1ccccc1 ZINC000677244457 566733987 /nfs/dbraw/zinc/73/39/87/566733987.db2.gz AGPNHLZFHRJUBM-CQSZACIVSA-N 0 1 377.275 3.440 10 0 GGAEMN O=C([O-])[C@H]([NH2+]Cc1ccc(-c2ccc(Br)cc2)o1)[C@@H]1CCCO1 ZINC000630470111 566734939 /nfs/dbraw/zinc/73/49/39/566734939.db2.gz RWVWXERHYKXNAU-JKSUJKDBSA-N 0 1 380.238 3.431 10 0 GGAEMN COc1ccc([C@H](CN2CCCC2)Nc2ncncc2Br)cc1 ZINC000541575861 566735369 /nfs/dbraw/zinc/73/53/69/566735369.db2.gz HKIIMRUFRJUUOG-INIZCTEOSA-N 0 1 377.286 3.497 10 0 GGAEMN CC(C)C[C@@H](N)c1noc([C@@H]2CCCCN2S(=O)(=O)c2cccs2)n1 ZINC000580951958 566738185 /nfs/dbraw/zinc/73/81/85/566738185.db2.gz YHJCTNMCZOYAME-OLZOCXBDSA-N 0 1 384.527 3.093 10 0 GGAEMN CSc1cc(Br)ccc1C(=O)NCCCCN1CCOCC1 ZINC000654517891 566738427 /nfs/dbraw/zinc/73/84/27/566738427.db2.gz GGLRBRZFPLXDOE-UHFFFAOYSA-N 0 1 387.343 3.013 10 0 GGAEMN COCCSc1ccc([C@@H](C)NC(=O)CCSc2nnc(C)[nH]2)cc1 ZINC000468869605 566738658 /nfs/dbraw/zinc/73/86/58/566738658.db2.gz HUKRUWSWHCBFGE-GFCCVEGCSA-N 0 1 380.539 3.211 10 0 GGAEMN COC(=O)c1sc2ccccc2c1S(=O)(=O)NC(C)(C)C(F)(F)F ZINC000451030918 566738839 /nfs/dbraw/zinc/73/88/39/566738839.db2.gz KKEDMXORDKXLDC-UHFFFAOYSA-N 0 1 381.397 3.307 10 0 GGAEMN COCC[N@H+]1CC[C@@H](NC(=O)c2oc3c(cc(Br)cc3C)c2C)C1 ZINC000426995041 566740714 /nfs/dbraw/zinc/74/07/14/566740714.db2.gz MDMZMQSKJQHQRE-CQSZACIVSA-N 0 1 395.297 3.263 10 0 GGAEMN COCCN1CC[C@@H](NC(=O)c2oc3c(cc(Br)cc3C)c2C)C1 ZINC000426995041 566740719 /nfs/dbraw/zinc/74/07/19/566740719.db2.gz MDMZMQSKJQHQRE-CQSZACIVSA-N 0 1 395.297 3.263 10 0 GGAEMN CC(C)c1noc([C@@H](C)n2cc([C@@H](N)c3ccc(Br)cc3)nn2)n1 ZINC000630599371 566742151 /nfs/dbraw/zinc/74/21/51/566742151.db2.gz JXXFDWLVAFGRIE-YGRLFVJLSA-N 0 1 391.273 3.204 10 0 GGAEMN COc1cccc([C@@H](CNC(=O)c2c(F)cncc2Br)N(C)C)c1 ZINC000630577080 566742459 /nfs/dbraw/zinc/74/24/59/566742459.db2.gz HCSMHAIHERDEPJ-OAHLLOKOSA-N 0 1 396.260 3.025 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CCN(C(C)C)CC1 ZINC000468923572 566744442 /nfs/dbraw/zinc/74/44/42/566744442.db2.gz HSWAUTWWZQBDJF-CYBMUJFWSA-N 0 1 384.318 3.254 10 0 GGAEMN CSc1n[nH]c(NC(=O)CSCc2ccc(Br)cc2F)n1 ZINC000608986680 566745200 /nfs/dbraw/zinc/74/52/00/566745200.db2.gz IUTQBOQWIXCJIS-UHFFFAOYSA-N 0 1 391.291 3.300 10 0 GGAEMN O=S(=O)(Nc1c(O)cccc1F)c1cc(F)c(Br)cc1F ZINC000677417197 566745264 /nfs/dbraw/zinc/74/52/64/566745264.db2.gz NCYFYBNBOPJVAC-UHFFFAOYSA-N 0 1 382.157 3.373 10 0 GGAEMN Cc1cnc(C(=O)Nc2ccc(Sc3nncn3C)c(Cl)c2)c(O)c1 ZINC000427114295 566748345 /nfs/dbraw/zinc/74/83/45/566748345.db2.gz LWZQGUVPASUXML-UHFFFAOYSA-N 0 1 375.841 3.281 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1C[C@H]2CCCC[C@@H]2C1 ZINC000427181983 566754222 /nfs/dbraw/zinc/75/42/22/566754222.db2.gz KYHKVANAFABIBE-GHMZBOCLSA-N 0 1 395.244 3.430 10 0 GGAEMN CN(C)c1ccncc1C(=O)N1CCN(c2c(Cl)cccc2Cl)CC1 ZINC000469030375 566754480 /nfs/dbraw/zinc/75/44/80/566754480.db2.gz PUVVFFWAWBYFBJ-UHFFFAOYSA-N 0 1 379.291 3.417 10 0 GGAEMN CCN(CC)[C@@H](CNC(=O)c1c(F)cncc1Br)c1ccco1 ZINC000630839991 566756315 /nfs/dbraw/zinc/75/63/15/566756315.db2.gz MYOONNAVHZXBPH-ZDUSSCGKSA-N 0 1 384.249 3.389 10 0 GGAEMN CCOC(=O)C(CC)(CC)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000561991960 566756318 /nfs/dbraw/zinc/75/63/18/566756318.db2.gz WTOPPBRPQLBZHT-UHFFFAOYSA-N 0 1 382.258 3.177 10 0 GGAEMN CCN(CCNC(=O)Cc1ccc(Br)s1)CCC(F)(F)F ZINC000427214545 566757693 /nfs/dbraw/zinc/75/76/93/566757693.db2.gz BCSQIHAIXIWIEZ-UHFFFAOYSA-N 0 1 387.265 3.444 10 0 GGAEMN CC(C)c1n[nH]cc1C(=O)Nc1ncn(Cc2cccc(Br)c2)n1 ZINC000630861298 566758455 /nfs/dbraw/zinc/75/84/55/566758455.db2.gz SLXIQMNAHFOEIZ-UHFFFAOYSA-N 0 1 389.257 3.188 10 0 GGAEMN Cc1cc(C)n([C@@H](C)C(=O)Nc2nc(-c3ccccc3Br)n[nH]2)n1 ZINC000516364160 566759511 /nfs/dbraw/zinc/75/95/11/566759511.db2.gz FEBGZOSSEYVEOJ-NSHDSACASA-N 0 1 389.257 3.247 10 0 GGAEMN C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)N1CC[C@H](C(F)F)C1 ZINC000677729193 566762280 /nfs/dbraw/zinc/76/22/80/566762280.db2.gz AIVRILYPIHWSRY-AAEUAGOBSA-N 0 1 375.257 3.383 10 0 GGAEMN CC(C)(C)c1nc(CNS(=O)(=O)Cc2ccc(Cl)cc2Cl)n[nH]1 ZINC000516428801 566763250 /nfs/dbraw/zinc/76/32/50/566763250.db2.gz AFVVRQNEORYSGD-UHFFFAOYSA-N 0 1 377.297 3.029 10 0 GGAEMN CN(CC(=O)NCc1cc2cccnc2cc1Br)[C@H]1CCSC1 ZINC000677920631 566769525 /nfs/dbraw/zinc/76/95/25/566769525.db2.gz NIUHLYXMKKRCTH-AWEZNQCLSA-N 0 1 394.338 3.051 10 0 GGAEMN O=C1[C@@H](Sc2nc(-c3ccccc3Br)n[nH]2)CCN1C1CCC1 ZINC000631004669 566770587 /nfs/dbraw/zinc/77/05/87/566770587.db2.gz WRAFPECSUXYCSE-ZDUSSCGKSA-N 0 1 393.310 3.480 10 0 GGAEMN COCCCn1c(=O)[nH]nc1SCC(=O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000631005088 566771056 /nfs/dbraw/zinc/77/10/56/566771056.db2.gz MSVAUZXTLVPMEZ-PHIMTYICSA-N 0 1 381.420 3.050 10 0 GGAEMN C[C@H](NCC(=O)Nc1nc2c(s1)CCCC2)c1ccc([S@@](C)=O)cc1 ZINC000542053770 566771943 /nfs/dbraw/zinc/77/19/43/566771943.db2.gz RGTXQWWAIMAYCB-UOXLDJKESA-N 0 1 377.535 3.049 10 0 GGAEMN Cc1cnc(CN2CC[C@H](Cc3cccc(I)c3)C2)nc1 ZINC000451184035 566772881 /nfs/dbraw/zinc/77/28/81/566772881.db2.gz AAHPLGWRSLOGCT-OAHLLOKOSA-N 0 1 393.272 3.454 10 0 GGAEMN CC(C)n1ncnc1CNC[C@H]1CCN(c2cccc(Br)c2)C1 ZINC000631054233 566773402 /nfs/dbraw/zinc/77/34/02/566773402.db2.gz SLAZZCBJMMUILG-CQSZACIVSA-N 0 1 378.318 3.238 10 0 GGAEMN O=S(=O)(C[C@H]1CCCC1(F)F)NCC1(N2CCSCC2)CCCCC1 ZINC000451189453 566774106 /nfs/dbraw/zinc/77/41/06/566774106.db2.gz FJBWBNNEONJVLR-OAHLLOKOSA-N 0 1 396.569 3.093 10 0 GGAEMN Clc1ccc(OCCCNCc2cn(C[C@@H]3CCOC3)nn2)c(Cl)c1 ZINC000631055584 566774665 /nfs/dbraw/zinc/77/46/65/566774665.db2.gz CWAJSXINKXBFDT-ZDUSSCGKSA-N 0 1 385.295 3.180 10 0 GGAEMN FC(F)(F)CN1CC[C@H](CNCc2ncc(Br)cc2Cl)C1 ZINC000631044802 566774674 /nfs/dbraw/zinc/77/46/74/566774674.db2.gz NRPZZBDIWNTMCS-SECBINFHSA-N 0 1 386.643 3.471 10 0 GGAEMN CC(C)n1ncnc1CNC[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000631054231 566774750 /nfs/dbraw/zinc/77/47/50/566774750.db2.gz SLAZZCBJMMUILG-AWEZNQCLSA-N 0 1 378.318 3.238 10 0 GGAEMN CCCn1c(=O)[nH]nc1S[C@@H](C(=O)OC)c1ccccc1C(F)(F)F ZINC000542104717 566775689 /nfs/dbraw/zinc/77/56/89/566775689.db2.gz QAHQPBYHUCSUCT-LLVKDONJSA-N 0 1 375.372 3.419 10 0 GGAEMN COc1ccccc1CN(CCO)CCOc1cccc(Br)c1 ZINC000489194288 566775843 /nfs/dbraw/zinc/77/58/43/566775843.db2.gz HDYNALWSQOFJLN-UHFFFAOYSA-N 0 1 380.282 3.331 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NC(=O)c2[nH]nc3ccc(Br)cc32)n[nH]1 ZINC000489220816 566775906 /nfs/dbraw/zinc/77/59/06/566775906.db2.gz PYJJTICAQKPUCV-DTWKUNHWSA-N 0 1 391.273 3.448 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccnc(SC)c2)ccc1Br ZINC000678033734 566777170 /nfs/dbraw/zinc/77/71/70/566777170.db2.gz UORJDBWIPVJLSW-UHFFFAOYSA-N 0 1 389.296 3.375 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)N[C@H](Cc1ccccc1)C(N)=O ZINC000469284114 566777704 /nfs/dbraw/zinc/77/77/04/566777704.db2.gz UCUQXVBRWRENDM-BLLLJJGKSA-N 0 1 377.282 3.205 10 0 GGAEMN Fc1cccnc1N1CC[C@@H](NCc2ncc(Br)cc2Cl)C1 ZINC000631088929 566778098 /nfs/dbraw/zinc/77/80/98/566778098.db2.gz OUDIERSCHXGVBV-LLVKDONJSA-N 0 1 385.668 3.400 10 0 GGAEMN O=C(c1cccc2n[nH]cc21)N(CCO)Cc1cc(Br)cs1 ZINC000427551757 566778387 /nfs/dbraw/zinc/77/83/87/566778387.db2.gz YPXMQNGYROJRKA-UHFFFAOYSA-N 0 1 380.267 3.022 10 0 GGAEMN CC[C@H]1COCCN1CCCOc1cccc(I)c1 ZINC000609673696 566779991 /nfs/dbraw/zinc/77/99/91/566779991.db2.gz YEGPTHUDCLNWNB-AWEZNQCLSA-N 0 1 375.250 3.171 10 0 GGAEMN CC(C)(CNCc1cn(C[C@H]2CCOC2)nn1)c1ccccc1Br ZINC000631098581 566780773 /nfs/dbraw/zinc/78/07/73/566780773.db2.gz QIBMEBKHOOXRFG-CQSZACIVSA-N 0 1 393.329 3.145 10 0 GGAEMN Cc1cc(N2CCC(NCc3ncc(Br)cc3Cl)CC2)n[nH]1 ZINC000631119695 566781216 /nfs/dbraw/zinc/78/12/16/566781216.db2.gz ZJEJKYSIHSCWNA-UHFFFAOYSA-N 0 1 384.709 3.288 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@@H]2CCCC2(F)F)[C@@H]1c1cccs1 ZINC000451246272 566781460 /nfs/dbraw/zinc/78/14/60/566781460.db2.gz VOJGKDFXVBUAOX-IJEWVQPXSA-N 0 1 392.537 3.486 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@@H]2CCCC2(F)F)[C@H]1c1cccs1 ZINC000451246273 566782019 /nfs/dbraw/zinc/78/20/19/566782019.db2.gz VOJGKDFXVBUAOX-YCPHGPKFSA-N 0 1 392.537 3.486 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N(CCO)Cc1cc(Br)cs1 ZINC000427581959 566781879 /nfs/dbraw/zinc/78/18/79/566781879.db2.gz BRXCKKBKUHAVDC-UHFFFAOYSA-N 0 1 380.267 3.022 10 0 GGAEMN Cc1cc(N2CCC[C@H](NCc3ncc(Br)cc3Cl)C2)n(C)n1 ZINC000631122195 566782072 /nfs/dbraw/zinc/78/20/72/566782072.db2.gz XQTWREPKCLLNHW-ZDUSSCGKSA-N 0 1 398.736 3.298 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)[C@@H](C)Cc2cnc[nH]2)CC1 ZINC000655156713 566782637 /nfs/dbraw/zinc/78/26/37/566782637.db2.gz IHYHSUUITLIZLW-NSHDSACASA-N 0 1 378.270 3.165 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)n[nH]1 ZINC000469339769 566783306 /nfs/dbraw/zinc/78/33/06/566783306.db2.gz NJLWLBMAXCAMEI-UWVGGRQHSA-N 0 1 396.289 3.260 10 0 GGAEMN C[C@@](CO)(NCc1ccnn1CC1CCC1)c1ccc(Br)cc1 ZINC000631133874 566784292 /nfs/dbraw/zinc/78/42/92/566784292.db2.gz LOYDLFHOXBAKDF-SFHVURJKSA-N 0 1 378.314 3.443 10 0 GGAEMN Cc1cc(Cl)ccc1S(=O)(=O)NCCNCc1ccc(C(F)F)nc1 ZINC000631134321 566784318 /nfs/dbraw/zinc/78/43/18/566784318.db2.gz CDGPHNIQIWYBQC-UHFFFAOYSA-N 0 1 389.855 3.049 10 0 GGAEMN Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)CCc1nn[nH]n1 ZINC000631130719 566784341 /nfs/dbraw/zinc/78/43/41/566784341.db2.gz YLIWBZIRYPBUPM-SECBINFHSA-N 0 1 376.873 3.095 10 0 GGAEMN CN(C)[C@@H]1CCOc2c(NC(=O)c3cncc(Br)c3)cccc21 ZINC000469364894 566786093 /nfs/dbraw/zinc/78/60/93/566786093.db2.gz RGEUGCZHERCLAV-OAHLLOKOSA-N 0 1 376.254 3.482 10 0 GGAEMN Cc1ccoc1CNC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000489412044 566787260 /nfs/dbraw/zinc/78/72/60/566787260.db2.gz XMEYZJUGPKGULY-UHFFFAOYSA-N 0 1 390.241 3.135 10 0 GGAEMN Cc1ccoc1CNC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000489412044 566787268 /nfs/dbraw/zinc/78/72/68/566787268.db2.gz XMEYZJUGPKGULY-UHFFFAOYSA-N 0 1 390.241 3.135 10 0 GGAEMN COc1ccc([C@@H](CO)CNCc2ncc(Br)cc2Cl)cc1 ZINC000631157414 566787574 /nfs/dbraw/zinc/78/75/74/566787574.db2.gz AMVRBDBUDMEMEJ-GFCCVEGCSA-N 0 1 385.689 3.372 10 0 GGAEMN Brc1ccc(/C=C/CCNCc2cn(C[C@H]3CCOC3)nn2)cc1 ZINC000631180805 566788779 /nfs/dbraw/zinc/78/87/79/566788779.db2.gz HYXBYRJKSUHVDU-BCMPFUBYSA-N 0 1 391.313 3.270 10 0 GGAEMN Brc1ccc(/C=C/CCNCc2cn(C[C@@H]3CCOC3)nn2)cc1 ZINC000631180808 566789070 /nfs/dbraw/zinc/78/90/70/566789070.db2.gz HYXBYRJKSUHVDU-VQRJYJFOSA-N 0 1 391.313 3.270 10 0 GGAEMN Brc1ccc(/C=C\CCNCc2cn(C[C@@H]3CCOC3)nn2)cc1 ZINC000631180807 566789132 /nfs/dbraw/zinc/78/91/32/566789132.db2.gz HYXBYRJKSUHVDU-SWQCVOCJSA-N 0 1 391.313 3.270 10 0 GGAEMN C[C@@H](CC(=O)NCc1n[nH]c([C@@H]2CCCO2)n1)c1ccc(Br)cc1 ZINC000655231074 566789219 /nfs/dbraw/zinc/78/92/19/566789219.db2.gz IJTUFIRDHFPNBR-FZMZJTMJSA-N 0 1 393.285 3.229 10 0 GGAEMN COc1ccc(C(C)(C)NCc2ccc(Cl)c(S(N)(=O)=O)c2)cc1F ZINC000631184403 566789364 /nfs/dbraw/zinc/78/93/64/566789364.db2.gz SIGMSWPKHJNMHR-UHFFFAOYSA-N 0 1 386.876 3.160 10 0 GGAEMN Clc1ccc(CNCc2n[nH]c(C3CCOCC3)n2)c(Br)c1 ZINC000631213091 566790801 /nfs/dbraw/zinc/79/08/01/566790801.db2.gz IRZARUJYJLCGGL-UHFFFAOYSA-N 0 1 385.693 3.404 10 0 GGAEMN CN(C)c1cc(Cl)cc(Cl)c1CNCc1n[nH]c(C2CCOCC2)n1 ZINC000631213474 566791314 /nfs/dbraw/zinc/79/13/14/566791314.db2.gz OCLZHXJNLSPSSP-UHFFFAOYSA-N 0 1 384.311 3.361 10 0 GGAEMN O=C(c1csc(-c2ccc(Cl)cc2Cl)n1)N1CCN2C[C@H](O)C[C@H]2C1 ZINC000655298601 566792401 /nfs/dbraw/zinc/79/24/01/566792401.db2.gz QYVZYWSIIRCYJZ-NWDGAFQWSA-N 0 1 398.315 3.008 10 0 GGAEMN O=C(NCCNC(=O)c1ccc(Cl)cc1)c1n[nH]c2ccc(Cl)cc21 ZINC000489538317 566794922 /nfs/dbraw/zinc/79/49/22/566794922.db2.gz OULHLWPVIDAXKY-UHFFFAOYSA-N 0 1 377.231 3.030 10 0 GGAEMN Cc1nc([C@@H]2CCN(c3ncc(Br)cc3C(F)(F)F)C2)n[nH]1 ZINC000631303180 566798787 /nfs/dbraw/zinc/79/87/87/566798787.db2.gz FSTHPAKGVOKYLX-MRVPVSSYSA-N 0 1 376.180 3.283 10 0 GGAEMN Cc1nnc([C@@H]2CCN(c3ncc(Br)cc3C(F)(F)F)C2)[nH]1 ZINC000631303180 566798791 /nfs/dbraw/zinc/79/87/91/566798791.db2.gz FSTHPAKGVOKYLX-MRVPVSSYSA-N 0 1 376.180 3.283 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCc1nnc([C@@H]2CCOC2)[nH]1 ZINC000631374478 566799309 /nfs/dbraw/zinc/79/93/09/566799309.db2.gz MNDNBTGDUAMODU-SSDOTTSWSA-N 0 1 392.179 3.097 10 0 GGAEMN FC(F)(F)c1cc(Br)cnc1NCc1n[nH]c([C@@H]2CCOC2)n1 ZINC000631374478 566799317 /nfs/dbraw/zinc/79/93/17/566799317.db2.gz MNDNBTGDUAMODU-SSDOTTSWSA-N 0 1 392.179 3.097 10 0 GGAEMN COCCN(Cc1ccc(Br)s1)C(=O)CN1[C@H](C)CC[C@H]1C ZINC000427807424 566800267 /nfs/dbraw/zinc/80/02/67/566800267.db2.gz ULLBSHPYKJVZLI-CHWSQXEVSA-N 0 1 389.359 3.358 10 0 GGAEMN Cc1nc(S(=O)(=O)NCC(C)(C)[C@@H]2CCCCO2)sc1Br ZINC000678488573 566802594 /nfs/dbraw/zinc/80/25/94/566802594.db2.gz TUPOXHITULRLNJ-JTQLQIEISA-N 0 1 397.360 3.088 10 0 GGAEMN Brc1ccc(-c2nc(CNCc3nc4c(s3)CCC4)n[nH]2)cc1 ZINC000678496210 566802476 /nfs/dbraw/zinc/80/24/76/566802476.db2.gz FAEORRVUPKDIDG-UHFFFAOYSA-N 0 1 390.310 3.469 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNCc3nc4c(s3)CCC4)n2)cc1 ZINC000678496210 566802480 /nfs/dbraw/zinc/80/24/80/566802480.db2.gz FAEORRVUPKDIDG-UHFFFAOYSA-N 0 1 390.310 3.469 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCN(C)c3cc(Br)ccc32)cn1 ZINC000517048729 566802899 /nfs/dbraw/zinc/80/28/99/566802899.db2.gz WESZILVKAJKAEC-UHFFFAOYSA-N 0 1 389.297 3.002 10 0 GGAEMN Brc1ccc2c(ccnc2NCc2n[nH]c(C3CCOCC3)n2)c1 ZINC000631459174 566804436 /nfs/dbraw/zinc/80/44/36/566804436.db2.gz ADXOQXCOPWWLJX-UHFFFAOYSA-N 0 1 388.269 3.043 10 0 GGAEMN Brc1cccc2sc(=NCc3nc(C4CCOCC4)n[nH]3)[nH]c21 ZINC000631458138 566804607 /nfs/dbraw/zinc/80/46/07/566804607.db2.gz CVFJCYRYCXYTPI-UHFFFAOYSA-N 0 1 394.298 3.105 10 0 GGAEMN Brc1cccc2sc(=NCc3n[nH]c(C4CCOCC4)n3)[nH]c21 ZINC000631458138 566804613 /nfs/dbraw/zinc/80/46/13/566804613.db2.gz CVFJCYRYCXYTPI-UHFFFAOYSA-N 0 1 394.298 3.105 10 0 GGAEMN O=C(CCc1nn[nH]n1)Nc1cc(C(F)(F)F)ccc1SCC(F)F ZINC000631473022 566804697 /nfs/dbraw/zinc/80/46/97/566804697.db2.gz HKYTWKKHGLPHEN-UHFFFAOYSA-N 0 1 381.330 3.147 10 0 GGAEMN Brc1csc2cnc(NCc3n[nH]c(C4CCOCC4)n3)nc12 ZINC000631459986 566804728 /nfs/dbraw/zinc/80/47/28/566804728.db2.gz YIKVTTVNJIONMP-UHFFFAOYSA-N 0 1 395.286 3.078 10 0 GGAEMN Cc1ccccc1[C@@H](N)C(=O)N1CCOc2cccc(Br)c2C1 ZINC000655503083 566805167 /nfs/dbraw/zinc/80/51/67/566805167.db2.gz BTELKYPFNLQQDK-QGZVFWFLSA-N 0 1 375.266 3.179 10 0 GGAEMN COc1c(C)cccc1CNC(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000655490740 566805223 /nfs/dbraw/zinc/80/52/23/566805223.db2.gz OLZKQOYFHDBAPJ-GOSISDBHSA-N 0 1 377.282 3.256 10 0 GGAEMN O=C([C@H]1NCCc2ccccc21)N1CCOc2cccc(Br)c2C1 ZINC000655504108 566805899 /nfs/dbraw/zinc/80/58/99/566805899.db2.gz MOQQNQDPCIUKCO-SFHVURJKSA-N 0 1 387.277 3.057 10 0 GGAEMN Cc1ncc([C@H](C)NCc2ccccc2CS(=O)(=O)N2CCCC2)s1 ZINC000678608066 566807272 /nfs/dbraw/zinc/80/72/72/566807272.db2.gz XUUTXMMXNYOYAX-AWEZNQCLSA-N 0 1 379.551 3.228 10 0 GGAEMN Cc1cccc2c1OC[C@H](NC(=O)c1cc(Br)cc3nc[nH]c31)C2 ZINC000427971339 566807916 /nfs/dbraw/zinc/80/79/16/566807916.db2.gz LZTGMPFXKPBVLF-CYBMUJFWSA-N 0 1 386.249 3.367 10 0 GGAEMN O=C(C[C@@H]1CC[C@H]2C[C@H]21)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000562642549 566808956 /nfs/dbraw/zinc/80/89/56/566808956.db2.gz BWKJQTWAJIYCJJ-SGMGOOAPSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(C[C@@H]1CC[C@H]2C[C@H]21)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000562642549 566808960 /nfs/dbraw/zinc/80/89/60/566808960.db2.gz BWKJQTWAJIYCJJ-SGMGOOAPSA-N 0 1 375.270 3.287 10 0 GGAEMN O=S(=O)(c1ccc(Cl)s1)N1CCCN(CC[C@H]2CCCCO2)CC1 ZINC000542519333 566808919 /nfs/dbraw/zinc/80/89/19/566808919.db2.gz AULLZNWIFCTDAC-CQSZACIVSA-N 0 1 392.974 3.057 10 0 GGAEMN OCCC1(CNCc2ncc(Br)cc2Br)CCC1 ZINC000542517609 566809090 /nfs/dbraw/zinc/80/90/90/566809090.db2.gz HWEFDGFRUCTNRM-UHFFFAOYSA-N 0 1 378.108 3.249 10 0 GGAEMN O=C(C[C@@H]1CC[C@@H]2C[C@@H]21)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000562642546 566809111 /nfs/dbraw/zinc/80/91/11/566809111.db2.gz BWKJQTWAJIYCJJ-DYEKYZERSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(C[C@@H]1CC[C@@H]2C[C@@H]21)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000562642546 566809116 /nfs/dbraw/zinc/80/91/16/566809116.db2.gz BWKJQTWAJIYCJJ-DYEKYZERSA-N 0 1 375.270 3.287 10 0 GGAEMN CCN(CCNC(=O)Cc1sccc1Br)CCC(F)(F)F ZINC000451385633 566809220 /nfs/dbraw/zinc/80/92/20/566809220.db2.gz SGWSMTICIOVYRM-UHFFFAOYSA-N 0 1 387.265 3.444 10 0 GGAEMN CC(C)C[C@H](NCC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1cccs1 ZINC000542554858 566810556 /nfs/dbraw/zinc/81/05/56/566810556.db2.gz GJIVRKZFYXABAB-INIZCTEOSA-N 0 1 380.535 3.467 10 0 GGAEMN CN(C(=O)CSCc1ccc(Br)cc1F)[C@H]1CCCN(C)C1 ZINC000610187849 566814171 /nfs/dbraw/zinc/81/41/71/566814171.db2.gz OWCDAXNPCMNUJR-AWEZNQCLSA-N 0 1 389.334 3.374 10 0 GGAEMN O=C(c1oc2ccccc2c1Br)N1CCC(c2nc[nH]n2)CC1 ZINC000631681768 566814547 /nfs/dbraw/zinc/81/45/47/566814547.db2.gz HCYHTYLGKKLDQB-UHFFFAOYSA-N 0 1 375.226 3.333 10 0 GGAEMN O=C(Nc1nc(-c2ccc(Br)cc2)n[nH]1)c1cccc2nccnc21 ZINC000542618452 566814895 /nfs/dbraw/zinc/81/48/95/566814895.db2.gz KHJHLYZITSLMAV-UHFFFAOYSA-N 0 1 395.220 3.430 10 0 GGAEMN COC(=O)c1ccc(Br)cc1CN1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451415701 566815678 /nfs/dbraw/zinc/81/56/78/566815678.db2.gz FTGRPVHAUBZMDI-GVDBMIGSSA-N 0 1 382.298 3.361 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 ZINC000610231248 566816623 /nfs/dbraw/zinc/81/66/23/566816623.db2.gz HEQVJKYZZWVSPS-CHWSQXEVSA-N 0 1 392.253 3.400 10 0 GGAEMN C[C@@H](NCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1ccc(F)c(Br)c1 ZINC000678771714 566816658 /nfs/dbraw/zinc/81/66/58/566816658.db2.gz YFQIBRDUMLYPBM-CSMYWGQOSA-N 0 1 399.304 3.409 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 ZINC000610231329 566817073 /nfs/dbraw/zinc/81/70/73/566817073.db2.gz MUJIDZFUHAOVSL-CHWSQXEVSA-N 0 1 392.253 3.400 10 0 GGAEMN O=C(c1[nH]nc2ccc(I)cc21)N1CCC2(CC2)CC1 ZINC000610293688 566821935 /nfs/dbraw/zinc/82/19/35/566821935.db2.gz FXGMQLRZVSKSIJ-UHFFFAOYSA-N 0 1 381.217 3.184 10 0 GGAEMN CC(C)N(CC1CC1)C(=O)c1[nH]nc2ccc(I)cc21 ZINC000610290270 566822401 /nfs/dbraw/zinc/82/24/01/566822401.db2.gz DFZRNFCDDXKUDV-UHFFFAOYSA-N 0 1 383.233 3.428 10 0 GGAEMN CN(C)c1ccncc1C(=O)N[C@@H]1CSc2ccc(Br)cc21 ZINC000428198346 566823507 /nfs/dbraw/zinc/82/35/07/566823507.db2.gz JREXDKDKFMNZDT-CYBMUJFWSA-N 0 1 378.295 3.487 10 0 GGAEMN Cc1nnc(CN2CCN(CC/C=C/c3ccc(Br)cc3)CC2)[nH]1 ZINC000678891371 566823857 /nfs/dbraw/zinc/82/38/57/566823857.db2.gz PAQRJSUDYYZTMO-DUXPYHPUSA-N 0 1 390.329 3.097 10 0 GGAEMN C[C@@H]1C[C@@H](NC(=O)c2c(F)cncc2Br)CN1Cc1ccccc1 ZINC000631768067 566824013 /nfs/dbraw/zinc/82/40/13/566824013.db2.gz ASIXJSOEGDTPCW-TZMCWYRMSA-N 0 1 392.272 3.376 10 0 GGAEMN Cc1ncc(C(=O)N2CCC[C@H]2c2ccc(I)cc2)[nH]1 ZINC000610366194 566827257 /nfs/dbraw/zinc/82/72/57/566827257.db2.gz VZIGZDDSOOUPDO-AWEZNQCLSA-N 0 1 381.217 3.300 10 0 GGAEMN CC[C@@H](N[C@@H]1CCCn2nccc21)c1ccc(Cl)c(S(=O)(=O)NC)c1 ZINC000631809371 566828948 /nfs/dbraw/zinc/82/89/48/566828948.db2.gz ICEUXKSALOVCBL-HUUCEWRRSA-N 0 1 382.917 3.020 10 0 GGAEMN COC(=O)c1cc(CN[C@H](C)c2ccc(Br)cc2OC)cn1C ZINC000582089800 566829702 /nfs/dbraw/zinc/82/97/02/566829702.db2.gz WVTHCPZTLMZMFF-LLVKDONJSA-N 0 1 381.270 3.434 10 0 GGAEMN COc1ccc(Cl)c(S(=O)(=O)N[C@H](C[C@H]2CCCO2)C(F)(F)F)c1 ZINC000655661774 566830650 /nfs/dbraw/zinc/83/06/50/566830650.db2.gz IBLCDBQMJVVOQV-ZWNOBZJWSA-N 0 1 387.807 3.127 10 0 GGAEMN O=S(=O)(N[C@H](C[C@H]1CCCO1)C(F)(F)F)c1cc(F)cc(Cl)c1 ZINC000655662606 566831587 /nfs/dbraw/zinc/83/15/87/566831587.db2.gz UAFFUGXIENNROD-ZYHUDNBSSA-N 0 1 375.771 3.257 10 0 GGAEMN COc1ccc(Cl)cc1S(=O)(=O)N[C@H](C[C@@H]1CCCO1)C(F)(F)F ZINC000655662879 566831860 /nfs/dbraw/zinc/83/18/60/566831860.db2.gz XRKAUJDTQQHHLW-GXFFZTMASA-N 0 1 387.807 3.127 10 0 GGAEMN O=S(=O)(N[C@H](C[C@H]1CCCO1)C(F)(F)F)c1ccccc1C(F)(F)F ZINC000655663901 566832184 /nfs/dbraw/zinc/83/21/84/566832184.db2.gz OPHFWXKCFJWQTK-BXKDBHETSA-N 0 1 391.333 3.484 10 0 GGAEMN O=S(=O)(N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1C(F)(F)F ZINC000655663902 566832219 /nfs/dbraw/zinc/83/22/19/566832219.db2.gz OPHFWXKCFJWQTK-CABZTGNLSA-N 0 1 391.333 3.484 10 0 GGAEMN O=C(NCCCc1nc[nH]n1)Nc1cc(Cl)ccc1OCC(F)(F)F ZINC000490130325 566832324 /nfs/dbraw/zinc/83/23/24/566832324.db2.gz XXDUWRODPKCQFE-UHFFFAOYSA-N 0 1 377.754 3.154 10 0 GGAEMN CC(C)c1nc(CN2CCN(Cc3ccc(Br)cc3)CC2)n[nH]1 ZINC000428373508 566834121 /nfs/dbraw/zinc/83/41/21/566834121.db2.gz NQFQUWQYYFZYIU-UHFFFAOYSA-N 0 1 378.318 3.008 10 0 GGAEMN O=S(=O)(Cc1cc(Cl)sc1Cl)N[C@H]1CCCN2CCCC[C@@H]12 ZINC000655669135 566834262 /nfs/dbraw/zinc/83/42/62/566834262.db2.gz XLYLAFZQFWADEK-RYUDHWBXSA-N 0 1 383.366 3.491 10 0 GGAEMN O=C(Nc1cc(I)ccc1O)c1cccc2cn[nH]c21 ZINC000610486202 566834780 /nfs/dbraw/zinc/83/47/80/566834780.db2.gz PCCAQDRDNWEJSN-UHFFFAOYSA-N 0 1 379.157 3.125 10 0 GGAEMN CN(CC(=O)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1)[C@H]1CCSC1 ZINC000490182811 566834977 /nfs/dbraw/zinc/83/49/77/566834977.db2.gz RKKSQORXZSHEKP-XJKSGUPXSA-N 0 1 378.929 3.317 10 0 GGAEMN O=S(=O)(NC[C@@H]1CC12CCSCC2)c1cc(C(F)(F)F)ccc1O ZINC000562929571 566835460 /nfs/dbraw/zinc/83/54/60/566835460.db2.gz GIRHFYZEIMGNME-NSHDSACASA-N 0 1 381.441 3.223 10 0 GGAEMN COC(=O)c1ccc(NS(=O)(=O)c2c(Cl)cccc2C(F)(F)F)cn1 ZINC000542939991 566839499 /nfs/dbraw/zinc/83/94/99/566839499.db2.gz XGHCWPOJWIIETD-UHFFFAOYSA-N 0 1 394.758 3.341 10 0 GGAEMN Cc1cc(Br)ccc1NC(=O)CCNCc1cc2n(n1)CCCC2 ZINC000655724885 566839751 /nfs/dbraw/zinc/83/97/51/566839751.db2.gz JIAFLPQMOHXIRI-UHFFFAOYSA-N 0 1 391.313 3.409 10 0 GGAEMN Cc1ccc(Br)cc1NC(=O)CCNCc1cc2n(n1)CCCC2 ZINC000655738256 566839933 /nfs/dbraw/zinc/83/99/33/566839933.db2.gz UWYWINWYJXJHOR-UHFFFAOYSA-N 0 1 391.313 3.409 10 0 GGAEMN Cc1sc2ncnc(SCC(=O)N(C)[C@@H]3CCN(C4CC4)C3)c2c1C ZINC000517693390 566839893 /nfs/dbraw/zinc/83/98/93/566839893.db2.gz QPNYYGBKWYMBEA-CQSZACIVSA-N 0 1 376.551 3.095 10 0 GGAEMN Brc1ccc(N2CC[C@H](NCc3cc4n(n3)CCCC4)C2)cc1 ZINC000655729690 566841565 /nfs/dbraw/zinc/84/15/65/566841565.db2.gz IUVGJOLLCIBXKX-HNNXBMFYSA-N 0 1 375.314 3.350 10 0 GGAEMN CN1CCC[C@H](CNS(=O)(=O)C[C@H]2CCC2(F)F)[C@@H]1c1cccs1 ZINC000632027623 566841730 /nfs/dbraw/zinc/84/17/30/566841730.db2.gz IZXQJWORZQEVIF-UMVBOHGHSA-N 0 1 378.510 3.096 10 0 GGAEMN O[C@H](CNCc1nnc2c(Cl)cc(C(F)(F)F)cn12)CC1CCCC1 ZINC000562985467 566841827 /nfs/dbraw/zinc/84/18/27/566841827.db2.gz LAWGQICPTFNQFT-LBPRGKRZSA-N 0 1 376.810 3.432 10 0 GGAEMN COCCN1CCC[C@@H](NC(=O)c2c(C)cc(Br)cc2Cl)C1 ZINC000679231712 566842463 /nfs/dbraw/zinc/84/24/63/566842463.db2.gz YTZYWMUNPKEIEF-CYBMUJFWSA-N 0 1 389.721 3.252 10 0 GGAEMN O=C(Cn1cc(Br)cn1)Nc1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000490297129 566842593 /nfs/dbraw/zinc/84/25/93/566842593.db2.gz BUDJKYYXWDLOCM-UHFFFAOYSA-N 0 1 388.147 3.179 10 0 GGAEMN Fc1ccc2c(c1Br)CC[C@H]2[NH2+]Cc1nnc([C@H]2CCCO2)[n-]1 ZINC000655795819 566848594 /nfs/dbraw/zinc/84/85/94/566848594.db2.gz CRKQCHNZEZYBHJ-CHWSQXEVSA-N 0 1 381.249 3.335 10 0 GGAEMN Fc1ccc2c(c1Br)CC[C@H]2[NH2+]Cc1nnc([C@@H]2CCCO2)[n-]1 ZINC000655795820 566849572 /nfs/dbraw/zinc/84/95/72/566849572.db2.gz CRKQCHNZEZYBHJ-OLZOCXBDSA-N 0 1 381.249 3.335 10 0 GGAEMN CC[C@@H]1CN(C)CCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000563064773 566850413 /nfs/dbraw/zinc/85/04/13/566850413.db2.gz WFXQVCGPIKVQDH-IUODEOHRSA-N 0 1 382.302 3.008 10 0 GGAEMN Brc1ccccc1-n1cc(CN[C@@H](C2CC2)[C@@H]2CCCCO2)nn1 ZINC000655812648 566851760 /nfs/dbraw/zinc/85/17/60/566851760.db2.gz QJEFNWUFJNLFJG-ROUUACIJSA-N 0 1 391.313 3.467 10 0 GGAEMN Brc1ccccc1-n1cc(CN[C@H](C2CC2)[C@@H]2CCCCO2)nn1 ZINC000655812649 566851772 /nfs/dbraw/zinc/85/17/72/566851772.db2.gz QJEFNWUFJNLFJG-ZWKOTPCHSA-N 0 1 391.313 3.467 10 0 GGAEMN COc1cc(CN[C@H]2CCc3ccccc3NC2=O)cc(Br)c1O ZINC000655813281 566852096 /nfs/dbraw/zinc/85/20/96/566852096.db2.gz BLUBXLZMIYGGOJ-HNNXBMFYSA-N 0 1 391.265 3.206 10 0 GGAEMN CS(=O)(=O)c1ccc(CNCc2cnc(-c3ccccc3)[nH]2)cc1Cl ZINC000428544327 566856232 /nfs/dbraw/zinc/85/62/32/566856232.db2.gz XQJWXOMARUUUJB-UHFFFAOYSA-N 0 1 375.881 3.423 10 0 GGAEMN O=S1(=O)C[C@@H](CN[C@H]2CCSc3c(F)cccc32)Oc2ccccc21 ZINC000563126236 566856800 /nfs/dbraw/zinc/85/68/00/566856800.db2.gz RYIARLZEUICXAK-DOMZBBRYSA-N 0 1 379.478 3.187 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCCSCC1)c1cccc(C(F)(F)F)c1 ZINC000470291526 566861576 /nfs/dbraw/zinc/86/15/76/566861576.db2.gz ZLLIOAORPLGPAT-OAHLLOKOSA-N 0 1 375.460 3.457 10 0 GGAEMN CO[C@H](CCNC(=O)c1n[nH]c2ccc(Br)cc21)C(F)(F)F ZINC000470330583 566864855 /nfs/dbraw/zinc/86/48/55/566864855.db2.gz NUVRTXQWGHCWPT-SNVBAGLBSA-N 0 1 380.164 3.023 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCC[C@H](OC(F)F)C1)c1ccc(Cl)cc1 ZINC000679698078 566868530 /nfs/dbraw/zinc/86/85/30/566868530.db2.gz DSVQTGLBGQHCIR-LSDHHAIUSA-N 0 1 375.847 3.356 10 0 GGAEMN CC(C)(C)[C@H](O)C[C@H](CO)NCc1cccc(Br)c1OC(F)F ZINC000563261180 566869384 /nfs/dbraw/zinc/86/93/84/566869384.db2.gz KYACYVBVWCEEQX-DGCLKSJQSA-N 0 1 396.272 3.298 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC(c2nc(C(F)(F)F)cs2)CC1 ZINC000451729317 566871272 /nfs/dbraw/zinc/87/12/72/566871272.db2.gz JXUCUQUQEZWIMC-UHFFFAOYSA-N 0 1 399.504 3.013 10 0 GGAEMN Cc1cc(Br)cc(C)c1NC(=O)CCCN1CCCC[C@@H]1C(N)=O ZINC000679817520 566874965 /nfs/dbraw/zinc/87/49/65/566874965.db2.gz MXWHOJSAIOGJRX-OAHLLOKOSA-N 0 1 396.329 3.124 10 0 GGAEMN O=C(NC[C@H](O)CCc1ccccc1)c1n[nH]c2ccc(Br)cc21 ZINC000543385701 566875237 /nfs/dbraw/zinc/87/52/37/566875237.db2.gz JHGPYDVFSSESQC-CQSZACIVSA-N 0 1 388.265 3.049 10 0 GGAEMN CCOC(=O)CCC1CCN(C(=O)c2cccc(Br)c2O)CC1 ZINC000610987793 566878999 /nfs/dbraw/zinc/87/89/99/566878999.db2.gz SBEAFHZQXXHCCN-UHFFFAOYSA-N 0 1 384.270 3.350 10 0 GGAEMN Cc1nc(-c2ccc(Br)cc2)c(NC(=O)CN2CC[C@H](C)C2)n1C ZINC000563385014 566879805 /nfs/dbraw/zinc/87/98/05/566879805.db2.gz JLQBFKABLWEQEC-LBPRGKRZSA-N 0 1 391.313 3.438 10 0 GGAEMN CC1(C)CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CCS1 ZINC000543421428 566880762 /nfs/dbraw/zinc/88/07/62/566880762.db2.gz DKUOAXKNEKQDNB-UHFFFAOYSA-N 0 1 381.295 3.258 10 0 GGAEMN O=S1(=O)CCCC[C@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000543427591 566880791 /nfs/dbraw/zinc/88/07/91/566880791.db2.gz PKBOOEPQPHGAMD-ZFWWWQNUSA-N 0 1 388.327 3.220 10 0 GGAEMN Cc1c(Br)cccc1CS(=O)(=O)Nc1ccc(C2CC2)nn1 ZINC000656183901 566881795 /nfs/dbraw/zinc/88/17/95/566881795.db2.gz RPHKTXISRNOMGP-UHFFFAOYSA-N 0 1 382.283 3.367 10 0 GGAEMN FC(F)(F)c1nc(NCc2n[nH]c([C@H]3CCCO3)n2)ccc1Br ZINC000656208640 566884182 /nfs/dbraw/zinc/88/41/82/566884182.db2.gz VGQHRMUOSLDDGN-MRVPVSSYSA-N 0 1 392.179 3.445 10 0 GGAEMN CN(Cc1ccccc1Br)C(=O)CN1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000543483130 566885600 /nfs/dbraw/zinc/88/56/00/566885600.db2.gz IGOADJNFPZBSDI-RDJZCZTQSA-N 0 1 397.357 3.136 10 0 GGAEMN CS(=O)(=O)CC[C@H]1CCCCN1CCc1cccc(OC(F)(F)F)c1 ZINC000428859728 566886874 /nfs/dbraw/zinc/88/68/74/566886874.db2.gz DAPBASZEUXIZIL-OAHLLOKOSA-N 0 1 379.444 3.417 10 0 GGAEMN COCC(C)(C)Cc1nc(-c2nc(-c3cccc(Br)c3)n[nH]2)no1 ZINC000518503089 566887396 /nfs/dbraw/zinc/88/73/96/566887396.db2.gz OBNANJPPLWIVPF-UHFFFAOYSA-N 0 1 392.257 3.499 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N(C)CCc2cccc(Br)c2)cn1 ZINC000428911023 566887427 /nfs/dbraw/zinc/88/74/27/566887427.db2.gz IGVWZZZPJJFBAS-UHFFFAOYSA-N 0 1 376.298 3.220 10 0 GGAEMN COc1c(Br)cccc1CNC[C@H]1CS(=O)(=O)c2ccccc21 ZINC000563506415 566889399 /nfs/dbraw/zinc/88/93/99/566889399.db2.gz OJSDYEPQHBCSFV-ZDUSSCGKSA-N 0 1 396.306 3.118 10 0 GGAEMN CNC(=O)CCOC1CCN(Cc2oc3ccccc3c2Br)CC1 ZINC000656255819 566890143 /nfs/dbraw/zinc/89/01/43/566890143.db2.gz QEUWTKUNFKINJJ-UHFFFAOYSA-N 0 1 395.297 3.312 10 0 GGAEMN CCOC(=O)[C@H](Cc1cc(Cl)cc(Cl)c1)NC(=O)c1[nH]nc(C)c1C ZINC000470658633 566893478 /nfs/dbraw/zinc/89/34/78/566893478.db2.gz JSERYAHCOCXWSY-AWEZNQCLSA-N 0 1 384.263 3.238 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(F)cc1Br ZINC000518620466 566894809 /nfs/dbraw/zinc/89/48/09/566894809.db2.gz RVYKVHLDGGSCNW-TXEJJXNPSA-N 0 1 393.322 3.129 10 0 GGAEMN O=C(Nc1cc(I)ccc1O)c1cccc2[nH]ncc21 ZINC000611157109 566894717 /nfs/dbraw/zinc/89/47/17/566894717.db2.gz WQEPUTWFXLJZOM-UHFFFAOYSA-N 0 1 379.157 3.125 10 0 GGAEMN C[C@@]1(O)C[C@H](N[C@@H](c2ccc(Cl)cc2)c2cccc(S(C)(=O)=O)c2)C1 ZINC000563569882 566896074 /nfs/dbraw/zinc/89/60/74/566896074.db2.gz CHYZNSLSZIJHBJ-YTQUADARSA-N 0 1 379.909 3.336 10 0 GGAEMN Cc1ccc(S(=O)(=O)NCCN2[C@H](C)CCC[C@H]2C)c(Br)c1 ZINC000518622352 566897613 /nfs/dbraw/zinc/89/76/13/566897613.db2.gz OFUNCEDHUKZWMS-ZIAGYGMSSA-N 0 1 389.359 3.299 10 0 GGAEMN O[C@H]([C@@H]1CCN(CCOc2cc(F)cc(Br)c2)C1)C(F)(F)F ZINC000451886863 566900133 /nfs/dbraw/zinc/90/01/33/566900133.db2.gz JFJMNKIJVPJRQQ-NOZJJQNGSA-N 0 1 386.183 3.212 10 0 GGAEMN O=C(N[C@H]1COc2cc(F)cc(F)c21)c1n[nH]c2ccc(Br)cc21 ZINC000680307560 566901133 /nfs/dbraw/zinc/90/11/33/566901133.db2.gz NEZSKANFOGFEJH-LBPRGKRZSA-N 0 1 394.175 3.467 10 0 GGAEMN O[C@H]([C@H]1CCN(CCOc2cc(F)cc(Br)c2)C1)C(F)(F)F ZINC000451886869 566901234 /nfs/dbraw/zinc/90/12/34/566901234.db2.gz JFJMNKIJVPJRQQ-TVQRCGJNSA-N 0 1 386.183 3.212 10 0 GGAEMN CSc1ncc(Cl)c(C(=O)Nc2cccc3c2OCC[C@H]3N(C)C)n1 ZINC000582884933 566902323 /nfs/dbraw/zinc/90/23/23/566902323.db2.gz ACJGDTVJFIYJOQ-CYBMUJFWSA-N 0 1 378.885 3.489 10 0 GGAEMN CC[C@H](NC(=O)c1n[nH]c2ccc(I)cc21)C(F)(F)F ZINC000470796224 566904681 /nfs/dbraw/zinc/90/46/81/566904681.db2.gz HQUKHINLXJPYEG-VIFPVBQESA-N 0 1 397.138 3.238 10 0 GGAEMN O=C1[C@@H](N2CCC[C@]3(CCOC3)C2)CCN1c1cccc(Br)c1 ZINC000451912891 566905743 /nfs/dbraw/zinc/90/57/43/566905743.db2.gz VFAKHUCUZWIEDS-WMZOPIPTSA-N 0 1 379.298 3.057 10 0 GGAEMN C[C@@H](NCC(=O)N1CCN(Cc2ccsc2)CC1)c1ccc(Cl)s1 ZINC000680406884 566907590 /nfs/dbraw/zinc/90/75/90/566907590.db2.gz HDKJWXXFZVYBSE-CYBMUJFWSA-N 0 1 383.970 3.458 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)c1cnccc1N(C)C ZINC000470830087 566908332 /nfs/dbraw/zinc/90/83/32/566908332.db2.gz GUVKGNWCPGQFNE-NSHDSACASA-N 0 1 378.270 3.410 10 0 GGAEMN C[C@H](NCC(=O)N1CCC[C@H](C(F)(F)F)C1)[C@@H]1OCCc2sccc21 ZINC000429120728 566909699 /nfs/dbraw/zinc/90/96/99/566909699.db2.gz IHSMDALHSSHIRX-MKBNYLNASA-N 0 1 376.444 3.141 10 0 GGAEMN Cn1cc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)c(C(F)(F)F)n1 ZINC000563710592 566909849 /nfs/dbraw/zinc/90/98/49/566909849.db2.gz ZYYJUGRGZDTXCD-NSHDSACASA-N 0 1 398.212 3.275 10 0 GGAEMN Brc1ccc(-c2nc(CNCc3ccc4c(n3)CCC4)n[nH]2)cc1 ZINC000656529654 566910545 /nfs/dbraw/zinc/91/05/45/566910545.db2.gz MRRNJYDMINBKDG-UHFFFAOYSA-N 0 1 384.281 3.408 10 0 GGAEMN Brc1ccc(-c2n[nH]c(CNCc3ccc4c(n3)CCC4)n2)cc1 ZINC000656529654 566910551 /nfs/dbraw/zinc/91/05/51/566910551.db2.gz MRRNJYDMINBKDG-UHFFFAOYSA-N 0 1 384.281 3.408 10 0 GGAEMN COC(=O)c1cc(NS(=O)(=O)c2ccc(C)o2)c(Br)cc1F ZINC000611338372 566911312 /nfs/dbraw/zinc/91/13/12/566911312.db2.gz QLMAURJKUGOBLH-UHFFFAOYSA-N 0 1 392.202 3.077 10 0 GGAEMN CC(C)CCc1cc(=NC(=O)c2cc(Br)cc3[nH]cnc32)[nH][nH]1 ZINC000582995719 566912186 /nfs/dbraw/zinc/91/21/86/566912186.db2.gz HYOIYFIIIPAFCT-UHFFFAOYSA-N 0 1 376.258 3.311 10 0 GGAEMN Cn1c(CNC[C@@H](O)COc2c(Cl)cccc2Cl)nc2ccccc21 ZINC000563732987 566912831 /nfs/dbraw/zinc/91/28/31/566912831.db2.gz UYMUECOLGVOULQ-GFCCVEGCSA-N 0 1 380.275 3.410 10 0 GGAEMN C[C@H](C(=O)[O-])[C@@H]([NH2+]Cc1cn(C2CCC2)nn1)c1ccc(Br)cc1 ZINC000656567585 566917312 /nfs/dbraw/zinc/91/73/12/566917312.db2.gz VXUYJBFTDYXKQE-MEDUHNTESA-N 0 1 393.285 3.317 10 0 GGAEMN NC1(c2noc([C@@H]3CCO[C@H]3c3cncc(Br)c3)n2)CCCC1 ZINC000656561061 566917527 /nfs/dbraw/zinc/91/75/27/566917527.db2.gz PFANZZIRLAIFOL-OLZOCXBDSA-N 0 1 379.258 3.200 10 0 GGAEMN CN(C)[C@H](CNC(=O)N1CCC(Cc2nccs2)CC1)c1ccsc1 ZINC000632856296 566919323 /nfs/dbraw/zinc/91/93/23/566919323.db2.gz HPZPIHMCCQSSQG-MRXNPFEDSA-N 0 1 378.567 3.472 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc3cc(C)cc(Br)c3o2)CC1 ZINC000543878509 566919639 /nfs/dbraw/zinc/91/96/39/566919639.db2.gz COZMAVZPOCQKAK-UHFFFAOYSA-N 0 1 395.297 3.298 10 0 GGAEMN C[C@H](N[C@@H](CO)c1ccc(Cl)cc1)C(=O)N1CCSc2ccccc21 ZINC000583173078 566927000 /nfs/dbraw/zinc/92/70/00/566927000.db2.gz UYPHGVFPGVUEOH-BBRMVZONSA-N 0 1 376.909 3.490 10 0 GGAEMN C[C@@H]1CCCc2nc(S(=O)(=O)Nc3cccc(Br)c3F)cn21 ZINC000656637050 566929717 /nfs/dbraw/zinc/92/97/17/566929717.db2.gz BHRXSKYPMNWKDR-SECBINFHSA-N 0 1 388.262 3.483 10 0 GGAEMN CC(C)CN(Cc1ccccc1Br)C(=O)[C@H](C)CN1CCOCC1 ZINC000544022588 566930059 /nfs/dbraw/zinc/93/00/59/566930059.db2.gz FVYFPZCWLCJFKS-MRXNPFEDSA-N 0 1 397.357 3.402 10 0 GGAEMN COc1cc(OC)cc(S(=O)(=O)Nc2cnc(C(F)(F)F)c(C)c2)c1 ZINC000656637962 566930459 /nfs/dbraw/zinc/93/04/59/566930459.db2.gz ROLWZMSWOANHKF-UHFFFAOYSA-N 0 1 376.356 3.227 10 0 GGAEMN COCc1ccc(NS(=O)(=O)c2ccc(OC)nc2)cc1C(F)(F)F ZINC000656634886 566930595 /nfs/dbraw/zinc/93/05/95/566930595.db2.gz JYYKTWIGBHJNNW-UHFFFAOYSA-N 0 1 376.356 3.056 10 0 GGAEMN Cc1cccc([C@H](C)NCC(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)c1 ZINC000452074491 566930711 /nfs/dbraw/zinc/93/07/11/566930711.db2.gz AXCPEWTUIUIQLX-ZDUSSCGKSA-N 0 1 380.897 3.341 10 0 GGAEMN O=C(CN[C@@H](c1cccs1)C1(CO)CCC1)Nc1nc2c(s1)CCC2 ZINC000452063570 566930734 /nfs/dbraw/zinc/93/07/34/566930734.db2.gz XBSYAQLWHNGDMV-INIZCTEOSA-N 0 1 377.535 3.125 10 0 GGAEMN COC[C@@H]1CCCN(CC(=O)N(C)Cc2cc(Br)cs2)CC1 ZINC000452085088 566931755 /nfs/dbraw/zinc/93/17/55/566931755.db2.gz NJSMTJGQIHHLQN-CYBMUJFWSA-N 0 1 389.359 3.218 10 0 GGAEMN NC(=O)[C@@H](N[C@H]1C[C@H](Oc2ccccc2)C1)c1ccc(Br)cc1 ZINC000656685669 566934138 /nfs/dbraw/zinc/93/41/38/566934138.db2.gz XGJWOBCVRHIWLU-XIRDDKMYSA-N 0 1 375.266 3.175 10 0 GGAEMN CC(C)N(CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)C[C@H](C)O ZINC000519340004 566934580 /nfs/dbraw/zinc/93/45/80/566934580.db2.gz KHJRTKBHIRZHAC-JTQLQIEISA-N 0 1 397.235 3.498 10 0 GGAEMN O=C(Nc1nc2ccc(F)cc2[nH]1)[C@H]1Cc2cc(Br)ccc2O1 ZINC000471166135 566934672 /nfs/dbraw/zinc/93/46/72/566934672.db2.gz UUERVQIVRPEFBO-CQSZACIVSA-N 0 1 376.185 3.407 10 0 GGAEMN O[C@@H](CNCc1cnc(C(F)(F)F)nc1)COc1ccc(Cl)c(Cl)c1 ZINC000656704146 566935098 /nfs/dbraw/zinc/93/50/98/566935098.db2.gz GLKPTHNJQRPHOZ-JTQLQIEISA-N 0 1 396.196 3.332 10 0 GGAEMN O=C(NCCC1(F)CCC1)c1n[nH]c2ccc(I)cc21 ZINC000563991197 566936120 /nfs/dbraw/zinc/93/61/20/566936120.db2.gz FCUWJMDGGRNBCL-UHFFFAOYSA-N 0 1 387.196 3.180 10 0 GGAEMN CC(C)N1CC[C@@H](N(C)S(=O)(=O)c2cccc(Br)c2Cl)C1 ZINC000452105283 566936771 /nfs/dbraw/zinc/93/67/71/566936771.db2.gz NPFRFGQXPKRCDY-LLVKDONJSA-N 0 1 395.750 3.206 10 0 GGAEMN CN(CCCc1nc(-c2cccs2)no1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O ZINC000471228137 566937923 /nfs/dbraw/zinc/93/79/23/566937923.db2.gz VACGXEHOGLTFEC-HIFRSBDPSA-N 0 1 383.539 3.018 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000519406359 566938127 /nfs/dbraw/zinc/93/81/27/566938127.db2.gz UAMDUVYHROYOFC-IAQYHMDHSA-N 0 1 378.270 3.357 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@@H]1C[C@H]1C1CCC1 ZINC000583325984 566941376 /nfs/dbraw/zinc/94/13/76/566941376.db2.gz GVSBUMIJJCVAMG-UONOGXRCSA-N 0 1 375.270 3.287 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1C[C@H]1C1CCC1 ZINC000583325984 566941382 /nfs/dbraw/zinc/94/13/82/566941382.db2.gz GVSBUMIJJCVAMG-UONOGXRCSA-N 0 1 375.270 3.287 10 0 GGAEMN COC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccc(OC)c(F)c1C ZINC000611912239 566942828 /nfs/dbraw/zinc/94/28/28/566942828.db2.gz KBNXUWDDEXPBRA-UHFFFAOYSA-N 0 1 387.816 3.384 10 0 GGAEMN CCN1CC[C@H]2OCCN(C(=O)c3ccc(-c4csc(C)n4)s3)[C@H]2C1 ZINC000633204047 566943697 /nfs/dbraw/zinc/94/36/97/566943697.db2.gz SVRUBBAREWFGFA-LSDHHAIUSA-N 0 1 377.535 3.115 10 0 GGAEMN Cc1cc(Br)c2c(c1)CCN(C(=O)N[C@H]1CCc3nc[nH]c3C1)C2 ZINC000633251486 566946412 /nfs/dbraw/zinc/94/64/12/566946412.db2.gz UMQJCKDSIPTZRL-ZDUSSCGKSA-N 0 1 389.297 3.106 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1cc(C)ccc1C(F)(F)F)C1CCOCC1 ZINC000656742174 566946942 /nfs/dbraw/zinc/94/69/42/566946942.db2.gz HSKYMNRLOBAOCB-HNNXBMFYSA-N 0 1 381.416 3.197 10 0 GGAEMN CN(Cc1ccc(Br)cc1F)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000633250569 566947598 /nfs/dbraw/zinc/94/75/98/566947598.db2.gz MONFFWDLASDYFJ-GFCCVEGCSA-N 0 1 381.249 3.010 10 0 GGAEMN O=C(Nc1cccc([C@H]2CNC(=O)C2)c1)c1ccc(Br)c(O)c1 ZINC000493567560 566950331 /nfs/dbraw/zinc/95/03/31/566950331.db2.gz ULKVWGPSESKSPV-GFCCVEGCSA-N 0 1 375.222 3.011 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)c1cc(C(F)(F)F)ccc1Br ZINC000493575585 566951285 /nfs/dbraw/zinc/95/12/85/566951285.db2.gz CPIAXJMDUARGSG-SECBINFHSA-N 0 1 388.187 3.478 10 0 GGAEMN C[C@H]1C[C@@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)CN1C1CC1 ZINC000612103526 566953555 /nfs/dbraw/zinc/95/35/55/566953555.db2.gz IUBIEMNGUQWVLZ-NKWVEPMBSA-N 0 1 395.194 3.361 10 0 GGAEMN COCCN1CCC[C@H](NC(=O)c2coc3c2cc(Br)cc3C)C1 ZINC000681179885 566956851 /nfs/dbraw/zinc/95/68/51/566956851.db2.gz UGKOSIADHZIARE-AWEZNQCLSA-N 0 1 395.297 3.344 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)NC[C@H](c1ccccc1)N1CCCC1 ZINC000656863375 566959858 /nfs/dbraw/zinc/95/98/58/566959858.db2.gz QQMQKJOOHIEWCK-GDBMZVCRSA-N 0 1 378.460 3.331 10 0 GGAEMN Cc1cc([C@@H](C)NCC(=O)Nc2cc(S(C)(=O)=O)ccc2F)c(C)s1 ZINC000544398929 566961303 /nfs/dbraw/zinc/96/13/03/566961303.db2.gz JKGRCBVBIAJSNR-LLVKDONJSA-N 0 1 384.498 3.197 10 0 GGAEMN C[C@@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Br)c1nnc[nH]1 ZINC000493923886 566962223 /nfs/dbraw/zinc/96/22/23/566962223.db2.gz AHDQIRDMZHEQLG-ZCFIWIBFSA-N 0 1 378.152 3.469 10 0 GGAEMN C[C@@H]1CN(C(=O)c2cc(Br)c(F)cc2[O-])CC[N@H+](C2CCC2)C1 ZINC000452326542 566962397 /nfs/dbraw/zinc/96/23/97/566962397.db2.gz LSUUVGVXYYQJPJ-NSHDSACASA-N 0 1 385.277 3.240 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000656873778 566963120 /nfs/dbraw/zinc/96/31/20/566963120.db2.gz MZERRBOUMYBLTM-GDBMZVCRSA-N 0 1 378.460 3.159 10 0 GGAEMN C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000612303491 566963217 /nfs/dbraw/zinc/96/32/17/566963217.db2.gz HUUZAQMKFISLPO-SVRRBLITSA-N 0 1 395.194 3.218 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 ZINC000656883842 566964302 /nfs/dbraw/zinc/96/43/02/566964302.db2.gz SIYRVVYVWWEJTK-YCPHGPKFSA-N 0 1 378.460 3.330 10 0 GGAEMN COc1ccc(Br)c(CN2CCC[C@@H](c3ccnc(N)n3)C2)c1 ZINC000564304046 566964367 /nfs/dbraw/zinc/96/43/67/566964367.db2.gz QCYHOQOVEXQCEQ-GFCCVEGCSA-N 0 1 377.286 3.040 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2cc(Cl)c(OC)cc2OC)ccc1F ZINC000471595251 566964622 /nfs/dbraw/zinc/96/46/22/566964622.db2.gz SQFMTLGKFNACKU-UHFFFAOYSA-N 0 1 375.805 3.306 10 0 GGAEMN O=S(=O)(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(Cl)cc1Cl ZINC000429909216 566965511 /nfs/dbraw/zinc/96/55/11/566965511.db2.gz NXJDNWGNWQOXBY-UHFFFAOYSA-N 0 1 397.287 3.300 10 0 GGAEMN CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](CO)c2ccsc2)cc1 ZINC000471617183 566965514 /nfs/dbraw/zinc/96/55/14/566965514.db2.gz GWTSWSUZBQADLU-RDTXWAMCSA-N 0 1 382.551 3.163 10 0 GGAEMN CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](CO)c2ccsc2)cc1 ZINC000471617182 566965526 /nfs/dbraw/zinc/96/55/26/566965526.db2.gz GWTSWSUZBQADLU-KSSFIOAISA-N 0 1 382.551 3.163 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2c(F)cc(Br)cc2C1 ZINC000612336177 566965588 /nfs/dbraw/zinc/96/55/88/566965588.db2.gz BEQFVMNAHAUTER-JTQLQIEISA-N 0 1 378.245 3.001 10 0 GGAEMN O=C(NC[C@H]1CCCN1CCCO)c1sc2ccccc2c1Br ZINC000452360328 566968037 /nfs/dbraw/zinc/96/80/37/566968037.db2.gz INICXFCOORURCP-GFCCVEGCSA-N 0 1 397.338 3.240 10 0 GGAEMN O=C(c1ccc(Br)c(F)c1)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633525342 566968263 /nfs/dbraw/zinc/96/82/63/566968263.db2.gz BGGHLBQPGGNGHE-UHFFFAOYSA-N 0 1 394.244 3.016 10 0 GGAEMN Cc1csc(C(=O)N2CCc3nc[nH]c3C23CCOCC3)c1Br ZINC000633527159 566968463 /nfs/dbraw/zinc/96/84/63/566968463.db2.gz KOIKBIMGYPDCJS-UHFFFAOYSA-N 0 1 396.310 3.246 10 0 GGAEMN O=C(CSc1ccc(Cl)cc1)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633524825 566968864 /nfs/dbraw/zinc/96/88/64/566968864.db2.gz QSJICWCSNHHIJE-UHFFFAOYSA-N 0 1 377.897 3.246 10 0 GGAEMN Cc1ccc(Br)cc1C(=O)N1CCc2nc[nH]c2C12CCOCC2 ZINC000633526486 566969399 /nfs/dbraw/zinc/96/93/99/566969399.db2.gz RCRBRSZPOHRALQ-UHFFFAOYSA-N 0 1 390.281 3.185 10 0 GGAEMN O=C(NC[C@@H]1CCCCN1CCO)c1sc2ccccc2c1Br ZINC000452380645 566971856 /nfs/dbraw/zinc/97/18/56/566971856.db2.gz SYYJUPBBGPTNJU-LBPRGKRZSA-N 0 1 397.338 3.240 10 0 GGAEMN CCC[C@H](C)[C@H](CO)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000519829659 566971953 /nfs/dbraw/zinc/97/19/53/566971953.db2.gz QFXSGAXFXVMXRR-BHDSKKPTSA-N 0 1 383.341 3.089 10 0 GGAEMN O=C(CCc1c[nH]nn1)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000633594630 566972271 /nfs/dbraw/zinc/97/22/71/566972271.db2.gz VHDRWHZIYCJILS-UHFFFAOYSA-N 0 1 388.686 3.046 10 0 GGAEMN O=C(CCc1cnn[nH]1)N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000633594630 566972275 /nfs/dbraw/zinc/97/22/75/566972275.db2.gz VHDRWHZIYCJILS-UHFFFAOYSA-N 0 1 388.686 3.046 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1ccc(Br)cc1)C(C)C ZINC000564407064 566972658 /nfs/dbraw/zinc/97/26/58/566972658.db2.gz RIHHSONJKAMFPI-UHFFFAOYSA-N 0 1 391.375 3.331 10 0 GGAEMN COc1cc(Cl)c(Br)cc1C(=O)N(C)[C@H]1CN2CCC1CC2 ZINC000429985008 566972927 /nfs/dbraw/zinc/97/29/27/566972927.db2.gz JKSYHMUWJKUDGG-AWEZNQCLSA-N 0 1 387.705 3.277 10 0 GGAEMN O=S(=O)(NCC[C@H](O)C(F)(F)F)c1c(Cl)cc(Cl)cc1Cl ZINC000544611801 566973467 /nfs/dbraw/zinc/97/34/67/566973467.db2.gz JWFYBYSOCYJZMB-QMMMGPOBSA-N 0 1 386.606 3.238 10 0 GGAEMN O=C(NC[C@H]1CCCCN1CCO)c1csc(-c2ccccc2Cl)n1 ZINC000452395923 566975119 /nfs/dbraw/zinc/97/51/19/566975119.db2.gz XHYYNKJVNSKSFX-CYBMUJFWSA-N 0 1 379.913 3.040 10 0 GGAEMN C[C@@H](Cc1ccc(F)c(Br)c1)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000612515621 566978391 /nfs/dbraw/zinc/97/83/91/566978391.db2.gz LYGHHBIGWQICKC-JQWIXIFHSA-N 0 1 380.261 3.164 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000656933404 566978462 /nfs/dbraw/zinc/97/84/62/566978462.db2.gz OFYUZVUGDIPSAC-FMKPAKJESA-N 0 1 378.460 3.157 10 0 GGAEMN CC(C)c1nc(CNC(=O)CSCc2cc(-c3cccs3)on2)n[nH]1 ZINC000452418945 566978843 /nfs/dbraw/zinc/97/88/43/566978843.db2.gz OCKWHGXDDZPSBN-UHFFFAOYSA-N 0 1 377.495 3.194 10 0 GGAEMN COc1ccc(CCC(=O)N[C@@H]2CCCc3cn[nH]c32)c(Br)c1 ZINC000612533496 566979192 /nfs/dbraw/zinc/97/91/92/566979192.db2.gz UNMHNAILAGZQBK-OAHLLOKOSA-N 0 1 378.270 3.307 10 0 GGAEMN CN(C)c1ccc(NS(=O)(=O)c2cccc(Cl)c2Br)cn1 ZINC000430071708 566980125 /nfs/dbraw/zinc/98/01/25/566980125.db2.gz PLXVEOJSWGWBNO-UHFFFAOYSA-N 0 1 390.690 3.364 10 0 GGAEMN OCCN(CCOCC(F)(F)C(F)F)Cc1cc(Br)cs1 ZINC000494278542 566980469 /nfs/dbraw/zinc/98/04/69/566980469.db2.gz ASGSMVPUGNNBRZ-UHFFFAOYSA-N 0 1 394.228 3.222 10 0 GGAEMN COc1cccc(OCCN(CCO)Cc2cc(Br)cs2)c1 ZINC000494277703 566981110 /nfs/dbraw/zinc/98/11/10/566981110.db2.gz TXURQAVKVDRRLJ-UHFFFAOYSA-N 0 1 386.311 3.393 10 0 GGAEMN C/C(=C\c1cccc(C(F)(F)F)c1)CN(C)[C@H]1CCN(S(C)(=O)=O)C1 ZINC000430100314 566981781 /nfs/dbraw/zinc/98/17/81/566981781.db2.gz ASLQCIZPZSNBIW-WQMJKPAKSA-N 0 1 376.444 3.074 10 0 GGAEMN Cc1n[nH]c(C(C)C)c1C(=O)NCC(=O)c1ccc(Br)c(F)c1 ZINC000633709424 566982652 /nfs/dbraw/zinc/98/26/52/566982652.db2.gz LMRGXXGLJZFYQW-UHFFFAOYSA-N 0 1 382.233 3.356 10 0 GGAEMN O=S(=O)(N[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1c(F)cccc1F ZINC000564524521 566983404 /nfs/dbraw/zinc/98/34/04/566983404.db2.gz XUCCFXNOJNMCBJ-MFKMUULPSA-N 0 1 375.343 3.401 10 0 GGAEMN COc1ccccc1OCCN(CCO)Cc1cc(Br)cs1 ZINC000494290056 566983732 /nfs/dbraw/zinc/98/37/32/566983732.db2.gz IAOWFGLXCVZQLY-UHFFFAOYSA-N 0 1 386.311 3.393 10 0 GGAEMN COc1ccc(CCC(=O)N[C@H](C)Cc2cc(C)[nH]n2)c(Br)c1 ZINC000612602832 566984274 /nfs/dbraw/zinc/98/42/74/566984274.db2.gz KNTAHEZZVDVWLL-LLVKDONJSA-N 0 1 380.286 3.169 10 0 GGAEMN COc1ccc(CCC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)c(Br)c1 ZINC000612602833 566984335 /nfs/dbraw/zinc/98/43/35/566984335.db2.gz KNTAHEZZVDVWLL-NSHDSACASA-N 0 1 380.286 3.169 10 0 GGAEMN C[C@H](CC(F)(F)F)CS(=O)(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000656960921 566984500 /nfs/dbraw/zinc/98/45/00/566984500.db2.gz QJZNKSHKXZRLOF-FMKPAKJESA-N 0 1 378.460 3.015 10 0 GGAEMN C[C@@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@@H](c1ccccc1)N(C)C ZINC000583831337 566987048 /nfs/dbraw/zinc/98/70/48/566987048.db2.gz LYFAXXHUZNLUAN-DYVFJYSZSA-N 0 1 389.293 3.439 10 0 GGAEMN CCCSc1nc(=NC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)s[n-]1 ZINC000471944075 566989186 /nfs/dbraw/zinc/98/91/86/566989186.db2.gz PYBREBMLNAYZBP-UONOGXRCSA-N 0 1 377.539 3.029 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1coc(C2CC2)n1 ZINC000681634211 566996461 /nfs/dbraw/zinc/99/64/61/566996461.db2.gz YDIXAZAOTYKRIW-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1coc(C2CC2)n1 ZINC000681634211 566996465 /nfs/dbraw/zinc/99/64/65/566996465.db2.gz YDIXAZAOTYKRIW-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN CC[C@@H](C(=O)N1CC2(CCOCC2)c2ccc(Br)cc21)N(C)C ZINC000633846987 566997903 /nfs/dbraw/zinc/99/79/03/566997903.db2.gz AWQFGVXMBFESQJ-HNNXBMFYSA-N 0 1 381.314 3.184 10 0 GGAEMN COc1ccc(Br)c(CN(C)C(=O)CCSc2nnc(C)[nH]2)c1 ZINC000430184466 566999571 /nfs/dbraw/zinc/99/95/71/566999571.db2.gz AQSZEJNRDSRSDG-UHFFFAOYSA-N 0 1 399.314 3.025 10 0 GGAEMN CC[C@@H]1Cc2c(Br)cccc2CN1C[C@@H](O)COC[C@H]1CCCO1 ZINC000583974088 567000026 /nfs/dbraw/zinc/00/00/26/567000026.db2.gz GYDUTPCNIJUAJX-BRWVUGGUSA-N 0 1 398.341 3.142 10 0 GGAEMN C[C@@H](NC[C@H]1CS(=O)(=O)c2ccccc2O1)c1cccc(Br)c1 ZINC000520406504 567002901 /nfs/dbraw/zinc/00/29/01/567002901.db2.gz JECBWYHEFMSVAW-DOMZBBRYSA-N 0 1 396.306 3.335 10 0 GGAEMN Cc1c(Br)cccc1CS(=O)(=O)NC[C@H]1CCN1C(C)(C)C ZINC000657033700 567003667 /nfs/dbraw/zinc/00/36/67/567003667.db2.gz GOWIEEFNEUWXEA-CQSZACIVSA-N 0 1 389.359 3.050 10 0 GGAEMN C[C@@H]1CN(CCOc2ccc(Br)cc2)C[C@@]2(CCO[C@H](C)C2)O1 ZINC000430271528 567003907 /nfs/dbraw/zinc/00/39/07/567003907.db2.gz VJVGGEZPGQXNNS-RKVPGOIHSA-N 0 1 384.314 3.486 10 0 GGAEMN COc1cc(Br)ccc1CNC(=O)N[C@@H](C)c1n[nH]c(C(C)C)n1 ZINC000430276846 567004027 /nfs/dbraw/zinc/00/40/27/567004027.db2.gz MRVSQPXFAZZHHY-JTQLQIEISA-N 0 1 396.289 3.260 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2cccc(C[S@](C)=O)c2)c2ccccc2n1C ZINC000564742515 567004221 /nfs/dbraw/zinc/00/42/21/567004221.db2.gz AZGVHCXOCYULEB-DEOSSOPVSA-N 0 1 376.503 3.166 10 0 GGAEMN CCN1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)C[C@@H]1C ZINC000612953470 567004451 /nfs/dbraw/zinc/00/44/51/567004451.db2.gz NBJGRGJRGPNRPJ-AWEZNQCLSA-N 0 1 380.330 3.216 10 0 GGAEMN C[C@H](Sc1ccccc1Cl)C(=O)NCc1n[nH]c(C2CCOCC2)n1 ZINC000633991833 567008240 /nfs/dbraw/zinc/00/82/40/567008240.db2.gz XYJWRRBHHPKXQK-NSHDSACASA-N 0 1 380.901 3.149 10 0 GGAEMN C[C@H](Cc1cc(Br)ccc1F)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000612987734 567008797 /nfs/dbraw/zinc/00/87/97/567008797.db2.gz NMBKZMAAFIIELW-MNOVXSKESA-N 0 1 380.261 3.164 10 0 GGAEMN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000612987736 567008835 /nfs/dbraw/zinc/00/88/35/567008835.db2.gz NMBKZMAAFIIELW-WDEREUQCSA-N 0 1 380.261 3.164 10 0 GGAEMN Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2nc([C@H](N)CC(C)C)no2)s1 ZINC000564798571 567008950 /nfs/dbraw/zinc/00/89/50/567008950.db2.gz XZOVHOCUFPPJDF-CHWSQXEVSA-N 0 1 384.527 3.011 10 0 GGAEMN Cc1ccc(Br)c(C)c1C(=O)NCc1n[nH]c(C2CCOCC2)n1 ZINC000634004715 567010601 /nfs/dbraw/zinc/01/06/01/567010601.db2.gz DPQMEKSLCMEMAJ-UHFFFAOYSA-N 0 1 393.285 3.008 10 0 GGAEMN COC(=O)c1ccc(S(=O)(=O)Nc2c3c(ccc2Cl)CC(C)(C)O3)o1 ZINC000430371889 567012416 /nfs/dbraw/zinc/01/24/16/567012416.db2.gz AOABDEBDPRXHHF-UHFFFAOYSA-N 0 1 385.825 3.234 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCCS(=O)(=O)c1cc(Cl)ccc1Cl ZINC000494643406 567013189 /nfs/dbraw/zinc/01/31/89/567013189.db2.gz QLLWOXXFQYJSML-CYBMUJFWSA-N 0 1 394.345 3.460 10 0 GGAEMN O[C@@H](CNCc1cn2cc(Cl)ccc2n1)COCc1ccccc1Cl ZINC000564845388 567013172 /nfs/dbraw/zinc/01/31/72/567013172.db2.gz XCMWBLKEWSQRJW-INIZCTEOSA-N 0 1 380.275 3.308 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)N[C@H](C)c1ccc(Br)cc1 ZINC000494644542 567013252 /nfs/dbraw/zinc/01/32/52/567013252.db2.gz CGOZBANWQCMJML-IUODEOHRSA-N 0 1 397.338 3.319 10 0 GGAEMN Cc1ccsc1[C@H](CO)NCC(=O)NCCc1cccc(Cl)c1Cl ZINC000494644246 567013419 /nfs/dbraw/zinc/01/34/19/567013419.db2.gz ZWAWWGLBVLRLSV-AWEZNQCLSA-N 0 1 387.332 3.345 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)c2c(F)c(F)c(Br)c(F)c2F)n[nH]1 ZINC000613125129 567015947 /nfs/dbraw/zinc/01/59/47/567015947.db2.gz YDBHZNXIABSDPG-BYPYZUCNSA-N 0 1 395.154 3.177 10 0 GGAEMN Cc1nnc(SCCC(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[nH][nH]2)[nH]1 ZINC000584152235 567017348 /nfs/dbraw/zinc/01/73/48/567017348.db2.gz HIRJXRRXRBVUOT-UHFFFAOYSA-N 0 1 397.291 3.353 10 0 GGAEMN Cc1ccsc1[C@@H](CO)NCC(=O)N(C)Cc1ccccc1Br ZINC000494688149 567017666 /nfs/dbraw/zinc/01/76/66/567017666.db2.gz SFWRIDLVGHKYAN-OAHLLOKOSA-N 0 1 397.338 3.101 10 0 GGAEMN Cc1c(Br)cncc1C(=O)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 ZINC000613152887 567017943 /nfs/dbraw/zinc/01/79/43/567017943.db2.gz WWKKSZYPECZRBA-GFCCVEGCSA-N 0 1 390.285 3.168 10 0 GGAEMN CCOC[C@H](C)NC(=O)c1sccc1S(=O)(=O)Nc1ccc(C)cc1 ZINC000494716528 567018869 /nfs/dbraw/zinc/01/88/69/567018869.db2.gz DNHSUQNSEJWICW-ZDUSSCGKSA-N 0 1 382.507 3.012 10 0 GGAEMN C[C@H]1CN(C(=O)c2cc(Br)cc(N3CCCC3)c2)[C@@H](C)CN1C ZINC000613190964 567019304 /nfs/dbraw/zinc/01/93/04/567019304.db2.gz KNERVKXKMKVREW-KBPBESRZSA-N 0 1 380.330 3.214 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCc2sccc2[C@H]1c1cccs1 ZINC000584201550 567021110 /nfs/dbraw/zinc/02/11/10/567021110.db2.gz ZAGXJXXHTSZEHT-KRWDZBQOSA-N 0 1 384.592 3.429 10 0 GGAEMN C[C@](N)(C(=O)N[C@H]1C[C@]1(F)c1ccccc1)c1ccc(Br)cc1 ZINC000564941709 567022557 /nfs/dbraw/zinc/02/25/57/567022557.db2.gz BPXRPDUDTVMFIG-JQHSSLGASA-N 0 1 377.257 3.377 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCc3cccc(Br)c3C2)CC1 ZINC000545151070 567022733 /nfs/dbraw/zinc/02/27/33/567022733.db2.gz AAXAUTNIPRWWOR-UHFFFAOYSA-N 0 1 378.314 3.169 10 0 GGAEMN CCN(CCc1nccs1)C(=O)[C@](C)(N)c1ccc(Br)cc1 ZINC000564935252 567022983 /nfs/dbraw/zinc/02/29/83/567022983.db2.gz UTUGXIKVOVMQEJ-MRXNPFEDSA-N 0 1 382.327 3.171 10 0 GGAEMN C[C@@H]1C[C@@H](Nc2ncnc3cccc(I)c32)C[N@H+]1C1CC1 ZINC000545163191 567023592 /nfs/dbraw/zinc/02/35/92/567023592.db2.gz AWMRTOJVSVECBC-GHMZBOCLSA-N 0 1 394.260 3.272 10 0 GGAEMN CC(C)[C@@H]1C[N@@H+](C)CCN1c1ncnc2cccc(I)c21 ZINC000545164031 567023711 /nfs/dbraw/zinc/02/37/11/567023711.db2.gz HFXJGNDSVJZZPK-AWEZNQCLSA-N 0 1 396.276 3.011 10 0 GGAEMN CC1=CCN(CCNC(=O)Nc2cccc(I)c2)CC1 ZINC000545155966 567024119 /nfs/dbraw/zinc/02/41/19/567024119.db2.gz DZFFAHVOIAVASW-UHFFFAOYSA-N 0 1 385.249 3.065 10 0 GGAEMN C[C@@H]1C[C@H](Nc2ncnc3cccc(I)c32)C[N@H+]1C1CC1 ZINC000545163192 567024389 /nfs/dbraw/zinc/02/43/89/567024389.db2.gz AWMRTOJVSVECBC-MNOVXSKESA-N 0 1 394.260 3.272 10 0 GGAEMN CC(C)C[C@H](N)c1noc(Cc2csc(NC(=O)c3cccs3)n2)n1 ZINC000520811475 567025850 /nfs/dbraw/zinc/02/58/50/567025850.db2.gz KBTGBTCRKCQJTG-NSHDSACASA-N 0 1 377.495 3.477 10 0 GGAEMN Cc1cc(C(=O)N(C)[C@H]2CCCN(C)C2)nn1-c1ccc(Br)cc1 ZINC000430646229 567026451 /nfs/dbraw/zinc/02/64/51/567026451.db2.gz WEDLGXDHCSKFOR-INIZCTEOSA-N 0 1 391.313 3.109 10 0 GGAEMN COc1cnccc1[C@@H](C)NC[C@H](O)COc1cc(F)cc(Br)c1 ZINC000584270530 567027100 /nfs/dbraw/zinc/02/71/00/567027100.db2.gz GIPZYFTZBRIMDU-RISCZKNCSA-N 0 1 399.260 3.082 10 0 GGAEMN COc1cnccc1[C@H](C)NC[C@H](O)COc1cc(F)cc(Br)c1 ZINC000584270529 567027321 /nfs/dbraw/zinc/02/73/21/567027321.db2.gz GIPZYFTZBRIMDU-FZMZJTMJSA-N 0 1 399.260 3.082 10 0 GGAEMN C[N@@H+](CCCC(=O)[O-])CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1 ZINC000430667968 567027600 /nfs/dbraw/zinc/02/76/00/567027600.db2.gz GWGQLKQXUGLWEL-UHFFFAOYSA-N 0 1 397.191 3.203 10 0 GGAEMN C[C@]1(CCNS(=O)(=O)c2cc(Br)c(F)cc2F)CC1(F)F ZINC000657160776 567028592 /nfs/dbraw/zinc/02/85/92/567028592.db2.gz VHOKSEAZQNGFCG-NSHDSACASA-N 0 1 390.196 3.441 10 0 GGAEMN Cc1cscc1CN[C@@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000430724598 567030701 /nfs/dbraw/zinc/03/07/01/567030701.db2.gz OLJGHLXGKXYZGV-JTQLQIEISA-N 0 1 389.340 3.317 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1cc2c(ccc(F)c2Br)[nH]1 ZINC000584298755 567031741 /nfs/dbraw/zinc/03/17/41/567031741.db2.gz JGTKIKZFCVJQAI-QMMMGPOBSA-N 0 1 377.217 3.080 10 0 GGAEMN Cn1cc(C[C@@H]2CCC[C@@H]2NS(=O)(=O)c2c(Cl)ccc(F)c2F)cn1 ZINC000657180131 567033081 /nfs/dbraw/zinc/03/30/81/567033081.db2.gz ZTWYMTTTYCXCNA-FZMZJTMJSA-N 0 1 389.855 3.041 10 0 GGAEMN O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCc2cc[nH]c(=O)c2C1 ZINC000494902686 567033692 /nfs/dbraw/zinc/03/36/92/567033692.db2.gz JSTJHXYEIHPZQB-UHFFFAOYSA-N 0 1 399.248 3.138 10 0 GGAEMN Cc1ccc(CN2CC[C@H](NC(=O)c3c(F)cncc3Br)C2)cc1 ZINC000634459297 567034589 /nfs/dbraw/zinc/03/45/89/567034589.db2.gz RLBHAYKXJDDBLK-AWEZNQCLSA-N 0 1 392.272 3.296 10 0 GGAEMN O[C@@H](COc1ccc(Cl)cc1Cl)CN1CCC[C@@H](c2ccncn2)C1 ZINC000613380589 567035440 /nfs/dbraw/zinc/03/54/40/567035440.db2.gz JTRXGTWCMCMSGA-UKRRQHHQSA-N 0 1 382.291 3.403 10 0 GGAEMN CC1(C)NC(=O)CC[C@H]1NCc1ccc(Cl)cc1I ZINC000494976062 567035785 /nfs/dbraw/zinc/03/57/85/567035785.db2.gz FSBHMEXKHHYIQU-GFCCVEGCSA-N 0 1 392.668 3.091 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CC[C@H](O)[C@H]2CCCC[C@H]21 ZINC000634492702 567035883 /nfs/dbraw/zinc/03/58/83/567035883.db2.gz KHIPWHLJWWYEMW-GLQYFDAESA-N 0 1 378.270 3.091 10 0 GGAEMN Brc1ccc2nc(CN3CCN(Cc4ccccc4)CC3)cn2c1 ZINC000613398800 567036519 /nfs/dbraw/zinc/03/65/19/567036519.db2.gz FYGFCVKMTDJDJS-UHFFFAOYSA-N 0 1 385.309 3.415 10 0 GGAEMN C[C@]1(NC(=O)c2ncsc2Br)CCN(Cc2ccccc2)C1 ZINC000565065746 567036460 /nfs/dbraw/zinc/03/64/60/567036460.db2.gz XKVDBNBHDOEUNS-INIZCTEOSA-N 0 1 380.311 3.300 10 0 GGAEMN O[C@@H](COc1cc(F)cc(Br)c1)CN1CCC[C@H](OC(F)F)C1 ZINC000682219801 567037794 /nfs/dbraw/zinc/03/77/94/567037794.db2.gz VAQWGLCEWWEDPH-OLZOCXBDSA-N 0 1 398.219 3.032 10 0 GGAEMN O=C(Cc1ccc(Br)cc1O)NC[C@H](c1ccco1)N1CCCC1 ZINC000430889958 567038630 /nfs/dbraw/zinc/03/86/30/567038630.db2.gz QNFPIDHOLHZKHP-OAHLLOKOSA-N 0 1 393.281 3.244 10 0 GGAEMN CC(C)(C)n1cc(Br)c(C(=O)N=c2ncn(C3CCCCC3)[nH]2)n1 ZINC000613451976 567039036 /nfs/dbraw/zinc/03/90/36/567039036.db2.gz RIHYWLBHDWGRER-UHFFFAOYSA-N 0 1 395.305 3.172 10 0 GGAEMN CO[C@H](CSc1nc(-c2ccccc2Br)n[nH]1)[C@H]1CCOC1 ZINC000657233139 567039341 /nfs/dbraw/zinc/03/93/41/567039341.db2.gz RREFRDNRVSEIHR-GXFFZTMASA-N 0 1 384.299 3.378 10 0 GGAEMN CO[C@H](CSc1nc(-c2ccccc2Br)n[nH]1)[C@@H]1CCOC1 ZINC000657233143 567039593 /nfs/dbraw/zinc/03/95/93/567039593.db2.gz RREFRDNRVSEIHR-ZWNOBZJWSA-N 0 1 384.299 3.378 10 0 GGAEMN NC(=O)[C@H](N[C@@H]1[C@H]2Cc3c(cccc3Br)[C@@H]12)c1ccc(F)cc1 ZINC000634576544 567039562 /nfs/dbraw/zinc/03/95/62/567039562.db2.gz UNCHREZRJMYLAS-RKTXRCNFSA-N 0 1 375.241 3.043 10 0 GGAEMN Cn1ccc2c1cccc2NS(=O)(=O)c1cc2c(cc1Cl)OCCO2 ZINC000521075216 567039625 /nfs/dbraw/zinc/03/96/25/567039625.db2.gz WKAABVLBFKAQJQ-UHFFFAOYSA-N 0 1 378.837 3.404 10 0 GGAEMN NC(=O)[C@H](NCC1([C@@H]2CCCCO2)CCC1)c1cccc(Br)c1 ZINC000634580164 567040035 /nfs/dbraw/zinc/04/00/35/567040035.db2.gz ZZKGWVDAJNVPLS-JKSUJKDBSA-N 0 1 381.314 3.305 10 0 GGAEMN NC(=O)[C@@H](N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12)c1ccc(F)cc1 ZINC000634577447 567040816 /nfs/dbraw/zinc/04/08/16/567040816.db2.gz MJPLTJPCUQGKGG-VVLHAWIVSA-N 0 1 375.241 3.043 10 0 GGAEMN NC(=O)[C@H](NCC1([C@@H]2CCCCO2)CCC1)c1ccc(Br)cc1 ZINC000634579289 567040913 /nfs/dbraw/zinc/04/09/13/567040913.db2.gz BMDYLLNIEHQFOV-JKSUJKDBSA-N 0 1 381.314 3.305 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3ccc(Br)cc3C)[nH]c21 ZINC000472605123 567041539 /nfs/dbraw/zinc/04/15/39/567041539.db2.gz WZZSSHRGZZQCRJ-UHFFFAOYSA-N 0 1 394.294 3.421 10 0 GGAEMN C[C@@](O)(C[C@H](O)CSc1nc(-c2ccccc2Br)n[nH]1)C1CC1 ZINC000634639362 567042359 /nfs/dbraw/zinc/04/23/59/567042359.db2.gz HNJNNMCUVRWSMM-MEDUHNTESA-N 0 1 398.326 3.238 10 0 GGAEMN C[C@@](O)(C[C@@H](O)CSc1nc(-c2ccccc2Br)n[nH]1)C1CC1 ZINC000634639360 567042879 /nfs/dbraw/zinc/04/28/79/567042879.db2.gz HNJNNMCUVRWSMM-BDJLRTHQSA-N 0 1 398.326 3.238 10 0 GGAEMN CC(C)c1nc(CS(=O)(=O)c2ccc(Br)c(Cl)c2)n[nH]1 ZINC000453027246 567043731 /nfs/dbraw/zinc/04/37/31/567043731.db2.gz AROKTRRRIAWRTG-UHFFFAOYSA-N 0 1 378.679 3.318 10 0 GGAEMN COc1cccc([C@@H](CNCc2c(F)cncc2Br)N(C)C)c1 ZINC000657285405 567044240 /nfs/dbraw/zinc/04/42/40/567044240.db2.gz CADBXDLETIXBON-QGZVFWFLSA-N 0 1 382.277 3.384 10 0 GGAEMN O[C@]1(CSc2nnc(C(F)(F)F)s2)CCN(Cc2ccccc2)C1 ZINC000634648501 567045063 /nfs/dbraw/zinc/04/50/63/567045063.db2.gz SFOXTJGGGHTRCW-CQSZACIVSA-N 0 1 375.441 3.286 10 0 GGAEMN Cc1oc(C[N@@H+](C)C[C@H](O)COc2c(Cl)cccc2Cl)cc1C(=O)[O-] ZINC000584475670 567045691 /nfs/dbraw/zinc/04/56/91/567045691.db2.gz UKBCHDCJIAZBHY-NSHDSACASA-N 0 1 388.247 3.465 10 0 GGAEMN Cn1ncc(C(F)(F)F)c1CNC[C@@H](O)COc1cccc(Cl)c1Cl ZINC000657330530 567047428 /nfs/dbraw/zinc/04/74/28/567047428.db2.gz SCDNGVJWBHFGAX-SECBINFHSA-N 0 1 398.212 3.275 10 0 GGAEMN Cn1ncc(C2CCC2)c1CNCc1cc2c(c(Br)c1)OCO2 ZINC000657330254 567047864 /nfs/dbraw/zinc/04/78/64/567047864.db2.gz MUGDJQNDTQPGMF-UHFFFAOYSA-N 0 1 378.270 3.469 10 0 GGAEMN C[C@@H](N[C@H](Cc1ccccc1)C(=O)N(C)C)c1cncc(Br)c1 ZINC000565243727 567049421 /nfs/dbraw/zinc/04/94/21/567049421.db2.gz OOIXNSWQWRJHSQ-CXAGYDPISA-N 0 1 376.298 3.194 10 0 GGAEMN COc1ccc(CCNCc2c(F)cncc2Br)c(OC)c1OC ZINC000657345314 567049649 /nfs/dbraw/zinc/04/96/49/567049649.db2.gz OHGMHUQJDCDWMO-UHFFFAOYSA-N 0 1 399.260 3.341 10 0 GGAEMN O=S(=O)(Nc1ccnn1CC1CCC1)c1cscc1Br ZINC000634664271 567049940 /nfs/dbraw/zinc/04/99/40/567049940.db2.gz WPTKJNQTSSMEHT-UHFFFAOYSA-N 0 1 376.301 3.308 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@@H]1Cc2ccccc2CN1 ZINC000584531149 567050479 /nfs/dbraw/zinc/05/04/79/567050479.db2.gz VZORQWUMVODYBM-PXAZEXFGSA-N 0 1 389.293 3.349 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)[C@H]1Cc2ccccc2CN1 ZINC000584531152 567050802 /nfs/dbraw/zinc/05/08/02/567050802.db2.gz VZORQWUMVODYBM-YVEFUNNKSA-N 0 1 389.293 3.349 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1CC[C@@H](OC)C[C@H]1C(=O)[O-] ZINC000565255438 567052033 /nfs/dbraw/zinc/05/20/33/567052033.db2.gz SBFJGPWTYIGTAR-CABCVRRESA-N 0 1 386.286 3.302 10 0 GGAEMN CCCOc1ccc(Br)cc1C[N@H+]1CC[C@H](OC)C[C@@H]1C(=O)[O-] ZINC000565255446 567052460 /nfs/dbraw/zinc/05/24/60/567052460.db2.gz SBFJGPWTYIGTAR-LSDHHAIUSA-N 0 1 386.286 3.302 10 0 GGAEMN CCc1cc(N2CCC[C@@H](NCc3c(F)cncc3Br)C2)ncn1 ZINC000657358433 567052479 /nfs/dbraw/zinc/05/24/79/567052479.db2.gz DEFXWGRKQQOKDT-CYBMUJFWSA-N 0 1 394.292 3.094 10 0 GGAEMN O[C@@H](CN[C@@H](c1ccsc1)c1ccc(Cl)cc1)CC1(O)CCOCC1 ZINC000634700928 567054246 /nfs/dbraw/zinc/05/42/46/567054246.db2.gz HRIPCVKTDNKCLQ-QZTJIDSGSA-N 0 1 381.925 3.373 10 0 GGAEMN OC[C@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Br)c1 ZINC000657398707 567054624 /nfs/dbraw/zinc/05/46/24/567054624.db2.gz FOJUKCNUQSMHQM-MOPGFXCFSA-N 0 1 392.293 3.440 10 0 GGAEMN Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NC[C@H]1CCCCN1CCO ZINC000584571792 567055943 /nfs/dbraw/zinc/05/59/43/567055943.db2.gz XHFIWTQNFSHWQC-GFCCVEGCSA-N 0 1 399.969 3.410 10 0 GGAEMN C[S@](=O)c1cccc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)c1 ZINC000613705008 567056813 /nfs/dbraw/zinc/05/68/13/567056813.db2.gz CLWRFCZPYRGABK-MQNRADLISA-N 0 1 376.547 3.128 10 0 GGAEMN OC[C@@H](CNCc1c(F)cncc1Br)Cc1ccc(F)c(F)c1 ZINC000657448703 567057058 /nfs/dbraw/zinc/05/70/58/567057058.db2.gz WHLFFCAJKMMUIF-LLVKDONJSA-N 0 1 389.215 3.202 10 0 GGAEMN C[S@@](=O)c1cccc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)c1 ZINC000613705010 567057388 /nfs/dbraw/zinc/05/73/88/567057388.db2.gz CLWRFCZPYRGABK-SGANQWHYSA-N 0 1 376.547 3.128 10 0 GGAEMN CCn1ccnc1[C@H](C)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000453154062 567057567 /nfs/dbraw/zinc/05/75/67/567057567.db2.gz ZCNNESHJHJJAKM-NSHDSACASA-N 0 1 375.274 3.301 10 0 GGAEMN CCn1ccnc1[C@H](C)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000453154062 567057574 /nfs/dbraw/zinc/05/75/74/567057574.db2.gz ZCNNESHJHJJAKM-NSHDSACASA-N 0 1 375.274 3.301 10 0 GGAEMN OC[C@]1(CNCc2c(F)cncc2Br)C[C@@H]1c1ccc(F)cc1 ZINC000657449205 567058396 /nfs/dbraw/zinc/05/83/96/567058396.db2.gz QZWBETNMJMKCRR-RHSMWYFYSA-N 0 1 383.236 3.378 10 0 GGAEMN CCCC[C@@H](NCc1ccc(Br)cc1)C(=O)Nc1cc(C)on1 ZINC000495499156 567062444 /nfs/dbraw/zinc/06/24/44/567062444.db2.gz DKBGGAQSSSZGSY-OAHLLOKOSA-N 0 1 380.286 3.455 10 0 GGAEMN CCCC[C@H](NCc1ccc(Br)cc1)C(=O)Nc1cc(C)on1 ZINC000495499155 567062684 /nfs/dbraw/zinc/06/26/84/567062684.db2.gz DKBGGAQSSSZGSY-HNNXBMFYSA-N 0 1 380.286 3.455 10 0 GGAEMN COCc1cc(Cl)cc(S(=O)(=O)Nc2ccc(C(N)=O)c(Cl)c2)c1 ZINC000565395520 567063705 /nfs/dbraw/zinc/06/37/05/567063705.db2.gz VRDHOQWOUZEHTK-UHFFFAOYSA-N 0 1 389.260 3.040 10 0 GGAEMN CC(C)[C@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)c1ccnn1C ZINC000682648279 567065732 /nfs/dbraw/zinc/06/57/32/567065732.db2.gz RCQCPJSUVPRWAH-ZDUSSCGKSA-N 0 1 390.285 3.229 10 0 GGAEMN C[C@@H](NC(=O)c1sccc1CN(C)C)C1CCN(CC(F)(F)F)CC1 ZINC000473194755 567067585 /nfs/dbraw/zinc/06/75/85/567067585.db2.gz UFRNNOFDIUXUOO-GFCCVEGCSA-N 0 1 377.476 3.202 10 0 GGAEMN COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000613864979 567068110 /nfs/dbraw/zinc/06/81/10/567068110.db2.gz BQRNMMXUBJJNEU-MNOVXSKESA-N 0 1 378.270 3.163 10 0 GGAEMN CNC(=O)[C@H](CNCc1ncc(CSC)s1)Cc1ccc(F)cc1C ZINC000521624576 567068511 /nfs/dbraw/zinc/06/85/11/567068511.db2.gz DKFTXVQKENJJPR-AWEZNQCLSA-N 0 1 381.542 3.148 10 0 GGAEMN CO[C@H](CCNCc1cn(-c2ccccc2Br)nn1)C(F)(F)F ZINC000565449957 567069600 /nfs/dbraw/zinc/06/96/00/567069600.db2.gz JAORLBRJJZNFAO-CYBMUJFWSA-N 0 1 393.207 3.087 10 0 GGAEMN Cc1cc(Br)cn2c(CN[C@@H]3Cc4ccccc4N(C)C3=O)cnc12 ZINC000657574813 567072195 /nfs/dbraw/zinc/07/21/95/567072195.db2.gz OARFDOKZXZZBFX-MRXNPFEDSA-N 0 1 399.292 3.083 10 0 GGAEMN CN1c2ccccc2C[C@@H](NCC2=Cc3cc(Br)ccc3OC2)C1=O ZINC000657573904 567072260 /nfs/dbraw/zinc/07/22/60/567072260.db2.gz HQXNSRDFVQKHIP-QGZVFWFLSA-N 0 1 399.288 3.402 10 0 GGAEMN CN(CCc1ccc(Br)cc1)CC(=O)N1CCO[C@H]2CCCC[C@H]21 ZINC000521656457 567072778 /nfs/dbraw/zinc/07/27/78/567072778.db2.gz KTOQUHYPPNHKOY-MSOLQXFVSA-N 0 1 395.341 3.093 10 0 GGAEMN CN1c2ccccc2C[C@H](NCC2=Cc3cc(Br)ccc3OC2)C1=O ZINC000657573903 567072913 /nfs/dbraw/zinc/07/29/13/567072913.db2.gz HQXNSRDFVQKHIP-KRWDZBQOSA-N 0 1 399.288 3.402 10 0 GGAEMN COc1sc(CN[C@H]2Cc3ccccc3N(C)C2=O)cc1Br ZINC000657574879 567073181 /nfs/dbraw/zinc/07/31/81/567073181.db2.gz PNBIFWSOFLRQRR-ZDUSSCGKSA-N 0 1 381.295 3.197 10 0 GGAEMN Cc1cc(Br)cc2c(=O)c(-c3noc([C@H]4CC[N@H+](C)C4)n3)c[n-]c12 ZINC000545762599 567074522 /nfs/dbraw/zinc/07/45/22/567074522.db2.gz BLXRMHPWESQUFR-JTQLQIEISA-N 0 1 389.253 3.068 10 0 GGAEMN Cc1ccc(C(=O)NCCCN2C[C@@H](C)O[C@@H](C)C2)c(C)c1Br ZINC000682856458 567076330 /nfs/dbraw/zinc/07/63/30/567076330.db2.gz PNYWMCMWKNOOJN-OKILXGFUSA-N 0 1 383.330 3.295 10 0 GGAEMN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN[C@@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657639661 567078890 /nfs/dbraw/zinc/07/88/90/567078890.db2.gz SZIUZAMYRULXBY-MLGOLLRUSA-N 0 1 381.929 3.198 10 0 GGAEMN CSc1cc(Br)ccc1CN[C@@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657639180 567078919 /nfs/dbraw/zinc/07/89/19/567078919.db2.gz QQQGTDONIXSNSJ-GXFFZTMASA-N 0 1 378.357 3.226 10 0 GGAEMN CSc1cc(Br)ccc1CN[C@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657639179 567079039 /nfs/dbraw/zinc/07/90/39/567079039.db2.gz QQQGTDONIXSNSJ-GWCFXTLKSA-N 0 1 378.357 3.226 10 0 GGAEMN Cc1nn(-c2ccc(Cl)cc2)c(C)c1CN[C@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657639662 567079081 /nfs/dbraw/zinc/07/90/81/567079081.db2.gz SZIUZAMYRULXBY-WBMJQRKESA-N 0 1 381.929 3.198 10 0 GGAEMN CS(=O)(=O)C1(CNCc2ccc(Br)c(F)c2)CCCCC1 ZINC000657656931 567081812 /nfs/dbraw/zinc/08/18/12/567081812.db2.gz QWMNOSBJDBAXKS-UHFFFAOYSA-N 0 1 378.307 3.425 10 0 GGAEMN Ic1cccc2ncnc(N[C@@H]3CCCc4cn[nH]c43)c12 ZINC000545875728 567084008 /nfs/dbraw/zinc/08/40/08/567084008.db2.gz XZZCRIGVZJIJLQ-GFCCVEGCSA-N 0 1 391.216 3.447 10 0 GGAEMN O=C(NCCCn1cnc2ccccc21)c1n[nH]c2ccc(Br)cc21 ZINC000521923132 567086998 /nfs/dbraw/zinc/08/69/98/567086998.db2.gz ZTCIUTBNHYWZTI-UHFFFAOYSA-N 0 1 398.264 3.495 10 0 GGAEMN Fc1ccccc1-c1n[nH]c(Sc2ncc(I)cn2)n1 ZINC000545915341 567087345 /nfs/dbraw/zinc/08/73/45/567087345.db2.gz COLCCFYDICICAE-UHFFFAOYSA-N 0 1 399.192 3.157 10 0 GGAEMN CSc1cc(Cl)ccc1NC(=O)C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000657720758 567090024 /nfs/dbraw/zinc/09/00/24/567090024.db2.gz HAWZGWHFPTUPQP-UHFFFAOYSA-N 0 1 378.885 3.130 10 0 GGAEMN O=C(N[C@@H]1CSc2ccc(Br)cc21)[C@H]1CCc2[nH]cnc2C1 ZINC000614150835 567090044 /nfs/dbraw/zinc/09/00/44/567090044.db2.gz SQNYUGQXMDJDMJ-LKFCYVNXSA-N 0 1 378.295 3.240 10 0 GGAEMN COc1ccc(CCNC(=O)c2n[nH]c3ccc(Br)cc32)cc1F ZINC000521962157 567090570 /nfs/dbraw/zinc/09/05/70/567090570.db2.gz PTTDSJOXJXUTQZ-UHFFFAOYSA-N 0 1 392.228 3.446 10 0 GGAEMN COCCN(CC(=O)OC(C)(C)C)Cc1nc2ccc(Br)cc2[nH]1 ZINC000614164694 567090927 /nfs/dbraw/zinc/09/09/27/567090927.db2.gz RBCXFKOKAWSKJU-UHFFFAOYSA-N 0 1 398.301 3.116 10 0 GGAEMN CC(C)[C@]1(C(=O)[O-])CC[N@@H+](C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000565722108 567092463 /nfs/dbraw/zinc/09/24/63/567092463.db2.gz GVBXMUQSHQLGJF-SJCJKPOMSA-N 0 1 376.280 3.166 10 0 GGAEMN COc1ccc(CNCC2(O)CCC(F)(F)CC2)c(Br)c1O ZINC000657776541 567095069 /nfs/dbraw/zinc/09/50/69/567095069.db2.gz DQPOGNFKAPEJLO-UHFFFAOYSA-N 0 1 380.229 3.193 10 0 GGAEMN Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000522037498 567095217 /nfs/dbraw/zinc/09/52/17/567095217.db2.gz LDCRECDXUKNESQ-OAHLLOKOSA-N 0 1 390.325 3.476 10 0 GGAEMN Cc1cc(C(=O)N2CCN(Cc3ccc(C)cc3Br)[C@H](C)C2)n[nH]1 ZINC000453612552 567096443 /nfs/dbraw/zinc/09/64/43/567096443.db2.gz LPBIWEDNEUTRDE-CQSZACIVSA-N 0 1 391.313 3.136 10 0 GGAEMN CC(C)(CNCc1ncc(I)s1)[C@@H]1CCCCO1 ZINC000586778435 567096624 /nfs/dbraw/zinc/09/66/24/567096624.db2.gz INENYTMJNWPGOE-JTQLQIEISA-N 0 1 380.295 3.433 10 0 GGAEMN Cc1cc(C(=O)N2CCN(Cc3ccc(C)c(Br)c3)[C@H](C)C2)n[nH]1 ZINC000453615199 567097127 /nfs/dbraw/zinc/09/71/27/567097127.db2.gz OMUXJNOTMITKEI-CQSZACIVSA-N 0 1 391.313 3.136 10 0 GGAEMN C[C@H](O)[C@H](NCc1cc(Br)c2c(c1)OCCO2)c1ccccc1 ZINC000657819955 567098230 /nfs/dbraw/zinc/09/82/30/567098230.db2.gz VBMWQAVHGHHVAF-SJCJKPOMSA-N 0 1 378.266 3.432 10 0 GGAEMN COc1ccc(Br)cc1[C@H]1CCCN1C(=O)N[C@H]1CCCN(C)C1 ZINC000586853203 567101596 /nfs/dbraw/zinc/10/15/96/567101596.db2.gz UEPMHZYPXUUCFQ-GOEBONIOSA-N 0 1 396.329 3.398 10 0 GGAEMN CCCc1nc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)co1 ZINC000546084507 567103874 /nfs/dbraw/zinc/10/38/74/567103874.db2.gz XIYLOSKHTKSPRK-UHFFFAOYSA-N 0 1 390.241 3.105 10 0 GGAEMN CCCc1nc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)co1 ZINC000546084507 567103881 /nfs/dbraw/zinc/10/38/81/567103881.db2.gz XIYLOSKHTKSPRK-UHFFFAOYSA-N 0 1 390.241 3.105 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)s[n-]1 ZINC000473825571 567104412 /nfs/dbraw/zinc/10/44/12/567104412.db2.gz CIPDWVVEAZATKT-OLZOCXBDSA-N 0 1 379.555 3.381 10 0 GGAEMN C[C@H](NCCNS(=O)(=O)c1ccc(Cl)s1)c1cc2cnccc2o1 ZINC000657929156 567105565 /nfs/dbraw/zinc/10/55/65/567105565.db2.gz CSTFJZYJIXSHQM-JTQLQIEISA-N 0 1 385.898 3.172 10 0 GGAEMN Cc1ccsc1-c1nc(=NC(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)s[n-]1 ZINC000473845456 567106617 /nfs/dbraw/zinc/10/66/17/567106617.db2.gz WWHMEXJEQYQAEW-WCQYABFASA-N 0 1 379.555 3.239 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)C[C@H](C)c2ccc(Br)cc2)C1 ZINC000431785164 567106791 /nfs/dbraw/zinc/10/67/91/567106791.db2.gz MVNWLVMITZQIDD-MAUKXSAKSA-N 0 1 397.357 3.416 10 0 GGAEMN O[C@@H](CNCc1cn2cc(Cl)ccc2n1)COCc1ccc(Cl)cc1 ZINC000565887183 567108220 /nfs/dbraw/zinc/10/82/20/567108220.db2.gz HKGZYRLYXHZJEH-KRWDZBQOSA-N 0 1 380.275 3.308 10 0 GGAEMN O=C(CCOc1cccc(Cl)c1Cl)N1CCC[C@H](c2n[nH]c(=O)o2)C1 ZINC000614386830 567108553 /nfs/dbraw/zinc/10/85/53/567108553.db2.gz IFYUOZKGPZAHGS-JTQLQIEISA-N 0 1 386.235 3.257 10 0 GGAEMN O=C(CCOc1cccc(Cl)c1Cl)N1CCC[C@@H](c2n[nH]c(=O)o2)C1 ZINC000614386832 567109166 /nfs/dbraw/zinc/10/91/66/567109166.db2.gz IFYUOZKGPZAHGS-SNVBAGLBSA-N 0 1 386.235 3.257 10 0 GGAEMN CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC(=O)c1cnccc1N(C)C ZINC000546134998 567109272 /nfs/dbraw/zinc/10/92/72/567109272.db2.gz MEXJGBBBWDPFRG-YVEFUNNKSA-N 0 1 392.297 3.416 10 0 GGAEMN COc1ccc(CNCCc2cnc(C3CC3)nc2)c(Br)c1O ZINC000546175743 567111985 /nfs/dbraw/zinc/11/19/85/567111985.db2.gz PYBVIDHBAOICQQ-UHFFFAOYSA-N 0 1 378.270 3.163 10 0 GGAEMN Cc1nc([C@H](C)NC(=O)CSCc2ccc(Br)cc2F)n[nH]1 ZINC000588073582 567112401 /nfs/dbraw/zinc/11/24/01/567112401.db2.gz XCVBPDZQYORKHX-QMMMGPOBSA-N 0 1 387.278 3.125 10 0 GGAEMN Cc1nc([C@@](C)(NC(=O)c2n[nH]c3ccc(Br)cc32)C2CC2)no1 ZINC000497604148 567113260 /nfs/dbraw/zinc/11/32/60/567113260.db2.gz LUTGUNNDTXTWFC-INIZCTEOSA-N 0 1 390.241 3.072 10 0 GGAEMN O=C(c1c(Cl)cc(F)cc1Cl)N1CCCN(C[C@H]2CCCO2)CC1 ZINC000683311673 567113994 /nfs/dbraw/zinc/11/39/94/567113994.db2.gz YZIQQINOLONQON-CYBMUJFWSA-N 0 1 375.271 3.459 10 0 GGAEMN O=C(NCCCCN1CCOCC1)N1CCc2c(ccc(Cl)c2Cl)C1 ZINC000522413542 567115792 /nfs/dbraw/zinc/11/57/92/567115792.db2.gz UTCKYIUHFRGPAD-UHFFFAOYSA-N 0 1 386.323 3.174 10 0 GGAEMN O=C1[C@@H](N2CCC(c3c[nH]cn3)CC2)CCN1c1cccc(Br)c1 ZINC000683366674 567117402 /nfs/dbraw/zinc/11/74/02/567117402.db2.gz HURQTIBZYRSOGJ-KRWDZBQOSA-N 0 1 389.297 3.157 10 0 GGAEMN O=C(N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000635889631 567117531 /nfs/dbraw/zinc/11/75/31/567117531.db2.gz WAKYXZDFZMUUQK-FDYHWXHSSA-N 0 1 378.245 3.477 10 0 GGAEMN O=C([C@@H]1C[C@H]1c1cnc[nH]1)N1CCC[C@H](Nc2cccc(Br)c2)C1 ZINC000635874341 567117742 /nfs/dbraw/zinc/11/77/42/567117742.db2.gz NJGQEUPAMGJOTP-ARFHVFGLSA-N 0 1 389.297 3.379 10 0 GGAEMN O=C(NC[C@@H]1CN2CCN1CCC2)c1sc2cccc(Cl)c2c1Cl ZINC000614511374 567117617 /nfs/dbraw/zinc/11/76/17/567117617.db2.gz IBPBRDGBJAWUGS-LLVKDONJSA-N 0 1 384.332 3.328 10 0 GGAEMN O=C1[C@H](N2CCC(c3c[nH]cn3)CC2)CCN1c1cccc(Br)c1 ZINC000683366675 567117679 /nfs/dbraw/zinc/11/76/79/567117679.db2.gz HURQTIBZYRSOGJ-QGZVFWFLSA-N 0 1 389.297 3.157 10 0 GGAEMN O=C1NCC[C@@H]1N[C@H]1CCCc2nc(-c3ccccc3Br)sc21 ZINC000658052187 567118680 /nfs/dbraw/zinc/11/86/80/567118680.db2.gz BPYMRZXBGQPENR-JSGCOSHPSA-N 0 1 392.322 3.428 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)[C@@H]2C[C@H]2c2cnc[nH]2)CC1 ZINC000636073478 567122431 /nfs/dbraw/zinc/12/24/31/567122431.db2.gz QEWDBOWPSXADBD-VXGBXAGGSA-N 0 1 376.254 3.090 10 0 GGAEMN CN(C(=O)c1ncc(Br)s1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000683411803 567122871 /nfs/dbraw/zinc/12/28/71/567122871.db2.gz PQAOVBHMCMNGFE-CYBMUJFWSA-N 0 1 380.311 3.252 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@H](CO)N[C@@H](C)c2ncc(Br)cc2F)C1 ZINC000658117309 567123919 /nfs/dbraw/zinc/12/39/19/567123919.db2.gz ZXUOIOKCNHVSGQ-MEDZGJRSSA-N 0 1 375.282 3.200 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@@H](CO)N[C@H](C)c2ncc(Br)cc2F)C1 ZINC000658117311 567124999 /nfs/dbraw/zinc/12/49/99/567124999.db2.gz ZXUOIOKCNHVSGQ-NDPMZMCLSA-N 0 1 375.282 3.200 10 0 GGAEMN COCc1nnc(C[NH2+][C@@H]2c3cc(Br)ccc3SC[C@H]2C)[n-]1 ZINC000658157735 567125638 /nfs/dbraw/zinc/12/56/38/567125638.db2.gz CWDJFHBGSKZFAA-PSLIRLAXSA-N 0 1 383.315 3.286 10 0 GGAEMN Cn1ccnc1CN1CCN(CC/C=C/c2ccc(Br)cc2)CC1 ZINC000522713813 567126135 /nfs/dbraw/zinc/12/61/35/567126135.db2.gz RXSDFMRNQSQOBH-DUXPYHPUSA-N 0 1 389.341 3.404 10 0 GGAEMN O=C(c1c[nH]c2ccc(Br)cc2c1=O)N1CC(CC(F)(F)F)C1 ZINC000683491639 567128452 /nfs/dbraw/zinc/12/84/52/567128452.db2.gz DAAAHDAZSHYSIJ-UHFFFAOYSA-N 0 1 389.171 3.315 10 0 GGAEMN C[C@]1(CN[C@@H]2CCS(=O)(=O)c3ccc(Br)cc32)CC1(F)F ZINC000658216870 567129167 /nfs/dbraw/zinc/12/91/67/567129167.db2.gz DBTIWWYXTURDOW-DGCLKSJQSA-N 0 1 380.254 3.303 10 0 GGAEMN C[C@@H](NC[C@@H]1CCC[C@@H](C)O1)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000658216151 567129454 /nfs/dbraw/zinc/12/94/54/567129454.db2.gz PRJMEEQAUZMCHE-MXWKQRLJSA-N 0 1 381.325 3.249 10 0 GGAEMN C[C@@H]1CCC[C@@H](CN[C@H]2CCS(=O)(=O)c3ccc(Br)cc32)O1 ZINC000658216141 567129599 /nfs/dbraw/zinc/12/95/99/567129599.db2.gz PLZUWCVJOQSHRX-ZLDLUXBVSA-N 0 1 388.327 3.215 10 0 GGAEMN CCn1ccc(CN(C)C(=O)c2c[nH]c3ccc(Br)cc3c2=O)c1 ZINC000683501413 567129572 /nfs/dbraw/zinc/12/95/72/567129572.db2.gz RKHHKJNJLACXDK-UHFFFAOYSA-N 0 1 388.265 3.384 10 0 GGAEMN CCOCc1cccc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)c1 ZINC000588635466 567130539 /nfs/dbraw/zinc/13/05/39/567130539.db2.gz ZQKLRLFOBTVHPP-UHFFFAOYSA-N 0 1 383.853 3.449 10 0 GGAEMN Cc1c([C@H](C)N[C@H]2C[C@@H](O)C23CCC3)nnn1-c1cccc(Br)c1 ZINC000658257443 567131023 /nfs/dbraw/zinc/13/10/23/567131023.db2.gz XXEGCJTUQJJGSZ-KNXALSJPSA-N 0 1 391.313 3.292 10 0 GGAEMN O=C(N[C@@H]1CSCc2ccc(Br)cc21)[C@@H]1C[C@H]1c1cnc[nH]1 ZINC000636181385 567131643 /nfs/dbraw/zinc/13/16/43/567131643.db2.gz FGJWQWUNKYKBIO-UMVBOHGHSA-N 0 1 378.295 3.380 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc2c(c1)COC2 ZINC000588653793 567132337 /nfs/dbraw/zinc/13/23/37/567132337.db2.gz STNXDJMBFVJZIP-UHFFFAOYSA-N 0 1 399.248 3.194 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc2c(c1)COC2 ZINC000588653793 567132340 /nfs/dbraw/zinc/13/23/40/567132340.db2.gz STNXDJMBFVJZIP-UHFFFAOYSA-N 0 1 399.248 3.194 10 0 GGAEMN O=C(CCSc1ccc(Br)cc1)NC1(c2nn[nH]n2)CCCC1 ZINC000522855437 567133064 /nfs/dbraw/zinc/13/30/64/567133064.db2.gz BBXSFZSYJSPHRW-UHFFFAOYSA-N 0 1 396.314 3.030 10 0 GGAEMN Cc1cccc2nc(CNS(=O)(=O)c3cc(F)ccc3Br)[nH]c21 ZINC000497934511 567133213 /nfs/dbraw/zinc/13/32/13/567133213.db2.gz MUSKGUYUJGLQDG-UHFFFAOYSA-N 0 1 398.257 3.251 10 0 GGAEMN CCS(=O)(=O)C1(CN[C@@H]2CCCOc3cc(Br)ccc32)CC1 ZINC000658300211 567133768 /nfs/dbraw/zinc/13/37/68/567133768.db2.gz SUVVWVNBERPIHW-CQSZACIVSA-N 0 1 388.327 3.220 10 0 GGAEMN COc1ccc([C@@H](C)NCCN2C[C@H]3CCCCN3C2=O)c(Br)c1 ZINC000658307744 567135257 /nfs/dbraw/zinc/13/52/57/567135257.db2.gz WBTOBHNHHLYQJO-ZIAGYGMSSA-N 0 1 396.329 3.398 10 0 GGAEMN CC1=CCN(CCNC(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)CC1 ZINC000546565760 567137903 /nfs/dbraw/zinc/13/79/03/567137903.db2.gz HZDBKRLWMSLMFL-DLBZAZTESA-N 0 1 378.314 3.256 10 0 GGAEMN CCc1nc([C@H](C)Nc2ncnc3cccc(I)c32)n[nH]1 ZINC000546582532 567139425 /nfs/dbraw/zinc/13/94/25/567139425.db2.gz IFJORZMEKVJQMI-QMMMGPOBSA-N 0 1 394.220 3.088 10 0 GGAEMN CCc1nc([C@@H](C)Nc2ncnc3cccc(I)c32)n[nH]1 ZINC000546582531 567139478 /nfs/dbraw/zinc/13/94/78/567139478.db2.gz IFJORZMEKVJQMI-MRVPVSSYSA-N 0 1 394.220 3.088 10 0 GGAEMN Cc1c(Br)cncc1C(=O)N(C)CCCN(C)Cc1ccco1 ZINC000614798269 567140033 /nfs/dbraw/zinc/14/00/33/567140033.db2.gz FFYMNWOTHRVQIT-UHFFFAOYSA-N 0 1 380.286 3.340 10 0 GGAEMN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000474150692 567140677 /nfs/dbraw/zinc/14/06/77/567140677.db2.gz BIRBOSIGSYACBZ-GXSJLCMTSA-N 0 1 395.219 3.434 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@H](NCc1n[nH]cc1Br)CC3 ZINC000546613116 567142634 /nfs/dbraw/zinc/14/26/34/567142634.db2.gz CHEALSKQRDNNKZ-SNVBAGLBSA-N 0 1 375.270 3.309 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@@H](NCc1n[nH]cc1Br)CC3 ZINC000546613115 567143049 /nfs/dbraw/zinc/14/30/49/567143049.db2.gz CHEALSKQRDNNKZ-JTQLQIEISA-N 0 1 375.270 3.309 10 0 GGAEMN O=S(=O)(Cc1ccc(OC(F)(F)F)cc1)Nc1cc(C(F)(F)F)[nH]n1 ZINC000683708822 567146341 /nfs/dbraw/zinc/14/63/41/567146341.db2.gz RRMKDVRQCUNLIF-UHFFFAOYSA-N 0 1 389.277 3.269 10 0 GGAEMN NC(=O)c1csc(=NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)[nH]1 ZINC000432340795 567151207 /nfs/dbraw/zinc/15/12/07/567151207.db2.gz PJSBLPXGHXEZEY-UHFFFAOYSA-N 0 1 385.320 3.047 10 0 GGAEMN CC1(C)CC[C@H]1NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000498156092 567155071 /nfs/dbraw/zinc/15/50/71/567155071.db2.gz MFTNWGWDUCCHSD-GFCCVEGCSA-N 0 1 378.274 3.222 10 0 GGAEMN CC1(C)CC[C@H]1NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000498156092 567155074 /nfs/dbraw/zinc/15/50/74/567155074.db2.gz MFTNWGWDUCCHSD-GFCCVEGCSA-N 0 1 378.274 3.222 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2sccc2Br)[nH]n1 ZINC000566410539 567155346 /nfs/dbraw/zinc/15/53/46/567155346.db2.gz ZNJZIHCQSVBWEJ-UHFFFAOYSA-N 0 1 381.299 3.007 10 0 GGAEMN Cc1ccc(C(=O)N2CCN(C3CCOCC3)C[C@@H]2C)c(C)c1Br ZINC000683787531 567155432 /nfs/dbraw/zinc/15/54/32/567155432.db2.gz BJJSVCPQAKSCQH-AWEZNQCLSA-N 0 1 395.341 3.391 10 0 GGAEMN O=C(COc1ccc(Br)cc1F)Nc1cnn(-c2ccncc2)c1 ZINC000589078645 567155798 /nfs/dbraw/zinc/15/57/98/567155798.db2.gz ZHKYHYIHWDEBJG-UHFFFAOYSA-N 0 1 391.200 3.186 10 0 GGAEMN CN([C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1ccc(F)cc1Cl ZINC000474307881 567158102 /nfs/dbraw/zinc/15/81/02/567158102.db2.gz HRSMRINQJVNNBD-INIZCTEOSA-N 0 1 382.888 3.374 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(N3CCOC[C@@H]3C)CC2)c(C)c1Br ZINC000615086049 567158545 /nfs/dbraw/zinc/15/85/45/567158545.db2.gz JLYBKNNCIHYUAM-AWEZNQCLSA-N 0 1 395.341 3.391 10 0 GGAEMN C[C@@H]1CN(C(=O)c2n[nH]c(-c3ccccc3)c2Br)[C@@H](C)[C@@H](C)O1 ZINC000474330801 567159290 /nfs/dbraw/zinc/15/92/90/567159290.db2.gz LBCPSCIEQZPCTH-GRYCIOLGSA-N 0 1 378.270 3.477 10 0 GGAEMN CCc1nc(CNC(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)n[nH]1 ZINC000454281845 567160022 /nfs/dbraw/zinc/16/00/22/567160022.db2.gz ZCDHIQNUYHTTDS-UHFFFAOYSA-N 0 1 376.873 3.390 10 0 GGAEMN Cc1ccnc(NS(=O)(=O)c2cn3c(n2)CCC[C@H]3C)c1Br ZINC000566491147 567163617 /nfs/dbraw/zinc/16/36/17/567163617.db2.gz OESLJZCUBDDDCO-SNVBAGLBSA-N 0 1 385.287 3.047 10 0 GGAEMN CN(C)Cc1cc(CNC(=O)COc2cccc(Br)c2)ccc1F ZINC000523739512 567169390 /nfs/dbraw/zinc/16/93/90/567169390.db2.gz VLFMLGCSLPOBTL-UHFFFAOYSA-N 0 1 395.272 3.345 10 0 GGAEMN CN(C)[C@H]1CCOc2c(NC(=O)CCn3cc(Br)cn3)cccc21 ZINC000684089362 567174337 /nfs/dbraw/zinc/17/43/37/567174337.db2.gz MZLYVDDBRJMDPU-HNNXBMFYSA-N 0 1 393.285 3.060 10 0 GGAEMN CN1CC[C@H](NC(=O)c2cn3ccc(Br)cc3n2)[C@@H]1c1ccccc1 ZINC000566635557 567174686 /nfs/dbraw/zinc/17/46/86/567174686.db2.gz GREPLGCNHIULDW-YJBOKZPZSA-N 0 1 399.292 3.272 10 0 GGAEMN Cc1cc(Br)cc(C(=O)N2CCOC[C@H]2[C@H]2CCC[N@@H+]2C)c1C ZINC000615274494 567175084 /nfs/dbraw/zinc/17/50/84/567175084.db2.gz JICPGWHTPPAYFF-SJORKVTESA-N 0 1 381.314 3.001 10 0 GGAEMN Cc1cc(Br)cc(C(=O)N2CCOC[C@@H]2[C@H]2CCC[N@@H+]2C)c1C ZINC000615274490 567175256 /nfs/dbraw/zinc/17/52/56/567175256.db2.gz JICPGWHTPPAYFF-IAGOWNOFSA-N 0 1 381.314 3.001 10 0 GGAEMN CS(=O)(=O)Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2cc[nH]c2c1 ZINC000432650649 567177457 /nfs/dbraw/zinc/17/74/57/567177457.db2.gz DFKVHBMZWZVFKX-UHFFFAOYSA-N 0 1 398.893 3.167 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2cc(Br)c3c(c2)OCCCO3)C[C@@H]1C(=O)[O-] ZINC000566679509 567180193 /nfs/dbraw/zinc/18/01/93/567180193.db2.gz WHSLHPRGQHWTSM-YPMHNXCESA-N 0 1 384.270 3.153 10 0 GGAEMN CN1CCC[C@@H](NC(=O)N2CCC[C@@H](Nc3cccc(Br)c3)C2)C1 ZINC000684135016 567183488 /nfs/dbraw/zinc/18/34/88/567183488.db2.gz NDYMKVCBBIURAH-IAGOWNOFSA-N 0 1 395.345 3.129 10 0 GGAEMN Cc1cc(C[C@@H](C)N2C(=O)N[C@@](C)(c3ccc(Cl)c(Cl)c3)C2=O)n[nH]1 ZINC000566774413 567188787 /nfs/dbraw/zinc/18/87/87/567188787.db2.gz DYCMTFHNNGLBRJ-QGHHPUGFSA-N 0 1 381.263 3.423 10 0 GGAEMN Cc1cc(C[C@@H](C)N2C(=O)N[C@](C)(c3ccc(Cl)c(Cl)c3)C2=O)n[nH]1 ZINC000566774410 567188914 /nfs/dbraw/zinc/18/89/14/567188914.db2.gz DYCMTFHNNGLBRJ-BMLIUANNSA-N 0 1 381.263 3.423 10 0 GGAEMN COc1cc(Br)ccc1[C@H](C)NC(=O)NCCN1CC=CCC1 ZINC000474672832 567189822 /nfs/dbraw/zinc/18/98/22/567189822.db2.gz ANUOFUQWVNXCCF-ZDUSSCGKSA-N 0 1 382.302 3.080 10 0 GGAEMN CCc1ncc(S(=O)(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)s1 ZINC000547304185 567198285 /nfs/dbraw/zinc/19/82/85/567198285.db2.gz FZYGININFQFALL-LRDDRELGSA-N 0 1 385.580 3.128 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1 ZINC000659286394 567199769 /nfs/dbraw/zinc/19/97/69/567199769.db2.gz FGKMNFZOHXYVBT-HNNXBMFYSA-N 0 1 394.269 3.327 10 0 GGAEMN CN1CCN(c2cc(C(=O)NCc3ccc(Cl)cc3Cl)ccn2)CC1 ZINC000589977501 567200539 /nfs/dbraw/zinc/20/05/39/567200539.db2.gz HQBCERPCVVOPAK-UHFFFAOYSA-N 0 1 379.291 3.070 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N1CCC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000659299857 567202640 /nfs/dbraw/zinc/20/26/40/567202640.db2.gz GOJIADYIAXXNKG-CJNGLKHVSA-N 0 1 375.296 3.116 10 0 GGAEMN CC1=CCN(CCNC(=O)NCc2cc3cc(Br)ccc3[nH]2)CC1 ZINC000547347457 567203280 /nfs/dbraw/zinc/20/32/80/567203280.db2.gz ZTEDYHXCWPQUDW-UHFFFAOYSA-N 0 1 391.313 3.382 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(C)Cc1ccc(Br)cc1Cl ZINC000566943245 567205088 /nfs/dbraw/zinc/20/50/88/567205088.db2.gz IENNXDBMSOCZHN-UHFFFAOYSA-N 0 1 397.766 3.206 10 0 GGAEMN Cn1c(=O)sc2cc(CN[C@H](CO)c3ccc(Br)cc3)ccc21 ZINC000684389792 567205773 /nfs/dbraw/zinc/20/57/73/567205773.db2.gz PVPLCSGLYFUMKJ-CQSZACIVSA-N 0 1 393.306 3.186 10 0 GGAEMN CC(C)OC[C@H](N)C(=O)N1CCCC[C@H]1Cc1cccc(Br)c1 ZINC000659323813 567206722 /nfs/dbraw/zinc/20/67/22/567206722.db2.gz CZMWXIBYCOUIBJ-IRXDYDNUSA-N 0 1 383.330 3.125 10 0 GGAEMN NC(=O)[C@@H](CNCc1c(F)cccc1Br)Cc1ccc(F)cc1 ZINC000474890902 567207619 /nfs/dbraw/zinc/20/76/19/567207619.db2.gz BRNVOGHZOCUISU-GFCCVEGCSA-N 0 1 383.236 3.161 10 0 GGAEMN COCCN1CCC[C@@H]1CNC(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000590119005 567210231 /nfs/dbraw/zinc/21/02/31/567210231.db2.gz GNYDJYDCMSNZIU-OAHLLOKOSA-N 0 1 379.913 3.304 10 0 GGAEMN C[C@@H]1CN(C(=O)N[C@@H]2CCOc3c(Br)cccc32)C[C@H](C)N1C ZINC000454917541 567212552 /nfs/dbraw/zinc/21/25/52/567212552.db2.gz ZFHIYVCARSRPQS-TYNCELHUSA-N 0 1 382.302 3.007 10 0 GGAEMN COC(=O)CCC1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000547506946 567215168 /nfs/dbraw/zinc/21/51/68/567215168.db2.gz KLTKRARFFXFRGS-UHFFFAOYSA-N 0 1 380.286 3.491 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C[C@@H]1C ZINC000498977170 567217080 /nfs/dbraw/zinc/21/70/80/567217080.db2.gz XYCDKCKEKXQBFH-HEHGZKQESA-N 0 1 396.329 3.397 10 0 GGAEMN CC[C@@H](C)c1nc([C@@H](C)NS(=O)(=O)c2ccc3nc(C)sc3c2)n[nH]1 ZINC000567101070 567218711 /nfs/dbraw/zinc/21/87/11/567218711.db2.gz SSSYUSHTVYTVGR-NXEZZACHSA-N 0 1 379.511 3.276 10 0 GGAEMN CC[C@H](C)c1nc([C@@H](C)NS(=O)(=O)c2ccc3nc(C)sc3c2)n[nH]1 ZINC000567101072 567219060 /nfs/dbraw/zinc/21/90/60/567219060.db2.gz SSSYUSHTVYTVGR-VHSXEESVSA-N 0 1 379.511 3.276 10 0 GGAEMN Cc1c(Br)ccc(C(=O)Nc2nc(-c3ccncc3)n[nH]2)c1F ZINC000433082915 567221116 /nfs/dbraw/zinc/22/11/16/567221116.db2.gz LYQFQQPUFWHEBP-UHFFFAOYSA-N 0 1 376.189 3.329 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@@](C)(CO)c2cc(Cl)cc(Cl)c2)cn1 ZINC000616074686 567223492 /nfs/dbraw/zinc/22/34/92/567223492.db2.gz CTZWXMZJMNVZGM-SFHVURJKSA-N 0 1 382.291 3.088 10 0 GGAEMN CC1(C)CCN(C(=O)c2[nH]nc3ccc(I)cc32)CC1 ZINC000499098126 567223849 /nfs/dbraw/zinc/22/38/49/567223849.db2.gz AGNDHZHYUNDTIQ-UHFFFAOYSA-N 0 1 383.233 3.430 10 0 GGAEMN O=C([O-])[C@@]12C[N@@H+](C[C@@H](O)COc3c(Cl)cccc3Cl)C[C@@H]1CCCC2 ZINC000659798596 567225730 /nfs/dbraw/zinc/22/57/30/567225730.db2.gz KAIBLLCPMWKMMH-JCGVRSQUSA-N 0 1 388.291 3.310 10 0 GGAEMN NC(=O)CC1(NCc2csc(-c3cccc(Br)c3)n2)CCC1 ZINC000475095484 567225877 /nfs/dbraw/zinc/22/58/77/567225877.db2.gz UPYCFRIQIGEBLZ-UHFFFAOYSA-N 0 1 380.311 3.460 10 0 GGAEMN CC1=C(C)CN(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000684662317 567226937 /nfs/dbraw/zinc/22/69/37/567226937.db2.gz GOCANFPFJVSTAO-UHFFFAOYSA-N 0 1 390.285 3.486 10 0 GGAEMN CC1=C(C)CN(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000684662317 567226943 /nfs/dbraw/zinc/22/69/43/567226943.db2.gz GOCANFPFJVSTAO-UHFFFAOYSA-N 0 1 390.285 3.486 10 0 GGAEMN Cc1ccncc1[C@H](C)N[C@H](C)c1ccc(Br)c(S(N)(=O)=O)c1 ZINC000684677152 567228141 /nfs/dbraw/zinc/22/81/41/567228141.db2.gz QATRCTQSMQLWOI-NEPJUHHUSA-N 0 1 398.326 3.212 10 0 GGAEMN O=C([C@@H]1CCc2[nH]cnc2C1)N1CCC[C@H]1c1ccc(Br)cn1 ZINC000616197333 567231609 /nfs/dbraw/zinc/23/16/09/567231609.db2.gz QMMMSYBNJSBSNT-BZNIZROVSA-N 0 1 375.270 3.036 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(Cc3ccc(Br)s3)CC2)n[nH]1 ZINC000659831848 567231527 /nfs/dbraw/zinc/23/15/27/567231527.db2.gz KZZWTVMCPFFMNT-LLVKDONJSA-N 0 1 384.347 3.070 10 0 GGAEMN COc1ccc(CCC(=O)NCc2n[nH]c(C(C)(C)C)n2)c(Br)c1 ZINC000616221991 567232985 /nfs/dbraw/zinc/23/29/85/567232985.db2.gz NAFUTDOBYNGCBZ-UHFFFAOYSA-N 0 1 395.301 3.122 10 0 GGAEMN CCn1c(CNCCC(C)(C)C(=O)OC)nc2cc(Br)ccc21 ZINC000475215466 567233088 /nfs/dbraw/zinc/23/30/88/567233088.db2.gz LCBFUHYZDPQGOQ-UHFFFAOYSA-N 0 1 382.302 3.498 10 0 GGAEMN Cc1cc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cc2n[nH]cc21 ZINC000499266117 567233433 /nfs/dbraw/zinc/23/34/33/567233433.db2.gz MPBCLOWSYVUCPC-UHFFFAOYSA-N 0 1 379.825 3.097 10 0 GGAEMN COC(=O)c1cnc(NS(=O)(=O)c2cc(C)ccc2Cl)c(Cl)c1 ZINC000590592363 567233826 /nfs/dbraw/zinc/23/38/26/567233826.db2.gz ZKADQTRCGJUIQB-UHFFFAOYSA-N 0 1 375.233 3.284 10 0 GGAEMN COC(=O)c1nn(-c2ccc(Cl)c(Cl)c2)cc1CN[C@@H](C)C(C)(C)O ZINC000590643805 567236573 /nfs/dbraw/zinc/23/65/73/567236573.db2.gz CAFUIIHASCYVQB-JTQLQIEISA-N 0 1 386.279 3.215 10 0 GGAEMN O=C1[C@@H](N2CCC[C@]3(CCCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433266211 567237302 /nfs/dbraw/zinc/23/73/02/567237302.db2.gz RSYNHZGRHNBFAG-HKUYNNGSSA-N 0 1 393.325 3.447 10 0 GGAEMN CSc1cccc(CN2CCC(N(CC(F)(F)F)S(C)(=O)=O)CC2)c1 ZINC000659925917 567240364 /nfs/dbraw/zinc/24/03/64/567240364.db2.gz HTBCSZJOPAAQAE-UHFFFAOYSA-N 0 1 396.500 3.197 10 0 GGAEMN C[C@H]1[C@H](C(F)(F)F)CCN1Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000547771105 567245281 /nfs/dbraw/zinc/24/52/81/567245281.db2.gz QZNBEPGZAPCQPH-JOYOIKCWSA-N 0 1 390.203 3.230 10 0 GGAEMN Cc1cc(C)c(NC(=O)NC[C@H]2CCCC[N@H+]2CCO)cc1Br ZINC000455196126 567245520 /nfs/dbraw/zinc/24/55/20/567245520.db2.gz QCCRNMFRUXUZCZ-CQSZACIVSA-N 0 1 384.318 3.034 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(Cc3ccc(Br)c(F)c3)CC2)n[nH]1 ZINC000660011557 567247537 /nfs/dbraw/zinc/24/75/37/567247537.db2.gz HITSIPLVPCKWFK-GFCCVEGCSA-N 0 1 396.308 3.148 10 0 GGAEMN COc1ccc(Br)cc1C1(NC(=O)[C@@H]2CCc3[nH]cnc3C2)CC1 ZINC000616456492 567247665 /nfs/dbraw/zinc/24/76/65/567247665.db2.gz BLYMSGIITLDIMJ-LLVKDONJSA-N 0 1 390.281 3.091 10 0 GGAEMN O=C(NC1(c2ccccc2Br)CCC1)[C@H]1CCCc2n[nH]nc21 ZINC000616510308 567248763 /nfs/dbraw/zinc/24/87/63/567248763.db2.gz NPKYJYBZSDJHOL-NSHDSACASA-N 0 1 375.270 3.183 10 0 GGAEMN CC(C)(C)N1CCc2nc(NC(=O)Cc3csc4nccn34)sc2C1 ZINC000567494598 567251446 /nfs/dbraw/zinc/25/14/46/567251446.db2.gz RSZOWUFSFROUOQ-UHFFFAOYSA-N 0 1 375.523 3.190 10 0 GGAEMN COc1ncc(CNC2(c3ccc(Br)cc3)CCOCC2)c(C)n1 ZINC000685002372 567251484 /nfs/dbraw/zinc/25/14/84/567251484.db2.gz MSJRPWZDGKVXBN-UHFFFAOYSA-N 0 1 392.297 3.352 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1n[nH]c([C@H]2CCCO2)n1 ZINC000616694211 567252169 /nfs/dbraw/zinc/25/21/69/567252169.db2.gz CXOKNOKANQLXIG-TVQRCGJNSA-N 0 1 385.251 3.047 10 0 GGAEMN O=C(N[C@@H]1CCc2nc[nH]c2C1)NC1(Cc2ccccc2Br)CC1 ZINC000567541405 567254973 /nfs/dbraw/zinc/25/49/73/567254973.db2.gz LVDMYVNPOGKUPV-CYBMUJFWSA-N 0 1 389.297 3.104 10 0 GGAEMN CC(=O)Nc1ccccc1CNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000525602287 567255427 /nfs/dbraw/zinc/25/54/27/567255427.db2.gz QKVVSTNEAYFINQ-UHFFFAOYSA-N 0 1 387.237 3.214 10 0 GGAEMN C[C@](CO)(NC(=O)c1[nH]nc2c1CCCCC2)c1ccc(Br)cc1 ZINC000616829051 567257862 /nfs/dbraw/zinc/25/78/62/567257862.db2.gz IQBOOFOCCBNMIX-GOSISDBHSA-N 0 1 392.297 3.079 10 0 GGAEMN O=c1cc(CN[C@@H](c2cccnc2)C2CC2)nc2ccc(Br)cn12 ZINC000525833879 567268326 /nfs/dbraw/zinc/26/83/26/567268326.db2.gz PUXMTEXTSKWTCU-GOSISDBHSA-N 0 1 385.265 3.093 10 0 GGAEMN COc1cc(Cl)ccc1[C@@H](C)NC[C@H]1CS(=O)(=O)c2ccccc2O1 ZINC000567733539 567271965 /nfs/dbraw/zinc/27/19/65/567271965.db2.gz IQEAHAHRIMBHLB-OCCSQVGLSA-N 0 1 381.881 3.234 10 0 GGAEMN NC(=O)[C@@H](NC[C@H]1CC12CCSCC2)c1ccc(Br)cc1F ZINC000567722609 567272366 /nfs/dbraw/zinc/27/23/66/567272366.db2.gz NUMMDAPJJNXCAU-YGRLFVJLSA-N 0 1 387.318 3.238 10 0 GGAEMN NC(=O)[C@H](NC[C@H]1CC12CCSCC2)c1ccc(Br)cc1F ZINC000567722608 567272394 /nfs/dbraw/zinc/27/23/94/567272394.db2.gz NUMMDAPJJNXCAU-QMTHXVAHSA-N 0 1 387.318 3.238 10 0 GGAEMN CCN1C[C@H](C)N(C(=O)Nc2ccc(Br)c(C(=O)OC)c2)C[C@@H]1C ZINC000548081793 567278341 /nfs/dbraw/zinc/27/83/41/567278341.db2.gz LKUAASMFRJCTKA-RYUDHWBXSA-N 0 1 398.301 3.182 10 0 GGAEMN CCc1nc([C@@H](C)N[C@@H](C)c2cc3c(cc2Br)OCCO3)n[nH]1 ZINC000660189151 567278546 /nfs/dbraw/zinc/27/85/46/567278546.db2.gz XZGUODJJYTWVQM-VHSXEESVSA-N 0 1 381.274 3.313 10 0 GGAEMN C[C@@H](NCCO[C@@H]1CC1(F)F)c1cc2c(cc1Br)OCCO2 ZINC000660188650 567278856 /nfs/dbraw/zinc/27/88/56/567278856.db2.gz UZHWAUCAFGWJNE-YMTOWFKASA-N 0 1 378.213 3.295 10 0 GGAEMN COCC[C@H]1CCCCN(C(=O)[C@](C)(N)c2ccc(Br)cc2)C1 ZINC000567825124 567281825 /nfs/dbraw/zinc/28/18/25/567281825.db2.gz WOHGWINUSTYPIT-RDTXWAMCSA-N 0 1 383.330 3.288 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NC1(c2cccc(Br)c2)CCC1 ZINC000685590148 567283300 /nfs/dbraw/zinc/28/33/00/567283300.db2.gz MFBACYYECBFQMO-UHFFFAOYSA-N 0 1 389.359 3.090 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(Cc2cc3c(cc2Br)OCCO3)n1 ZINC000567852579 567283444 /nfs/dbraw/zinc/28/34/44/567283444.db2.gz SKCZGIXIRRYJBM-GFCCVEGCSA-N 0 1 382.258 3.240 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1 ZINC000685589150 567283693 /nfs/dbraw/zinc/28/36/93/567283693.db2.gz YTIONUUEZFFWQE-CQSZACIVSA-N 0 1 381.567 3.441 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N(Cc1cccc(Br)c1)C1CC1 ZINC000685589372 567284483 /nfs/dbraw/zinc/28/44/83/567284483.db2.gz RKFQTOCYZWIGIP-UHFFFAOYSA-N 0 1 389.359 3.085 10 0 GGAEMN CO[C@@H](CCNC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C)C(F)(F)F ZINC000526046585 567284924 /nfs/dbraw/zinc/28/49/24/567284924.db2.gz MAKIKYQMRHHPBN-KBPBESRZSA-N 0 1 381.826 3.209 10 0 GGAEMN CC(C)[C@@H]1C[C@H]1C(=O)Nc1cc(Br)ccc1N1CCN(C)CC1 ZINC000475890938 567285427 /nfs/dbraw/zinc/28/54/27/567285427.db2.gz DQOQBTOLPRNNIM-LSDHHAIUSA-N 0 1 380.330 3.432 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NCc1cnc(-c2ccc(Cl)cc2)s1 ZINC000685599081 567285679 /nfs/dbraw/zinc/28/56/79/567285679.db2.gz PHPXBEQKIPSNPR-UHFFFAOYSA-N 0 1 387.958 3.225 10 0 GGAEMN CCN(CC)CCS(=O)(=O)NCc1cc(-c2ccc(OC)cc2)cs1 ZINC000685593362 567285860 /nfs/dbraw/zinc/28/58/60/567285860.db2.gz DCFDKEVGLZLOJV-UHFFFAOYSA-N 0 1 382.551 3.185 10 0 GGAEMN C[C@@H](NC(=O)CN1CC[C@@H](O)CC12CCC2)c1ccc(Br)cc1 ZINC000567885889 567286599 /nfs/dbraw/zinc/28/65/99/567286599.db2.gz APKGIRXPWMYPTK-CZUORRHYSA-N 0 1 381.314 3.006 10 0 GGAEMN COCCOCCOCCCN1CCc2c(Br)cc(C)cc2C1 ZINC000660327969 567286681 /nfs/dbraw/zinc/28/66/81/567286681.db2.gz FPKFEFFWGBSHHJ-UHFFFAOYSA-N 0 1 386.330 3.185 10 0 GGAEMN Cn1c(CNC(=O)c2cc(Br)cc3nc[nH]c32)nc2ccccc21 ZINC000499970977 567287534 /nfs/dbraw/zinc/28/75/34/567287534.db2.gz GYUMYAAYVVEUNU-UHFFFAOYSA-N 0 1 384.237 3.142 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1ccc2cc[nH]c2n1 ZINC000499944935 567287772 /nfs/dbraw/zinc/28/77/72/567287772.db2.gz FPWIESGLKDRYRW-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc2cc[nH]c2n1 ZINC000499944935 567287776 /nfs/dbraw/zinc/28/77/76/567287776.db2.gz FPWIESGLKDRYRW-UHFFFAOYSA-N 0 1 397.236 3.041 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccc(Br)cc2O)ccc1F ZINC000526073724 567289848 /nfs/dbraw/zinc/28/98/48/567289848.db2.gz DJRWIPABTVWGQR-UHFFFAOYSA-N 0 1 376.203 3.103 10 0 GGAEMN CCN1C[C@@H](C)N(C(=O)Nc2ccc(Br)cc2C(=O)OC)C[C@H]1C ZINC000500033792 567291398 /nfs/dbraw/zinc/29/13/98/567291398.db2.gz CJDGQBTUYZAKOW-VXGBXAGGSA-N 0 1 398.301 3.182 10 0 GGAEMN NS(=O)(=O)c1cc(CN(Cc2cccc(Br)c2)CC2CC2)co1 ZINC000660391953 567293284 /nfs/dbraw/zinc/29/32/84/567293284.db2.gz BRUFXGGSHFKNAE-UHFFFAOYSA-N 0 1 399.310 3.102 10 0 GGAEMN COCCN(CC[C@@H]1Sc2ccccc2NC1=O)Cc1scnc1C ZINC000660428509 567293872 /nfs/dbraw/zinc/29/38/72/567293872.db2.gz DJEZIIVQGCDHSX-INIZCTEOSA-N 0 1 377.535 3.403 10 0 GGAEMN CC[C@@H]1[C@@H](C)CCN1C(=O)c1[nH]nc2ccc(I)cc21 ZINC000476061581 567294890 /nfs/dbraw/zinc/29/48/90/567294890.db2.gz MKUCJWMDSRCHEF-TVQRCGJNSA-N 0 1 383.233 3.428 10 0 GGAEMN CCc1nc([C@@H](C)N2CCN(Cc3cc(Br)ccc3F)CC2)n[nH]1 ZINC000660465064 567298002 /nfs/dbraw/zinc/29/80/02/567298002.db2.gz IDLGKWBKKGNSGN-GFCCVEGCSA-N 0 1 396.308 3.148 10 0 GGAEMN C[S@](=O)c1cccc(C(=O)Nc2nc3c(s2)CN(C(C)(C)C)CC3)c1 ZINC000591802282 567298318 /nfs/dbraw/zinc/29/83/18/567298318.db2.gz NXKDDZXGLIOFEG-VWLOTQADSA-N 0 1 377.535 3.289 10 0 GGAEMN Clc1cc(Br)cnc1CN1CCC[C@H](N2CCOCC2)CC1 ZINC000660474512 567299268 /nfs/dbraw/zinc/29/92/68/567299268.db2.gz JJPSGXSQSGDUJO-AWEZNQCLSA-N 0 1 388.737 3.184 10 0 GGAEMN C[C@@H](c1ccccc1)[C@H](CO)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000685816698 567299438 /nfs/dbraw/zinc/29/94/38/567299438.db2.gz OTUFMPQBAOZAGM-ZBEGNZNMSA-N 0 1 388.265 3.220 10 0 GGAEMN CCCC[C@H](NC(=O)NCC)C(=O)Nc1nc2ccc(Br)cc2[nH]1 ZINC000434240399 567300504 /nfs/dbraw/zinc/30/05/04/567300504.db2.gz SISVVMFAXBUTQU-LBPRGKRZSA-N 0 1 396.289 3.142 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074492 567302392 /nfs/dbraw/zinc/30/23/92/567302392.db2.gz KINIYCXCDJSBIG-HZPDHXFCSA-N 0 1 380.897 3.451 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2csc(Cc3ccc(Cl)cc3)n2)C1 ZINC000568074492 567302399 /nfs/dbraw/zinc/30/23/99/567302399.db2.gz KINIYCXCDJSBIG-HZPDHXFCSA-N 0 1 380.897 3.451 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)Cc2ccc(Br)cc2C)[nH]1 ZINC000434340537 567304921 /nfs/dbraw/zinc/30/49/21/567304921.db2.gz GDUWVSHIPOCUGX-UHFFFAOYSA-N 0 1 383.315 3.325 10 0 GGAEMN Cc1cc(N2CCC[C@@H](N[C@H](C)c3cn[nH]c3)C2=O)ccc1Br ZINC000548298577 567305452 /nfs/dbraw/zinc/30/54/52/567305452.db2.gz MSNYZLQTIXPITM-MLGOLLRUSA-N 0 1 377.286 3.327 10 0 GGAEMN Cc1nn(-c2ccc(C(=O)N[C@H]3CCCN(C)C3)cc2)c(C)c1Br ZINC000617414828 567305939 /nfs/dbraw/zinc/30/59/39/567305939.db2.gz RQJWVJPKTDTKEK-HNNXBMFYSA-N 0 1 391.313 3.076 10 0 GGAEMN CC(C)[C@H](N[C@@H](C)C(=O)N1CCSc2ccccc21)[C@H](O)C(F)(F)F ZINC000660526389 567306095 /nfs/dbraw/zinc/30/60/95/567306095.db2.gz UTQKHOFNXWPVHT-CQDKDKBSSA-N 0 1 376.444 3.051 10 0 GGAEMN CC(C)[C@H](NCc1nc2ccc(Br)cc2[nH]1)[C@H](O)C(F)(F)F ZINC000660527509 567306517 /nfs/dbraw/zinc/30/65/17/567306517.db2.gz DQDQKZVXXSDCAK-STQMWFEESA-N 0 1 380.208 3.363 10 0 GGAEMN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@H]1CCCN(C)C1 ZINC000617414874 567306636 /nfs/dbraw/zinc/30/66/36/567306636.db2.gz SVMWFEWVPULFTR-PWSUYJOCSA-N 0 1 375.694 3.080 10 0 GGAEMN CN1CCC[C@H](NC(=O)c2ccc(Oc3cccc(Br)c3)nc2)C1 ZINC000617414158 567306684 /nfs/dbraw/zinc/30/66/84/567306684.db2.gz AYKQLGISHKYLIF-HNNXBMFYSA-N 0 1 390.281 3.460 10 0 GGAEMN C[C@@]1(C2CC2)CN(C(=O)c2cc(-c3ccc(Br)cc3)[nH]n2)CCO1 ZINC000617402356 567306888 /nfs/dbraw/zinc/30/68/88/567306888.db2.gz HBJDPGCZRJGDEV-SFHVURJKSA-N 0 1 390.281 3.480 10 0 GGAEMN CN1CCC[C@@H](NC(=O)c2cccnc2Oc2ccc(Br)cc2)C1 ZINC000617414637 567306999 /nfs/dbraw/zinc/30/69/99/567306999.db2.gz NKKUBMPWGOZOJI-CQSZACIVSA-N 0 1 390.281 3.460 10 0 GGAEMN Cc1ccc(CN[C@H](c2cnn(C)c2)C2(CO)CCC2)cc1Br ZINC000660597442 567311293 /nfs/dbraw/zinc/31/12/93/567311293.db2.gz BISVMCIFYDQPLA-QGZVFWFLSA-N 0 1 378.314 3.485 10 0 GGAEMN Cc1nccc(NC(=O)NC[C@@H](c2ccsc2)N(C)C)c1Br ZINC000527089331 567312915 /nfs/dbraw/zinc/31/29/15/567312915.db2.gz IEOKAZHNPPXBLL-ZDUSSCGKSA-N 0 1 383.315 3.060 10 0 GGAEMN C[C@H](CNC(=O)N(C)CC1CN(C)C1)Sc1ccc(Br)cc1 ZINC000660628609 567313035 /nfs/dbraw/zinc/31/30/35/567313035.db2.gz ALJTWPDNBPIFHL-GFCCVEGCSA-N 0 1 386.359 3.133 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCC(=O)N2CC[C@@H](C)Sc3ccccc32)[C@@H]1SC ZINC000592165710 567318713 /nfs/dbraw/zinc/31/87/13/567318713.db2.gz DYZWOMDHXMONKB-UMHPPVOVSA-N 0 1 380.579 3.403 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cc(C)c(Cl)cc2OC)[C@@H]1SC ZINC000592174240 567319460 /nfs/dbraw/zinc/31/94/60/567319460.db2.gz JFBBJMRGAGDLRV-PREXVCJDSA-N 0 1 386.945 3.483 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cccc(Br)c2)[C@@H]1SC ZINC000592169312 567319551 /nfs/dbraw/zinc/31/95/51/567319551.db2.gz RAEOMUSDZDOPNY-QOWREQOWSA-N 0 1 387.343 3.275 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2ccc(OC)c(OC)c2Br)[C@@H]1SC ZINC000592169851 567319838 /nfs/dbraw/zinc/31/98/38/567319838.db2.gz XAHCBWKNYMPAJM-KFNAQCHYSA-N 0 1 390.343 3.465 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(Br)cc2F)[C@@H]1SC ZINC000592166704 567320072 /nfs/dbraw/zinc/32/00/72/567320072.db2.gz ITYQHYUOQCPDHV-NFAWXSAZSA-N 0 1 391.306 3.025 10 0 GGAEMN CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2nc3ccc(F)cc3s2)[C@@H]1SC ZINC000592174239 567320339 /nfs/dbraw/zinc/32/03/39/567320339.db2.gz JEPOVANDOWGCOA-OBEQPXDXSA-N 0 1 383.514 3.261 10 0 GGAEMN CN(C)C[C@H]1CCCN1S(=O)(=O)c1ccc2cc(Br)ccc2c1 ZINC000476420525 567322915 /nfs/dbraw/zinc/32/29/15/567322915.db2.gz DZDMIBUOJAYINX-MRXNPFEDSA-N 0 1 397.338 3.317 10 0 GGAEMN Brc1cc2c(cc1CN1CCC[C@@H](n3ccnn3)CC1)OCCO2 ZINC000639814110 567324379 /nfs/dbraw/zinc/32/43/79/567324379.db2.gz CCDMRTNGBCEQEH-CQSZACIVSA-N 0 1 393.285 3.039 10 0 GGAEMN Cc1cc(C)c(C(=O)N2[C@H](C)CN(C)C[C@@H]2C)cc1I ZINC000476470192 567326103 /nfs/dbraw/zinc/32/61/03/567326103.db2.gz IOFRFCAAERDHAH-BETUJISGSA-N 0 1 386.277 3.073 10 0 GGAEMN O=S(=O)(Cc1ccc(Cl)cc1Cl)NC[C@@H]1CCCCN1C1CC1 ZINC000434769326 567327529 /nfs/dbraw/zinc/32/75/29/567327529.db2.gz YQCYPQTVZYAAHC-HNNXBMFYSA-N 0 1 377.337 3.430 10 0 GGAEMN CC(C)NC(=O)CC[N@@H+](CCc1ccc(Cl)cc1)C[C@@H](O)C(F)(F)F ZINC000568438149 567328777 /nfs/dbraw/zinc/32/87/77/567328777.db2.gz HUEPNUVMGMOZQZ-OAHLLOKOSA-N 0 1 380.838 3.022 10 0 GGAEMN CC(C)NC(=O)CCN(CCc1ccc(Cl)cc1)C[C@@H](O)C(F)(F)F ZINC000568438149 567328781 /nfs/dbraw/zinc/32/87/81/567328781.db2.gz HUEPNUVMGMOZQZ-OAHLLOKOSA-N 0 1 380.838 3.022 10 0 GGAEMN C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1C(=O)N[C@H]1CCCN(C)C1 ZINC000660838840 567330250 /nfs/dbraw/zinc/33/02/50/567330250.db2.gz ZYRNFHBJRWQVON-COXVUDFISA-N 0 1 396.329 3.015 10 0 GGAEMN CC(C)(C)OC(=O)C1(CNCc2ncc(C(F)(F)F)s2)CCOCC1 ZINC000592373576 567333788 /nfs/dbraw/zinc/33/37/88/567333788.db2.gz ZPCCMKQQFQHOOG-UHFFFAOYSA-N 0 1 380.432 3.390 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](CCOc2ccc(Cl)cc2Br)C1 ZINC000568521645 567334996 /nfs/dbraw/zinc/33/49/96/567334996.db2.gz JWRYWHRVRCESMF-VXGBXAGGSA-N 0 1 392.677 3.045 10 0 GGAEMN CC(=O)c1[nH]c(CCN2CCOc3cccc(Br)c3C2)nc1C ZINC000660926267 567335481 /nfs/dbraw/zinc/33/54/81/567335481.db2.gz LQCMRXKZFRESJY-UHFFFAOYSA-N 0 1 378.270 3.120 10 0 GGAEMN O=C(NCc1n[nH]c(-c2ccc(Br)cc2)n1)c1cc(C2CC2)no1 ZINC000568587486 567340571 /nfs/dbraw/zinc/34/05/71/567340571.db2.gz DXIBLKUAZPTSFO-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN O=C(NCc1nc(-c2ccc(Br)cc2)n[nH]1)c1cc(C2CC2)no1 ZINC000568587486 567340576 /nfs/dbraw/zinc/34/05/76/567340576.db2.gz DXIBLKUAZPTSFO-UHFFFAOYSA-N 0 1 388.225 3.030 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000592504813 567342536 /nfs/dbraw/zinc/34/25/36/567342536.db2.gz ZFDVYQGZRCFURO-ZBEGNZNMSA-N 0 1 390.286 3.310 10 0 GGAEMN Cc1ccc(-c2n[nH]c(NC(=O)Cc3ccc(Br)cc3O)n2)cc1 ZINC000548732491 567345134 /nfs/dbraw/zinc/34/51/34/567345134.db2.gz OFINTYNEWKTXFM-UHFFFAOYSA-N 0 1 387.237 3.429 10 0 GGAEMN O=C(N[C@@H]1CCCc2cn[nH]c21)N1CCc2ccc(F)c(Br)c2C1 ZINC000527607007 567348143 /nfs/dbraw/zinc/34/81/43/567348143.db2.gz CALJIQKKWBNXJH-CQSZACIVSA-N 0 1 393.260 3.457 10 0 GGAEMN O=C(N[C@H]1CCCc2cn[nH]c21)N1CCc2ccc(F)c(Br)c2C1 ZINC000527607006 567348442 /nfs/dbraw/zinc/34/84/42/567348442.db2.gz CALJIQKKWBNXJH-AWEZNQCLSA-N 0 1 393.260 3.457 10 0 GGAEMN C[C@@](N)(C(=O)N1CCc2ccc(F)c(Br)c2C1)c1ccccc1 ZINC000527616489 567349121 /nfs/dbraw/zinc/34/91/21/567349121.db2.gz CVKYXISVQWNZEK-SFHVURJKSA-N 0 1 377.257 3.347 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1noc2c1COCC2)c1ccc(Cl)c(Cl)c1 ZINC000527615191 567349762 /nfs/dbraw/zinc/34/97/62/567349762.db2.gz RMPAIGCJWGLDFH-AWEZNQCLSA-N 0 1 384.263 3.087 10 0 GGAEMN N[C@@H](Cc1ccccc1)C(=O)N1CCc2ccc(F)c(Br)c2C1 ZINC000527617023 567350791 /nfs/dbraw/zinc/35/07/91/567350791.db2.gz AJCPPQPIQMZBAW-INIZCTEOSA-N 0 1 377.257 3.043 10 0 GGAEMN CC(C)Oc1cc(CNC(=O)c2n[nH]c3ccc(Br)cc32)ccn1 ZINC000500879143 567351353 /nfs/dbraw/zinc/35/13/53/567351353.db2.gz WPSVBVWJZFQURX-UHFFFAOYSA-N 0 1 389.253 3.438 10 0 GGAEMN CCOC(=O)c1c[nH]c(NC(=O)[C@H]2CCc3cc(Br)ccc32)n1 ZINC000592630165 567351929 /nfs/dbraw/zinc/35/19/29/567351929.db2.gz HILPKBHPTNJXLQ-LBPRGKRZSA-N 0 1 378.226 3.017 10 0 GGAEMN CC1=C[C@H](C)CN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000435258332 567352390 /nfs/dbraw/zinc/35/23/90/567352390.db2.gz BHTMUQWVENMOLU-VIFPVBQESA-N 0 1 381.217 3.206 10 0 GGAEMN Clc1ccc(-c2nnc(CN3CC[C@H](Cn4ccnn4)C3)o2)c(Cl)c1 ZINC000661145935 567352589 /nfs/dbraw/zinc/35/25/89/567352589.db2.gz WCIWMTZVMWVTCV-NSHDSACASA-N 0 1 379.251 3.157 10 0 GGAEMN C[C@@]12COC[C@]1(C)CN(C(=O)c1n[nH]c(-c3ccccc3)c1Br)C2 ZINC000618026628 567352883 /nfs/dbraw/zinc/35/28/83/567352883.db2.gz ZSDQXQHRSUWUAW-HDICACEKSA-N 0 1 390.281 3.338 10 0 GGAEMN CN(C)[C@@H](CNC(=O)N1CCOC[C@@H]1CC(F)F)c1ccc(Cl)cc1 ZINC000548815022 567352933 /nfs/dbraw/zinc/35/29/33/567352933.db2.gz JKDPSWNYGWFUFR-GJZGRUSLSA-N 0 1 375.847 3.008 10 0 GGAEMN C[NH+](C)CCNC(=O)c1cccc(C[NH2+]Cc2ccsc2Br)c1 ZINC000527653619 567356916 /nfs/dbraw/zinc/35/69/16/567356916.db2.gz NUZSATNZAGVSIY-UHFFFAOYSA-N 0 1 396.354 3.092 10 0 GGAEMN CO[C@@H]1CCC[C@H]([C@@H](CO)NCc2ncc(Br)cc2Cl)C1 ZINC000661217318 567357060 /nfs/dbraw/zinc/35/70/60/567357060.db2.gz MRHWPDHOINRLFA-JVLSTEMRSA-N 0 1 377.710 3.153 10 0 GGAEMN CO[C@@H]1CCC[C@@H]([C@H](CO)NCc2ncc(Br)cc2Cl)C1 ZINC000661217313 567357099 /nfs/dbraw/zinc/35/70/99/567357099.db2.gz MRHWPDHOINRLFA-HCKVZZMMSA-N 0 1 377.710 3.153 10 0 GGAEMN CC[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000661204070 567357576 /nfs/dbraw/zinc/35/75/76/567357576.db2.gz BUJKMVOSEMHJJZ-CABCVRRESA-N 0 1 391.313 3.350 10 0 GGAEMN Cc1ccc2c(c1Br)CN(C(=O)N[C@H]1CCc3nc[nH]c3C1)C2 ZINC000661205609 567357729 /nfs/dbraw/zinc/35/77/29/567357729.db2.gz ZSDNORSJTKWWTD-LBPRGKRZSA-N 0 1 375.270 3.063 10 0 GGAEMN COc1ccc(Br)c(S(=O)(=O)[N-]c2ccc3[nH+]c(C)cn3c2)c1 ZINC000476918356 567357771 /nfs/dbraw/zinc/35/77/71/567357771.db2.gz FFRZHJDLXNFFMW-UHFFFAOYSA-N 0 1 396.266 3.215 10 0 GGAEMN CO[C@@H]1CCC[C@@H]([C@@H](CO)NCc2nc3ccc(Br)cc3o2)C1 ZINC000661215047 567357937 /nfs/dbraw/zinc/35/79/37/567357937.db2.gz DRDWUSNVRHVJFH-UXIGCNINSA-N 0 1 383.286 3.246 10 0 GGAEMN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000661204071 567358093 /nfs/dbraw/zinc/35/80/93/567358093.db2.gz BUJKMVOSEMHJJZ-GJZGRUSLSA-N 0 1 391.313 3.350 10 0 GGAEMN Cc1cc(CNCC(C)(C)S(=O)(=O)c2ccc(Br)cc2)ccn1 ZINC000527663238 567358485 /nfs/dbraw/zinc/35/84/85/567358485.db2.gz WSESJQFVTJZYRA-UHFFFAOYSA-N 0 1 397.338 3.495 10 0 GGAEMN Cc1cc(Br)c(CN[C@@H]2CCC(=O)N(C)C2)cc1Br ZINC000527664745 567358585 /nfs/dbraw/zinc/35/85/85/567358585.db2.gz NXOZDOUDENYFDU-LLVKDONJSA-N 0 1 390.119 3.230 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N[C@H]2CCc3c2ccc(F)c3Br)cn1 ZINC000456281309 567358798 /nfs/dbraw/zinc/35/87/98/567358798.db2.gz VKGHJACUHQRUGG-INIZCTEOSA-N 0 1 392.272 3.462 10 0 GGAEMN COC[C@H](CCO)NCc1cc(Br)c(C)cc1Br ZINC000527663506 567358877 /nfs/dbraw/zinc/35/88/77/567358877.db2.gz CGCSYSJIJJWOTF-NSHDSACASA-N 0 1 381.108 3.007 10 0 GGAEMN COc1ccccc1[C@H](CNC(=O)[C@@H]1C[C@]1(C)Br)N1CCCC1 ZINC000527682963 567360992 /nfs/dbraw/zinc/36/09/92/567360992.db2.gz MQOMTCDTGKVRTL-MPGHIAIKSA-N 0 1 381.314 3.122 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1csc(-c2cc(Br)cs2)n1 ZINC000618194935 567362185 /nfs/dbraw/zinc/36/21/85/567362185.db2.gz OBDHORYVAIRGKJ-UHFFFAOYSA-N 0 1 386.340 3.268 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 ZINC000618193615 567362532 /nfs/dbraw/zinc/36/25/32/567362532.db2.gz ZVARZHWTXCWIJF-UHFFFAOYSA-N 0 1 381.263 3.209 10 0 GGAEMN Cc1cc(Br)c(CN[C@@]2(CCO)CCOC2)cc1Br ZINC000527701177 567364891 /nfs/dbraw/zinc/36/48/91/567364891.db2.gz SVWHDGWMDFLRKB-AWEZNQCLSA-N 0 1 393.119 3.151 10 0 GGAEMN O=C(COc1ccccc1)N1CC[C@H](NCc2ccsc2Br)C1 ZINC000527706750 567366721 /nfs/dbraw/zinc/36/67/21/567366721.db2.gz ZSMQAQURIVKUDO-AWEZNQCLSA-N 0 1 395.322 3.280 10 0 GGAEMN Cc1cc(Br)c(CNCCN2CCCC2=O)cc1Br ZINC000527730121 567370832 /nfs/dbraw/zinc/37/08/32/567370832.db2.gz ZNARVWVJBIRZES-UHFFFAOYSA-N 0 1 390.119 3.232 10 0 GGAEMN CCn1c(-c2ccc(Br)cc2)nnc1N1CCN(C2CCC2)CC1 ZINC000549053927 567370906 /nfs/dbraw/zinc/37/09/06/567370906.db2.gz UXAGZZITVXCGBE-UHFFFAOYSA-N 0 1 390.329 3.402 10 0 GGAEMN CN(C)[C@H](CNC(=O)NC[C@@H]1CSc2ccccc2O1)c1ccsc1 ZINC000568979054 567370896 /nfs/dbraw/zinc/37/08/96/567370896.db2.gz QFHGMJUPUUDFKT-HUUCEWRRSA-N 0 1 377.535 3.203 10 0 GGAEMN FC(F)(F)[C@@H](CNCc1ccc(I)cc1)n1cccn1 ZINC000527740334 567371863 /nfs/dbraw/zinc/37/18/63/567371863.db2.gz ZSLMLJXTKYAJEE-GFCCVEGCSA-N 0 1 395.166 3.381 10 0 GGAEMN O=C(NCc1nccn1-c1ccccc1)c1n[nH]c2ccc(Br)cc21 ZINC000549102622 567373982 /nfs/dbraw/zinc/37/39/82/567373982.db2.gz KNHAVSRFDOFPOE-UHFFFAOYSA-N 0 1 396.248 3.441 10 0 GGAEMN CS[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@H]1N1CCCC1 ZINC000477135910 567374351 /nfs/dbraw/zinc/37/43/51/567374351.db2.gz BTCYNHOZJZFGKQ-ZIAGYGMSSA-N 0 1 395.377 3.194 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N(C)[C@H](CO)c2cccc(Cl)c2Cl)cn1 ZINC000618341279 567374973 /nfs/dbraw/zinc/37/49/73/567374973.db2.gz DDSSTUYNKMYBFP-MRXNPFEDSA-N 0 1 382.291 3.256 10 0 GGAEMN CC(C)(CO)[C@@H](NCC(=O)N1CCC[C@H](C(F)(F)F)C1)c1cccs1 ZINC000569054909 567376450 /nfs/dbraw/zinc/37/64/50/567376450.db2.gz RDLASZMPAKSDCC-WFASDCNBSA-N 0 1 378.460 3.198 10 0 GGAEMN CN(C)C[C@@H](NCc1ccc(C(=O)N(C)C)[nH]1)c1ccc(Cl)c(Cl)c1 ZINC000527810227 567376357 /nfs/dbraw/zinc/37/63/57/567376357.db2.gz PABKDFYMPFFZDR-QGZVFWFLSA-N 0 1 383.323 3.416 10 0 GGAEMN CN1C(=O)c2ccccc2[C@@H]1CNCc1cc(Br)cc2c1OCC2 ZINC000527810046 567376967 /nfs/dbraw/zinc/37/69/67/567376967.db2.gz WDGQBCGWSKVWGC-KRWDZBQOSA-N 0 1 387.277 3.301 10 0 GGAEMN CN1C(=O)c2ccccc2[C@H]1CNCc1cc(Br)cc2c1OCC2 ZINC000527810049 567377253 /nfs/dbraw/zinc/37/72/53/567377253.db2.gz WDGQBCGWSKVWGC-QGZVFWFLSA-N 0 1 387.277 3.301 10 0 GGAEMN O=C(NC1CCCC1)c1ccc(=NCc2cc(Br)ccc2F)[nH]n1 ZINC000549189581 567378296 /nfs/dbraw/zinc/37/82/96/567378296.db2.gz KRXUEFHQSYJONQ-UHFFFAOYSA-N 0 1 393.260 3.085 10 0 GGAEMN C[C@H]1c2ccccc2C[C@H]1N[C@H](C(N)=O)c1ccc(Br)cc1F ZINC000661518869 567378819 /nfs/dbraw/zinc/37/88/19/567378819.db2.gz HJKLQUWNICFBIZ-HKJPBSJPSA-N 0 1 377.257 3.433 10 0 GGAEMN O=C(NCc1cc(Br)ccc1F)N1CCC(c2cnc[nH]2)CC1 ZINC000435623221 567379862 /nfs/dbraw/zinc/37/98/62/567379862.db2.gz GPESWEYRZZAOPW-UHFFFAOYSA-N 0 1 381.249 3.401 10 0 GGAEMN Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(Br)c1O ZINC000549206616 567380009 /nfs/dbraw/zinc/38/00/09/567380009.db2.gz LFVPHJFSEWHOLS-YHWZYXNKSA-N 0 1 390.281 3.439 10 0 GGAEMN Cc1nnc(SCC(=O)N[C@@H]2CSCc3ccc(Br)cc32)[nH]1 ZINC000618362126 567380434 /nfs/dbraw/zinc/38/04/34/567380434.db2.gz ZZDCZVNGDODXRC-GFCCVEGCSA-N 0 1 399.339 3.072 10 0 GGAEMN Cc1n[nH]c(SCC(=O)N[C@@H]2CSCc3ccc(Br)cc32)n1 ZINC000618362126 567380441 /nfs/dbraw/zinc/38/04/41/567380441.db2.gz ZZDCZVNGDODXRC-GFCCVEGCSA-N 0 1 399.339 3.072 10 0 GGAEMN O=C([C@@H]1CCCc2[nH]ncc21)N1CCOC[C@H]1c1ccc(Br)cc1 ZINC000618364261 567382441 /nfs/dbraw/zinc/38/24/41/567382441.db2.gz FWNXKQXKCZQNGP-PBHICJAKSA-N 0 1 390.281 3.192 10 0 GGAEMN CC(C)OCc1nc([C@@H](C)NCc2nc3ccc(Br)cc3[nH]2)no1 ZINC000569175561 567383378 /nfs/dbraw/zinc/38/33/78/567383378.db2.gz PHYLCTTXVJHFEY-SNVBAGLBSA-N 0 1 394.273 3.484 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(CNC(=O)[C@@H]3C[C@]3(C)Br)cc2)C[C@@H](C)O1 ZINC000527907737 567383854 /nfs/dbraw/zinc/38/38/54/567383854.db2.gz BUGSRLJCKDXOHL-GNSPCKGOSA-N 0 1 395.341 3.086 10 0 GGAEMN C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N=c1cc(-c2nccn2C)[nH][nH]1 ZINC000435712388 567384724 /nfs/dbraw/zinc/38/47/24/567384724.db2.gz ATZJEMODGHADRK-SNVBAGLBSA-N 0 1 378.263 3.356 10 0 GGAEMN CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1C[C@@H]2C[C@H]1C[S@]2=O ZINC000593099053 567385555 /nfs/dbraw/zinc/38/55/55/567385555.db2.gz HSZDIXJXIZMLQK-XSKAOVLVSA-N 0 1 382.957 3.389 10 0 GGAEMN C[C@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1cc(F)c(Br)cc1F ZINC000527948258 567386167 /nfs/dbraw/zinc/38/61/67/567386167.db2.gz DICSBMHCYKZCIF-DTWKUNHWSA-N 0 1 399.239 3.368 10 0 GGAEMN C[C@H](NC(=O)N[C@H]1CCc2nc[nH]c2C1)c1cc(F)c(Br)cc1F ZINC000527948259 567386307 /nfs/dbraw/zinc/38/63/07/567386307.db2.gz DICSBMHCYKZCIF-IUCAKERBSA-N 0 1 399.239 3.368 10 0 GGAEMN C[C@@H]1Cc2ccc(Br)cc2CN1CCc1nnnn1-c1ccccc1 ZINC000501427309 567388360 /nfs/dbraw/zinc/38/83/60/567388360.db2.gz QWJGKNLOZWYLCY-CQSZACIVSA-N 0 1 398.308 3.414 10 0 GGAEMN CC[C@H](C)N1CCN(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)CC1 ZINC000456529562 567388453 /nfs/dbraw/zinc/38/84/53/567388453.db2.gz LRVYSARSUUEZNK-LBPRGKRZSA-N 0 1 392.297 3.259 10 0 GGAEMN CCCN1CCN(c2nnc(-c3ccccc3Br)n2CC)CC1 ZINC000549397569 567389229 /nfs/dbraw/zinc/38/92/29/567389229.db2.gz KDFWISGSHXYMBC-UHFFFAOYSA-N 0 1 378.318 3.260 10 0 GGAEMN C[C@H](N[C@@H]1[C@H](C)O[C@H](C)[C@H]1C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl ZINC000528006920 567390113 /nfs/dbraw/zinc/39/01/13/567390113.db2.gz PNHSSIUJRGXAFZ-MJEBZVHXSA-N 0 1 381.325 3.103 10 0 GGAEMN C[C@H]1Cc2cn[nH]c2[C@@H](C(=O)Nc2nnc(C(F)(F)C(F)(F)F)s2)C1 ZINC000640737875 567390430 /nfs/dbraw/zinc/39/04/30/567390430.db2.gz DGHMQRVVLXHAEO-FSPLSTOPSA-N 0 1 381.330 3.220 10 0 GGAEMN CN(Cc1cnc[nH]1)C(=O)NCC1(Cc2ccc(Br)cc2)CC1 ZINC000661798429 567394199 /nfs/dbraw/zinc/39/41/99/567394199.db2.gz MVUSYIMNTFBOTP-UHFFFAOYSA-N 0 1 377.286 3.337 10 0 GGAEMN CO[C@H]1C[C@@H](N(C)C(=O)c2[nH]nc3ccc(Br)cc32)C12CCC2 ZINC000456638896 567397350 /nfs/dbraw/zinc/39/73/50/567397350.db2.gz NWGHEALWTNIMCW-KGLIPLIRSA-N 0 1 378.270 3.355 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSCc2ccc(Cl)cc2F)C1 ZINC000435967745 567398608 /nfs/dbraw/zinc/39/86/08/567398608.db2.gz ARQFVIQJAQGJBJ-MRXNPFEDSA-N 0 1 388.936 3.185 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CCc3[nH]c4ccc(Br)cc4c3C2)C1 ZINC000618560972 567400424 /nfs/dbraw/zinc/40/04/24/567400424.db2.gz AERCPMGRVAZGHQ-ZDUSSCGKSA-N 0 1 391.313 3.092 10 0 GGAEMN CCn1cnc(S(=O)(=O)Nc2c(C)cc(Br)cc2Cl)c1 ZINC000436017745 567400839 /nfs/dbraw/zinc/40/08/39/567400839.db2.gz ZHPJIAWIXKWKGN-UHFFFAOYSA-N 0 1 378.679 3.428 10 0 GGAEMN Cc1cc(C(=O)N=c2cc(-c3nccn3C)[nH][nH]2)cc(Cl)c1Br ZINC000501779348 567405907 /nfs/dbraw/zinc/40/59/07/567405907.db2.gz NBJIJWLMZWELDG-UHFFFAOYSA-N 0 1 394.660 3.209 10 0 GGAEMN CN1C(=O)CN(Cc2nc3ccc(Br)cc3[nH]2)[C@H]1c1ccccc1 ZINC000569477104 567406655 /nfs/dbraw/zinc/40/66/55/567406655.db2.gz VLZFKQRAFRWKLQ-SFHVURJKSA-N 0 1 385.265 3.298 10 0 GGAEMN Cc1n[nH]c(C(=O)N[C@@H](C)CCc2ccc(I)cc2)c1C ZINC000477662562 567408340 /nfs/dbraw/zinc/40/83/40/567408340.db2.gz KDOSPZRFSZGLJX-JTQLQIEISA-N 0 1 397.260 3.382 10 0 GGAEMN C[C@@H](Cc1ccc(Br)cc1)NC(=O)c1ccc(CN(C)C)nc1 ZINC000549749102 567409240 /nfs/dbraw/zinc/40/92/40/567409240.db2.gz HDRYVPROLQMILQ-ZDUSSCGKSA-N 0 1 376.298 3.267 10 0 GGAEMN O=C(c1ccsc1C(F)(F)F)N1CCC(CCN2CCOCC2)CC1 ZINC000528312963 567409417 /nfs/dbraw/zinc/40/94/17/567409417.db2.gz BPNFEBSPLZFYQZ-UHFFFAOYSA-N 0 1 376.444 3.341 10 0 GGAEMN CN(C)Cc1ccc(C(=O)N2CCc3sc(Br)cc3C2)cn1 ZINC000618794649 567415587 /nfs/dbraw/zinc/41/55/87/567415587.db2.gz YCNGFRWTCMBTTF-UHFFFAOYSA-N 0 1 380.311 3.166 10 0 GGAEMN Cc1cc(NC(=O)c2cccc(N3CCN(C)CC3)n2)ccc1Br ZINC000502064074 567417457 /nfs/dbraw/zinc/41/74/57/567417457.db2.gz HSDKHMKHJGZFCC-UHFFFAOYSA-N 0 1 389.297 3.157 10 0 GGAEMN CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(N2CCN(C)CC2)n1 ZINC000502077041 567418647 /nfs/dbraw/zinc/41/86/47/567418647.db2.gz FOGZZSAXRQQQCG-UHFFFAOYSA-N 0 1 378.929 3.211 10 0 GGAEMN Cc1nccc(NC(=O)N(C)Cc2cc(C(C)(C)C)[nH]n2)c1Br ZINC000569660022 567421663 /nfs/dbraw/zinc/42/16/63/567421663.db2.gz WBHHFNWGXMJMPI-UHFFFAOYSA-N 0 1 380.290 3.259 10 0 GGAEMN Cc1c(Br)ccc(C(=O)Nc2nc(-c3ccccn3)n[nH]2)c1F ZINC000436431706 567424190 /nfs/dbraw/zinc/42/41/90/567424190.db2.gz MMPMIAPAIYPJQR-UHFFFAOYSA-N 0 1 376.189 3.329 10 0 GGAEMN Cn1cc(C[C@@H]2CCC[C@H]2NC(=O)c2cccc(Br)c2O)cn1 ZINC000618928776 567424936 /nfs/dbraw/zinc/42/49/36/567424936.db2.gz BSPRWZGYMWOQAO-SWLSCSKDSA-N 0 1 378.270 3.029 10 0 GGAEMN Cn1cc(C[C@H]2CCC[C@H]2NC(=O)c2cccc(Br)c2O)cn1 ZINC000618928775 567425083 /nfs/dbraw/zinc/42/50/83/567425083.db2.gz BSPRWZGYMWOQAO-IUODEOHRSA-N 0 1 378.270 3.029 10 0 GGAEMN CC(C)CN1CCN(C(=O)N[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000618950572 567425878 /nfs/dbraw/zinc/42/58/78/567425878.db2.gz UOLWHSFYBHPRTP-INIZCTEOSA-N 0 1 396.329 3.256 10 0 GGAEMN C[C@]1(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C[C@H]2C[C@H]2C1 ZINC000550109671 567427770 /nfs/dbraw/zinc/42/77/70/567427770.db2.gz FHBANNYCIUYFNV-PBKGOJFUSA-N 0 1 375.270 3.287 10 0 GGAEMN C[C@]1(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C[C@H]2C[C@H]2C1 ZINC000550109671 567427775 /nfs/dbraw/zinc/42/77/75/567427775.db2.gz FHBANNYCIUYFNV-PBKGOJFUSA-N 0 1 375.270 3.287 10 0 GGAEMN CC(C)(C(=O)Nc1cc(F)c(I)c(F)c1)c1cnc[nH]1 ZINC000550142241 567429487 /nfs/dbraw/zinc/42/94/87/567429487.db2.gz FDDHAHPETRMFRY-UHFFFAOYSA-N 0 1 391.159 3.209 10 0 GGAEMN C[C@@]1(Br)C[C@@H]1C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000528497785 567430556 /nfs/dbraw/zinc/43/05/56/567430556.db2.gz RYAAYDFYGLCMFX-RHSMWYFYSA-N 0 1 387.362 3.090 10 0 GGAEMN C[C@@]1(Br)C[C@H]1C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1 ZINC000528497786 567430625 /nfs/dbraw/zinc/43/06/25/567430625.db2.gz RYAAYDFYGLCMFX-WMLDXEAASA-N 0 1 387.362 3.090 10 0 GGAEMN Cn1cc(CCN2CCC[C@@H]2c2ccc(I)cc2)cn1 ZINC000550174569 567432312 /nfs/dbraw/zinc/43/23/12/567432312.db2.gz VUGIYTDVVJWCEZ-MRXNPFEDSA-N 0 1 381.261 3.404 10 0 GGAEMN C[C@H](NCCN(C)S(=O)(=O)c1cccs1)c1cnn(C2CCCC2)c1 ZINC000502410998 567432405 /nfs/dbraw/zinc/43/24/05/567432405.db2.gz ZPFQRXMVJVMFAZ-AWEZNQCLSA-N 0 1 382.555 3.031 10 0 GGAEMN Cn1cc(CCN2CCC[C@H]2c2ccc(I)cc2)cn1 ZINC000550174566 567432520 /nfs/dbraw/zinc/43/25/20/567432520.db2.gz VUGIYTDVVJWCEZ-INIZCTEOSA-N 0 1 381.261 3.404 10 0 GGAEMN C[C@H]1CC[N@@H+](Cc2nc(-c3cccc(Br)c3)no2)C[C@H]1C(=O)[O-] ZINC000569810534 567434639 /nfs/dbraw/zinc/43/46/39/567434639.db2.gz LSMAGQVJQDZKJJ-GXFFZTMASA-N 0 1 380.242 3.042 10 0 GGAEMN COc1ccc(NC(=O)c2ccc(Br)cc2O)c(OC)c1OC ZINC000436561240 567434939 /nfs/dbraw/zinc/43/49/39/567434939.db2.gz HDCRBRJKOTVRQU-UHFFFAOYSA-N 0 1 382.210 3.433 10 0 GGAEMN C[C@H](CN1CCOCC1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F ZINC000619126112 567435074 /nfs/dbraw/zinc/43/50/74/567435074.db2.gz FAYLQDCGENRSPG-LLVKDONJSA-N 0 1 378.357 3.125 10 0 GGAEMN Cc1nnc(SCC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)[nH]1 ZINC000619125545 567435187 /nfs/dbraw/zinc/43/51/87/567435187.db2.gz RJJAQYCYJZALGZ-UHFFFAOYSA-N 0 1 378.342 3.375 10 0 GGAEMN Cc1n[nH]c(SCC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)n1 ZINC000619125545 567435190 /nfs/dbraw/zinc/43/51/90/567435190.db2.gz RJJAQYCYJZALGZ-UHFFFAOYSA-N 0 1 378.342 3.375 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1 ZINC000528546341 567435504 /nfs/dbraw/zinc/43/55/04/567435504.db2.gz DCNCLOWSLCQIGA-AWEZNQCLSA-N 0 1 387.343 3.053 10 0 GGAEMN Cc1ccc(Br)c(S(=O)(=O)NC[C@@H]2CCN2C2CCCC2)c1 ZINC000528546341 567435508 /nfs/dbraw/zinc/43/55/08/567435508.db2.gz DCNCLOWSLCQIGA-AWEZNQCLSA-N 0 1 387.343 3.053 10 0 GGAEMN CN(C(=O)c1snnc1C(C)(C)C)C1CCN(CCC(F)(F)F)CC1 ZINC000457075694 567437994 /nfs/dbraw/zinc/43/79/94/567437994.db2.gz XBHPFQSVJNGCDU-UHFFFAOYSA-N 0 1 378.464 3.324 10 0 GGAEMN CCn1c(CN=c2[nH]n3cc(C)nc3s2)nc2cc(Br)ccc21 ZINC000478139187 567437992 /nfs/dbraw/zinc/43/79/92/567437992.db2.gz UJYQOLVMMAUIOE-UHFFFAOYSA-N 0 1 391.298 3.265 10 0 GGAEMN CCC(=O)c1ccc(O)c(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000436648291 567440726 /nfs/dbraw/zinc/44/07/26/567440726.db2.gz STEKJSYEOIIYDT-UHFFFAOYSA-N 0 1 381.837 3.051 10 0 GGAEMN CCO[C@@H]1C[C@@H](NCc2cc(Br)cc3c2OCC3)[C@@H]1n1cccn1 ZINC000550325276 567441569 /nfs/dbraw/zinc/44/15/69/567441569.db2.gz RJMJSTPZOJOCQN-ZACQAIPSSA-N 0 1 392.297 3.089 10 0 GGAEMN COc1ccc(Br)c(CN2CC3(CCOCC3)CC[C@H]2CO)c1 ZINC000528646943 567444631 /nfs/dbraw/zinc/44/46/31/567444631.db2.gz YXMCFSMASQYDKS-HNNXBMFYSA-N 0 1 384.314 3.211 10 0 GGAEMN CC[N@H+]1CC[C@H]2OCCN(C(=O)c3cc(Br)ccc3Cl)[C@H]2C1 ZINC000502622696 567445567 /nfs/dbraw/zinc/44/55/67/567445567.db2.gz NVXIHZVXSWSXSV-LSDHHAIUSA-N 0 1 387.705 3.038 10 0 GGAEMN C[C@H](CCc1ccc(Br)cc1)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662528473 567446399 /nfs/dbraw/zinc/44/63/99/567446399.db2.gz AAPIJPCHVVIUBY-LLVKDONJSA-N 0 1 380.286 3.382 10 0 GGAEMN CCC[C@H]1CNCCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000662554981 567447672 /nfs/dbraw/zinc/44/76/72/567447672.db2.gz YAFIJNZJLVCAJP-INIZCTEOSA-N 0 1 380.330 3.263 10 0 GGAEMN Cc1nnc(SCCC(=O)N2CC[C@H](c3cc(C)c(Cl)cc3O)C2)[nH]1 ZINC000619375143 567448764 /nfs/dbraw/zinc/44/87/64/567448764.db2.gz SSNWMKKQEISYAZ-LBPRGKRZSA-N 0 1 380.901 3.279 10 0 GGAEMN Cc1cc([C@H]2CCN(C(=O)c3csc(=NC4CC4)[nH]3)C2)c(O)cc1Cl ZINC000619373819 567448796 /nfs/dbraw/zinc/44/87/96/567448796.db2.gz FNLVGZILLGFMPG-NSHDSACASA-N 0 1 377.897 3.436 10 0 GGAEMN CO[C@H]1CCC[C@@H](C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)C1 ZINC000550471285 567449861 /nfs/dbraw/zinc/44/98/61/567449861.db2.gz HFDIBLOVNRMPMC-OCCSQVGLSA-N 0 1 393.285 3.056 10 0 GGAEMN CO[C@H]1CCC[C@@H](C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000550471285 567449865 /nfs/dbraw/zinc/44/98/65/567449865.db2.gz HFDIBLOVNRMPMC-OCCSQVGLSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@H](NCCNS(=O)(=O)c1ccc(F)cc1F)c1ccc(Cl)c(F)c1 ZINC000570006346 567451153 /nfs/dbraw/zinc/45/11/53/567451153.db2.gz QSZNYYNPGJJFCI-JTQLQIEISA-N 0 1 392.830 3.386 10 0 GGAEMN CC(C)SCCNC(=O)c1cccc(C(=O)NCCSC(C)C)c1O ZINC000436772388 567451643 /nfs/dbraw/zinc/45/16/43/567451643.db2.gz NPFFRWLJIISOTE-UHFFFAOYSA-N 0 1 384.567 3.135 10 0 GGAEMN C[C@H]1O[C@@H](C)[C@H](C)[C@H]1NCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000528751393 567453203 /nfs/dbraw/zinc/45/32/03/567453203.db2.gz CONVIWDYNNFOSY-APNQJHFZSA-N 0 1 380.535 3.115 10 0 GGAEMN C[C@@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000594030827 567453593 /nfs/dbraw/zinc/45/35/93/567453593.db2.gz SFEVGRUNKPHOIF-TXEJJXNPSA-N 0 1 382.423 3.386 10 0 GGAEMN C[C@H]1CCC[C@H](C)N1CCNS(=O)(=O)c1cc(Br)ccc1F ZINC000594030831 567454039 /nfs/dbraw/zinc/45/40/39/567454039.db2.gz SKLDBJDKARFHCU-RYUDHWBXSA-N 0 1 393.322 3.129 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)NC(=O)c1cc(C(C)(C)N)no1 ZINC000662642978 567454103 /nfs/dbraw/zinc/45/41/03/567454103.db2.gz HUQSLOUVFMYNSN-GFCCVEGCSA-N 0 1 380.286 3.382 10 0 GGAEMN O=C(NC[C@H](O)CCc1ccccc1)c1cc(Br)cc2nc[nH]c21 ZINC000502833209 567455843 /nfs/dbraw/zinc/45/58/43/567455843.db2.gz SYLZFSUMSYXBAG-CQSZACIVSA-N 0 1 388.265 3.049 10 0 GGAEMN O=C(NC[C@@H](O)CCc1ccccc1)c1cc(Br)cc2nc[nH]c21 ZINC000502833208 567456333 /nfs/dbraw/zinc/45/63/33/567456333.db2.gz SYLZFSUMSYXBAG-AWEZNQCLSA-N 0 1 388.265 3.049 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@@H](O)COc2cc(Cl)ccc2Cl)n[nH]1 ZINC000528792740 567456491 /nfs/dbraw/zinc/45/64/91/567456491.db2.gz VJGOLDJPXPLNIB-IUODEOHRSA-N 0 1 384.263 3.066 10 0 GGAEMN O=c1ccc([C@@H]2CCCN2C[C@@H](O)COc2c(Cl)cccc2Cl)n[nH]1 ZINC000528794418 567456512 /nfs/dbraw/zinc/45/65/12/567456512.db2.gz ZERSZGUURAGJJN-ABAIWWIYSA-N 0 1 384.263 3.066 10 0 GGAEMN O=c1ccc([C@H]2CCCN2C[C@@H](O)COc2c(Cl)cccc2Cl)n[nH]1 ZINC000528794419 567456525 /nfs/dbraw/zinc/45/65/25/567456525.db2.gz ZERSZGUURAGJJN-IAQYHMDHSA-N 0 1 384.263 3.066 10 0 GGAEMN Cc1cc(=NC(=O)c2cc(Br)cc3[nH]cnc32)[nH]n1[C@H](C)C1CC1 ZINC000502859061 567457182 /nfs/dbraw/zinc/45/71/82/567457182.db2.gz GTCSINCAAKDNDT-SNVBAGLBSA-N 0 1 388.269 3.476 10 0 GGAEMN CC(C)(C)C1CN(C(=O)c2[nH]nc3ccc(I)cc32)C1 ZINC000457345351 567459244 /nfs/dbraw/zinc/45/92/44/567459244.db2.gz RAMFHAXNKXNABT-UHFFFAOYSA-N 0 1 383.233 3.286 10 0 GGAEMN CCC[C@@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)OCC ZINC000570128881 567459780 /nfs/dbraw/zinc/45/97/80/567459780.db2.gz RJRFQOXKCDKBKL-JTQLQIEISA-N 0 1 382.258 3.035 10 0 GGAEMN COc1ccc(CNC[C@H]2CS(=O)(=O)c3ccccc32)c(Cl)c1OC ZINC000570129839 567459945 /nfs/dbraw/zinc/45/99/45/567459945.db2.gz XNAYUAJXBBDULE-ZDUSSCGKSA-N 0 1 381.881 3.018 10 0 GGAEMN CCOC(=O)c1cc(NC(=O)c2cc(Br)cc3nc[nH]c32)cn1C ZINC000502986588 567463806 /nfs/dbraw/zinc/46/38/06/567463806.db2.gz FJGFPCGZGZVZNZ-UHFFFAOYSA-N 0 1 391.225 3.093 10 0 GGAEMN CCN1CCN(CC(C)(C)NC(=O)NCc2ccc(Cl)cc2Cl)CC1 ZINC000457415011 567464209 /nfs/dbraw/zinc/46/42/09/567464209.db2.gz MISJECJCCSZQAI-UHFFFAOYSA-N 0 1 387.355 3.209 10 0 GGAEMN CC(C)(N)c1cc(C(=O)NC2(c3ccccc3Br)CCC2)on1 ZINC000662827953 567464868 /nfs/dbraw/zinc/46/48/68/567464868.db2.gz QUWPRQGNJAYNRF-UHFFFAOYSA-N 0 1 378.270 3.440 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)N1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000528898922 567467225 /nfs/dbraw/zinc/46/72/25/567467225.db2.gz BAZAEGPLYXKZTG-DCGLDWPTSA-N 0 1 375.270 3.309 10 0 GGAEMN C[C@]1(Br)C[C@H]1C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)n[nH]1 ZINC000528898922 567467232 /nfs/dbraw/zinc/46/72/32/567467232.db2.gz BAZAEGPLYXKZTG-DCGLDWPTSA-N 0 1 375.270 3.309 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)N1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1 ZINC000528898931 567467431 /nfs/dbraw/zinc/46/74/31/567467431.db2.gz BAZAEGPLYXKZTG-XNJGSVPQSA-N 0 1 375.270 3.309 10 0 GGAEMN C[C@]1(Br)C[C@@H]1C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)n[nH]1 ZINC000528898931 567467435 /nfs/dbraw/zinc/46/74/35/567467435.db2.gz BAZAEGPLYXKZTG-XNJGSVPQSA-N 0 1 375.270 3.309 10 0 GGAEMN Cc1ccc2nc(CNC(=O)c3cc(Br)cc4nc[nH]c43)cn2c1 ZINC000503142332 567469109 /nfs/dbraw/zinc/46/91/09/567469109.db2.gz PMDUZMGTNGCACN-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN O=C([C@@H]1NCCc2ccccc21)N1CCOc2cc(Br)ccc2C1 ZINC000662940930 567469923 /nfs/dbraw/zinc/46/99/23/567469923.db2.gz ZVFFNHMAIYUANI-GOSISDBHSA-N 0 1 387.277 3.057 10 0 GGAEMN C[C@@](N)(C(=O)N1CCOc2cc(Br)ccc2C1)c1ccccc1 ZINC000662940860 567470671 /nfs/dbraw/zinc/47/06/71/567470671.db2.gz YTXYKDSFRGRMHK-SFHVURJKSA-N 0 1 375.266 3.044 10 0 GGAEMN O=C(Cc1c(F)ccc(Br)c1F)Nc1nc(-c2ccccn2)n[nH]1 ZINC000503159958 567470967 /nfs/dbraw/zinc/47/09/67/567470967.db2.gz SAZUBLYSZYKKCO-UHFFFAOYSA-N 0 1 394.179 3.089 10 0 GGAEMN CCC(C)(C)OCC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000457521868 567471637 /nfs/dbraw/zinc/47/16/37/567471637.db2.gz LVLQGDUDMQLIOA-UHFFFAOYSA-N 0 1 381.274 3.056 10 0 GGAEMN CCC(C)(C)OCC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000457521868 567471639 /nfs/dbraw/zinc/47/16/39/567471639.db2.gz LVLQGDUDMQLIOA-UHFFFAOYSA-N 0 1 381.274 3.056 10 0 GGAEMN O=C(Nc1cc(Br)cc(Cl)c1O)C1CN(CC(F)(F)F)C1 ZINC000503219161 567473520 /nfs/dbraw/zinc/47/35/20/567473520.db2.gz QPAUAJOSTIFYEC-UHFFFAOYSA-N 0 1 387.583 3.241 10 0 GGAEMN CCN1CCN(c2ccc(CNC(=O)c3scc(C)c3Cl)cn2)CC1 ZINC000478673484 567473944 /nfs/dbraw/zinc/47/39/44/567473944.db2.gz QXCQBHMWVBIZIU-UHFFFAOYSA-N 0 1 378.929 3.177 10 0 GGAEMN COC[C@@](C)([NH2+]Cc1cnc(-c2ccc(Br)cc2)s1)C(=O)[O-] ZINC000551055981 567475168 /nfs/dbraw/zinc/47/51/68/567475168.db2.gz YPIYIWIRRURQGK-OAHLLOKOSA-N 0 1 385.283 3.152 10 0 GGAEMN CCOC(=O)c1ccc(CNC(=O)c2cc(Br)cc3nc[nH]c32)o1 ZINC000619725143 567475568 /nfs/dbraw/zinc/47/55/68/567475568.db2.gz ATQRYKDKKJVHMO-UHFFFAOYSA-N 0 1 392.209 3.025 10 0 GGAEMN C[C@@H](NC(=O)CN1CC[C@@H](C)C1)c1nc(-c2ccc(Br)cc2)no1 ZINC000570343765 567477877 /nfs/dbraw/zinc/47/78/77/567477877.db2.gz QRFHFVHDAKIBQP-VXGBXAGGSA-N 0 1 393.285 3.018 10 0 GGAEMN COc1nc(C)cc(C)c1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503288198 567478987 /nfs/dbraw/zinc/47/89/87/567478987.db2.gz BPRLWLURZWABSK-UHFFFAOYSA-N 0 1 389.253 3.276 10 0 GGAEMN Cc1c(S(=O)(=O)Nc2ccccc2C[S@@](C)=O)c2ccccc2n1C ZINC000551118093 567479609 /nfs/dbraw/zinc/47/96/09/567479609.db2.gz DWUJNBCLCAULRN-XMMPIXPASA-N 0 1 376.503 3.166 10 0 GGAEMN CSc1c(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)cnn1C ZINC000478734272 567480407 /nfs/dbraw/zinc/48/04/07/567480407.db2.gz DSCFALDVXCBZOB-UHFFFAOYSA-N 0 1 378.929 3.190 10 0 GGAEMN Cc1nc2cccc(C(=O)Nc3cc(I)ccc3O)c2[nH]1 ZINC000619808455 567481656 /nfs/dbraw/zinc/48/16/56/567481656.db2.gz JJOCOBHXRVHLFW-UHFFFAOYSA-N 0 1 393.184 3.434 10 0 GGAEMN CCN1CC[C@@H](NC(=O)c2scc(Br)c2Br)C1 ZINC000529493216 567520400 /nfs/dbraw/zinc/52/04/00/567520400.db2.gz RVMUDMYYADCHSI-SSDOTTSWSA-N 0 1 382.121 3.097 10 0 GGAEMN O=C(c1cc(-c2ccoc2)[nH]n1)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000642662636 567485016 /nfs/dbraw/zinc/48/50/16/567485016.db2.gz ZXTNQJFVJPBDBC-UHFFFAOYSA-N 0 1 376.869 3.343 10 0 GGAEMN Cc1c2cc(Br)ccc2oc1C(=O)NCCCCN1CCOCC1 ZINC000642674639 567485762 /nfs/dbraw/zinc/48/57/62/567485762.db2.gz FFDFOEMFZIDFNQ-UHFFFAOYSA-N 0 1 395.297 3.346 10 0 GGAEMN COC(=O)[C@@H](NC(=O)c1cc(Br)cc2nc[nH]c21)c1cccs1 ZINC000503452595 567486095 /nfs/dbraw/zinc/48/60/95/567486095.db2.gz DJCHCQMRSZOFOW-ZDUSSCGKSA-N 0 1 394.250 3.031 10 0 GGAEMN CCCn1c(=O)[nH]nc1S(=O)(=O)Cc1nc(-c2ccccc2Cl)cs1 ZINC000478818478 567486236 /nfs/dbraw/zinc/48/62/36/567486236.db2.gz DHQNEIWWWPGFBN-UHFFFAOYSA-N 0 1 398.897 3.145 10 0 GGAEMN Cn1c(=O)oc2ccc(NC(=O)c3cc(Br)cc4nc[nH]c43)cc21 ZINC000503493619 567488333 /nfs/dbraw/zinc/48/83/33/567488333.db2.gz OFWSHVFRRNQYNG-UHFFFAOYSA-N 0 1 387.193 3.023 10 0 GGAEMN CN(CCC(F)(F)F)[C@@H](CNCc1cn(C)nn1)c1ccc(Cl)cc1 ZINC000551236557 567490892 /nfs/dbraw/zinc/49/08/92/567490892.db2.gz QWNAMHWICKOLRU-HNNXBMFYSA-N 0 1 375.826 3.184 10 0 GGAEMN O=C(NCCSCC(F)(F)F)c1cc(Br)cc2nc[nH]c21 ZINC000503529705 567491508 /nfs/dbraw/zinc/49/15/08/567491508.db2.gz RSSMBERFKWEGFN-UHFFFAOYSA-N 0 1 382.205 3.351 10 0 GGAEMN Cc1nncn1-c1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503539318 567492756 /nfs/dbraw/zinc/49/27/56/567492756.db2.gz SSOZASQMBGTQDL-UHFFFAOYSA-N 0 1 397.236 3.467 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)c(Cl)c2)nc1C ZINC000663299538 567493238 /nfs/dbraw/zinc/49/32/38/567493238.db2.gz AAAJFKHYGXEXNF-UHFFFAOYSA-N 0 1 383.857 3.201 10 0 GGAEMN CCc1ccc([C@@H](COC)N[C@@H](C)Cn2cc(Br)ccc2=O)o1 ZINC000551282875 567493849 /nfs/dbraw/zinc/49/38/49/567493849.db2.gz GJCKCITUZDSRAK-SWLSCSKDSA-N 0 1 383.286 3.132 10 0 GGAEMN CN1C(=O)N([C@@H]2CCc3nc[nH]c3C2)C(=O)[C@H]1c1cccc(Cl)c1Cl ZINC000663318763 567496131 /nfs/dbraw/zinc/49/61/31/567496131.db2.gz MQSSWMBSSIARNX-RFAUZJTJSA-N 0 1 379.247 3.209 10 0 GGAEMN O=C(NCCc1ccc2c(c1)CCO2)c1cc(Br)cc2nc[nH]c21 ZINC000503599625 567496436 /nfs/dbraw/zinc/49/64/36/567496436.db2.gz ONVOWPRZTHYSRF-UHFFFAOYSA-N 0 1 386.249 3.233 10 0 GGAEMN Cc1cccc2nc(CNC(=O)c3cc(Br)cc4nc[nH]c43)cn21 ZINC000503605417 567496537 /nfs/dbraw/zinc/49/65/37/567496537.db2.gz XKUDFKORGJWQDM-UHFFFAOYSA-N 0 1 384.237 3.212 10 0 GGAEMN COCC[N@H+]1CCC[C@@H]1CNC(=O)N1CCc2cc(Cl)cc(Cl)c2C1 ZINC000437467818 567496997 /nfs/dbraw/zinc/49/69/97/567496997.db2.gz NKLPZLKLONFXBS-OAHLLOKOSA-N 0 1 386.323 3.172 10 0 GGAEMN CC(C)C[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC(C)C ZINC000503637776 567497346 /nfs/dbraw/zinc/49/73/46/567497346.db2.gz UKKUKGBALVNZPE-AWEZNQCLSA-N 0 1 396.285 3.422 10 0 GGAEMN O=C(CCNC(=O)c1cc(Br)cc2nc[nH]c21)Nc1ccccc1 ZINC000503638499 567498226 /nfs/dbraw/zinc/49/82/26/567498226.db2.gz ZESHOVLDPXNVPF-UHFFFAOYSA-N 0 1 387.237 3.084 10 0 GGAEMN COC(=O)Cc1cccc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000503670997 567500060 /nfs/dbraw/zinc/50/00/60/567500060.db2.gz NKUMEISHFDRTKO-UHFFFAOYSA-N 0 1 388.221 3.293 10 0 GGAEMN O=C(NCCOc1ccc(Cl)cn1)c1cc(Br)cc2nc[nH]c21 ZINC000503685599 567500238 /nfs/dbraw/zinc/50/02/38/567500238.db2.gz QWVFJSQGXULUGN-UHFFFAOYSA-N 0 1 395.644 3.183 10 0 GGAEMN CCCn1nccc1NS(=O)(=O)c1cc(Cl)ccc1OCCCOC ZINC000479072353 567501211 /nfs/dbraw/zinc/50/12/11/567501211.db2.gz VZBBVUQHIPHUMI-UHFFFAOYSA-N 0 1 387.889 3.163 10 0 GGAEMN CCC(CC)(CNC(=O)c1cc(Br)cc2nc[nH]c21)C(=O)OC ZINC000503760307 567504674 /nfs/dbraw/zinc/50/46/74/567504674.db2.gz UHAKPIPWHDPJDR-UHFFFAOYSA-N 0 1 382.258 3.035 10 0 GGAEMN CCNC(=O)C[C@H]1CCCCN1CC(=O)Nc1ccc(Br)cc1C ZINC000551427057 567506290 /nfs/dbraw/zinc/50/62/90/567506290.db2.gz HQXAPDLDUGUXOU-OAHLLOKOSA-N 0 1 396.329 3.077 10 0 GGAEMN C[C@@H](N[C@H]1CCN(Cc2ccc(F)cc2)C1=O)c1cncc(Br)c1 ZINC000570740303 567509705 /nfs/dbraw/zinc/50/97/05/567509705.db2.gz KGWMXEAYSPQZKE-PXAZEXFGSA-N 0 1 392.272 3.435 10 0 GGAEMN COCc1nc(CN[C@H]2CCCSc3ccc(Br)cc32)n[nH]1 ZINC000663450750 567510484 /nfs/dbraw/zinc/51/04/84/567510484.db2.gz BKSQCUXILHBMKD-LBPRGKRZSA-N 0 1 383.315 3.430 10 0 GGAEMN COCc1nnc(C[NH2+][C@H]2CCCSc3ccc(Br)cc32)[n-]1 ZINC000663450750 567510488 /nfs/dbraw/zinc/51/04/88/567510488.db2.gz BKSQCUXILHBMKD-LBPRGKRZSA-N 0 1 383.315 3.430 10 0 GGAEMN Brc1cnc(C2CC2)nc1N1CCC(CCN2CCOCC2)CC1 ZINC000663480412 567510783 /nfs/dbraw/zinc/51/07/83/567510783.db2.gz PEXYOGVPSFCMKC-UHFFFAOYSA-N 0 1 395.345 3.055 10 0 GGAEMN CC1(C2(NC(=O)NCc3n[nH]c(-c4ccc(Br)cc4)n3)CC2)CC1 ZINC000570777958 567512798 /nfs/dbraw/zinc/51/27/98/567512798.db2.gz HIWZNHDIUARLCZ-UHFFFAOYSA-N 0 1 390.285 3.366 10 0 GGAEMN CC1(C2(NC(=O)NCc3nc(-c4ccc(Br)cc4)n[nH]3)CC2)CC1 ZINC000570777958 567512803 /nfs/dbraw/zinc/51/28/03/567512803.db2.gz HIWZNHDIUARLCZ-UHFFFAOYSA-N 0 1 390.285 3.366 10 0 GGAEMN C[C@@H]1COCCN1C1CCN(C(=O)c2sc3ncccc3c2Cl)CC1 ZINC000529411475 567514213 /nfs/dbraw/zinc/51/42/13/567514213.db2.gz SNPHQZIYCCXMSN-GFCCVEGCSA-N 0 1 379.913 3.275 10 0 GGAEMN O=C(NCc1ccnc(OC(F)F)c1)c1n[nH]c2ccc(Br)cc21 ZINC000551528231 567514279 /nfs/dbraw/zinc/51/42/79/567514279.db2.gz GZEVITJCDOVYQH-UHFFFAOYSA-N 0 1 397.179 3.252 10 0 GGAEMN CC[C@@H](Cc1ccc(Br)cc1)NC(=O)[C@H]1CCc2[nH]cnc2C1 ZINC000620338139 567514713 /nfs/dbraw/zinc/51/47/13/567514713.db2.gz KZAKAKHJNOFEMM-ZFWWWQNUSA-N 0 1 376.298 3.415 10 0 GGAEMN CN(C)[C@H](CNC(=O)c1cc(Br)cc2[nH]cnc21)c1ccsc1 ZINC000503957292 567515471 /nfs/dbraw/zinc/51/54/71/567515471.db2.gz HGZWEEFRHHBHOH-CQSZACIVSA-N 0 1 393.310 3.420 10 0 GGAEMN CC(C)CN1CCO[C@@H](CNC(=O)CSCc2cc(F)ccc2Cl)C1 ZINC000437938587 567515443 /nfs/dbraw/zinc/51/54/43/567515443.db2.gz DBYGNDRGCBGHMN-INIZCTEOSA-N 0 1 388.936 3.185 10 0 GGAEMN O=C(Nc1ccc(-n2cccn2)nc1)c1cc(Br)cc2nc[nH]c21 ZINC000503964605 567515895 /nfs/dbraw/zinc/51/58/95/567515895.db2.gz RXSSAIRJYGVHCL-UHFFFAOYSA-N 0 1 383.209 3.158 10 0 GGAEMN O=C(Nc1ccc(Cn2cncn2)cc1)c1cc(Br)cc2nc[nH]c21 ZINC000503978817 567516508 /nfs/dbraw/zinc/51/65/08/567516508.db2.gz YPYUKWLHCHVZBS-UHFFFAOYSA-N 0 1 397.236 3.218 10 0 GGAEMN O=C(Cc1c(F)ccc(Br)c1F)N1CCN(C2CCCC2)CC1 ZINC000503965890 567517048 /nfs/dbraw/zinc/51/70/48/567517048.db2.gz XWRYKMIFFJKJAZ-UHFFFAOYSA-N 0 1 387.268 3.357 10 0 GGAEMN CC(C)(C(=O)NCc1n[nH]c(C2CC2)n1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000529444472 567517054 /nfs/dbraw/zinc/51/70/54/567517054.db2.gz WGLVRTHRRHAIFK-CQSZACIVSA-N 0 1 383.279 3.365 10 0 GGAEMN C[C@H](N[C@@H](CO)C[C@H](O)C(C)(C)C)c1ccccc1I ZINC000551573023 567518563 /nfs/dbraw/zinc/51/85/63/567518563.db2.gz YUGJUNUGCHGTQD-ZOWXZIJZSA-N 0 1 391.293 3.100 10 0 GGAEMN Clc1cc(CNCc2cnn3c2CCC3)ccc1I ZINC000594938198 567526486 /nfs/dbraw/zinc/52/64/86/567526486.db2.gz UOFDPAALBFTOBJ-UHFFFAOYSA-N 0 1 387.652 3.377 10 0 GGAEMN COC(=O)[C@@H]1C[C@@H]1[C@H](C)N[C@H](C)c1cc2c(cc1Br)OCCO2 ZINC000594923239 567526691 /nfs/dbraw/zinc/52/66/91/567526691.db2.gz GYYRJHRVLSSBPW-SBFPOUOMSA-N 0 1 384.270 3.069 10 0 GGAEMN C[S@](=O)[C@@H]1CCC[C@H](NCc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000594959644 567528593 /nfs/dbraw/zinc/52/85/93/567528593.db2.gz GFXZQLGFISMSTF-YZYGWBJASA-N 0 1 387.336 3.353 10 0 GGAEMN O=C(N[C@H]1CCOc2c(Br)cccc21)c1ccc(-c2nnc[nH]2)cc1 ZINC000504302165 567528842 /nfs/dbraw/zinc/52/88/42/567528842.db2.gz IWJNEMQBEWNVPB-HNNXBMFYSA-N 0 1 399.248 3.488 10 0 GGAEMN CC[C@@H](NCc1cc(Cl)ccc1I)[C@H](O)C(F)F ZINC000594957023 567528871 /nfs/dbraw/zinc/52/88/71/567528871.db2.gz MPBQONUFRHARFF-MNOVXSKESA-N 0 1 389.611 3.439 10 0 GGAEMN COCCN(Cc1c[nH]nc1-c1ccc(Br)s1)[C@H]1CCOC1 ZINC000529553115 567529425 /nfs/dbraw/zinc/52/94/25/567529425.db2.gz DJDXLPGTFAOTPF-LBPRGKRZSA-N 0 1 386.315 3.138 10 0 GGAEMN O=C(N[C@@H]1CCOc2c(Br)cccc21)c1n[nH]nc1-c1ccccc1 ZINC000504338435 567531319 /nfs/dbraw/zinc/53/13/19/567531319.db2.gz KGBOXSLLCCMSDV-CQSZACIVSA-N 0 1 399.248 3.488 10 0 GGAEMN CN(C)CCN(Cc1ccsc1)C(=O)C(=O)c1ccc(Br)cc1 ZINC000458203017 567532140 /nfs/dbraw/zinc/53/21/40/567532140.db2.gz OIKKPUUSPGNVFZ-UHFFFAOYSA-N 0 1 395.322 3.284 10 0 GGAEMN CCNC(=O)c1ccc(=N[C@H]2c3cccc(Br)c3CC2(C)C)[nH]n1 ZINC000644143551 567536120 /nfs/dbraw/zinc/53/61/20/567536120.db2.gz XXJMEDUWUJWTPK-INIZCTEOSA-N 0 1 389.297 3.146 10 0 GGAEMN COC(=O)c1ccc(CN2CCC(c3c[nH]cn3)CC2)c(Br)c1 ZINC000551806781 567537573 /nfs/dbraw/zinc/53/75/73/567537573.db2.gz UDGWKBMABWXICZ-UHFFFAOYSA-N 0 1 378.270 3.338 10 0 GGAEMN CC1CCN(CC(=O)N(C)[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000438627630 567538718 /nfs/dbraw/zinc/53/87/18/567538718.db2.gz MUTUVPUBIPWSRX-MRXNPFEDSA-N 0 1 381.314 3.463 10 0 GGAEMN COc1cc(CN2CC[C@H]3CC[C@@H](C2)[S@]3=O)ccc1OCC(F)(F)F ZINC000529673442 567539261 /nfs/dbraw/zinc/53/92/61/567539261.db2.gz IWYMRKXEDDXJMI-JXQWACKNSA-N 0 1 377.428 3.122 10 0 GGAEMN O=C(Cc1ccc(Br)s1)NC[C@@H]1CCN1Cc1ccccc1 ZINC000620773588 567540203 /nfs/dbraw/zinc/54/02/03/567540203.db2.gz VQYSRUVFMKUPCZ-AWEZNQCLSA-N 0 1 379.323 3.444 10 0 GGAEMN COCCOc1cc(C)ccc1NS(=O)(=O)c1ccc2ncsc2c1 ZINC000479501769 567540459 /nfs/dbraw/zinc/54/04/59/567540459.db2.gz XPPFWTCKBULMKT-UHFFFAOYSA-N 0 1 378.475 3.431 10 0 GGAEMN COc1ccc(NC(C)=O)cc1NS(=O)(=O)c1ccc2ncsc2c1 ZINC000479510938 567541141 /nfs/dbraw/zinc/54/11/41/567541141.db2.gz NROOTEGEXIJDFK-UHFFFAOYSA-N 0 1 377.447 3.064 10 0 GGAEMN C[C@H](CN(C)C(=O)c1[nH]nc2ccc(Br)cc21)C(=O)OC(C)(C)C ZINC000458367183 567541310 /nfs/dbraw/zinc/54/13/10/567541310.db2.gz UWOSMZXYGYEHEX-SNVBAGLBSA-N 0 1 396.285 3.375 10 0 GGAEMN O=C(Cc1cscc1Br)NC[C@H]1CCN1Cc1ccccc1 ZINC000620778156 567542020 /nfs/dbraw/zinc/54/20/20/567542020.db2.gz GIEAJDXTJUGPIJ-OAHLLOKOSA-N 0 1 379.323 3.444 10 0 GGAEMN C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000551921896 567543549 /nfs/dbraw/zinc/54/35/49/567543549.db2.gz HOTUVJDTFDCQMQ-MWLCHTKSSA-N 0 1 398.688 3.267 10 0 GGAEMN OC[C@H](CN=c1nc(C(F)(F)F)[n-]s1)Cc1ccc(C(F)(F)F)cc1 ZINC000571189705 567543788 /nfs/dbraw/zinc/54/37/88/567543788.db2.gz UUXFJGYTSCIASE-VIFPVBQESA-N 0 1 385.333 3.261 10 0 GGAEMN COc1cc(C)c(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cc1F ZINC000479553804 567544715 /nfs/dbraw/zinc/54/47/15/567544715.db2.gz KQDGQFNDYMSSLP-UHFFFAOYSA-N 0 1 387.816 3.368 10 0 GGAEMN C[C@@H](NC(=O)[C@@H]1CCc2[nH]cnc2C1)c1cc(F)c(Br)cc1F ZINC000529750535 567545112 /nfs/dbraw/zinc/54/51/12/567545112.db2.gz MJSDRKFHOSYMIJ-RKDXNWHRSA-N 0 1 384.224 3.433 10 0 GGAEMN CCOC(=O)c1nc(C)[nH]c1NC(=O)c1c(F)ccc(Br)c1F ZINC000571230708 567546303 /nfs/dbraw/zinc/54/63/03/567546303.db2.gz VWGVHHQNOZTHRS-UHFFFAOYSA-N 0 1 388.168 3.188 10 0 GGAEMN COc1ccc(CN2CCN(Cc3ccccc3)CC2)c(Br)c1O ZINC000571256925 567548818 /nfs/dbraw/zinc/54/88/18/567548818.db2.gz FYRZRHCVJANSSW-UHFFFAOYSA-N 0 1 391.309 3.481 10 0 GGAEMN O=C(NC/C=C/c1ccc(Br)cc1)N[C@@H]1CCc2nc[nH]c2C1 ZINC000571278307 567550318 /nfs/dbraw/zinc/55/03/18/567550318.db2.gz IJGQFOOAHLZZRM-VSZDKKFSSA-N 0 1 375.270 3.042 10 0 GGAEMN FC(F)(F)COc1cccc(COCCc2c[nH]nn2)c1Br ZINC000664046746 567550350 /nfs/dbraw/zinc/55/03/50/567550350.db2.gz OIUNFSGKOGKPMC-UHFFFAOYSA-N 0 1 380.164 3.268 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N(C)Cc2ccc(F)cc2Br)n[nH]1 ZINC000479682573 567552690 /nfs/dbraw/zinc/55/26/90/567552690.db2.gz FWXGONMCGLYVPR-JTQLQIEISA-N 0 1 383.265 3.392 10 0 GGAEMN COC[C@H](CN1CCC[C@H]1c1ccccc1I)OC ZINC000595326240 567554208 /nfs/dbraw/zinc/55/42/08/567554208.db2.gz YQJMDIVZDQWOTA-WFASDCNBSA-N 0 1 375.250 3.090 10 0 GGAEMN COC[C@H](CN1CCC[C@@H]1c1ccccc1I)OC ZINC000595326238 567555002 /nfs/dbraw/zinc/55/50/02/567555002.db2.gz YQJMDIVZDQWOTA-SWLSCSKDSA-N 0 1 375.250 3.090 10 0 GGAEMN Cc1cccc(Br)c1C(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000529908237 567554982 /nfs/dbraw/zinc/55/49/82/567554982.db2.gz GBMLGCWHNBSMLY-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](C)[C@H](C)c1ccccc1C(F)(F)F ZINC000571330910 567555076 /nfs/dbraw/zinc/55/50/76/567555076.db2.gz OZLNDOLWBJSHGT-KBPBESRZSA-N 0 1 380.476 3.459 10 0 GGAEMN CC(C)n1cc(Br)cc1C(=O)N1CCC(C)(N2CCOCC2)CC1 ZINC000529915013 567555212 /nfs/dbraw/zinc/55/52/12/567555212.db2.gz VCVPDKHSWDTYKX-UHFFFAOYSA-N 0 1 398.345 3.158 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@H](C)[C@H](C)c1ccccc1C(F)(F)F ZINC000571330913 567555375 /nfs/dbraw/zinc/55/53/75/567555375.db2.gz OZLNDOLWBJSHGT-UONOGXRCSA-N 0 1 380.476 3.459 10 0 GGAEMN Cc1ccc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c(Br)c1 ZINC000529911722 567555437 /nfs/dbraw/zinc/55/54/37/567555437.db2.gz ZBOPFXUUPJHJMV-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN Cc1cccc(C(=O)N2CCC(C)(N3CCOCC3)CC2)c1Br ZINC000529911599 567555493 /nfs/dbraw/zinc/55/54/93/567555493.db2.gz VDWLECCNPRRZRJ-UHFFFAOYSA-N 0 1 381.314 3.084 10 0 GGAEMN CC1(N2CCOCC2)CCN(C(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000529910834 567555519 /nfs/dbraw/zinc/55/55/19/567555519.db2.gz VTPHZFNDFDEHMT-UHFFFAOYSA-N 0 1 375.271 3.459 10 0 GGAEMN O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCN([C@@H]2CCC[C@H]2O)CC1 ZINC000644521620 567555589 /nfs/dbraw/zinc/55/55/89/567555589.db2.gz BHGZRBRLVAAWEQ-RBSFLKMASA-N 0 1 383.945 3.020 10 0 GGAEMN CC1=CCN(CCNC(=O)N2CCc3cc(Br)ccc3C2)CC1 ZINC000479741554 567556452 /nfs/dbraw/zinc/55/64/52/567556452.db2.gz JEJWBSUIFILQCR-UHFFFAOYSA-N 0 1 378.314 3.169 10 0 GGAEMN O=C(N[C@H](c1ccncc1)C1(CO)CCC1)c1cccc(Br)c1O ZINC000621032872 567556540 /nfs/dbraw/zinc/55/65/40/567556540.db2.gz AJYAEYBBFAJECS-MRXNPFEDSA-N 0 1 391.265 3.183 10 0 GGAEMN CN(C[C@H]1CC1(C)C)C(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1 ZINC000664200753 567557529 /nfs/dbraw/zinc/55/75/29/567557529.db2.gz CHUFHFOXDGBXEB-GFCCVEGCSA-N 0 1 392.301 3.422 10 0 GGAEMN CN(C[C@H]1CC1(C)C)C(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1 ZINC000664200753 567557535 /nfs/dbraw/zinc/55/75/35/567557535.db2.gz CHUFHFOXDGBXEB-GFCCVEGCSA-N 0 1 392.301 3.422 10 0 GGAEMN CC(C)OC(=O)CC[C@@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000505104635 567558632 /nfs/dbraw/zinc/55/86/32/567558632.db2.gz NAFIGXQYVXBRAV-SNVBAGLBSA-N 0 1 382.258 3.176 10 0 GGAEMN CC(C)OC(=O)CC[C@H](C)NC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000505104634 567558645 /nfs/dbraw/zinc/55/86/45/567558645.db2.gz NAFIGXQYVXBRAV-JTQLQIEISA-N 0 1 382.258 3.176 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@H]1CCCC12OCCO2)c1ccc(Cl)c(Cl)c1 ZINC000530032931 567563259 /nfs/dbraw/zinc/56/32/59/567563259.db2.gz LRDBIWREKZDSOD-CZUORRHYSA-N 0 1 387.307 3.256 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032720 567563849 /nfs/dbraw/zinc/56/38/49/567563849.db2.gz WNFAMXUERDXUAD-PXAZEXFGSA-N 0 1 381.307 3.241 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@@H]1CCCC12OCCO2)c1ccc(Cl)c(Cl)c1 ZINC000530032932 567563905 /nfs/dbraw/zinc/56/39/05/567563905.db2.gz LRDBIWREKZDSOD-XJKSGUPXSA-N 0 1 387.307 3.256 10 0 GGAEMN CN(C)C[C@H](NC(=O)c1ccnn1CC(F)F)c1ccc(Cl)c(Cl)c1 ZINC000530033681 567564012 /nfs/dbraw/zinc/56/40/12/567564012.db2.gz QFKNWXLYCPECAE-ZDUSSCGKSA-N 0 1 391.249 3.488 10 0 GGAEMN CN(C)C[C@H](NC(=O)[C@@H]1CCC[C@H](C(N)=O)C1)c1ccc(Cl)c(Cl)c1 ZINC000530032775 567564190 /nfs/dbraw/zinc/56/41/90/567564190.db2.gz JVZSGKMXQLURFB-ZENOOKHLSA-N 0 1 386.323 3.004 10 0 GGAEMN CN(C)C[C@@H](NC(=O)[C@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(Cl)c1 ZINC000530032723 567564197 /nfs/dbraw/zinc/56/41/97/567564197.db2.gz WNFAMXUERDXUAD-YVEFUNNKSA-N 0 1 381.307 3.241 10 0 GGAEMN O=C(NC[C@H](CO)CC1CCCC1)c1cc(Br)cc2nc[nH]c21 ZINC000505185586 567564622 /nfs/dbraw/zinc/56/46/22/567564622.db2.gz RBMHDPXWKFMSNW-GFCCVEGCSA-N 0 1 380.286 3.244 10 0 GGAEMN Cn1cc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c(C(F)(F)F)n1 ZINC000644604498 567565026 /nfs/dbraw/zinc/56/50/26/567565026.db2.gz FXVHETNNWMHYOK-JTQLQIEISA-N 0 1 398.212 3.275 10 0 GGAEMN O=S1(=O)CC[C@H](N(CCCCc2cccc(Cl)c2)C[C@H]2CCCO2)C1 ZINC000621271103 567570532 /nfs/dbraw/zinc/57/05/32/567570532.db2.gz XCCGOEXYJKGORX-RBUKOAKNSA-N 0 1 385.957 3.331 10 0 GGAEMN C[C@@H]1C[C@H](S(=O)(=O)NCC(F)(F)c2ccc(Br)cc2)CCO1 ZINC000621304927 567576643 /nfs/dbraw/zinc/57/66/43/567576643.db2.gz LILKDWGRKWNHSF-ZWNOBZJWSA-N 0 1 398.269 3.028 10 0 GGAEMN O=S(=O)(NCC[C@@H]1CC1(F)F)c1cc(F)c(Br)cc1F ZINC000621303351 567576796 /nfs/dbraw/zinc/57/67/96/567576796.db2.gz DBRCGZNQSMWOBL-ZCFIWIBFSA-N 0 1 376.169 3.051 10 0 GGAEMN O=S(=O)(NCC[C@H]1CC1(F)F)c1cc(Br)c(F)cc1F ZINC000621303368 567576948 /nfs/dbraw/zinc/57/69/48/567576948.db2.gz DOJHJVQFMNJIGA-LURJTMIESA-N 0 1 376.169 3.051 10 0 GGAEMN CN(C)c1ncc(CN(C)Cc2cc(Br)cc3cccnc32)cn1 ZINC000505465825 567577078 /nfs/dbraw/zinc/57/70/78/567577078.db2.gz YKUCEPIRWDRSDY-UHFFFAOYSA-N 0 1 386.297 3.485 10 0 GGAEMN COC(=O)[C@@H]1OCC[C@@H]1NCc1ccc(-c2ccc(Br)cc2)o1 ZINC000595664505 567577329 /nfs/dbraw/zinc/57/73/29/567577329.db2.gz BPVZCSXGMBBTIW-GOEBONIOSA-N 0 1 380.238 3.129 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166709 567577594 /nfs/dbraw/zinc/57/75/94/567577594.db2.gz SJVPNVUKNDZNDK-NEPJUHHUSA-N 0 1 376.678 3.475 10 0 GGAEMN CO[C@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166709 567577601 /nfs/dbraw/zinc/57/76/01/567577601.db2.gz SJVPNVUKNDZNDK-NEPJUHHUSA-N 0 1 376.678 3.475 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166712 567577945 /nfs/dbraw/zinc/57/79/45/567577945.db2.gz SJVPNVUKNDZNDK-VXGBXAGGSA-N 0 1 376.678 3.475 10 0 GGAEMN CO[C@@H]1C[C@H](CC(=O)[O-])[N@@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166712 567577951 /nfs/dbraw/zinc/57/79/51/567577951.db2.gz SJVPNVUKNDZNDK-VXGBXAGGSA-N 0 1 376.678 3.475 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166710 567578014 /nfs/dbraw/zinc/57/80/14/567578014.db2.gz SJVPNVUKNDZNDK-NWDGAFQWSA-N 0 1 376.678 3.475 10 0 GGAEMN CO[C@@H]1C[C@@H](CC(=O)[O-])[N@@H+](Cc2cc(Cl)c(C)cc2Br)C1 ZINC000530166710 567578023 /nfs/dbraw/zinc/57/80/23/567578023.db2.gz SJVPNVUKNDZNDK-NWDGAFQWSA-N 0 1 376.678 3.475 10 0 GGAEMN CCCOc1cncc(NS(=O)(=O)c2ccc(OC(F)F)c(F)c2)c1 ZINC000530156657 567578105 /nfs/dbraw/zinc/57/81/05/567578105.db2.gz DHVXDQMTKCSMQB-UHFFFAOYSA-N 0 1 376.356 3.412 10 0 GGAEMN O=C(CN1CC[C@@H](Sc2cccc(Cl)c2)C1)N1CCOC[C@H]1C1CC1 ZINC000644786076 567578703 /nfs/dbraw/zinc/57/87/03/567578703.db2.gz FPCLRWCDUBZHHI-MSOLQXFVSA-N 0 1 380.941 3.144 10 0 GGAEMN C[C@H](NCC(=O)Nc1nc2c(s1)CCCC2)[C@@H]1OCCc2sccc21 ZINC000644785619 567579114 /nfs/dbraw/zinc/57/91/14/567579114.db2.gz FTXLONOYAUBGAR-GTNSWQLSSA-N 0 1 377.535 3.314 10 0 GGAEMN O=C(CN1CC[C@H](Sc2cccc(Cl)c2)C1)N1CCOC[C@H]1C1CC1 ZINC000644786078 567579263 /nfs/dbraw/zinc/57/92/63/567579263.db2.gz FPCLRWCDUBZHHI-ROUUACIJSA-N 0 1 380.941 3.144 10 0 GGAEMN FC(F)(F)[C@@H](CN[C@@H]1CCCOc2ccc(Cl)cc21)N1CCOCC1 ZINC000552338563 567579230 /nfs/dbraw/zinc/57/92/30/567579230.db2.gz HYHSCAWOXKVHAF-GDBMZVCRSA-N 0 1 378.822 3.406 10 0 GGAEMN O=C([O-])[C@@H]1c2ccoc2CC[N@@H+]1C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000530169713 567579629 /nfs/dbraw/zinc/57/96/29/567579629.db2.gz RRHAJYZLWPBFBX-BMIGLBTASA-N 0 1 386.231 3.010 10 0 GGAEMN C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)[N@@H+]1Cc1nc2ccc(Br)cc2n1C ZINC000530172832 567580037 /nfs/dbraw/zinc/58/00/37/567580037.db2.gz AZTWAAJFEMMZAG-ZSBIGDGJSA-N 0 1 380.286 3.409 10 0 GGAEMN NC(=O)c1c(F)cc(Br)cc1NC[C@H]1CCN1Cc1ccccc1 ZINC000664631423 567580526 /nfs/dbraw/zinc/58/05/26/567580526.db2.gz KTHCMEZGJFLXOG-CQSZACIVSA-N 0 1 392.272 3.374 10 0 GGAEMN CO[C@H](C(=O)Nc1nc(-c2ccccc2Br)n[nH]1)C1CCCC1 ZINC000621413340 567582801 /nfs/dbraw/zinc/58/28/01/567582801.db2.gz GQYAQMZCWMLTHN-ZDUSSCGKSA-N 0 1 379.258 3.378 10 0 GGAEMN O=S1(=O)CC[C@@H](NCCc2ccccc2O)c2cc(Br)ccc21 ZINC000480156465 567583235 /nfs/dbraw/zinc/58/32/35/567583235.db2.gz BDNTVTHJPVWLBG-OAHLLOKOSA-N 0 1 396.306 3.206 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000664708652 567584366 /nfs/dbraw/zinc/58/43/66/567584366.db2.gz NIJOWEOVCTVFMK-INIZCTEOSA-N 0 1 384.293 3.242 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CC[C@@H](O)CC12CCC2 ZINC000571788492 567589615 /nfs/dbraw/zinc/58/96/15/567589615.db2.gz XXHPVKAFMGIAKX-CYBMUJFWSA-N 0 1 390.281 3.359 10 0 GGAEMN O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000571811446 567590997 /nfs/dbraw/zinc/59/09/97/567590997.db2.gz XUFRQPTXRYVRRB-APYUEPQZSA-N 0 1 388.291 3.451 10 0 GGAEMN COC(=O)c1sc2c(c1Br)CN(Cc1n[nH]c(C(C)(C)C)n1)C2 ZINC000595905173 567591046 /nfs/dbraw/zinc/59/10/46/567591046.db2.gz MJLNAOXNYGQSLO-UHFFFAOYSA-N 0 1 399.314 3.229 10 0 GGAEMN CNC(=O)CCOC1CCN(Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000552487883 567592407 /nfs/dbraw/zinc/59/24/07/567592407.db2.gz PYZCIDIUOWXUIJ-UHFFFAOYSA-N 0 1 376.831 3.059 10 0 GGAEMN CN1CCC[C@H](NC(=O)N2CC[C@H](Cc3ccc(Br)cc3)C2)C1 ZINC000644943370 567592399 /nfs/dbraw/zinc/59/23/99/567592399.db2.gz JWNXCPWEZOPHIU-WBVHZDCISA-N 0 1 380.330 3.117 10 0 GGAEMN Clc1ccc(-n2cc(CNCCc3cn4c(n3)SCC4)nn2)c(Cl)c1 ZINC000530330562 567593908 /nfs/dbraw/zinc/59/39/08/567593908.db2.gz FSJJUHQTYNCPCD-UHFFFAOYSA-N 0 1 395.319 3.209 10 0 GGAEMN CCC(CC)(CNC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)OC ZINC000505760338 567596009 /nfs/dbraw/zinc/59/60/09/567596009.db2.gz PWIQPTDZCVHTEA-UHFFFAOYSA-N 0 1 382.258 3.035 10 0 GGAEMN COC(=O)c1cc(S(=O)(=O)Nc2ccc(O[C@H]3CC3(F)F)cc2)cs1 ZINC000596022871 567599027 /nfs/dbraw/zinc/59/90/27/567599027.db2.gz UNKHAZLQRBTXGP-ZDUSSCGKSA-N 0 1 389.401 3.122 10 0 GGAEMN COCc1nc(CNC(=O)N[C@H](c2c(Cl)cccc2Cl)C2CC2)n[nH]1 ZINC000664918828 567599237 /nfs/dbraw/zinc/59/92/37/567599237.db2.gz CAFSGGXCKNJDJY-HNNXBMFYSA-N 0 1 384.267 3.208 10 0 GGAEMN COCc1nnc(CNC(=O)N[C@H](c2c(Cl)cccc2Cl)C2CC2)[nH]1 ZINC000664918828 567599244 /nfs/dbraw/zinc/59/92/44/567599244.db2.gz CAFSGGXCKNJDJY-HNNXBMFYSA-N 0 1 384.267 3.208 10 0 GGAEMN C[C@H](NC(=O)C(C)(C)c1cnc[nH]1)c1cc2c(cc1Br)OCCO2 ZINC000621677826 567604112 /nfs/dbraw/zinc/60/41/12/567604112.db2.gz GSWVRDHEVORXEN-JTQLQIEISA-N 0 1 394.269 3.098 10 0 GGAEMN COc1ccc(F)cc1CNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000505974652 567604920 /nfs/dbraw/zinc/60/49/20/567604920.db2.gz ZXTFKLKTWHFBTD-UHFFFAOYSA-N 0 1 378.201 3.403 10 0 GGAEMN CC(C)(C(=O)NC[C@H]1CCN(c2cccc(Br)c2)C1)c1cnc[nH]1 ZINC000621720915 567607339 /nfs/dbraw/zinc/60/73/39/567607339.db2.gz UWXMSWRPPULOMJ-CYBMUJFWSA-N 0 1 391.313 3.093 10 0 GGAEMN Nc1nc2c(c(N3CCO[C@H](c4cccc(Br)c4)C3)n1)CCCC2 ZINC000645149129 567607876 /nfs/dbraw/zinc/60/78/76/567607876.db2.gz LHMAHCWQGQXXLZ-INIZCTEOSA-N 0 1 389.297 3.108 10 0 GGAEMN Nc1nc2c(c(N3CCO[C@H](c4ccc(Br)cc4)C3)n1)CCCC2 ZINC000645135648 567608849 /nfs/dbraw/zinc/60/88/49/567608849.db2.gz KQIHMTQYSLFBCB-INIZCTEOSA-N 0 1 389.297 3.108 10 0 GGAEMN CN1CCN(C(C)(C)CN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750616 567608996 /nfs/dbraw/zinc/60/89/96/567608996.db2.gz SZURXKZPNSKBLK-HNNXBMFYSA-N 0 1 390.316 3.371 10 0 GGAEMN CCO[C@@H](C)c1noc(CN(C)Cc2nc3ccc(Br)cc3[nH]2)n1 ZINC000480529801 567610049 /nfs/dbraw/zinc/61/00/49/567610049.db2.gz RFLPYVBBQJRLEP-JTQLQIEISA-N 0 1 394.273 3.438 10 0 GGAEMN OCCN1CCCC[C@H]1CN[C@H](c1ccc(Br)cc1)C(F)F ZINC000621763252 567610268 /nfs/dbraw/zinc/61/02/68/567610268.db2.gz UPXBMJRKXSPKDB-LSDHHAIUSA-N 0 1 377.273 3.192 10 0 GGAEMN O[C@]1(C(F)(F)F)CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000480538417 567611525 /nfs/dbraw/zinc/61/15/25/567611525.db2.gz SBFZYEAHYKCYMC-CYBMUJFWSA-N 0 1 378.192 3.215 10 0 GGAEMN O=C(Nc1cccc(-c2c[nH]nn2)c1)c1cc(Br)cc2nc[nH]c21 ZINC000572085188 567613213 /nfs/dbraw/zinc/61/32/13/567613213.db2.gz TVEAGIKUCIPACO-UHFFFAOYSA-N 0 1 383.209 3.363 10 0 GGAEMN CCN1CCN(c2ccc(CNc3nccc(C)c3Br)cn2)CC1 ZINC000552957887 567619459 /nfs/dbraw/zinc/61/94/59/567619459.db2.gz RDNNZXHBALFGPD-UHFFFAOYSA-N 0 1 390.329 3.302 10 0 GGAEMN COc1cc2nccc(NCC(C)(C)[C@]3(O)CCOC3)c2cc1Br ZINC000645365380 567621169 /nfs/dbraw/zinc/62/11/69/567621169.db2.gz DVBDHLZWXFZPFP-SFHVURJKSA-N 0 1 395.297 3.017 10 0 GGAEMN CCOc1cc(CN[C@H](C)C(=O)N2CCCC[C@H]2C)cc(Br)c1O ZINC000459417213 567622004 /nfs/dbraw/zinc/62/20/04/567622004.db2.gz VWULJRVDGWXHQA-CHWSQXEVSA-N 0 1 399.329 3.433 10 0 GGAEMN O=C(Nc1nc(-c2cccs2)ns1)C(C[C@H]1COCCO1)C(F)(F)F ZINC000621947269 567624734 /nfs/dbraw/zinc/62/47/34/567624734.db2.gz QIMMARYELJLPJD-IUCAKERBSA-N 0 1 393.412 3.189 10 0 GGAEMN CN(C(=O)c1cccc(Br)c1O)C1CCN(CC(F)(F)F)CC1 ZINC000572243908 567625248 /nfs/dbraw/zinc/62/52/48/567625248.db2.gz BHDGMHVHWKLJJR-UHFFFAOYSA-N 0 1 395.219 3.253 10 0 GGAEMN CCOCCOc1ccc(Br)cc1CN1CCN(C2CC2)CC1 ZINC000506461715 567627023 /nfs/dbraw/zinc/62/70/23/567627023.db2.gz WZSYIYQVRPEHSR-UHFFFAOYSA-N 0 1 383.330 3.144 10 0 GGAEMN CO[C@H](c1ccc(Br)cc1)[C@@H](C)NCc1cn2cccnc2n1 ZINC000459465493 567627621 /nfs/dbraw/zinc/62/76/21/567627621.db2.gz NLRKHZHFRLLRRM-WBMJQRKESA-N 0 1 375.270 3.358 10 0 GGAEMN CCOc1cc(CN[C@H](CC)[C@H](O)C(F)(F)F)cc(Br)c1O ZINC000459466611 567628181 /nfs/dbraw/zinc/62/81/81/567628181.db2.gz YYLIMSZWYFKWEQ-MFKMUULPSA-N 0 1 386.208 3.345 10 0 GGAEMN COc1cccc(CN(CCN(C)C)S(=O)(=O)c2cc(C)sc2C)c1 ZINC000480762027 567628580 /nfs/dbraw/zinc/62/85/80/567628580.db2.gz UEWFIGJXBYSRAF-UHFFFAOYSA-N 0 1 382.551 3.126 10 0 GGAEMN COc1ccc([C@@H](C)NC(=O)[C@@H]2CCc3[nH]cnc3C2)cc1Br ZINC000665532695 567628766 /nfs/dbraw/zinc/62/87/66/567628766.db2.gz QTSICWGSKGJWTA-ZYHUDNBSSA-N 0 1 378.270 3.163 10 0 GGAEMN COc1ccc([C@H](C)NC(=O)[C@@H]2CCc3[nH]cnc3C2)cc1Br ZINC000665532692 567628962 /nfs/dbraw/zinc/62/89/62/567628962.db2.gz QTSICWGSKGJWTA-CMPLNLGQSA-N 0 1 378.270 3.163 10 0 GGAEMN CC(C)CN1CCO[C@H](CNC(=O)CSC[C@H]2CCCCC2(F)F)C1 ZINC000596397846 567629304 /nfs/dbraw/zinc/62/93/04/567629304.db2.gz YDMOQNAIFVKDHU-HZPDHXFCSA-N 0 1 378.529 3.018 10 0 GGAEMN CN(C)Cc1ccc(C(=O)Nc2cccc(I)c2)cn1 ZINC000572306760 567629666 /nfs/dbraw/zinc/62/96/66/567629666.db2.gz NGEDEJSZVNSNEQ-UHFFFAOYSA-N 0 1 381.217 3.000 10 0 GGAEMN CCOc1cc(CNCc2cccn(CC)c2=O)cc(Br)c1O ZINC000459505337 567631339 /nfs/dbraw/zinc/63/13/39/567631339.db2.gz NSGHXWDPZKYEOS-UHFFFAOYSA-N 0 1 381.270 3.025 10 0 GGAEMN CCOc1cc(CN2CC[C@H](c3nccn3C)C2)cc(Br)c1O ZINC000459552016 567636203 /nfs/dbraw/zinc/63/62/03/567636203.db2.gz QEVMGOPWWXXBMG-ZDUSSCGKSA-N 0 1 380.286 3.276 10 0 GGAEMN CC(C)(C)c1nc(CNC(=O)Nc2cc(F)cc(Br)c2F)n[nH]1 ZINC000459541634 567636260 /nfs/dbraw/zinc/63/62/60/567636260.db2.gz ZXYLSAGLDWYUKG-UHFFFAOYSA-N 0 1 388.216 3.465 10 0 GGAEMN CCOc1cc(CN2CC[C@@H](c3nccn3C)C2)cc(Br)c1O ZINC000459552015 567636313 /nfs/dbraw/zinc/63/63/13/567636313.db2.gz QEVMGOPWWXXBMG-CYBMUJFWSA-N 0 1 380.286 3.276 10 0 GGAEMN O=C1CN(Cc2nc3ccc(Br)cc3[nH]2)CN1Cc1ccccc1 ZINC000480852178 567636437 /nfs/dbraw/zinc/63/64/37/567636437.db2.gz LJVSEVPLHKSMIN-UHFFFAOYSA-N 0 1 385.265 3.127 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@@H](C)NC(=O)c2ccc(Br)s2)n1 ZINC000572403488 567636621 /nfs/dbraw/zinc/63/66/21/567636621.db2.gz MHRCKRBKTSRIRM-BDAKNGLRSA-N 0 1 387.303 3.431 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@H](C)NC(=O)c2ccc(Br)s2)n1 ZINC000572403490 567636955 /nfs/dbraw/zinc/63/69/55/567636955.db2.gz MHRCKRBKTSRIRM-IUCAKERBSA-N 0 1 387.303 3.431 10 0 GGAEMN O=C(CCC(=O)c1cc(Cl)sc1Cl)NC1(c2nn[nH]n2)CCCC1 ZINC000531028941 567637734 /nfs/dbraw/zinc/63/77/34/567637734.db2.gz FHWLMZHXDNFKCP-UHFFFAOYSA-N 0 1 388.280 3.117 10 0 GGAEMN COC(=O)CSCCC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 ZINC000440749541 567642800 /nfs/dbraw/zinc/64/28/00/567642800.db2.gz HFIJURLCQBKOOH-AWEZNQCLSA-N 0 1 381.885 3.176 10 0 GGAEMN CCOCc1cccc(NS(=O)(=O)c2ccc(C(=O)OC)c(Cl)c2)c1 ZINC000440831964 567645022 /nfs/dbraw/zinc/64/50/22/567645022.db2.gz KTMUPSSAMDSXKA-UHFFFAOYSA-N 0 1 383.853 3.464 10 0 GGAEMN CO[C@@H](CS(=O)(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)C(C)C ZINC000645596053 567645941 /nfs/dbraw/zinc/64/59/41/567645941.db2.gz DWGJTIONQYTBBX-CVEARBPZSA-N 0 1 385.917 3.354 10 0 GGAEMN COCCc1ccnc(NC(=O)c2cc(Br)cc3nc[nH]c32)c1 ZINC000553348418 567645931 /nfs/dbraw/zinc/64/59/31/567645931.db2.gz OKASSNNVXHZILI-UHFFFAOYSA-N 0 1 375.226 3.162 10 0 GGAEMN CC[C@@H](C)c1nc([C@H](C)NC(=O)Cc2ccc(Br)cc2O)n[nH]1 ZINC000506863207 567647564 /nfs/dbraw/zinc/64/75/64/567647564.db2.gz VSPZDCHYQLFQKX-ZJUUUORDSA-N 0 1 381.274 3.206 10 0 GGAEMN COCCN1CCCN(C(=O)c2cc(Br)cc(OC(C)C)c2)CC1 ZINC000531313629 567652814 /nfs/dbraw/zinc/65/28/14/567652814.db2.gz PXDDNIRCLWNNNF-UHFFFAOYSA-N 0 1 399.329 3.031 10 0 GGAEMN CC(=O)NC1CCC(N(C)Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000481054557 567654495 /nfs/dbraw/zinc/65/44/95/567654495.db2.gz GVENEEJISUSECY-UHFFFAOYSA-N 0 1 379.302 3.205 10 0 GGAEMN CCN1CCC(N(C)S(=O)(=O)c2c(C)cc(Br)cc2C)CC1 ZINC000507005621 567654743 /nfs/dbraw/zinc/65/47/43/567654743.db2.gz BWRVOOYHLGBAFC-UHFFFAOYSA-N 0 1 389.359 3.171 10 0 GGAEMN CC(C)[C@@H](NC(=O)c1cccc(Br)c1O)c1nnc2ccccn21 ZINC000531360520 567655450 /nfs/dbraw/zinc/65/54/50/567655450.db2.gz VMWRMQAQEDHKMF-CQSZACIVSA-N 0 1 389.253 3.325 10 0 GGAEMN COCc1nc(CNC(=O)N2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)n[nH]1 ZINC000666117576 567655873 /nfs/dbraw/zinc/65/58/73/567655873.db2.gz GMZHTESDXKESPW-VIFPVBQESA-N 0 1 384.267 3.087 10 0 GGAEMN COCc1nnc(CNC(=O)N2CCc3cc(Cl)c(Cl)cc3[C@@H]2C)[nH]1 ZINC000666117576 567655881 /nfs/dbraw/zinc/65/58/81/567655881.db2.gz GMZHTESDXKESPW-VIFPVBQESA-N 0 1 384.267 3.087 10 0 GGAEMN COCc1nc(CNC(=O)NC(C)(C)Cc2ccc(Cl)cc2Cl)n[nH]1 ZINC000666119547 567656120 /nfs/dbraw/zinc/65/61/20/567656120.db2.gz VRHVBBGOKWKZJO-UHFFFAOYSA-N 0 1 386.283 3.078 10 0 GGAEMN COCc1nnc(CNC(=O)NC(C)(C)Cc2ccc(Cl)cc2Cl)[nH]1 ZINC000666119547 567656126 /nfs/dbraw/zinc/65/61/26/567656126.db2.gz VRHVBBGOKWKZJO-UHFFFAOYSA-N 0 1 386.283 3.078 10 0 GGAEMN Cc1ccc2nc(NC(=O)c3cncc(I)c3)[nH]c2c1 ZINC000553473470 567656155 /nfs/dbraw/zinc/65/61/55/567656155.db2.gz NHVLGBHXKIEJEU-UHFFFAOYSA-N 0 1 378.173 3.123 10 0 GGAEMN COCc1nc(CNC(=O)Nc2cccc(Cl)c2SCC(F)F)n[nH]1 ZINC000666131135 567656184 /nfs/dbraw/zinc/65/61/84/567656184.db2.gz SIATZNIPEICUBK-UHFFFAOYSA-N 0 1 391.831 3.283 10 0 GGAEMN COCc1nnc(CNC(=O)Nc2cccc(Cl)c2SCC(F)F)[nH]1 ZINC000666131135 567656191 /nfs/dbraw/zinc/65/61/91/567656191.db2.gz SIATZNIPEICUBK-UHFFFAOYSA-N 0 1 391.831 3.283 10 0 GGAEMN Cc1cc(NC(=O)CN2CCC[C@H]([C@@H]3CCOC3)C2)ccc1Br ZINC000441201932 567657953 /nfs/dbraw/zinc/65/79/53/567657953.db2.gz QRGYMJBADXLQIY-LSDHHAIUSA-N 0 1 381.314 3.445 10 0 GGAEMN COC(=O)c1cncc(NS(=O)(=O)c2c(C)cc(Br)cc2C)c1 ZINC000507105760 567659403 /nfs/dbraw/zinc/65/94/03/567659403.db2.gz VZAYZIYWXAYGGK-UHFFFAOYSA-N 0 1 399.266 3.048 10 0 GGAEMN C[C@H](C(=O)Nc1cccc(Cl)c1O)c1ccc(S(=O)(=O)N(C)C)cc1 ZINC000531460318 567659592 /nfs/dbraw/zinc/65/95/92/567659592.db2.gz CZYYCPGWRKWKRW-NSHDSACASA-N 0 1 382.869 3.038 10 0 GGAEMN Cc1ccccc1[C@H]1C(=O)NCCN1Cc1nc2ccc(Br)cc2[nH]1 ZINC000481202985 567662398 /nfs/dbraw/zinc/66/23/98/567662398.db2.gz KKZRLXKPAFUTGF-SFHVURJKSA-N 0 1 399.292 3.307 10 0 GGAEMN CCOC(=O)CC1(NS(=O)(=O)c2c(Cl)ccc(F)c2F)CCCC1 ZINC000553529265 567662694 /nfs/dbraw/zinc/66/26/94/567662694.db2.gz RLLBWOFQVJQRKG-UHFFFAOYSA-N 0 1 381.828 3.163 10 0 GGAEMN COc1cc(S(=O)(=O)Nc2ccccc2O[C@H]2CCOC2)ccc1Cl ZINC000666302762 567664166 /nfs/dbraw/zinc/66/41/66/567664166.db2.gz HVMLKCLUBVWHFS-LBPRGKRZSA-N 0 1 383.853 3.317 10 0 GGAEMN CC(C)(C)c1nnc(CNC(=O)c2n[nH]c3ccc(Br)cc32)s1 ZINC000531576355 567667281 /nfs/dbraw/zinc/66/72/81/567667281.db2.gz IPTKOCNFEUCOHF-UHFFFAOYSA-N 0 1 394.298 3.404 10 0 GGAEMN NC(=O)C[C@H]1CCCCN1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000441514006 567667586 /nfs/dbraw/zinc/66/75/86/567667586.db2.gz OYYFBUFYDZDSPM-CQSZACIVSA-N 0 1 378.270 3.334 10 0 GGAEMN CCOc1cc(Cl)ccc1NS(=O)(=O)c1ccc(CC(=O)OC)cc1 ZINC000531582552 567667806 /nfs/dbraw/zinc/66/78/06/567667806.db2.gz DBVASXPLLQIUBR-UHFFFAOYSA-N 0 1 383.853 3.255 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1cc(Br)ccc1N1CCCC1 ZINC000666358686 567668857 /nfs/dbraw/zinc/66/88/57/567668857.db2.gz LJCBBSDCFYUDJG-UHFFFAOYSA-N 0 1 381.318 3.075 10 0 GGAEMN C[C@@H](CNS(=O)(=O)c1cc(Br)c(F)cc1F)CC(F)F ZINC000645795674 567668933 /nfs/dbraw/zinc/66/89/33/567668933.db2.gz KGOPVXRIYQUKBE-ZCFIWIBFSA-N 0 1 378.185 3.297 10 0 GGAEMN CN(Cc1cnc[nH]1)C(=O)N[C@H]1CSCc2ccc(Br)cc21 ZINC000666399749 567672047 /nfs/dbraw/zinc/67/20/47/567672047.db2.gz UJGGSCAAVBGMLG-AWEZNQCLSA-N 0 1 381.299 3.302 10 0 GGAEMN CCCN(C)[C@H](CNC(=O)NCC[C@@H](C)[S@@](C)=O)c1ccc(Cl)cc1 ZINC000553677714 567674667 /nfs/dbraw/zinc/67/46/67/567674667.db2.gz RVZNRMKSQAEDTK-FQUGFPQKSA-N 0 1 387.977 3.179 10 0 GGAEMN CN(Cc1cccc(O)c1)C(=O)c1c[nH]c2ccc(Br)cc2c1=O ZINC000572943803 567676982 /nfs/dbraw/zinc/67/69/82/567676982.db2.gz DYOLXMXWBCHHBQ-UHFFFAOYSA-N 0 1 387.233 3.268 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000572967174 567677921 /nfs/dbraw/zinc/67/79/21/567677921.db2.gz RSLADYPHRVLUKY-INIZCTEOSA-N 0 1 389.359 3.258 10 0 GGAEMN CC(C)(CNC(=O)[C@H]1CCc2[nH]cnc2C1)c1ccc(Br)cc1 ZINC000666459031 567678947 /nfs/dbraw/zinc/67/89/47/567678947.db2.gz ORZUYKRPHQFLPS-LBPRGKRZSA-N 0 1 376.298 3.371 10 0 GGAEMN COCc1nc(CNC(=O)Nc2ccc(Br)cc2C(C)C)n[nH]1 ZINC000666464137 567679468 /nfs/dbraw/zinc/67/94/68/567679468.db2.gz NOXGWVYMAVUFSO-UHFFFAOYSA-N 0 1 382.262 3.159 10 0 GGAEMN COCc1nnc(CNC(=O)Nc2ccc(Br)cc2C(C)C)[nH]1 ZINC000666464137 567679471 /nfs/dbraw/zinc/67/94/71/567679471.db2.gz NOXGWVYMAVUFSO-UHFFFAOYSA-N 0 1 382.262 3.159 10 0 GGAEMN CC(C)c1n[nH]c(C(N)=O)c1NC(=O)[C@H]1CCc2cc(Br)ccc21 ZINC000573003628 567681064 /nfs/dbraw/zinc/68/10/64/567681064.db2.gz URQYWNDVAVHWND-LBPRGKRZSA-N 0 1 391.269 3.063 10 0 GGAEMN O[C@H](CCNCc1cc(Cl)ccc1I)C(F)(F)F ZINC000597127505 567683148 /nfs/dbraw/zinc/68/31/48/567683148.db2.gz HLDWPBIBWHROPG-SNVBAGLBSA-N 0 1 393.574 3.348 10 0 GGAEMN CC(=O)c1cccc(C(=O)NCc2n[nH]c(-c3ccc(Br)cc3)n2)c1 ZINC000481504996 567684062 /nfs/dbraw/zinc/68/40/62/567684062.db2.gz FIUZXXYYXSVHRL-UHFFFAOYSA-N 0 1 399.248 3.367 10 0 GGAEMN CC(=O)c1cccc(C(=O)NCc2nc(-c3ccc(Br)cc3)n[nH]2)c1 ZINC000481504996 567684067 /nfs/dbraw/zinc/68/40/67/567684067.db2.gz FIUZXXYYXSVHRL-UHFFFAOYSA-N 0 1 399.248 3.367 10 0 GGAEMN CN1CCCC[C@H]1C(=O)NCc1cc(Cl)ccc1I ZINC000597898594 567723728 /nfs/dbraw/zinc/72/37/28/567723728.db2.gz SJIPCYABUOEDBM-ZDUSSCGKSA-N 0 1 392.668 3.045 10 0 GGAEMN Brc1ccc2ncnc(N[C@H]3CCCC[C@@H]3N3CCOCC3)c2c1 ZINC000531911031 567686709 /nfs/dbraw/zinc/68/67/09/567686709.db2.gz JGUPFTONVAWSNR-IRXDYDNUSA-N 0 1 391.313 3.448 10 0 GGAEMN COc1ccc(Br)cc1C1(NC[C@@H](O)COCc2ccco2)CC1 ZINC000645974595 567687084 /nfs/dbraw/zinc/68/70/84/567687084.db2.gz MTFINZJEXXTOKP-CQSZACIVSA-N 0 1 396.281 3.207 10 0 GGAEMN COc1ccccc1C1(NC[C@H](O)COc2ccc(Br)cc2)CC1 ZINC000645998416 567687786 /nfs/dbraw/zinc/68/77/86/567687786.db2.gz SLCIFHNLXCUSSB-HNNXBMFYSA-N 0 1 392.293 3.476 10 0 GGAEMN O=C(NCc1ccc2c(=O)cc[nH]c2c1)c1n[nH]c2ccc(Br)cc21 ZINC000646030383 567689191 /nfs/dbraw/zinc/68/91/91/567689191.db2.gz WRQDJVWHUMUZBF-UHFFFAOYSA-N 0 1 397.232 3.097 10 0 GGAEMN C[C@H]1Cc2cn[nH]c2[C@H](C(=O)Nc2nccc3cc(Br)ccc32)C1 ZINC000623218371 567692379 /nfs/dbraw/zinc/69/23/79/567692379.db2.gz CNBBHRNEDMWQMY-ZUZCIYMTSA-N 0 1 385.265 3.447 10 0 GGAEMN C[C@@H]1Cc2cn[nH]c2[C@@H](C(=O)Nc2nccc3cc(Br)ccc32)C1 ZINC000623218368 567692435 /nfs/dbraw/zinc/69/24/35/567692435.db2.gz CNBBHRNEDMWQMY-BMIGLBTASA-N 0 1 385.265 3.447 10 0 GGAEMN C[C@H]1Cc2c[nH]nc2[C@@H](C(=O)N2CCOc3cccc(Br)c3C2)C1 ZINC000623224311 567692682 /nfs/dbraw/zinc/69/26/82/567692682.db2.gz CBFAODOIQGNNLJ-AAEUAGOBSA-N 0 1 390.281 3.259 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2cc(Br)ccc2C)C1 ZINC000646113143 567694136 /nfs/dbraw/zinc/69/41/36/567694136.db2.gz LSDGRTKBUMKDCA-AWEZNQCLSA-N 0 1 379.220 3.258 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccc(Br)cc2C)C1 ZINC000646112946 567695131 /nfs/dbraw/zinc/69/51/31/567695131.db2.gz WGIBPJTYLWTUJR-AWEZNQCLSA-N 0 1 379.220 3.258 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(CCOc2cc(Cl)ccc2Cl)C1 ZINC000646108118 567695204 /nfs/dbraw/zinc/69/52/04/567695204.db2.gz OEKGOQRSFAZSBM-CQSZACIVSA-N 0 1 385.213 3.373 10 0 GGAEMN CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2cc(Br)ccc2C)C1 ZINC000646113144 567695236 /nfs/dbraw/zinc/69/52/36/567695236.db2.gz LSDGRTKBUMKDCA-CQSZACIVSA-N 0 1 379.220 3.258 10 0 GGAEMN CNC(=O)[C@]1(C(F)(F)F)CCN(CCCc2ccccc2Br)C1 ZINC000646112133 567695377 /nfs/dbraw/zinc/69/53/77/567695377.db2.gz IINNWUTZNNPTNM-HNNXBMFYSA-N 0 1 393.247 3.382 10 0 GGAEMN CC[C@H](Cc1ccccc1Br)C(=O)N1CCCN(CCOC)CC1 ZINC000532067545 567696167 /nfs/dbraw/zinc/69/61/67/567696167.db2.gz ZHMQRPVGKQFYIJ-MRXNPFEDSA-N 0 1 397.357 3.199 10 0 GGAEMN CC[C@@H](Cc1ccccc1Br)C(=O)N1CCCN(CCOC)CC1 ZINC000532067544 567696333 /nfs/dbraw/zinc/69/63/33/567696333.db2.gz ZHMQRPVGKQFYIJ-INIZCTEOSA-N 0 1 397.357 3.199 10 0 GGAEMN CCN(CCCN1CCc2nccc(Br)c2C1)CC(F)(F)F ZINC000623286912 567698622 /nfs/dbraw/zinc/69/86/22/567698622.db2.gz IOOVAKHEFHAWFO-UHFFFAOYSA-N 0 1 380.252 3.477 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2cnn(-c3ccc(Br)cc3)c2)C[C@H]1C(=O)[O-] ZINC000573249139 567699128 /nfs/dbraw/zinc/69/91/28/567699128.db2.gz WPVLDAITSXYIOX-MLGOLLRUSA-N 0 1 378.270 3.177 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1 ZINC000460718431 567699706 /nfs/dbraw/zinc/69/97/06/567699706.db2.gz LEWYCWYWCAYYOB-UONOGXRCSA-N 0 1 383.330 3.237 10 0 GGAEMN Cc1cnc(CCN(C)C(=O)[C@](C)(N)c2ccc(Br)cc2)s1 ZINC000646268476 567702335 /nfs/dbraw/zinc/70/23/35/567702335.db2.gz COTDEGDWZRAZKH-MRXNPFEDSA-N 0 1 382.327 3.089 10 0 GGAEMN COc1ccc(Br)cc1CC(=O)NC[C@@H](c1ccsc1)N(C)C ZINC000460766719 567702372 /nfs/dbraw/zinc/70/23/72/567702372.db2.gz DESADAYJYALIQI-HNNXBMFYSA-N 0 1 397.338 3.481 10 0 GGAEMN CC(C)CN1CCN(C(=O)N[C@H]2CCOc3c(Br)cccc32)CC1 ZINC000507814038 567707901 /nfs/dbraw/zinc/70/79/01/567707901.db2.gz MDDKDENGNPHRMR-INIZCTEOSA-N 0 1 396.329 3.256 10 0 GGAEMN CC(C)[C@@H]1CN(C)CCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507809695 567707949 /nfs/dbraw/zinc/70/79/49/567707949.db2.gz SFIIOJAHQQYCFF-CVEARBPZSA-N 0 1 396.329 3.254 10 0 GGAEMN O=S1(=O)CCC(CCNCc2csc(COc3ccccc3)n2)CC1 ZINC000507818399 567708597 /nfs/dbraw/zinc/70/85/97/567708597.db2.gz GBBSBUXRMWAITQ-UHFFFAOYSA-N 0 1 380.535 3.027 10 0 GGAEMN CCOc1ccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)cc1 ZINC000442832963 567711083 /nfs/dbraw/zinc/71/10/83/567711083.db2.gz GQYGSYRRMCZIOD-UHFFFAOYSA-N 0 1 377.340 3.490 10 0 GGAEMN COc1ccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)cc1C ZINC000442834217 567711191 /nfs/dbraw/zinc/71/11/91/567711191.db2.gz AMCLTEODNZJTRV-UHFFFAOYSA-N 0 1 377.340 3.409 10 0 GGAEMN O=C(Nc1nc2c(s1)CCCCC2)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000666896419 567711417 /nfs/dbraw/zinc/71/14/17/567711417.db2.gz PFVRCQQDACVDEM-GHMZBOCLSA-N 0 1 378.416 3.335 10 0 GGAEMN Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CCN2CCC1CC2 ZINC000507873350 567711929 /nfs/dbraw/zinc/71/19/29/567711929.db2.gz HBMZSWYBFCIAMJ-UHFFFAOYSA-N 0 1 390.281 3.333 10 0 GGAEMN CC(=O)c1ccc(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2O)cc1 ZINC000442846420 567712138 /nfs/dbraw/zinc/71/21/38/567712138.db2.gz ZEKMFCUEJJZQNK-UHFFFAOYSA-N 0 1 375.324 3.294 10 0 GGAEMN CCC[C@H](NCCNS(=O)(=O)c1ccc(Cl)cc1F)c1ccccn1 ZINC000442874770 567714328 /nfs/dbraw/zinc/71/43/28/567714328.db2.gz VAEMUUCMIZULAF-HNNXBMFYSA-N 0 1 385.892 3.283 10 0 GGAEMN CCC(CC)c1nnc(NC(=O)C(C[C@@H]2COCCO2)C(F)(F)F)s1 ZINC000666969444 567715380 /nfs/dbraw/zinc/71/53/80/567715380.db2.gz RIRYPBCZHLSFPY-MNOVXSKESA-N 0 1 381.420 3.364 10 0 GGAEMN Fc1cc(CNCc2ccsc2C(F)(F)F)cnc1N1CCOCC1 ZINC000623493518 567715893 /nfs/dbraw/zinc/71/58/93/567715893.db2.gz IGYQRUXAJBPVTD-UHFFFAOYSA-N 0 1 375.391 3.427 10 0 GGAEMN CN(CC1CN(C)C1)C(=O)Nc1cc(C(F)(F)F)ccc1Br ZINC000666991966 567716695 /nfs/dbraw/zinc/71/66/95/567716695.db2.gz NLWFRZCNHRTRSD-UHFFFAOYSA-N 0 1 380.208 3.493 10 0 GGAEMN COc1ccc([C@@H](N[C@@H]2CCCNC2=O)c2ccccc2)cc1Br ZINC000532441497 567717026 /nfs/dbraw/zinc/71/70/26/567717026.db2.gz TYPXNGYARYVXIQ-AEFFLSMTSA-N 0 1 389.293 3.415 10 0 GGAEMN COc1ccc([C@H](N[C@H]2CCCNC2=O)c2ccccc2)cc1Br ZINC000532441498 567717182 /nfs/dbraw/zinc/71/71/82/567717182.db2.gz TYPXNGYARYVXIQ-FUHWJXTLSA-N 0 1 389.293 3.415 10 0 GGAEMN O=S(=O)(c1ccccc1)N1CC[C@H](NCc2csc(C(F)(F)F)c2)C1 ZINC000623525960 567718803 /nfs/dbraw/zinc/71/88/03/567718803.db2.gz DWLXNPMSXRZTGZ-ZDUSSCGKSA-N 0 1 390.452 3.320 10 0 GGAEMN Cc1ccc(-n2cccn2)cc1NS(=O)(=O)c1cncc(Br)c1 ZINC000507971473 567719959 /nfs/dbraw/zinc/71/99/59/567719959.db2.gz RZXDNPABKUGYRJ-UHFFFAOYSA-N 0 1 393.266 3.139 10 0 GGAEMN CNC(=O)C[C@@H](C)NCc1cc(Br)c(C)cc1Br ZINC000623541524 567720850 /nfs/dbraw/zinc/72/08/50/567720850.db2.gz NRSYIEJFCBFTJA-SECBINFHSA-N 0 1 378.108 3.134 10 0 GGAEMN CCN(CC)CCS(=O)(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C ZINC000573529121 567720971 /nfs/dbraw/zinc/72/09/71/567720971.db2.gz OBWWMDYPDVPOJD-HNNXBMFYSA-N 0 1 381.567 3.441 10 0 GGAEMN O=C(c1cc(Br)cc2nc[nH]c21)N1C[C@@H](CO)Cc2ccccc21 ZINC000646525801 567723461 /nfs/dbraw/zinc/72/34/61/567723461.db2.gz WGVQAMMBIZUTTO-NSHDSACASA-N 0 1 386.249 3.137 10 0 GGAEMN COC(=O)c1ncc(NS(=O)(=O)c2cccc(Cl)c2C)cc1Cl ZINC000508066219 567723550 /nfs/dbraw/zinc/72/35/50/567723550.db2.gz ANWWWKCCYUGDBK-UHFFFAOYSA-N 0 1 375.233 3.284 10 0 GGAEMN CC(=O)N1CC[C@@H](NCc2cc(Br)c(C)cc2Br)C1 ZINC000623575821 567723849 /nfs/dbraw/zinc/72/38/49/567723849.db2.gz RINBXJHVVSMHEG-GFCCVEGCSA-N 0 1 390.119 3.230 10 0 GGAEMN Cc1cc(Br)c(CNC[C@@H](O)[C@@H]2CCCO2)cc1Br ZINC000623620014 567724785 /nfs/dbraw/zinc/72/47/85/567724785.db2.gz CTLGNLMUJVVEJE-KGLIPLIRSA-N 0 1 393.119 3.150 10 0 GGAEMN O=C([C@H]1CCc2[nH]cnc2C1)N1CCc2[nH]c3c(cccc3Br)c2C1 ZINC000667102063 567724809 /nfs/dbraw/zinc/72/48/09/567724809.db2.gz QHHHTLDBFHSPFH-NSHDSACASA-N 0 1 399.292 3.343 10 0 GGAEMN COc1cccc(N2C[C@@H](NCc3ccc(Br)s3)CC2=O)c1 ZINC000508073275 567725504 /nfs/dbraw/zinc/72/55/04/567725504.db2.gz VVQJGKQPKQWDDM-NSHDSACASA-N 0 1 381.295 3.414 10 0 GGAEMN COc1ccc(CN2CC[C@@H]2CNCc2ncc(Br)cc2F)cc1 ZINC000623641072 567727786 /nfs/dbraw/zinc/72/77/86/567727786.db2.gz HWWAFCUIECMGGG-OAHLLOKOSA-N 0 1 394.288 3.356 10 0 GGAEMN CCc1nc([C@H](C)NC(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)n[nH]1 ZINC000646544453 567728056 /nfs/dbraw/zinc/72/80/56/567728056.db2.gz VMTXPBURGUVCEW-QMMMGPOBSA-N 0 1 377.861 3.422 10 0 GGAEMN CCc1cnc(CN[C@]2(CO)CCc3cc(Br)ccc3C2)s1 ZINC000623645247 567728165 /nfs/dbraw/zinc/72/81/65/567728165.db2.gz USRLTOYJXPVKNY-QGZVFWFLSA-N 0 1 381.339 3.478 10 0 GGAEMN COc1cccc(N2C[C@@H](NCc3cc(Br)ccc3F)CC2=O)c1 ZINC000508089202 567728147 /nfs/dbraw/zinc/72/81/47/567728147.db2.gz RDABMRPXDSBOFX-AWEZNQCLSA-N 0 1 393.256 3.492 10 0 GGAEMN Clc1ccc(N2CCO[C@H](CNCc3ccc(Br)cn3)C2)cc1 ZINC000623654850 567728215 /nfs/dbraw/zinc/72/82/15/567728215.db2.gz KMQLYCDEYDNPIY-QGZVFWFLSA-N 0 1 396.716 3.493 10 0 GGAEMN CC(C)c1nc(CNC(=O)Nc2cnc(-c3ccc(Cl)s3)nc2)n[nH]1 ZINC000646545795 567728960 /nfs/dbraw/zinc/72/89/60/567728960.db2.gz VDYLVDGUCMKNQO-UHFFFAOYSA-N 0 1 377.861 3.422 10 0 GGAEMN O=C(N[C@H]1CCc2nc[nH]c2C1)c1ccc(Br)cc1Br ZINC000508094389 567729220 /nfs/dbraw/zinc/72/92/20/567729220.db2.gz HTPGSBSTXOPYDV-VIFPVBQESA-N 0 1 399.086 3.222 10 0 GGAEMN O=S(=O)(c1ccccc1)N1CC[C@H](NCc2ccc(C(F)(F)F)s2)C1 ZINC000573706663 567731072 /nfs/dbraw/zinc/73/10/72/567731072.db2.gz SMBZNZMMBFIIRX-LBPRGKRZSA-N 0 1 390.452 3.320 10 0 GGAEMN COc1cc(Br)ccc1[C@@H]1CCCN1C(=O)N[C@H]1CCCN(C)C1 ZINC000623717371 567734001 /nfs/dbraw/zinc/73/40/01/567734001.db2.gz XNUILWSMZTZFLE-HOCLYGCPSA-N 0 1 396.329 3.398 10 0 GGAEMN COC(=O)c1cc(Cl)cc(Cl)c1S(=O)(=O)Nc1ncccc1F ZINC000508176587 567735420 /nfs/dbraw/zinc/73/54/20/567735420.db2.gz AZONHGLBLIGRSN-UHFFFAOYSA-N 0 1 379.196 3.115 10 0 GGAEMN O=C(N=c1ccn(Cc2ccccc2)[nH]1)c1cc(Br)cc2[nH]cnc21 ZINC000554561202 567736296 /nfs/dbraw/zinc/73/62/96/567736296.db2.gz HQKIDVDCCJPGKK-UHFFFAOYSA-N 0 1 396.248 3.244 10 0 GGAEMN COC(=O)[C@H](NC(=O)c1cc(Br)cc2nc[nH]c21)C1CCCCC1 ZINC000554569113 567737271 /nfs/dbraw/zinc/73/72/71/567737271.db2.gz HBQDVHXBQGETIX-CQSZACIVSA-N 0 1 394.269 3.177 10 0 GGAEMN Cc1cc(Br)c(CNC[C@H]2CN(Cc3ccncc3)CCO2)s1 ZINC000623782028 567737338 /nfs/dbraw/zinc/73/73/38/567737338.db2.gz GNUNTFKVSLXHHS-HNNXBMFYSA-N 0 1 396.354 3.205 10 0 GGAEMN Cc1cc(C[C@@H](C)NC(=O)NCc2ccc(Br)c(F)c2F)n[nH]1 ZINC000623779130 567737651 /nfs/dbraw/zinc/73/76/51/567737651.db2.gz OXKDWDYPYHAXDZ-MRVPVSSYSA-N 0 1 387.228 3.189 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)NCc2cc(F)c(Br)cc2F)n[nH]1 ZINC000623778885 567737859 /nfs/dbraw/zinc/73/78/59/567737859.db2.gz GFGUPSDYMQXBHE-QMMMGPOBSA-N 0 1 387.228 3.189 10 0 GGAEMN Cc1ccc(CNC[C@H]2CN(Cc3ccncc3)CCO2)c(Br)c1 ZINC000623781200 567738009 /nfs/dbraw/zinc/73/80/09/567738009.db2.gz JPWGCQWXWXYVPV-SFHVURJKSA-N 0 1 390.325 3.143 10 0 GGAEMN Cc1cc(C[C@H](C)NC(=O)N[C@@H](C)Cc2cc(Br)ccc2F)n[nH]1 ZINC000532848327 567738653 /nfs/dbraw/zinc/73/86/53/567738653.db2.gz GBMCNNZEOCJAET-QWRGUYRKSA-N 0 1 397.292 3.481 10 0 GGAEMN COc1cc(Br)c(CNCC2(O)Cc3ccccc3C2)c(OC)c1 ZINC000532866424 567739814 /nfs/dbraw/zinc/73/98/14/567739814.db2.gz ODHJAUSJTKIJRE-UHFFFAOYSA-N 0 1 392.293 3.086 10 0 GGAEMN O=C([C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)N1CCN(C2CCCC2)CC1 ZINC000623821929 567740164 /nfs/dbraw/zinc/74/01/64/567740164.db2.gz MUWZWAHSWFYORM-NZSAHSFTSA-N 0 1 389.337 3.422 10 0 GGAEMN Cc1nc([C@H]2CCCCN2S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000508252283 567740546 /nfs/dbraw/zinc/74/05/46/567740546.db2.gz AEZSFDSXVONGRZ-CQSZACIVSA-N 0 1 389.308 3.477 10 0 GGAEMN CCOc1cc(CN[C@@H]2CCN(C3CCC3)C2=O)cc(Br)c1OC ZINC000623840094 567741075 /nfs/dbraw/zinc/74/10/75/567741075.db2.gz NGAIDGQNTSFZAC-OAHLLOKOSA-N 0 1 397.313 3.099 10 0 GGAEMN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@H]1CCNC1=O ZINC000532879641 567741280 /nfs/dbraw/zinc/74/12/80/567741280.db2.gz NDPTZZOAVGSDOK-ZANVPECISA-N 0 1 380.311 3.420 10 0 GGAEMN Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@H]1CCNC1=O ZINC000532879638 567741288 /nfs/dbraw/zinc/74/12/88/567741288.db2.gz NDPTZZOAVGSDOK-RNCFNFMXSA-N 0 1 380.311 3.420 10 0 GGAEMN Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@@H]1CCNC1=O ZINC000532879640 567741320 /nfs/dbraw/zinc/74/13/20/567741320.db2.gz NDPTZZOAVGSDOK-TVQRCGJNSA-N 0 1 380.311 3.420 10 0 GGAEMN O=C1[C@H](NCc2ccc(OC(F)F)c(Br)c2)CCN1C1CCC1 ZINC000623840922 567741483 /nfs/dbraw/zinc/74/14/83/567741483.db2.gz JBFMKDFUFKZIMO-CYBMUJFWSA-N 0 1 389.240 3.294 10 0 GGAEMN Cn1nccc1[C@@H]1CCCCN1C[C@@H](O)COc1ccc(Br)cc1 ZINC000532888135 567741526 /nfs/dbraw/zinc/74/15/26/567741526.db2.gz SNCKTWIHMNWGJZ-QAPCUYQASA-N 0 1 394.313 3.150 10 0 GGAEMN Cc1c([C@H](C)N[C@H]2COCC2(C)C)nnn1-c1cccc(Br)c1 ZINC000573894640 567742595 /nfs/dbraw/zinc/74/25/95/567742595.db2.gz JAHRCVGJBNHQMC-NHYWBVRUSA-N 0 1 379.302 3.414 10 0 GGAEMN Cc1ncc(NS(=O)(=O)c2cc(Br)ccc2F)c(C2CC2)n1 ZINC000532894527 567742868 /nfs/dbraw/zinc/74/28/68/567742868.db2.gz KGNXHTAISQJWSH-UHFFFAOYSA-N 0 1 386.246 3.365 10 0 GGAEMN COC(=O)[C@@H]1CCN(C(=O)c2cccc(Br)c2O)[C@@H]2CCCC[C@H]12 ZINC000598180865 567743263 /nfs/dbraw/zinc/74/32/63/567743263.db2.gz MFNDVNVEMFLZQR-LALPHHSUSA-N 0 1 396.281 3.349 10 0 GGAEMN O=C(NC1(c2noc(C(F)F)n2)CCC1)c1cccc(Br)c1O ZINC000646826059 567744173 /nfs/dbraw/zinc/74/41/73/567744173.db2.gz UMDNWEYEBQYFDG-UHFFFAOYSA-N 0 1 388.168 3.285 10 0 GGAEMN CN1CCN(C[C@H](Nc2ncc(Br)cc2F)c2ccccc2)CC1 ZINC000623934417 567748443 /nfs/dbraw/zinc/74/84/43/567748443.db2.gz RQXSXPMCFQONFU-KRWDZBQOSA-N 0 1 393.304 3.384 10 0 GGAEMN CCN(CC1=Nc2ccccc2S(=O)(=O)N1)c1ccc(Br)cc1 ZINC000533037541 567748433 /nfs/dbraw/zinc/74/84/33/567748433.db2.gz CSUARWZEXPHDRV-UHFFFAOYSA-N 0 1 394.294 3.298 10 0 GGAEMN CN(Cc1cn(C)nc1C(F)(F)F)C(=O)c1cccc(Br)c1O ZINC000533088554 567751276 /nfs/dbraw/zinc/75/12/76/567751276.db2.gz VUSHTKIQOOOWAE-UHFFFAOYSA-N 0 1 392.175 3.179 10 0 GGAEMN CN1CCC[C@H](NCc2cnc(-c3ccc(Br)cc3)s2)C1=O ZINC000533106681 567752162 /nfs/dbraw/zinc/75/21/62/567752162.db2.gz OXKRXXOQPMODLN-AWEZNQCLSA-N 0 1 380.311 3.283 10 0 GGAEMN Cc1ncsc1-c1ccc(CN2CCCC[C@@H]2CNS(C)(=O)=O)cc1 ZINC000667503976 567753394 /nfs/dbraw/zinc/75/33/94/567753394.db2.gz CRXHKHSEIQZWDN-QGZVFWFLSA-N 0 1 379.551 3.022 10 0 GGAEMN O=C(c1cccc2c[nH]nc21)N(CCO)Cc1cc(Br)cs1 ZINC000508538516 567753977 /nfs/dbraw/zinc/75/39/77/567753977.db2.gz NOTMUCUCJCXDPY-UHFFFAOYSA-N 0 1 380.267 3.022 10 0 GGAEMN OC[C@@H]1CCN(Cc2ccccc2)C[C@H]1Nc1ncc(Br)cc1F ZINC000624049033 567756377 /nfs/dbraw/zinc/75/63/77/567756377.db2.gz ZESLHEGYAOKPOO-WMLDXEAASA-N 0 1 394.288 3.278 10 0 GGAEMN CCC(=O)Nc1ccc(C)c(NS(=O)(=O)c2cnc(OC)c(Cl)c2)c1 ZINC000647124405 567761056 /nfs/dbraw/zinc/76/10/56/567761056.db2.gz DOYKPAOBZKVBMC-UHFFFAOYSA-N 0 1 383.857 3.201 10 0 GGAEMN COc1ncc(Br)cc1CN[C@H](C)CC(=O)Nc1cccc(F)c1 ZINC000624133756 567762071 /nfs/dbraw/zinc/76/20/71/567762071.db2.gz WBJSETKQPYOXLN-LLVKDONJSA-N 0 1 396.260 3.499 10 0 GGAEMN COc1ncc(Br)cc1CN[C@@H](C)CC(=O)N1CCCCCC1 ZINC000624133230 567762152 /nfs/dbraw/zinc/76/21/52/567762152.db2.gz JGUIULZWKZOMIZ-ZDUSSCGKSA-N 0 1 384.318 3.124 10 0 GGAEMN COc1ncc(Br)cc1CNC1CC[NH+](Cc2ccncc2)CC1 ZINC000624132808 567762260 /nfs/dbraw/zinc/76/22/60/567762260.db2.gz AGHGSBGRYBOBLX-UHFFFAOYSA-N 0 1 391.313 3.002 10 0 GGAEMN COc1ncc(Br)cc1CN[C@H](c1nnc[nH]1)C1CCCCC1 ZINC000624134464 567762285 /nfs/dbraw/zinc/76/22/85/567762285.db2.gz VZQFLLQNVZHCLG-AWEZNQCLSA-N 0 1 380.290 3.382 10 0 GGAEMN C[C@H]1CC(=O)CC[C@H]1C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598423098 567764585 /nfs/dbraw/zinc/76/45/85/567764585.db2.gz KAFOWJKVEBNJNT-GZMMTYOYSA-N 0 1 397.216 3.111 10 0 GGAEMN O=C(C[C@@H]1CCCCO1)Nc1nc2ccc(I)cc2[nH]1 ZINC000598422324 567764723 /nfs/dbraw/zinc/76/47/23/567764723.db2.gz ARKIRNCHOICXBF-JTQLQIEISA-N 0 1 385.205 3.065 10 0 GGAEMN CC[C@H](SC)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598424921 567764790 /nfs/dbraw/zinc/76/47/90/567764790.db2.gz RZUHVXAGNPUCNF-JTQLQIEISA-N 0 1 375.235 3.248 10 0 GGAEMN Clc1cc(Cl)cc([C@@H](c2nc([C@@H]3CCCN3)no2)N2CCOCC2)c1 ZINC000647145628 567765123 /nfs/dbraw/zinc/76/51/23/567765123.db2.gz ABGULJDTHAMLNL-GJZGRUSLSA-N 0 1 383.279 3.223 10 0 GGAEMN C[C@H](C(=O)Nc1nc2ccc(I)cc2[nH]1)C(F)(F)F ZINC000598423117 567765293 /nfs/dbraw/zinc/76/52/93/567765293.db2.gz KLTHBRJENBYMMS-RXMQYKEDSA-N 0 1 383.111 3.304 10 0 GGAEMN CC(C)SCC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598422591 567765347 /nfs/dbraw/zinc/76/53/47/567765347.db2.gz GHRLZSSWPARSCF-UHFFFAOYSA-N 0 1 375.235 3.248 10 0 GGAEMN CN1CCOC[C@@H]1CN[C@H](c1ccc(Br)o1)c1ccc(F)cc1 ZINC000624176053 567765502 /nfs/dbraw/zinc/76/55/02/567765502.db2.gz BCASRDXXAYTQNL-YOEHRIQHSA-N 0 1 383.261 3.191 10 0 GGAEMN O=C(Nc1ccc(-c2ccc(Cl)s2)nn1)N1CC[C@@H](N2CC=CC2)C1 ZINC000667681474 567765907 /nfs/dbraw/zinc/76/59/07/567765907.db2.gz KJDFAHLJEAUZGR-GFCCVEGCSA-N 0 1 375.885 3.337 10 0 GGAEMN C[C@H](CC(=O)Nc1nc2ccc(I)cc2[nH]1)[C@@H]1CCCO1 ZINC000598427039 567766023 /nfs/dbraw/zinc/76/60/23/567766023.db2.gz DXLZOKQDHYLWSE-RNCFNFMXSA-N 0 1 399.232 3.311 10 0 GGAEMN COC1(C(=O)Nc2nc3ccc(I)cc3[nH]2)CCCC1 ZINC000598427133 567766103 /nfs/dbraw/zinc/76/61/03/567766103.db2.gz GTIHWCDLCHIRMD-UHFFFAOYSA-N 0 1 385.205 3.065 10 0 GGAEMN O=C(Nc1nc2ccc(I)cc2[nH]1)[C@@H]1C[C@H]1C(F)(F)F ZINC000598428061 567766551 /nfs/dbraw/zinc/76/65/51/567766551.db2.gz LMIZEPKKESVTRH-RNFRBKRXSA-N 0 1 395.122 3.304 10 0 GGAEMN C[C@@H]1C(=O)CC[C@@H]1CC(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428248 567767352 /nfs/dbraw/zinc/76/73/52/567767352.db2.gz NSXOROZZPQFLOU-DTWKUNHWSA-N 0 1 397.216 3.111 10 0 GGAEMN CO[C@@H]1CCC[C@H](C(=O)Nc2nc3ccc(I)cc3[nH]2)C1 ZINC000598428184 567767674 /nfs/dbraw/zinc/76/76/74/567767674.db2.gz MQUKEQLBLHBSGG-GXSJLCMTSA-N 0 1 399.232 3.311 10 0 GGAEMN COC[C@@H](C)[C@H](C)C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000598428232 567767704 /nfs/dbraw/zinc/76/77/04/567767704.db2.gz NMXDHLGLTISCCI-BDAKNGLRSA-N 0 1 387.221 3.025 10 0 GGAEMN O=C(Nc1nc2ccc(I)cc2[nH]1)[C@H]1CCCSC1 ZINC000598428122 567767729 /nfs/dbraw/zinc/76/77/29/567767729.db2.gz MBFMNDPNWJUZHH-QMMMGPOBSA-N 0 1 387.246 3.249 10 0 GGAEMN O=S(=O)(CCOCC(F)(F)F)Nc1ccccc1OCc1cscn1 ZINC000555119564 567769184 /nfs/dbraw/zinc/76/91/84/567769184.db2.gz NUGDVXDQECMUSR-UHFFFAOYSA-N 0 1 396.412 3.043 10 0 GGAEMN COc1ncncc1CNCCCOc1ncc(C(F)(F)F)cc1Cl ZINC000647196556 567770116 /nfs/dbraw/zinc/77/01/16/567770116.db2.gz DMFFOCNIBLYPLY-UHFFFAOYSA-N 0 1 376.766 3.111 10 0 GGAEMN C[C@H](NC[C@@H]1CN(Cc2ccncc2)CCO1)c1sccc1Br ZINC000624266067 567771248 /nfs/dbraw/zinc/77/12/48/567771248.db2.gz FLFLJVUWEACKRK-DZGCQCFKSA-N 0 1 396.354 3.457 10 0 GGAEMN O=C(Nc1cc(Cl)ccc1N1CCSCC1)[C@H]1CCc2[nH]cnc2C1 ZINC000667738494 567771578 /nfs/dbraw/zinc/77/15/78/567771578.db2.gz PPDBXRRNVNOJSO-LBPRGKRZSA-N 0 1 376.913 3.360 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H]([C@H]2CCOC2)C1 ZINC000533504423 567771829 /nfs/dbraw/zinc/77/18/29/567771829.db2.gz AOJBGMDZRYRGHA-RYUDHWBXSA-N 0 1 378.270 3.214 10 0 GGAEMN O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000533504424 567771988 /nfs/dbraw/zinc/77/19/88/567771988.db2.gz AOJBGMDZRYRGHA-VXGBXAGGSA-N 0 1 378.270 3.214 10 0 GGAEMN CCC(C)(C)c1ccc(CNS(=O)(=O)c2csnc2C(=O)OC)cc1 ZINC000443739258 567773341 /nfs/dbraw/zinc/77/33/41/567773341.db2.gz WVAOXHDZMKUYHT-UHFFFAOYSA-N 0 1 382.507 3.096 10 0 GGAEMN CO[C@@H](CS(=O)(=O)Nc1ccc2cccc(Cl)c2n1)C1CCOCC1 ZINC000647271738 567776301 /nfs/dbraw/zinc/77/63/01/567776301.db2.gz GEAIDMUHZWDKTK-HNNXBMFYSA-N 0 1 384.885 3.072 10 0 GGAEMN CC(C)C[C@@H](N)c1noc(-c2cccnc2-n2cc(Br)cn2)n1 ZINC000574398938 567776698 /nfs/dbraw/zinc/77/66/98/567776698.db2.gz PRKBLAJJKLIYEE-GFCCVEGCSA-N 0 1 377.246 3.126 10 0 GGAEMN O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCO[C@H](C2CCC2)C1 ZINC000574420453 567776813 /nfs/dbraw/zinc/77/68/13/567776813.db2.gz YDADZRVHRDPZRU-AWEZNQCLSA-N 0 1 390.281 3.480 10 0 GGAEMN COc1ncc(S(=O)(=O)[N-]c2ccc3c(c2)CC[C@H]3[NH+](C)C)cc1Cl ZINC000647277219 567777434 /nfs/dbraw/zinc/77/74/34/567777434.db2.gz OHRBLUHEHGTAGX-MRXNPFEDSA-N 0 1 381.885 3.093 10 0 GGAEMN COc1ccccc1C1(N[C@@H](C)Cn2cc(Br)ccc2=O)CC1 ZINC000647329877 567779574 /nfs/dbraw/zinc/77/95/74/567779574.db2.gz YGQJXIJKKCJPLU-ZDUSSCGKSA-N 0 1 377.282 3.287 10 0 GGAEMN O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1n[nH]c2ccc(Br)cc21 ZINC000533656351 567780966 /nfs/dbraw/zinc/78/09/66/567780966.db2.gz PXRGFIRVYLERAP-XZJROXQQSA-N 0 1 390.281 3.403 10 0 GGAEMN C[C@@H]1CC[N@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@H]1C(=O)[O-] ZINC000647368309 567781887 /nfs/dbraw/zinc/78/18/87/567781887.db2.gz TUYOAXARRNCYMW-PSASIEDQSA-N 0 1 386.271 3.103 10 0 GGAEMN C[C@@H]1CC[N@@H+](Cc2nc(-c3cc(Br)cs3)no2)C[C@H]1C(=O)[O-] ZINC000647368309 567781893 /nfs/dbraw/zinc/78/18/93/567781893.db2.gz TUYOAXARRNCYMW-PSASIEDQSA-N 0 1 386.271 3.103 10 0 GGAEMN CCn1cnc(S(=O)(=O)N[C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1 ZINC000443962675 567782632 /nfs/dbraw/zinc/78/26/32/567782632.db2.gz JHSFEEGCMWPVCR-GFCCVEGCSA-N 0 1 385.770 3.277 10 0 GGAEMN C[C@@H](Cc1cc(Br)ccc1F)NC(=O)[C@@H]1CCCc2[nH]ncc21 ZINC000533716310 567783754 /nfs/dbraw/zinc/78/37/54/567783754.db2.gz JVMSICJMAOCYLF-GXFFZTMASA-N 0 1 380.261 3.479 10 0 GGAEMN C[C@H](CC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)[C@H]1CCCO1 ZINC000667947086 567784855 /nfs/dbraw/zinc/78/48/55/567784855.db2.gz FYLHHLNTPTVFEN-BXUZGUMPSA-N 0 1 393.285 3.056 10 0 GGAEMN C[C@H](CC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CCCO1 ZINC000667947086 567784860 /nfs/dbraw/zinc/78/48/60/567784860.db2.gz FYLHHLNTPTVFEN-BXUZGUMPSA-N 0 1 393.285 3.056 10 0 GGAEMN COc1cc(Br)ccc1[C@@H]1CCCN1c1nc2[nH]ncc2c(=O)[nH]1 ZINC000624529276 567785153 /nfs/dbraw/zinc/78/51/53/567785153.db2.gz NKLOIZQFSIWONI-LBPRGKRZSA-N 0 1 390.241 3.171 10 0 GGAEMN COc1cc(Br)ccc1[C@H]1CCCN1c1nc2[nH]ncc2c(=O)[nH]1 ZINC000624529275 567785269 /nfs/dbraw/zinc/78/52/69/567785269.db2.gz NKLOIZQFSIWONI-GFCCVEGCSA-N 0 1 390.241 3.171 10 0 GGAEMN Cc1cc(I)cc(C(=O)N2[C@@H](C)CN(C)C[C@@H]2C)c1C ZINC000533778674 567786169 /nfs/dbraw/zinc/78/61/69/567786169.db2.gz WVPAPKKMSJBCMY-RYUDHWBXSA-N 0 1 386.277 3.073 10 0 GGAEMN O=S(=O)(NCCc1ccsc1)c1cc(F)c(Br)cc1F ZINC000533801407 567787618 /nfs/dbraw/zinc/78/76/18/567787618.db2.gz FQKCBLGXCJVVNY-UHFFFAOYSA-N 0 1 382.251 3.310 10 0 GGAEMN CN(C)Cc1ccc(C(=O)NCCCc2ccc(Br)cc2F)cn1 ZINC000555557293 567788774 /nfs/dbraw/zinc/78/87/74/567788774.db2.gz ZJLQQNACAOKXEZ-UHFFFAOYSA-N 0 1 394.288 3.407 10 0 GGAEMN O=C(Nc1nc(-c2ccc[nH]2)cs1)C(C[C@@H]1COCCO1)C(F)(F)F ZINC000668018339 567788806 /nfs/dbraw/zinc/78/88/06/567788806.db2.gz IOHCTTKRWXODJP-NXEZZACHSA-N 0 1 375.372 3.061 10 0 GGAEMN CC1(N2CCOCC2)CCN(c2ncnc3cc(Br)sc32)CC1 ZINC000624605761 567790763 /nfs/dbraw/zinc/79/07/63/567790763.db2.gz ZJZMBRCJKLFNGJ-UHFFFAOYSA-N 0 1 397.342 3.145 10 0 GGAEMN CSCc1cnc(CNC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)s1 ZINC000555586979 567791200 /nfs/dbraw/zinc/79/12/00/567791200.db2.gz OZULOZYFSJWSJR-UHFFFAOYSA-N 0 1 384.958 3.382 10 0 GGAEMN Cn1ncc2ccc(CNC(=O)c3n[nH]c4ccc(Br)cc43)cc21 ZINC000574806071 567798499 /nfs/dbraw/zinc/79/84/99/567798499.db2.gz NFFZAUHHLFLFHW-UHFFFAOYSA-N 0 1 384.237 3.142 10 0 GGAEMN CCc1c(NC(=O)Cc2ccnn2C)[nH]nc1-c1ccc(Br)cc1 ZINC000444270476 567798809 /nfs/dbraw/zinc/79/88/09/567798809.db2.gz QUCRABRXMWYFAX-UHFFFAOYSA-N 0 1 388.269 3.316 10 0 GGAEMN CCCN(Cc1c(F)cccc1Cl)C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000444248271 567799078 /nfs/dbraw/zinc/79/90/78/567799078.db2.gz NDTHTTMUOGKMDQ-CQSZACIVSA-N 0 1 376.925 3.363 10 0 GGAEMN C[C@@H]1Cc2cn[nH]c2[C@@H](C(=O)Nc2cc(I)ccc2O)C1 ZINC000598934188 567799140 /nfs/dbraw/zinc/79/91/40/567799140.db2.gz OLRCVTCPQYUPHU-KCJUWKMLSA-N 0 1 397.216 3.025 10 0 GGAEMN CN(C(=O)c1ccc(Br)c(Cl)c1F)[C@H]1CN2CCC1CC2 ZINC000444268332 567799115 /nfs/dbraw/zinc/79/91/15/567799115.db2.gz NBUIBJTTZNSBFF-LBPRGKRZSA-N 0 1 375.669 3.408 10 0 GGAEMN COC[C@]1(C)CN(c2ccnc3cc(OC)c(Br)cc32)CCO1 ZINC000624777100 567799946 /nfs/dbraw/zinc/79/99/46/567799946.db2.gz JUDMGNSDWPUSRB-KRWDZBQOSA-N 0 1 381.270 3.248 10 0 GGAEMN O=C1[C@@H](Nc2ccc3cc(Br)c(F)cc3n2)CCN1C1CCC1 ZINC000624780224 567800496 /nfs/dbraw/zinc/80/04/96/567800496.db2.gz AQXDMAIMLIRPJN-AWEZNQCLSA-N 0 1 378.245 3.124 10 0 GGAEMN CC1CCN([C@@H](CNS(=O)(=O)[C@@H]2COC(C)(C)C2)c2cccs2)CC1 ZINC000624797023 567800895 /nfs/dbraw/zinc/80/08/95/567800895.db2.gz KZTJHKQYYIMEJR-HOTGVXAUSA-N 0 1 386.583 3.008 10 0 GGAEMN C[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(Br)cn1 ZINC000574857023 567800949 /nfs/dbraw/zinc/80/09/49/567800949.db2.gz DZOXUVOASFDQBQ-GFCCVEGCSA-N 0 1 383.311 3.240 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000624797782 567801308 /nfs/dbraw/zinc/80/13/08/567801308.db2.gz NDQNSEGYNFDBBE-INIZCTEOSA-N 0 1 376.513 3.150 10 0 GGAEMN C[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(Br)cn1 ZINC000574857024 567801401 /nfs/dbraw/zinc/80/14/01/567801401.db2.gz DZOXUVOASFDQBQ-LBPRGKRZSA-N 0 1 383.311 3.240 10 0 GGAEMN CCC(F)(F)C(C)(C)CS(=O)(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000624797785 567801426 /nfs/dbraw/zinc/80/14/26/567801426.db2.gz NDQNSEGYNFDBBE-MRXNPFEDSA-N 0 1 376.513 3.150 10 0 GGAEMN C[C@@](CO)(NC(=O)c1n[nH]c2ccc(Br)cc21)C1CCCCC1 ZINC000444310579 567801453 /nfs/dbraw/zinc/80/14/53/567801453.db2.gz IBKOCWQBJTVOSE-KRWDZBQOSA-N 0 1 380.286 3.387 10 0 GGAEMN C[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C(=O)Cc1ccccc1 ZINC000534202633 567803422 /nfs/dbraw/zinc/80/34/22/567803422.db2.gz GORXTPDYULJFHB-LLVKDONJSA-N 0 1 386.249 3.256 10 0 GGAEMN CC1(C)CN(C(=O)c2c[nH]c3ccc(Br)cc3c2=O)CC(C)(C)O1 ZINC000444409173 567804814 /nfs/dbraw/zinc/80/48/14/567804814.db2.gz DNXAPIISNGCSLD-UHFFFAOYSA-N 0 1 393.281 3.320 10 0 GGAEMN COC(=O)CCNC(=O)CCN[C@H](C)c1ccc(Cl)c(Cl)c1Cl ZINC000599088900 567804996 /nfs/dbraw/zinc/80/49/96/567804996.db2.gz QUZNDNXIGKJSRU-SECBINFHSA-N 0 1 381.687 3.367 10 0 GGAEMN CC(C)(NC(=O)NCc1n[nH]c(-c2ccc(Br)cc2)n1)C1CC1 ZINC000534291663 567806759 /nfs/dbraw/zinc/80/67/59/567806759.db2.gz CWAFHTWVZXDJKT-UHFFFAOYSA-N 0 1 378.274 3.222 10 0 GGAEMN CC(C)(NC(=O)NCc1nc(-c2ccc(Br)cc2)n[nH]1)C1CC1 ZINC000534291663 567806762 /nfs/dbraw/zinc/80/67/62/567806762.db2.gz CWAFHTWVZXDJKT-UHFFFAOYSA-N 0 1 378.274 3.222 10 0 GGAEMN CC(C)C[C@H](N)c1noc([C@@H]2CCN(c3ccccc3Br)C2=O)n1 ZINC000574988986 567806919 /nfs/dbraw/zinc/80/69/19/567806919.db2.gz ZHVXBAAKXAKHQY-AAEUAGOBSA-N 0 1 393.285 3.399 10 0 GGAEMN CN1CCN(c2ccc(Br)cc2NC(=O)Cc2ccccc2)CC1 ZINC000534309509 567807666 /nfs/dbraw/zinc/80/76/66/567807666.db2.gz LVOBNQYSLDEVPF-UHFFFAOYSA-N 0 1 388.309 3.382 10 0 GGAEMN C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1 ZINC000444555363 567807932 /nfs/dbraw/zinc/80/79/32/567807932.db2.gz TXSYWAGQSAIMDJ-STQMWFEESA-N 0 1 389.323 3.064 10 0 GGAEMN FC(F)Oc1ccc(Br)c(CN2CC[C@@H](Cn3ccnn3)C2)c1 ZINC000668453303 567810172 /nfs/dbraw/zinc/81/01/72/567810172.db2.gz GZAFXMBCFZAEEE-LLVKDONJSA-N 0 1 387.228 3.164 10 0 GGAEMN Cc1cc(N2CC[C@H](N(C)Cc3ccc(Br)cc3C)C2=O)n(C)n1 ZINC000444705117 567810284 /nfs/dbraw/zinc/81/02/84/567810284.db2.gz MBSWTELZTBMSIK-INIZCTEOSA-N 0 1 391.313 3.037 10 0 GGAEMN CCn1c(CNC[C@H](O)CC(F)(F)F)nc2cc(Br)ccc21 ZINC000575053707 567810347 /nfs/dbraw/zinc/81/03/47/567810347.db2.gz VPOTUFQMWVLZRC-SNVBAGLBSA-N 0 1 380.208 3.222 10 0 GGAEMN Cc1cc(Br)ccc1CN(C)[C@@H](C)C(=O)NC(=O)NC(C)(C)C ZINC000444695637 567810532 /nfs/dbraw/zinc/81/05/32/567810532.db2.gz SPAVCPVTUUQEFP-LBPRGKRZSA-N 0 1 384.318 3.202 10 0 GGAEMN C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C[C@@H]1C(=O)[O-] ZINC000575045810 567810667 /nfs/dbraw/zinc/81/06/67/567810667.db2.gz SDYBMHSRGHVBJP-ONGXEEELSA-N 0 1 378.778 3.340 10 0 GGAEMN CCOCC[C@H](O)CN1CCC[C@@H]1c1ccc(I)cc1 ZINC000444647867 567810737 /nfs/dbraw/zinc/81/07/37/567810737.db2.gz GAFYVQGBTFMUBG-JKSUJKDBSA-N 0 1 389.277 3.216 10 0 GGAEMN C[C@]1(c2ccccc2)CC[C@H](N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)C1 ZINC000668469881 567810853 /nfs/dbraw/zinc/81/08/53/567810853.db2.gz MMTFVFYVRRZCNA-QAETUUGQSA-N 0 1 375.456 3.404 10 0 GGAEMN Cc1ccc(Cl)c(OC[C@H](O)CN2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)c1 ZINC000444727066 567811701 /nfs/dbraw/zinc/81/17/01/567811701.db2.gz PHNOFYWROKMVEN-XJKCOSOUSA-N 0 1 381.822 3.023 10 0 GGAEMN O[C@@H]([C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)C1)C(F)(F)F ZINC000444723604 567811857 /nfs/dbraw/zinc/81/18/57/567811857.db2.gz WNZODXROKUECNX-OTYXRUKQSA-N 0 1 392.219 3.461 10 0 GGAEMN CN(C)S(=O)(=O)[C@@H]1CCCN(Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000575095322 567812415 /nfs/dbraw/zinc/81/24/15/567812415.db2.gz HDYNOZLHCUYQOM-QGZVFWFLSA-N 0 1 382.526 3.410 10 0 GGAEMN Brc1ccc(N2CCN(Cc3ccnn3-c3ccncc3)CC2)cc1 ZINC000668534511 567813000 /nfs/dbraw/zinc/81/30/00/567813000.db2.gz RDEWASGSMOQVPO-UHFFFAOYSA-N 0 1 398.308 3.352 10 0 GGAEMN C[C@@]12COC[C@H]1C[N@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597587 567814144 /nfs/dbraw/zinc/81/41/44/567814144.db2.gz UPVSUAYCWXSKEI-QMTHXVAHSA-N 0 1 391.103 3.386 10 0 GGAEMN C[C@@]12COC[C@H]1C[N@@H+](Cc1cc(Br)c([O-])c(Br)c1)C2 ZINC000668597587 567814146 /nfs/dbraw/zinc/81/41/46/567814146.db2.gz UPVSUAYCWXSKEI-QMTHXVAHSA-N 0 1 391.103 3.386 10 0 GGAEMN CN(C(=O)c1cc(-c2cccc(Br)c2)no1)[C@H]1CCN(C2CC2)C1 ZINC000668598814 567814507 /nfs/dbraw/zinc/81/45/07/567814507.db2.gz NWZSFOGRFCVSCX-HNNXBMFYSA-N 0 1 390.281 3.413 10 0 GGAEMN CCc1c(NC(=O)[C@H]2[C@@H]3COC[C@@H]32)[nH]nc1-c1ccc(Br)cc1 ZINC000668608207 567814548 /nfs/dbraw/zinc/81/45/48/567814548.db2.gz NHVKUUTVHOKDNM-WDNDVIMCSA-N 0 1 376.254 3.233 10 0 GGAEMN CN(C(=O)c1cc(-c2cccc(Br)c2)no1)[C@@H]1CCN(C2CC2)C1 ZINC000668598815 567814846 /nfs/dbraw/zinc/81/48/46/567814846.db2.gz NWZSFOGRFCVSCX-OAHLLOKOSA-N 0 1 390.281 3.413 10 0 GGAEMN COC(=O)c1cnc2c(c1)c(C)nn2CN1CCC(Cc2ccccc2)CC1 ZINC000048275260 570229622 /nfs/dbraw/zinc/22/96/22/570229622.db2.gz IDXINCVPDXZEJF-UHFFFAOYSA-N 0 1 378.476 3.439 10 0 GGAEMN CSc1nccn1-c1cccc(C(=O)Nc2nc(-c3ccccn3)n[nH]2)c1 ZINC000048279032 570230856 /nfs/dbraw/zinc/23/08/56/570230856.db2.gz BQSJCVLIHDQFTD-UHFFFAOYSA-N 0 1 377.433 3.027 10 0 GGAEMN CC(C)(C)[C@H](NCN1C(=O)C(=O)N(Cc2ccccc2)C1=O)c1cccs1 ZINC000048340487 570239194 /nfs/dbraw/zinc/23/91/94/570239194.db2.gz NOUIOLDUGLVOOD-MRXNPFEDSA-N 0 1 385.489 3.373 10 0 GGAEMN O=C(CNC(=O)c1ccoc1)Nc1ccc2nc(-c3ccc(F)cc3)[nH]c2c1 ZINC000048355974 570244398 /nfs/dbraw/zinc/24/43/98/570244398.db2.gz PLVRZVVLIMGABX-UHFFFAOYSA-N 0 1 378.363 3.331 10 0 GGAEMN C[C@@H](CN1CCN(Cc2ccccc2)CC1)N(C(=O)C1CCC1)c1ccccn1 ZINC000020432300 570255532 /nfs/dbraw/zinc/25/55/32/570255532.db2.gz OJXXKKCOHLAMIY-FQEVSTJZSA-N 0 1 392.547 3.421 10 0 GGAEMN COc1ccc(CN2CCC[C@@H]2c2c(C)noc2C)cc1CN1CCOCC1 ZINC000021719840 570294957 /nfs/dbraw/zinc/29/49/57/570294957.db2.gz QWUCYHALXHIPDX-HXUWFJFHSA-N 0 1 385.508 3.469 10 0 GGAEMN Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N2CCC[C@H]([N@@H+](C)CC(=O)[O-])CC2)c1 ZINC000186667269 570311295 /nfs/dbraw/zinc/31/12/95/570311295.db2.gz OWDPMXRHQWQLDM-ROUUACIJSA-N 0 1 390.524 3.283 10 0 GGAEMN C[C@H](NC(=O)CN1CCN(Cc2cccc3ccccc32)CC1)c1ccco1 ZINC000022790554 570328291 /nfs/dbraw/zinc/32/82/91/570328291.db2.gz WQPYKCYRNPCGKZ-SFHVURJKSA-N 0 1 377.488 3.428 10 0 GGAEMN Cc1ccc(-n2nc(C(=O)NCCN3CCCCC3)nc2-c2ccoc2)cc1 ZINC000034911259 570340846 /nfs/dbraw/zinc/34/08/46/570340846.db2.gz FNSGNJFACMNJAX-UHFFFAOYSA-N 0 1 379.464 3.051 10 0 GGAEMN CCN1CCN(c2nc(-c3ccccc3)ncc2C(=O)NC2CCCCC2)CC1 ZINC000034922059 570345241 /nfs/dbraw/zinc/34/52/41/570345241.db2.gz XPIUOYRNKWPCRE-UHFFFAOYSA-N 0 1 393.535 3.348 10 0 GGAEMN CN(C)[C@H](CNC(=O)[C@H]1CCCN(C(=O)c2cccs2)C1)c1ccsc1 ZINC000023133438 570346073 /nfs/dbraw/zinc/34/60/73/570346073.db2.gz RUEHVLCYIGWBHF-GOEBONIOSA-N 0 1 391.562 3.081 10 0 GGAEMN CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)NC[C@H](c1ccsc1)N(C)C ZINC000023133353 570346311 /nfs/dbraw/zinc/34/63/11/570346311.db2.gz MYEOOYVRRJEWQP-MSOLQXFVSA-N 0 1 379.570 3.188 10 0 GGAEMN Cc1cc(C)c(S(=O)(=O)NCCc2nnc(-c3ccc(F)cc3)[nH]2)cc1C ZINC000035509273 570379938 /nfs/dbraw/zinc/37/99/38/570379938.db2.gz PXZSVTKDWCZKGK-UHFFFAOYSA-N 0 1 388.468 3.057 10 0 GGAEMN Cc1n[nH]c(C2CC2)c1C(=O)N[C@@H](c1cnc2ccccc2c1)C1CC(O)C1 ZINC000220731099 570390725 /nfs/dbraw/zinc/39/07/25/570390725.db2.gz LRARUWCXXJXIFX-MKJPBZQASA-N 0 1 376.460 3.386 10 0 GGAEMN COc1ccc(NS(=O)(=O)c2cc(-c3noc(C)n3)sc2C)cc1OC ZINC000035539005 570391130 /nfs/dbraw/zinc/39/11/30/570391130.db2.gz OHSCVSMKKXBWJN-UHFFFAOYSA-N 0 1 395.462 3.233 10 0 GGAEMN CC(=O)Nc1ccc(NS(=O)(=O)c2cc(-c3noc(C)n3)sc2C)cc1 ZINC000035539181 570391155 /nfs/dbraw/zinc/39/11/55/570391155.db2.gz RAVRFCOWSWDXPA-UHFFFAOYSA-N 0 1 392.462 3.174 10 0 GGAEMN CCc1nc(SCc2noc(CCC(=O)Nc3cccc(C)c3C)n2)n[nH]1 ZINC000033270854 570404227 /nfs/dbraw/zinc/40/42/27/570404227.db2.gz NFJDMDCGPODWOH-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN CCc1n[nH]c(SCc2noc(CCC(=O)Nc3cccc(C)c3C)n2)n1 ZINC000033270854 570404230 /nfs/dbraw/zinc/40/42/30/570404230.db2.gz NFJDMDCGPODWOH-UHFFFAOYSA-N 0 1 386.481 3.231 10 0 GGAEMN O=C([O-])C[C@@]1(NC(=O)OCc2ccccc2)CCC[N@@H+](Cc2ccccc2)C1 ZINC000584883463 570405559 /nfs/dbraw/zinc/40/55/59/570405559.db2.gz ONKPFYLIYUVUBJ-QFIPXVFZSA-N 0 1 382.460 3.422 10 0 GGAEMN O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CCC[C@@H]1c1nnc2ccccn21 ZINC000025078835 570405741 /nfs/dbraw/zinc/40/57/41/570405741.db2.gz OHDUIQZGRHTSCA-QGZVFWFLSA-N 0 1 376.395 3.236 10 0 GGAEMN CCN1CCN(c2ccccc2NC(=O)NCCCN(C)c2ccccc2)CC1 ZINC000069946249 570414599 /nfs/dbraw/zinc/41/45/99/570414599.db2.gz VNUNMFXTAIBSBL-UHFFFAOYSA-N 0 1 395.551 3.477 10 0 GGAEMN O=C(c1[nH]nc2ccccc21)N1CCC(C(=O)N2CCc3ccccc3C2)CC1 ZINC000026100556 570422306 /nfs/dbraw/zinc/42/23/06/570422306.db2.gz HYHVJIBHZKQUJC-UHFFFAOYSA-N 0 1 388.471 3.000 10 0 GGAEMN C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCCN(Cc2ccccc2)CC1 ZINC000026356289 570424789 /nfs/dbraw/zinc/42/47/89/570424789.db2.gz IBROCDRJQGQQIF-KRWDZBQOSA-N 0 1 399.922 3.193 10 0 GGAEMN O=C(CN1CCC[C@H]1Cc1cccc(F)c1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000239782528 570430734 /nfs/dbraw/zinc/43/07/34/570430734.db2.gz COYOGQYZBOFXBL-OFNKIYASSA-N 0 1 395.522 3.475 10 0 GGAEMN COc1cc2nc(CSc3nc(-c4ccccc4)n[nH]3)[nH]c(=O)c2cc1OC ZINC000006465839 570442877 /nfs/dbraw/zinc/44/28/77/570442877.db2.gz ZYVNNFAAIIWGAM-UHFFFAOYSA-N 0 1 395.444 3.018 10 0 GGAEMN Cc1ccc2nc(SCC(=O)NCC(=O)Nc3cccc(C)c3C)[nH]c2c1 ZINC000006506513 570460229 /nfs/dbraw/zinc/46/02/29/570460229.db2.gz LBKHVLDSCBZBSS-UHFFFAOYSA-N 0 1 382.489 3.335 10 0 GGAEMN Cc1ccc(Oc2ccc(NC(=O)CSc3nc(N)cc(N)n3)cc2)cc1 ZINC000006533385 570469834 /nfs/dbraw/zinc/46/98/34/570469834.db2.gz VEKHYBIEALYTTP-UHFFFAOYSA-N 0 1 381.461 3.473 10 0 GGAEMN Cc1[nH]c(S(=O)(=O)[C@H](C)c2nnc(CC(C)C)o2)nc1Cc1ccccc1 ZINC000072283209 570472644 /nfs/dbraw/zinc/47/26/44/570472644.db2.gz HUQCIBFWBGVJPC-CQSZACIVSA-N 0 1 388.493 3.425 10 0 GGAEMN CC(C)CNC(=O)[C@H]1Cc2ccccc2N2CCN(Cc3ccc(F)cc3)C[C@H]12 ZINC000035894112 570474440 /nfs/dbraw/zinc/47/44/40/570474440.db2.gz ATJSGHZSKHAGRG-JTHBVZDNSA-N 0 1 395.522 3.461 10 0 GGAEMN C[C@@H]1CN(Cc2ccc(F)cc2)CCN1CCC(=O)Nc1cc(N)ccc1F ZINC000252536531 570478000 /nfs/dbraw/zinc/47/80/00/570478000.db2.gz IUUCUDXQMKZJBD-OAHLLOKOSA-N 0 1 388.462 3.082 10 0 GGAEMN CC(C)c1ccc(C(=O)N2CCN(C(=O)c3[nH]nc4ccccc43)CC2)cc1 ZINC000030883335 570500730 /nfs/dbraw/zinc/50/07/30/570500730.db2.gz NNMLRCPQVKROAZ-UHFFFAOYSA-N 0 1 376.460 3.285 10 0 GGAEMN CCOC(=O)C1=C(CN2CCCC[C@@H]2C)N(C)C(=O)N[C@H]1c1cccc(C)c1 ZINC000035991681 570505782 /nfs/dbraw/zinc/50/57/82/570505782.db2.gz VGZPKLYCEBZRLV-JXFKEZNVSA-N 0 1 385.508 3.383 10 0 GGAEMN CCCCNC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2OC)cc1 ZINC000006623364 570506815 /nfs/dbraw/zinc/50/68/15/570506815.db2.gz RKQAYRPFEVATEV-UHFFFAOYSA-N 0 1 377.466 3.418 10 0 GGAEMN CCOC(=O)C1C(CNc2ccc(F)cc2F)=NC(=O)N[C@H]1c1ccccc1 ZINC000020283317 570518193 /nfs/dbraw/zinc/51/81/93/570518193.db2.gz QIHURDHVQXJMJX-SFHVURJKSA-N 0 1 387.386 3.248 10 0 GGAEMN Cc1nn(C)c2[nH]c(C(=O)N3CCC(c4c[nH]c5ccccc54)CC3)cc(=O)c12 ZINC000072306919 570524418 /nfs/dbraw/zinc/52/44/18/570524418.db2.gz DWOYXOMHIXKNJD-UHFFFAOYSA-N 0 1 389.459 3.071 10 0 GGAEMN COCCCN(Cc1ccc(F)cc1F)C[C@H](O)COc1ccc(OC)cc1 ZINC000036099713 570538183 /nfs/dbraw/zinc/53/81/83/570538183.db2.gz XGKSATLEYOUDLZ-SFHVURJKSA-N 0 1 395.446 3.252 10 0 GGAEMN COC[C@H](O)CN(Cc1ccccc1)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000036146542 570549615 /nfs/dbraw/zinc/54/96/15/570549615.db2.gz ZJVZTHUDMZHKBW-UXHICEINSA-N 0 1 388.895 3.343 10 0 GGAEMN Cc1cccc(CN(CCC(=O)N2CCNCC2)C(=O)c2cc(C)cc(C)c2)c1 ZINC000035422090 570553072 /nfs/dbraw/zinc/55/30/72/570553072.db2.gz DRFFAFOGLCVVIM-UHFFFAOYSA-N 0 1 393.531 3.076 10 0 GGAEMN CCC[C@@H](O)CN[C@@H](c1nc(-c2cc(OC)c(OC)c(OC)c2)no1)C(C)C ZINC000036160520 570555762 /nfs/dbraw/zinc/55/57/62/570555762.db2.gz KCWMBFSWRQOPTD-RHSMWYFYSA-N 0 1 393.484 3.210 10 0 GGAEMN COc1ccc([C@@H](CNC(=O)c2ccc3ncsc3c2)N(C)C)cc1OC ZINC000006788242 570593843 /nfs/dbraw/zinc/59/38/43/570593843.db2.gz RSHSDDNFMGZPNC-MRXNPFEDSA-N 0 1 385.489 3.346 10 0 GGAEMN CCOc1ccc2ccccc2c1[C@@H]1NC(=O)N=C(C)C1C(=O)OCCOC ZINC000005445557 570595322 /nfs/dbraw/zinc/59/53/22/570595322.db2.gz HTQFMMLIVOVMFD-LJQANCHMSA-N 0 1 384.432 3.056 10 0 GGAEMN CN(C)CCN(Cc1ccccc1)C(=O)N1CCC[S@@](=O)c2ccccc21 ZINC000225646959 570597830 /nfs/dbraw/zinc/59/78/30/570597830.db2.gz VUNNXHWOILWXMP-HHHXNRCGSA-N 0 1 385.533 3.188 10 0 GGAEMN CCNC(=O)[C@H]1Cc2ccccc2N2CC[N@@H+](Cc3ccc(Cl)cc3)C[C@@H]12 ZINC000169679225 570600578 /nfs/dbraw/zinc/60/05/78/570600578.db2.gz YDLDNZVHLUKFFQ-FPOVZHCZSA-N 0 1 383.923 3.339 10 0 GGAEMN CCNC(=O)[C@H]1Cc2ccccc2N2CCN(Cc3ccc(Cl)cc3)C[C@@H]12 ZINC000169679225 570600583 /nfs/dbraw/zinc/60/05/83/570600583.db2.gz YDLDNZVHLUKFFQ-FPOVZHCZSA-N 0 1 383.923 3.339 10 0 GGAEMN CC[C@@H](O)CN1CCN(c2nc(C)nc(C)c2Cc2cc(C)ccc2C)CC1 ZINC000036340301 570625484 /nfs/dbraw/zinc/62/54/84/570625484.db2.gz LMUFGNBIJOISGW-OAQYLSRUSA-N 0 1 382.552 3.194 10 0 GGAEMN Cc1ccc(C2=NN(C(=O)CN3CCCC3)[C@@H](c3ccc4c(c3)OCO4)C2)cc1 ZINC000036344431 570626596 /nfs/dbraw/zinc/62/65/96/570626596.db2.gz IKCHVKWFHGAZMZ-HXUWFJFHSA-N 0 1 391.471 3.497 10 0 GGAEMN CCN1CCN(CC(=O)N2N=C(c3ccccc3)C[C@@H]2c2ccc(F)cc2)CC1 ZINC000036345190 570627560 /nfs/dbraw/zinc/62/75/60/570627560.db2.gz BROBXPWCDBLISD-JOCHJYFZSA-N 0 1 394.494 3.141 10 0 GGAEMN COc1ccc([C@H]2CC(c3ccccc3OC)=NN2C(=O)CN2CCCC2)cc1 ZINC000036345152 570627742 /nfs/dbraw/zinc/62/77/42/570627742.db2.gz KXCNAMCUOADUSG-OAQYLSRUSA-N 0 1 393.487 3.477 10 0 GGAEMN Cc1ccc2onc(CNC(=O)Nc3ccccc3N3CCN(C)CC3)c2c1 ZINC000006866154 570655067 /nfs/dbraw/zinc/65/50/67/570655067.db2.gz VNCLLZXVFCGSHN-UHFFFAOYSA-N 0 1 379.464 3.210 10 0 GGAEMN COC(=O)c1cccn1C1CCN([C@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)CC1 ZINC000228774726 570663345 /nfs/dbraw/zinc/66/33/45/570663345.db2.gz SREHHTMXZGWCTC-SFNKJDCFSA-N 0 1 389.540 3.241 10 0 GGAEMN Cc1cc(F)ccc1-n1cc(C(=O)Nc2cccc3c2CN(C2CC2)C3)nn1 ZINC000240412914 570684985 /nfs/dbraw/zinc/68/49/85/570684985.db2.gz FORRJVLHBJPAHN-UHFFFAOYSA-N 0 1 377.423 3.445 10 0 GGAEMN Cc1cc(NC(=O)c2cc3c(cc2F)NC(=O)CC3)cc(N2CCN(C)CC2)c1 ZINC000241815980 570687573 /nfs/dbraw/zinc/68/75/73/570687573.db2.gz SEPXYXVRAUHLCG-UHFFFAOYSA-N 0 1 396.466 3.023 10 0 GGAEMN Cc1c(C(=O)N[C@@H](C)c2ccccc2)sc2ncnc(N3CCN(C)CC3)c12 ZINC000033048294 570699292 /nfs/dbraw/zinc/69/92/92/570699292.db2.gz KUQSULVRDIVAEZ-HNNXBMFYSA-N 0 1 395.532 3.243 10 0 GGAEMN CCc1cc(C(=O)N2CCC3(C[C@@H]3N(Cc3ccsc3)C(C)=O)CC2)n[nH]1 ZINC000275773321 570699863 /nfs/dbraw/zinc/69/98/63/570699863.db2.gz SILRBPWFZGUEMP-SFHVURJKSA-N 0 1 386.521 3.077 10 0 GGAEMN O=C(CN1CCC[C@@H]1c1cccs1)N1CCN(Cc2ccccc2F)CC1 ZINC000012983415 570736869 /nfs/dbraw/zinc/73/68/69/570736869.db2.gz PNJVPTZSYPVACN-LJQANCHMSA-N 0 1 387.524 3.369 10 0 GGAEMN O=C(NCc1cccc(COC2CCOCC2)c1)c1n[nH]nc1-c1ccccc1 ZINC000188991162 570738707 /nfs/dbraw/zinc/73/87/07/570738707.db2.gz PQPIQOZQUUNWKE-UHFFFAOYSA-N 0 1 392.459 3.097 10 0 GGAEMN COc1ccc(C)cc1NC(=O)NCCc1n[nH]c(Cc2ccc(C)cc2)n1 ZINC000033062588 570748538 /nfs/dbraw/zinc/74/85/38/570748538.db2.gz GWTPGAGVGQTCAA-UHFFFAOYSA-N 0 1 379.464 3.385 10 0 GGAEMN Cc1ccc(NC(=O)N2CCN(c3cc(C)nc(N4CCCC4)n3)CC2)cc1 ZINC000064800084 570752721 /nfs/dbraw/zinc/75/27/21/570752721.db2.gz HLQUTQMVFXMDLC-UHFFFAOYSA-N 0 1 380.496 3.048 10 0 GGAEMN CN1CCN(c2nnc(-c3nc(-c4ccc(F)cc4)no3)c3ccccc32)CC1 ZINC000065258327 570760183 /nfs/dbraw/zinc/76/01/83/570760183.db2.gz MTTYLMRQVMEOJW-UHFFFAOYSA-N 0 1 390.422 3.238 10 0 GGAEMN CCCN(Cc1ccc(OC)c(OC)c1)Cc1cc(=O)n2c(C)csc2n1 ZINC000033068965 570773831 /nfs/dbraw/zinc/77/38/31/570773831.db2.gz IXTJPFRDEUFTIT-UHFFFAOYSA-N 0 1 387.505 3.494 10 0 GGAEMN CCCCN1CCN(C(=O)c2cn3ccnc(-c4ccc(C)cc4)c3n2)CC1 ZINC000065274543 570776932 /nfs/dbraw/zinc/77/69/32/570776932.db2.gz WKGHHBMQAPWBSP-UHFFFAOYSA-N 0 1 377.492 3.263 10 0 GGAEMN COc1ccccc1-n1c(O)c2c(-c3ccccc3)nn(-c3ccccc3)c2c1O ZINC000100909360 570779902 /nfs/dbraw/zinc/77/99/02/570779902.db2.gz ARQPBWSEFOXJPJ-RBBKRZOGSA-N 0 1 397.434 3.478 10 0 GGAEMN Cc1ccc2nc(N3CCC(C(=O)NCc4ccc5c(c4)OCO5)CC3)[nH]c2c1 ZINC000033070746 570802381 /nfs/dbraw/zinc/80/23/81/570802381.db2.gz ULQRGCMHHBOAMJ-UHFFFAOYSA-N 0 1 392.459 3.133 10 0 GGAEMN COc1cccc(CNC(=O)[C@H]2CCCN(c3nc4ccc(C)cc4[nH]3)C2)c1 ZINC000033072056 570803680 /nfs/dbraw/zinc/80/36/80/570803680.db2.gz JZKYFETUXVYANF-KRWDZBQOSA-N 0 1 378.476 3.413 10 0 GGAEMN O=C([C@H](Sc1nc(-c2ccccc2)n[nH]1)c1ccccc1)N1CCOCC1 ZINC000007149366 570807266 /nfs/dbraw/zinc/80/72/66/570807266.db2.gz IPSCNSRQASRTQX-QGZVFWFLSA-N 0 1 380.473 3.164 10 0 GGAEMN C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CSc1nc(-c2cccs2)n[nH]1 ZINC000007161182 570808498 /nfs/dbraw/zinc/80/84/98/570808498.db2.gz YSMOJHZAWIZNJU-NSHDSACASA-N 0 1 399.501 3.389 10 0 GGAEMN O=C1COc2cc(S(=O)(=O)Nc3cccc4c3CCCC4)c(Cl)cc2N1 ZINC000032818941 570831590 /nfs/dbraw/zinc/83/15/90/570831590.db2.gz JZXPEVWCKWANCB-UHFFFAOYSA-N 0 1 392.864 3.351 10 0 GGAEMN O=C(Nn1cnc2scc(-c3cccs3)c2c1=O)c1[nH]nc2ccccc21 ZINC000012548117 570849707 /nfs/dbraw/zinc/84/97/07/570849707.db2.gz VGGKDZYKGMLSOT-UHFFFAOYSA-N 0 1 393.453 3.447 10 0 GGAEMN CCCN1CCN(Cc2nc(-c3ccc(N4CCCCCC4)nc3)no2)CC1 ZINC000065216236 570852962 /nfs/dbraw/zinc/85/29/62/570852962.db2.gz OKPMXKXSFUWFDS-UHFFFAOYSA-N 0 1 384.528 3.040 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2cccc3c2OCC[C@H]3O)ccc1Br ZINC000170597594 570855646 /nfs/dbraw/zinc/85/56/46/570855646.db2.gz JCFUPXQPQDKFMF-OAHLLOKOSA-N 0 1 398.278 3.374 10 0 GGAEMN CCn1c(CN2CCN(C)CC2)nc2cc(NC(=O)c3cccs3)ccc21 ZINC000022936127 570857957 /nfs/dbraw/zinc/85/79/57/570857957.db2.gz WEKHSEIXQSHVHV-UHFFFAOYSA-N 0 1 383.521 3.117 10 0 GGAEMN Cn1ncc2c1nc(C1CCCC1)nc2NC1CCN(Cc2cccnc2)CC1 ZINC000072149058 570872647 /nfs/dbraw/zinc/87/26/47/570872647.db2.gz CGDWBKZHLMAXAC-UHFFFAOYSA-N 0 1 391.523 3.492 10 0 GGAEMN Cc1ccc(CN(C)[C@H](C)C(=O)NC(=O)Nc2ccc3c(c2)OCCO3)c(C)c1 ZINC000015023938 570872734 /nfs/dbraw/zinc/87/27/34/570872734.db2.gz CDZHSAXPKLALOK-MRXNPFEDSA-N 0 1 397.475 3.243 10 0 GGAEMN Cc1[nH]c(C)c(S(=O)(=O)Nc2cccc(F)c2)c1-c1nc(C2CC2)no1 ZINC000096379837 570895974 /nfs/dbraw/zinc/89/59/74/570895974.db2.gz SQVGEANMURYPKW-UHFFFAOYSA-N 0 1 376.413 3.499 10 0 GGAEMN COC(=O)c1cccc(OC[C@H](O)C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000104887919 570907183 /nfs/dbraw/zinc/90/71/83/570907183.db2.gz OQRDPNFIUUEVEG-CZUORRHYSA-N 0 1 379.403 3.184 10 0 GGAEMN Cc1ccc2c(O)c(C(=O)Nc3cccc(N4C(=S)N=NC4C)c3)cnc2n1 ZINC000089657312 570908186 /nfs/dbraw/zinc/90/81/86/570908186.db2.gz LOYPQGNYSVKLMR-UHFFFAOYSA-N 0 1 392.444 3.074 10 0 GGAEMN Cc1ccc2c([n-]cc(C(=O)Nc3cccc(N4C(=S)N=NC4C)c3)c2=O)[nH+]1 ZINC000089657312 570908190 /nfs/dbraw/zinc/90/81/90/570908190.db2.gz LOYPQGNYSVKLMR-UHFFFAOYSA-N 0 1 392.444 3.074 10 0 GGAEMN CC(C)OC[C@@H](O)C[N@H+](Cc1ccccc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104983767 570911319 /nfs/dbraw/zinc/91/13/19/570911319.db2.gz ZQETZVZWMILIOS-FCHUYYIVSA-N 0 1 382.504 3.468 10 0 GGAEMN CC(C)OC[C@@H](O)CN(Cc1ccccc1)C[C@H]1CC(c2ccccc2)=NO1 ZINC000104983767 570911320 /nfs/dbraw/zinc/91/13/20/570911320.db2.gz ZQETZVZWMILIOS-FCHUYYIVSA-N 0 1 382.504 3.468 10 0 GGAEMN Cc1nnc(SCc2noc(CCC(=O)Nc3ccc(Cl)cc3F)n2)[nH]1 ZINC000033270787 570947034 /nfs/dbraw/zinc/94/70/34/570947034.db2.gz QYWHMGWEJOPEDJ-UHFFFAOYSA-N 0 1 396.835 3.152 10 0 GGAEMN Cc1n[nH]c(SCc2noc(CCC(=O)Nc3ccc(Cl)cc3F)n2)n1 ZINC000033270787 570947039 /nfs/dbraw/zinc/94/70/39/570947039.db2.gz QYWHMGWEJOPEDJ-UHFFFAOYSA-N 0 1 396.835 3.152 10 0 GGAEMN Cc1nnc(SCc2noc(CCC(=O)Nc3ccc(F)c(Cl)c3)n2)[nH]1 ZINC000033270786 570947131 /nfs/dbraw/zinc/94/71/31/570947131.db2.gz BGLGQTKUALJRRH-UHFFFAOYSA-N 0 1 396.835 3.152 10 0 GGAEMN Cc1n[nH]c(SCc2noc(CCC(=O)Nc3ccc(F)c(Cl)c3)n2)n1 ZINC000033270786 570947132 /nfs/dbraw/zinc/94/71/32/570947132.db2.gz BGLGQTKUALJRRH-UHFFFAOYSA-N 0 1 396.835 3.152 10 0 GGAEMN CCOC(=O)[C@@H]1C[C@@H]2CCCN2[C@]12c1ccccc1N(Cc1ccccc1)C2=O ZINC000020663850 570952493 /nfs/dbraw/zinc/95/24/93/570952493.db2.gz JSPQCGNBGKHZMJ-VAXXYWNWSA-N 0 1 390.483 3.476 10 0 GGAEMN CCOC(=O)c1ccc(OC[C@H](O)CN2CCc3sccc3[C@H]2C)cc1 ZINC000252444438 570957657 /nfs/dbraw/zinc/95/76/57/570957657.db2.gz BWAJFVFSQPXYEZ-GDBMZVCRSA-N 0 1 375.490 3.284 10 0 GGAEMN O=C(CN1CCC[C@@H]1CN1CCc2ccccc21)N[C@H]1CCOc2ccccc21 ZINC000106531111 570964466 /nfs/dbraw/zinc/96/44/66/570964466.db2.gz KILZVJZPCBVPPH-CTNGQTDRSA-N 0 1 391.515 3.154 10 0 GGAEMN CC(=O)Nc1ccc(NC(=O)Nc2cc(C)cc(N3CCN(C)CC3)c2)cc1 ZINC000252479879 570967239 /nfs/dbraw/zinc/96/72/39/570967239.db2.gz BOKPBQRAGKCVTO-UHFFFAOYSA-N 0 1 381.480 3.349 10 0 GGAEMN C[C@@H]1C[N@@H+](CCC(=O)[O-])CCN1C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000725240376 570973440 /nfs/dbraw/zinc/97/34/40/570973440.db2.gz ANQMMUCRPPQMFP-MRXNPFEDSA-N 0 1 394.471 3.416 10 0 GGAEMN Cc1[nH]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)NCc1ccc(F)c(C)c1 ZINC000012733383 570977309 /nfs/dbraw/zinc/97/73/09/570977309.db2.gz FGTLLVLKXNWOQV-UHFFFAOYSA-N 0 1 385.414 3.310 10 0 GGAEMN Cc1ccc(-n2ncc(N3CC[C@H]4CCN(C)C[C@H]43)c(Cl)c2=O)cc1Cl ZINC000108170927 570984857 /nfs/dbraw/zinc/98/48/57/570984857.db2.gz MGOCXZHGDPTDFU-CXAGYDPISA-N 0 1 393.318 3.378 10 0 GGAEMN CN(C)[C@@H](CNC(=O)Nc1cccc(-c2nnnn2C2CC2)c1)c1cccs1 ZINC000043946416 571048694 /nfs/dbraw/zinc/04/86/94/571048694.db2.gz PQCPZVXUSWBDPI-INIZCTEOSA-N 0 1 397.508 3.161 10 0 GGAEMN CC(=O)N1CCCSc2ccc(S(=O)(=O)Nc3ccc(C)cn3)cc21 ZINC000035504556 642506900 /nfs/dbraw/zinc/50/69/00/642506900.db2.gz PWYJIFQVWVDBNH-UHFFFAOYSA-N 0 1 377.491 3.040 10 0 GGAEMN CCOc1cc(CN[C@H](C)C(=O)NCC(F)(F)F)ccc1OCC(C)C ZINC000054177090 1406641773 /nfs/dbraw/zinc/64/17/73/1406641773.db2.gz CEZALDLKCVBBNX-CYBMUJFWSA-N 0 1 376.419 3.277 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1CNCc1ccc(N2CCO[C@H](C)C2)nc1 ZINC000054467324 1406744010 /nfs/dbraw/zinc/74/40/10/1406744010.db2.gz ICBOVMZTYPXCNM-QGZVFWFLSA-N 0 1 391.519 3.399 10 0 GGAEMN CC(C)(C)c1ccc(S(=O)(=O)c2cnc3cc4c(cc3c2O)OCO4)cc1 ZINC000002705820 1398317368 /nfs/dbraw/zinc/31/73/68/1398317368.db2.gz CBQBKNKETLNUGX-UHFFFAOYSA-N 0 1 385.441 3.387 10 0 GGAEMN C[N@@H+](CCCn1c(=O)c2cc3c(cc2[n-]c1=S)OCO3)Cc1ccccc1 ZINC000002974129 1398323248 /nfs/dbraw/zinc/32/32/48/1398323248.db2.gz JZFFZHMQWVFXEX-UHFFFAOYSA-N 0 1 383.473 3.310 10 0 GGAEMN COc1ccccc1NS(=O)(=O)c1ccc2oc(SCC(C)=O)nc2c1 ZINC000003288084 1398332222 /nfs/dbraw/zinc/33/22/22/1398332222.db2.gz ZBZDPUAUXOKZSC-UHFFFAOYSA-N 0 1 392.458 3.318 10 0 GGAEMN CCS(=O)(=O)c1ccc(O)c(NS(=O)(=O)c2ccc3ccccc3c2)c1 ZINC000003324450 1398335194 /nfs/dbraw/zinc/33/51/94/1398335194.db2.gz SMQJRNNUPMLCQY-UHFFFAOYSA-N 0 1 391.470 3.140 10 0 GGAEMN COc1ccc2nc(SCC(=O)N3c4ccccc4NC(=O)C3(C)C)[nH]c2c1 ZINC000004273876 1398387957 /nfs/dbraw/zinc/38/79/57/1398387957.db2.gz ZFWHSRFFUDAFTI-UHFFFAOYSA-N 0 1 396.472 3.428 10 0 GGAEMN COc1ccc(-c2cccc(NS(=O)(=O)c3cc(C)ccc3OC)c2)nn1 ZINC000005204172 1398420693 /nfs/dbraw/zinc/42/06/93/1398420693.db2.gz ICRFXROCDKTEHP-UHFFFAOYSA-N 0 1 385.445 3.270 10 0 GGAEMN CCCCOC(=O)c1ccc(NS(=O)(=O)c2ccc(C(=O)OC)cc2)cc1 ZINC000007323306 1398654210 /nfs/dbraw/zinc/65/42/10/1398654210.db2.gz MZEQJYMTIDWXQQ-UHFFFAOYSA-N 0 1 391.445 3.231 10 0 GGAEMN C[C@@H](NC(=O)CSc1nc(-c2ccccc2)n[nH]1)c1ccc2c(c1)OCCO2 ZINC000008574592 1398841188 /nfs/dbraw/zinc/84/11/88/1398841188.db2.gz QKGUFWOTJPHIGH-CYBMUJFWSA-N 0 1 396.472 3.212 10 0 GGAEMN CC(=O)NCCc1ccc(C(=O)CSc2nc(-c3ccccc3)n[nH]2)cc1 ZINC000008574607 1398841281 /nfs/dbraw/zinc/84/12/81/1398841281.db2.gz NRFIOZWIFXIDAZ-UHFFFAOYSA-N 0 1 380.473 3.125 10 0 GGAEMN CC(=O)Nc1cc(C(=O)CSc2nncn2-c2ccccc2F)ccc1O ZINC000008720761 1398845108 /nfs/dbraw/zinc/84/51/08/1398845108.db2.gz OCSNLRZKVRPCSK-UHFFFAOYSA-N 0 1 386.408 3.045 10 0 GGAEMN CC[C@H]1c2cccn2CCN1C(=O)c1cc(COc2cccc(OC)c2)n[nH]1 ZINC000012306237 1399037684 /nfs/dbraw/zinc/03/76/84/1399037684.db2.gz IBEYXDGARFZDSP-IBGZPJMESA-N 0 1 380.448 3.406 10 0 GGAEMN COc1ccc(C(=O)C2CCN(C[C@H](O)COc3ccc(C)cc3)CC2)cc1 ZINC000014327860 1399099515 /nfs/dbraw/zinc/09/95/15/1399099515.db2.gz RBXDUQONWMMCNT-FQEVSTJZSA-N 0 1 383.488 3.338 10 0 GGAEMN Cc1cccc(N2CC[NH+](CCn3c(=O)c4ccccc4[n-]c3=S)CC2)c1C ZINC000020154008 1399343539 /nfs/dbraw/zinc/34/35/39/1399343539.db2.gz QHGOJMUPTDVDNN-UHFFFAOYSA-N 0 1 394.544 3.124 10 0 GGAEMN CCOC(=O)C1=C(CNCc2cccs2)NC(=O)N[C@@H]1c1ccc(C)cc1 ZINC000020213814 1399344147 /nfs/dbraw/zinc/34/41/47/1399344147.db2.gz ZWCYCCFRPJUECU-GOSISDBHSA-N 0 1 385.489 3.017 10 0 GGAEMN CC(=O)N1CCc2cc([C@@H](O)CN3CCN(c4ccc(Cl)cc4)CC3)ccc21 ZINC000020287286 1399344594 /nfs/dbraw/zinc/34/45/94/1399344594.db2.gz OAXXLMBPRMHKCP-QFIPXVFZSA-N 0 1 399.922 3.105 10 0 GGAEMN CN1CCN(c2ccccc2NC(=O)c2noc3c2COc2ccccc2-3)CC1 ZINC000020484701 1399347813 /nfs/dbraw/zinc/34/78/13/1399347813.db2.gz DYKDJUOMMCAPDN-UHFFFAOYSA-N 0 1 390.443 3.238 10 0 GGAEMN COc1ccc(Cl)cc1NS(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2C ZINC000020487301 1399347911 /nfs/dbraw/zinc/34/79/11/1399347911.db2.gz HTNHYPXFQYCJRR-UHFFFAOYSA-N 0 1 394.880 3.403 10 0 GGAEMN Cc1cc(N2CCN(C)CC2)nc2ccc(NC(=O)NCc3ccco3)cc12 ZINC000020574558 1399349503 /nfs/dbraw/zinc/34/95/03/1399349503.db2.gz NQZLVTOPFPDRDP-UHFFFAOYSA-N 0 1 379.464 3.210 10 0 GGAEMN CN1CC=C(c2noc(CCC(=O)N3CC=C(c4ccccc4)CC3)n2)CC1 ZINC000020901795 1399356851 /nfs/dbraw/zinc/35/68/51/1399356851.db2.gz VUQZZNHFDCQZHG-UHFFFAOYSA-N 0 1 378.476 3.037 10 0 GGAEMN CC(C)Cc1nc(SCc2cc(=O)n3nc(-c4ccccc4)sc3n2)n[nH]1 ZINC000020982763 1399359417 /nfs/dbraw/zinc/35/94/17/1399359417.db2.gz MVRKPILTKZTLGD-UHFFFAOYSA-N 0 1 398.517 3.427 10 0 GGAEMN CC(C)Cc1n[nH]c(SCc2cc(=O)n3nc(-c4ccccc4)sc3n2)n1 ZINC000020982763 1399359422 /nfs/dbraw/zinc/35/94/22/1399359422.db2.gz MVRKPILTKZTLGD-UHFFFAOYSA-N 0 1 398.517 3.427 10 0 GGAEMN CCN1CCN(Cn2nc(-c3ccncc3)n(-c3ccccc3)c2=S)CC1 ZINC000021114372 1399364872 /nfs/dbraw/zinc/36/48/72/1399364872.db2.gz SHFKKYSSKLYHSH-UHFFFAOYSA-N 0 1 380.521 3.060 10 0 GGAEMN COC(=O)CCCNC(=O)c1ccc(-c2[nH]nc3c2COc2ccccc2-3)cc1 ZINC000023314318 1399548999 /nfs/dbraw/zinc/54/89/99/1399548999.db2.gz ONGYMHKWVJSJAA-UHFFFAOYSA-N 0 1 391.427 3.319 10 0 GGAEMN COc1cc(/C=C2\NC(=O)NC2=O)ccc1OCCCOc1ccc(C)cc1C ZINC000027552189 1400054302 /nfs/dbraw/zinc/05/43/02/1400054302.db2.gz CFHLJLBGBQNYQD-ATVHPVEESA-N 0 1 396.443 3.340 10 0 GGAEMN CCOc1cc(/C=C2\NC(=O)NC2=O)ccc1OCCCOc1ccccc1C ZINC000027552194 1400054490 /nfs/dbraw/zinc/05/44/90/1400054490.db2.gz YPPDZILPCIIUJE-LGMDPLHJSA-N 0 1 396.443 3.422 10 0 GGAEMN CS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccc(OC2CCCC2)cc1 ZINC000028260761 1400144415 /nfs/dbraw/zinc/14/44/15/1400144415.db2.gz WKMIBGSABPKPFJ-UHFFFAOYSA-N 0 1 395.502 3.212 10 0 GGAEMN COC(=O)Cc1ccc(NS(=O)(=O)c2ccccc2OC(F)(F)F)cc1 ZINC000029338612 1400284926 /nfs/dbraw/zinc/28/49/26/1400284926.db2.gz CZXILMANZOTZIF-UHFFFAOYSA-N 0 1 389.351 3.102 10 0 GGAEMN COc1ccc(CN2CCC(NC(=O)NCCc3ccccc3)CC2)cc1F ZINC000056335360 1407302452 /nfs/dbraw/zinc/30/24/52/1407302452.db2.gz CYJIPFSKIOQCAL-UHFFFAOYSA-N 0 1 385.483 3.341 10 0 GGAEMN Cc1[nH]ncc1CCCNC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000045539968 1404142780 /nfs/dbraw/zinc/14/27/80/1404142780.db2.gz CBCRYLLAVJSJFR-UHFFFAOYSA-N 0 1 395.429 3.201 10 0 GGAEMN CN1CCN(c2ccccc2NC(=O)NCc2cc(-c3ccccc3)no2)CC1 ZINC000047797039 1404950097 /nfs/dbraw/zinc/95/00/97/1404950097.db2.gz HLVOFKBAPDUSTN-UHFFFAOYSA-N 0 1 391.475 3.415 10 0 GGAEMN COc1cccc(-c2n[nH]cc2CNCc2cc(OC)c(OC)cc2OC)c1 ZINC000048683274 1405257315 /nfs/dbraw/zinc/25/73/15/1405257315.db2.gz CVERBSWWDMRUDZ-UHFFFAOYSA-N 0 1 383.448 3.401 10 0 GGAEMN C[C@H](NCc1cnn(-c2ccccc2)c1)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000048744908 1405278740 /nfs/dbraw/zinc/27/87/40/1405278740.db2.gz HHZXDRCFWWTGNN-KRWDZBQOSA-N 0 1 390.487 3.381 10 0 GGAEMN C[C@H](NCc1cccc2c1OCCCO2)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000048744924 1405278808 /nfs/dbraw/zinc/27/88/08/1405278808.db2.gz BQOKOPGPKHGRDE-INIZCTEOSA-N 0 1 396.487 3.356 10 0 GGAEMN C[C@@H](NC(=O)NC[C@@H](O)CN1CCc2ccccc2C1)c1ccc(Cl)s1 ZINC000049169832 1405348397 /nfs/dbraw/zinc/34/83/97/1405348397.db2.gz BNWBJMFBJJRSFK-CZUORRHYSA-N 0 1 393.940 3.181 10 0 GGAEMN COCCOc1ccc([C@H](C)NC(=O)Cc2[nH]nc3ccccc32)cc1OC ZINC000050583273 1405607651 /nfs/dbraw/zinc/60/76/51/1405607651.db2.gz HBEHKYSLBPGCRX-AWEZNQCLSA-N 0 1 383.448 3.017 10 0 GGAEMN O=C(C1CCN(Cc2cc(F)cc3c2OCOC3)CC1)N1CCCCCC1 ZINC000052586479 1406091072 /nfs/dbraw/zinc/09/10/72/1406091072.db2.gz ASJGMRGDNYQTFL-UHFFFAOYSA-N 0 1 376.472 3.307 10 0 GGAEMN CN(C)[C@@H](CNC(=O)NCc1cnn(Cc2ccccc2)c1)c1ccc(F)cc1 ZINC000056936395 1407478129 /nfs/dbraw/zinc/47/81/29/1407478129.db2.gz ADRKXUTUJZTMEZ-NRFANRHFSA-N 0 1 395.482 3.173 10 0 GGAEMN O=C(CSc1nc(-c2ccc(Br)cc2)n[nH]1)Nc1ccccn1 ZINC000059777408 1407925976 /nfs/dbraw/zinc/92/59/76/1407925976.db2.gz GWVXLOFZAHZOSU-UHFFFAOYSA-N 0 1 390.266 3.360 10 0 GGAEMN O=C(CNCc1cccc(C(F)(F)F)c1)N1CCN(c2ccccc2)CC1 ZINC000060557232 1408002154 /nfs/dbraw/zinc/00/21/54/1408002154.db2.gz CNQYSICOXRFLND-UHFFFAOYSA-N 0 1 377.410 3.144 10 0 GGAEMN Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)NNC(=O)NC(C)C)cc12 ZINC000063270119 1408327216 /nfs/dbraw/zinc/32/72/16/1408327216.db2.gz FDGLYXXKFPMXEC-UHFFFAOYSA-N 0 1 391.884 3.401 10 0 GGAEMN CCC(CC)[C@@H](CNC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1)N1CCOCC1 ZINC000063355665 1408343357 /nfs/dbraw/zinc/34/33/57/1408343357.db2.gz GKQRLYDNYIMNHK-XUVXKRRUSA-N 0 1 377.504 3.118 10 0 GGAEMN O[C@H](COc1cccc(C(F)(F)F)c1)CN1CCN(Cc2ccccc2)CC1 ZINC000063481825 1408361514 /nfs/dbraw/zinc/36/15/14/1408361514.db2.gz FAFMXYGKCTZIAJ-IBGZPJMESA-N 0 1 394.437 3.263 10 0 GGAEMN COc1cccc(CNC[C@H](O)COc2c(C)cccc2C)c1OC(F)F ZINC000063525752 1408367568 /nfs/dbraw/zinc/36/75/68/1408367568.db2.gz ABSAHUBYYJWLMX-INIZCTEOSA-N 0 1 381.419 3.443 10 0 GGAEMN CCOc1cc(CNCC(=O)NCc2ccc(OC)cc2)cc(Cl)c1OC ZINC000064411119 1408549831 /nfs/dbraw/zinc/54/98/31/1408549831.db2.gz CKZNHDRRHGNQMR-UHFFFAOYSA-N 0 1 392.883 3.162 10 0 GGAEMN CCCCNC(=O)[C@@H]1CCCN([C@@H](C)C(=O)N2c3ccccc3CC[C@H]2C)C1 ZINC000065253395 1408657422 /nfs/dbraw/zinc/65/74/22/1408657422.db2.gz FYFCPFNGUPFGMI-WSTZPKSXSA-N 0 1 385.552 3.371 10 0 GGAEMN CNC(=O)c1ccc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000066861475 1408934886 /nfs/dbraw/zinc/93/48/86/1408934886.db2.gz FQIYVUKVGCBRML-UHFFFAOYSA-N 0 1 377.410 3.387 10 0 GGAEMN CN1CCN(c2ncccc2CNCc2csc(-c3ccsc3)n2)CC1 ZINC000066876662 1408939691 /nfs/dbraw/zinc/93/96/91/1408939691.db2.gz CZDKFLZFLGDVHK-UHFFFAOYSA-N 0 1 385.562 3.308 10 0 GGAEMN CN1CCN(c2ncccc2CNCc2csc(-c3ccc(F)cc3)n2)CC1 ZINC000066876806 1408939715 /nfs/dbraw/zinc/93/97/15/1408939715.db2.gz ICMYLGJXVIWFGH-UHFFFAOYSA-N 0 1 397.523 3.386 10 0 GGAEMN C[C@@H](NCc1nc2ccccc2n1C)c1ccc(OCC(=O)NC2CC2)cc1 ZINC000066973235 1408969666 /nfs/dbraw/zinc/96/96/66/1408969666.db2.gz HCSCTAZKXURFAD-OAHLLOKOSA-N 0 1 378.476 3.082 10 0 GGAEMN CCOc1ccc(CN[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC ZINC000067010783 1408979666 /nfs/dbraw/zinc/97/96/66/1408979666.db2.gz HPERAOSFKIYPAZ-HNNXBMFYSA-N 0 1 392.521 3.195 10 0 GGAEMN CNS(=O)(=O)c1cccc([C@H](C)NCc2cc(Cl)c(OC)c(OC)c2)c1 ZINC000067010533 1408979873 /nfs/dbraw/zinc/97/98/73/1408979873.db2.gz BWQURTSDNKNFJZ-LBPRGKRZSA-N 0 1 398.912 3.116 10 0 GGAEMN CC[C@@H](NCc1ccccc1OCC(=O)N(C)C)c1ccc2c(c1)OCCO2 ZINC000067220371 1409045992 /nfs/dbraw/zinc/04/59/92/1409045992.db2.gz DYRDLFHDZNUDQY-GOSISDBHSA-N 0 1 384.476 3.166 10 0 GGAEMN COc1cc([C@@H](C)NCc2cn(-c3ccccc3)nc2C)ccc1OCCO ZINC000067449471 1409121970 /nfs/dbraw/zinc/12/19/70/1409121970.db2.gz DOQGJBCGWDHEOB-MRXNPFEDSA-N 0 1 381.476 3.411 10 0 GGAEMN CCCOc1cc(CNCc2ccc(N3CCO[C@H](C)C3)nc2)ccc1OC ZINC000067669251 1409202965 /nfs/dbraw/zinc/20/29/65/1409202965.db2.gz HBKHXXORGZUCKM-QGZVFWFLSA-N 0 1 385.508 3.394 10 0 GGAEMN CCN(CC)[C@@H](CNC(=O)NCc1ccc(NC(=O)OC)cc1)c1ccco1 ZINC000067708974 1409211674 /nfs/dbraw/zinc/21/16/74/1409211674.db2.gz AKDKPITUTHRLLZ-KRWDZBQOSA-N 0 1 388.468 3.340 10 0 GGAEMN CC[C@H](C)NC(=O)[C@H](C)NCc1cc(Br)c2c(c1)OCCCO2 ZINC000068366642 1409381568 /nfs/dbraw/zinc/38/15/68/1409381568.db2.gz FHVSUQJOVIAHAY-RYUDHWBXSA-N 0 1 385.302 3.003 10 0 GGAEMN COc1ccc(COC[C@H](O)CN2CCN(c3cccc(Cl)c3)CC2)cc1 ZINC000068845935 1409507228 /nfs/dbraw/zinc/50/72/28/1409507228.db2.gz DPUMUZGHBIAAAW-HXUWFJFHSA-N 0 1 390.911 3.048 10 0 GGAEMN CC[C@H](C)NC(=O)[C@@H](C)NCc1ccc(OC(F)F)c(Br)c1 ZINC000092564392 1410173365 /nfs/dbraw/zinc/17/33/65/1410173365.db2.gz CTSPRALOYMFPOE-VHSXEESVSA-N 0 1 379.245 3.443 10 0 GGAEMN COc1cc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc(OC)c1OC ZINC000092644809 1410182185 /nfs/dbraw/zinc/18/21/85/1410182185.db2.gz JTLRRJAIDQMSFF-UHFFFAOYSA-N 0 1 390.524 3.373 10 0 GGAEMN Cc1ccnc(-n2c(=O)c3ccccc3nc2SCc2n[nH]c(C3CC3)n2)c1 ZINC000095457234 1410311855 /nfs/dbraw/zinc/31/18/55/1410311855.db2.gz COBUDGHGZJYVAO-UHFFFAOYSA-N 0 1 390.472 3.377 10 0 GGAEMN O=c1oc2cccnc2n1CCN1CCC[C@@H](c2nnc(C3CCCCC3)[nH]2)C1 ZINC000095993100 1410318552 /nfs/dbraw/zinc/31/85/52/1410318552.db2.gz ZUCIVNQAMULGHT-MRXNPFEDSA-N 0 1 396.495 3.035 10 0 GGAEMN COc1ccc(C(=O)Nc2c[nH]nc2[C@@H]2CCCN(Cc3cc(C)no3)C2)cc1 ZINC000096000180 1410320609 /nfs/dbraw/zinc/32/06/09/1410320609.db2.gz RNOYLRCWMSTFMG-MRXNPFEDSA-N 0 1 395.463 3.347 10 0 GGAEMN COc1ccc(C(=O)Nc2c[nH]nc2[C@H]2CCCN(Cc3cccnc3)C2)cc1 ZINC000096000194 1410320669 /nfs/dbraw/zinc/32/06/69/1410320669.db2.gz QMPOMJMRPWJUNG-SFHVURJKSA-N 0 1 391.475 3.445 10 0 GGAEMN COCC(=O)Nc1c[nH]nc1[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1 ZINC000096000127 1410320824 /nfs/dbraw/zinc/32/08/24/1410320824.db2.gz OBLWXEBIGASVER-AWEZNQCLSA-N 0 1 396.413 3.393 10 0 GGAEMN O=C(Nc1ccccc1)N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC000096239946 1410325977 /nfs/dbraw/zinc/32/59/77/1410325977.db2.gz GBZILMKRCATYNV-UHFFFAOYSA-N 0 1 380.492 3.228 10 0 GGAEMN Cc1ccc(C)c(NC(=O)C2CCN(c3nc4[nH]cnc(=O)c4s3)CC2)c1 ZINC000096331549 1410327558 /nfs/dbraw/zinc/32/75/58/1410327558.db2.gz YDWJMKPAXZSGMK-UHFFFAOYSA-N 0 1 383.477 3.264 10 0 GGAEMN Cc1ccc2nc(SCC(=O)NCc3ccc4c(c3)OCCCO4)[nH]c2c1 ZINC000096325036 1410327644 /nfs/dbraw/zinc/32/76/44/1410327644.db2.gz FWLYTBVPQIQLHH-UHFFFAOYSA-N 0 1 383.473 3.441 10 0 GGAEMN Cc1ccc(NC(=O)C2CCN(c3nc4[nH]cnc(=O)c4s3)CC2)c(C)c1 ZINC000096331557 1410327669 /nfs/dbraw/zinc/32/76/69/1410327669.db2.gz PMALMFJBADWVCR-UHFFFAOYSA-N 0 1 383.477 3.264 10 0 GGAEMN Cc1ccc(NC(=O)C2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)CC2)cc1 ZINC000096324619 1410327757 /nfs/dbraw/zinc/32/77/57/1410327757.db2.gz BQDKVOJIIYRDAN-UHFFFAOYSA-N 0 1 389.459 3.271 10 0 GGAEMN CCc1ccc(NC(=O)C2CCN(c3nc4[nH]cnc(=O)c4s3)CC2)cc1 ZINC000096331569 1410327773 /nfs/dbraw/zinc/32/77/73/1410327773.db2.gz ADYBAMHURJGIBA-UHFFFAOYSA-N 0 1 383.477 3.209 10 0 GGAEMN COc1cccc(NS(=O)(=O)c2c(C)[nH]c(-c3nnc(C4CC4)o3)c2C)c1 ZINC000096379464 1410329586 /nfs/dbraw/zinc/32/95/86/1410329586.db2.gz QEFNIKHTRHJFLW-UHFFFAOYSA-N 0 1 388.449 3.368 10 0 GGAEMN CCCN1CCN(C(=O)Cc2c3[nH]cccc-3c(=O)n2-c2cccc(C)c2)CC1 ZINC000096387062 1410330513 /nfs/dbraw/zinc/33/05/13/1410330513.db2.gz KCUASANRYLNSTM-HXUWFJFHSA-N 0 1 392.503 3.036 10 0 GGAEMN CN(C)[C@@H](CNC(=O)/C=C\c1ccc(N2CCCC2=O)cc1)c1cccc(F)c1 ZINC000096940648 1410338569 /nfs/dbraw/zinc/33/85/69/1410338569.db2.gz LCLIKOPIBQIIIQ-DGDFFNOKSA-N 0 1 395.478 3.385 10 0 GGAEMN COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CN[C@H](C)c1ccc(Cl)cc1 ZINC000096955251 1410340243 /nfs/dbraw/zinc/34/02/43/1410340243.db2.gz AAKXJQNPYGAJLO-KUHUBIRLSA-N 0 1 386.879 3.117 10 0 GGAEMN O=S(=O)(C1CCOCC1)N1CCN(Cc2ccccc2)C2(CCCCC2)C1 ZINC000097013697 1410346121 /nfs/dbraw/zinc/34/61/21/1410346121.db2.gz BQPZFEGIDFVYQH-UHFFFAOYSA-N 0 1 392.565 3.016 10 0 GGAEMN CCN1CCN(C(=O)/C=C\c2cn(-c3ccccc3)nc2-c2cccnc2)CC1 ZINC000097676020 1410387456 /nfs/dbraw/zinc/38/74/56/1410387456.db2.gz FWPKJXXSVGGXOR-KHPPLWFESA-N 0 1 387.487 3.112 10 0 GGAEMN NC(=O)C1CCN(c2ncccc2CNCc2ccc(C(F)(F)F)cc2)CC1 ZINC000105430313 1411065826 /nfs/dbraw/zinc/06/58/26/1411065826.db2.gz DFPBKDDWUIEXFZ-UHFFFAOYSA-N 0 1 392.425 3.092 10 0 GGAEMN NC(=O)C1CCN(c2ncccc2CNCc2csc3ccccc23)CC1 ZINC000105430274 1411066188 /nfs/dbraw/zinc/06/61/88/1411066188.db2.gz HASJNEAKMBMTLM-UHFFFAOYSA-N 0 1 380.517 3.288 10 0 GGAEMN CCN1CCN([C@H]2CCN(C(=O)c3sc4cccc(F)c4c3C)C2)CC1 ZINC000106804152 1411304460 /nfs/dbraw/zinc/30/44/60/1411304460.db2.gz KEHFRQNXYTZTLZ-HNNXBMFYSA-N 0 1 375.513 3.201 10 0 GGAEMN O=S(=O)(Nc1ccc(F)cc1OCCO)c1ccc(C(F)(F)F)cc1 ZINC000109010554 1411660385 /nfs/dbraw/zinc/66/03/85/1411660385.db2.gz QJUVBFPXLMAUBT-UHFFFAOYSA-N 0 1 379.331 3.016 10 0 GGAEMN O=C(Nc1cccc(F)c1)N1CCC2(CC1)COCCN(Cc1ccncc1)C2 ZINC000109208336 1411713680 /nfs/dbraw/zinc/71/36/80/1411713680.db2.gz QRMGFVUSPBMYJN-UHFFFAOYSA-N 0 1 398.482 3.367 10 0 GGAEMN COc1ccc(-c2n[nH]c(CNC(=O)NC3CC(c4ccccc4)C3)n2)cc1 ZINC000111854781 1412039407 /nfs/dbraw/zinc/03/94/07/1412039407.db2.gz AJINHHJRVBKYFW-UHFFFAOYSA-N 0 1 377.448 3.226 10 0 GGAEMN COc1ccc(-c2nc(CNC(=O)NC3CC(c4ccccc4)C3)n[nH]2)cc1 ZINC000111854781 1412039415 /nfs/dbraw/zinc/03/94/15/1412039415.db2.gz AJINHHJRVBKYFW-UHFFFAOYSA-N 0 1 377.448 3.226 10 0 GGAEMN C[C@@H](N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)C(=O)Nc1ncccn1 ZINC000112527334 1412163175 /nfs/dbraw/zinc/16/31/75/1412163175.db2.gz FRHUWFYMFQZZMH-JKSUJKDBSA-N 0 1 389.459 3.407 10 0 GGAEMN COc1ccc(OC(F)F)c(CNCc2ccc(N3CCO[C@@H](C)C3)nc2)c1 ZINC000112709722 1412201006 /nfs/dbraw/zinc/20/10/06/1412201006.db2.gz GMMKWNXBLTZCJY-AWEZNQCLSA-N 0 1 393.434 3.207 10 0 GGAEMN CN1CCN(c2ncccc2CNCc2c(Cl)cccc2OC(F)F)CC1 ZINC000112709958 1412201036 /nfs/dbraw/zinc/20/10/36/1412201036.db2.gz GBUZZTWCGDGOBR-UHFFFAOYSA-N 0 1 396.869 3.378 10 0 GGAEMN Cc1[nH]c(S(=O)(=O)Cc2cc3ccccc3[nH]c2=O)nc1Cc1ccccc1 ZINC000113636555 1412325020 /nfs/dbraw/zinc/32/50/20/1412325020.db2.gz GIUWFLKNPAELIQ-UHFFFAOYSA-N 0 1 393.468 3.124 10 0 GGAEMN Cc1[nH]c(S(=O)(=O)CC(=O)Nc2ccc(C)cc2)nc1Cc1ccccc1 ZINC000113636927 1412325137 /nfs/dbraw/zinc/32/51/37/1412325137.db2.gz CLVJSIVJXNUGDZ-UHFFFAOYSA-N 0 1 383.473 3.030 10 0 GGAEMN CNC(=O)c1cccc(CN2CCCC[C@H]2CNC(=O)Nc2ccccc2)c1 ZINC000113929476 1412353794 /nfs/dbraw/zinc/35/37/94/1412353794.db2.gz HHABWCJCRZQGAQ-FQEVSTJZSA-N 0 1 380.492 3.222 10 0 GGAEMN COc1ccc(CNC[C@H](O)COc2ccc(F)c(F)c2)c(OC(F)F)c1 ZINC000114766264 1412520980 /nfs/dbraw/zinc/52/09/80/1412520980.db2.gz AMPIHHGUGDBPIX-LBPRGKRZSA-N 0 1 389.345 3.104 10 0 GGAEMN COc1ccc(CNC[C@@H](O)COc2ccc(F)c(F)c2)c(OC(F)F)c1 ZINC000114766266 1412521061 /nfs/dbraw/zinc/52/10/61/1412521061.db2.gz AMPIHHGUGDBPIX-GFCCVEGCSA-N 0 1 389.345 3.104 10 0 GGAEMN COc1cccc(CS(=O)(=O)N(C)C2CCN(Cc3ccccc3)CC2)c1 ZINC000117923259 1413089074 /nfs/dbraw/zinc/08/90/74/1413089074.db2.gz QRDANFRQWDNCOR-UHFFFAOYSA-N 0 1 388.533 3.121 10 0 GGAEMN CC(C)(C)OC(=O)N1CCc2cccc(CN3CCC[C@@H](n4cncn4)C3)c21 ZINC000119509085 1413470241 /nfs/dbraw/zinc/47/02/41/1413470241.db2.gz HJZRPZRXZMPIQX-GOSISDBHSA-N 0 1 383.496 3.413 10 0 GGAEMN C[C@@H](CS(=O)(=O)c1ccccc1)NCc1ccc(N2CCCCC2=O)cc1 ZINC000119993206 1413645354 /nfs/dbraw/zinc/64/53/54/1413645354.db2.gz REOBPFFGGLBYLR-KRWDZBQOSA-N 0 1 386.517 3.156 10 0 GGAEMN Cc1nn(-c2ccccc2)cc1CNc1cccc(CN2CCC[C@@H]2C(N)=O)c1 ZINC000120110478 1413691852 /nfs/dbraw/zinc/69/18/52/1413691852.db2.gz BHCIDRNUXUCKHV-JOCHJYFZSA-N 0 1 389.503 3.243 10 0 GGAEMN NC(=O)[C@@H]1CCCN1Cc1cccc(NCc2cc3ccccc3[nH]c2=O)c1 ZINC000120136819 1413702846 /nfs/dbraw/zinc/70/28/46/1413702846.db2.gz FLFXEIROOVVFMD-FQEVSTJZSA-N 0 1 376.460 3.002 10 0 GGAEMN NC(=O)[C@H]1CCCN1Cc1cccc(NCc2ccc(F)c3cccnc23)c1 ZINC000120144616 1413704817 /nfs/dbraw/zinc/70/48/17/1413704817.db2.gz CNJNLFGJYFGRBW-HXUWFJFHSA-N 0 1 378.451 3.436 10 0 GGAEMN C[C@@H](Cc1ccc(Cl)cc1)N(C)CC(=O)NCCCN1CCCCCC1=O ZINC000121009371 1413975234 /nfs/dbraw/zinc/97/52/34/1413975234.db2.gz FTDSKYIPJYHAQA-KRWDZBQOSA-N 0 1 393.959 3.112 10 0 GGAEMN COc1ccc(CN2CCC(C(=O)N3CCCCCC3)CC2)c(OC)c1OC ZINC000121032209 1413983230 /nfs/dbraw/zinc/98/32/30/1413983230.db2.gz AQKFKEXYWPVKSY-UHFFFAOYSA-N 0 1 390.524 3.327 10 0 GGAEMN C[C@@H](NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccc(Cl)cc1 ZINC000121196730 1414040807 /nfs/dbraw/zinc/04/08/07/1414040807.db2.gz FVYPROOONUASFC-LLVKDONJSA-N 0 1 391.262 3.258 10 0 GGAEMN C[C@H](NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl)c1ccc(Cl)cc1 ZINC000121196591 1414040938 /nfs/dbraw/zinc/04/09/38/1414040938.db2.gz FVYPROOONUASFC-NSHDSACASA-N 0 1 391.262 3.258 10 0 GGAEMN C[C@@H](c1ccncc1)N1CCC(NC(=O)Nc2ccc3c(c2)N(C)CCO3)CC1 ZINC000121243934 1414056344 /nfs/dbraw/zinc/05/63/44/1414056344.db2.gz BBIFHYLGIDAFOW-INIZCTEOSA-N 0 1 395.507 3.257 10 0 GGAEMN C[C@@H]1CN(Cc2cccc(CNCc3c(Cl)nc4ccccn43)c2)CCO1 ZINC000121687489 1414223938 /nfs/dbraw/zinc/22/39/38/1414223938.db2.gz GICCPFSAZFVREG-MRXNPFEDSA-N 0 1 384.911 3.498 10 0 GGAEMN COc1ccccc1S(=O)(=O)Nc1ccccc1N1C[C@@H](C)O[C@@H](C)C1 ZINC000121886548 1414291416 /nfs/dbraw/zinc/29/14/16/1414291416.db2.gz CKBJJGHPLKVRSN-GASCZTMLSA-N 0 1 376.478 3.110 10 0 GGAEMN COCCCOC1CCN([C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000122535839 1414492787 /nfs/dbraw/zinc/49/27/87/1414492787.db2.gz AEYPXMFLIKQHMG-CVEARBPZSA-N 0 1 382.932 3.423 10 0 GGAEMN COCCCOC1CCN([C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000122535447 1414492862 /nfs/dbraw/zinc/49/28/62/1414492862.db2.gz AEYPXMFLIKQHMG-HZPDHXFCSA-N 0 1 382.932 3.423 10 0 GGAEMN CCOc1ccc(NS(=O)(=O)c2ccc(F)cc2Br)cn1 ZINC000123569161 1414777949 /nfs/dbraw/zinc/77/79/49/1414777949.db2.gz OLXPJOITXDSTLB-UHFFFAOYSA-N 0 1 375.219 3.183 10 0 GGAEMN C[C@@H](C(=O)N1c2ccccc2CC[C@@H]1C)N1CCC(CC(=O)N2CCCC2)CC1 ZINC000124181296 1414901843 /nfs/dbraw/zinc/90/18/43/1414901843.db2.gz FXYMRRDDWRONST-OALUTQOASA-N 0 1 397.563 3.467 10 0 GGAEMN COc1cccc(CN(C)C(=O)CN2CCC(c3ccc(O)cc3)CC2)c1OC ZINC000124329914 1414940875 /nfs/dbraw/zinc/94/08/75/1414940875.db2.gz HUFFBHJLNRIMOY-UHFFFAOYSA-N 0 1 398.503 3.247 10 0 GGAEMN CNS(=O)(=O)c1ccc([C@H](C)NCc2cnc(-c3ccc(C)o3)s2)cc1 ZINC000126070721 1415350390 /nfs/dbraw/zinc/35/03/90/1415350390.db2.gz CNNIQTWIFLAITD-ZDUSSCGKSA-N 0 1 391.518 3.470 10 0 GGAEMN CC(C)(C)c1nn(-c2ccccc2)cc1CN1CCC(N2CCNC2=O)CC1 ZINC000127602874 1415817567 /nfs/dbraw/zinc/81/75/67/1415817567.db2.gz AQGHEPBPDQGRMM-UHFFFAOYSA-N 0 1 381.524 3.159 10 0 GGAEMN Cc1cc(CNCc2cccnc2N2CCOCC2)cc(C)c1OC(F)F ZINC000128912572 1416100294 /nfs/dbraw/zinc/10/02/94/1416100294.db2.gz BBKPZCGNBYPXEC-UHFFFAOYSA-N 0 1 377.435 3.426 10 0 GGAEMN COc1cc(CNc2ccc(CCN3CCOCC3)cc2)cc(OC)c1OC ZINC000129230193 1416175683 /nfs/dbraw/zinc/17/56/83/1416175683.db2.gz AWOGGCCAPTXZBH-UHFFFAOYSA-N 0 1 386.492 3.199 10 0 GGAEMN C[C@H]1CCN(CC(=O)NCc2ccc(F)cc2C(F)(F)F)C[C@@H]1n1ccnc1 ZINC000129442695 1416210577 /nfs/dbraw/zinc/21/05/77/1416210577.db2.gz BDOHURDCXPATKE-GUYCJALGSA-N 0 1 398.404 3.240 10 0 GGAEMN Cc1cccc2nc(CCC(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)[nH]c21 ZINC000129887445 1416280032 /nfs/dbraw/zinc/28/00/32/1416280032.db2.gz SYJGEWGELRNGBF-LJQANCHMSA-N 0 1 390.487 3.111 10 0 GGAEMN CN(C)S(=O)(=O)c1ccccc1CNCc1cccc(-c2cccnc2)c1 ZINC000130522524 1416393299 /nfs/dbraw/zinc/39/32/99/1416393299.db2.gz CYUHEQDLXXHUFB-UHFFFAOYSA-N 0 1 381.501 3.289 10 0 GGAEMN Cc1ccccc1[C@@H](C)NC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO ZINC000130855912 1416468873 /nfs/dbraw/zinc/46/88/73/1416468873.db2.gz AFLJNAYPGXJDHB-SYYKKAFVSA-N 0 1 381.520 3.238 10 0 GGAEMN CCOc1ccc(CN[C@H](CC)CS(=O)(=O)c2ccccc2)cc1OC ZINC000130960115 1416487869 /nfs/dbraw/zinc/48/78/69/1416487869.db2.gz ICOYVYUDMRTARF-QGZVFWFLSA-N 0 1 377.506 3.436 10 0 GGAEMN CC(=O)N1CCc2cc(NS(=O)(=O)c3cnc(Cl)c(Cl)c3)ccc21 ZINC000132902987 1416829197 /nfs/dbraw/zinc/82/91/97/1416829197.db2.gz KUYUGAIZWXVPNR-UHFFFAOYSA-N 0 1 386.260 3.098 10 0 GGAEMN CCOC(=O)COc1cccc(NC(=O)[C@H]2CCCN2Cc2ccccc2)c1 ZINC000138519201 1417422418 /nfs/dbraw/zinc/42/24/18/1417422418.db2.gz CRFSBGHBICETHU-HXUWFJFHSA-N 0 1 382.460 3.232 10 0 GGAEMN CC(C)NCc1nc(-c2ncc(Br)cc2Br)no1 ZINC000139955456 1417482561 /nfs/dbraw/zinc/48/25/61/1417482561.db2.gz HGVBANCMQYUPOW-UHFFFAOYSA-N 0 1 376.052 3.155 10 0 GGAEMN CN(CC(=O)Nc1ccccc1C(=O)NC1CCCC1)C1Cc2ccccc2C1 ZINC000141241205 1417529742 /nfs/dbraw/zinc/52/97/42/1417529742.db2.gz AGOWKNHCOOHKQA-UHFFFAOYSA-N 0 1 391.515 3.397 10 0 GGAEMN CS(=O)(=O)c1ccc(CNCc2cnn(Cc3ccccc3Cl)c2)cc1 ZINC000145904187 1417703904 /nfs/dbraw/zinc/70/39/04/1417703904.db2.gz DSIIHDPSLDZWEM-UHFFFAOYSA-N 0 1 389.908 3.278 10 0 GGAEMN Cc1ccc(CNCc2ccc(-n3cncn3)c(C)c2)c(O[C@@H]2CCOC2)c1 ZINC000150758918 1417801233 /nfs/dbraw/zinc/80/12/33/1417801233.db2.gz FEFAMLZVASBBRF-HXUWFJFHSA-N 0 1 378.476 3.342 10 0 GGAEMN C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2cccc(Nc3nnn[n-]3)c2)CC1 ZINC000901087337 1429335108 /nfs/dbraw/zinc/33/51/08/1429335108.db2.gz FBOZLYLDHKEDPV-INIZCTEOSA-N 0 1 397.527 3.060 10 0 GGAEMN C[C@H]1CCCC[N@@H+]1CCC1CCN(C(=O)c2cccc(Nc3nn[n-]n3)c2)CC1 ZINC000901087337 1429335109 /nfs/dbraw/zinc/33/51/09/1429335109.db2.gz FBOZLYLDHKEDPV-INIZCTEOSA-N 0 1 397.527 3.060 10 0 GGAEMN C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)c2cccc(Nc3nn[n-]n3)c2)CC1 ZINC000901087337 1429335110 /nfs/dbraw/zinc/33/51/10/1429335110.db2.gz FBOZLYLDHKEDPV-INIZCTEOSA-N 0 1 397.527 3.060 10 0 GGAEMN C[C@@H](Cc1ccccc1F)NC(=O)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 ZINC000179557243 1429431129 /nfs/dbraw/zinc/43/11/29/1429431129.db2.gz CLDHNSZIVDIEBI-JTQLQIEISA-N 0 1 390.365 3.326 10 0 GGAEMN COC(=O)[C@H]1CCCN1Cc1cc(Br)cc(Br)c1O ZINC000179660942 1429495442 /nfs/dbraw/zinc/49/54/42/1429495442.db2.gz VHSHJCPGUWFNGB-LLVKDONJSA-N 0 1 393.075 3.055 10 0 GGAEMN COc1ccccc1CN(CCO)Cc1cc(Br)cc(C)c1O ZINC000179752238 1429538956 /nfs/dbraw/zinc/53/89/56/1429538956.db2.gz FPGIKPAWIQMEAX-UHFFFAOYSA-N 0 1 380.282 3.466 10 0 GGAEMN COc1ccc([C@H]2CCN(CC(=O)N(C)Cc3ccc(OC)c(OC)c3)C2)cc1 ZINC000155320904 1423316007 /nfs/dbraw/zinc/31/60/07/1423316007.db2.gz GAXNOGLFRKQSFK-IBGZPJMESA-N 0 1 398.503 3.160 10 0 GGAEMN C[C@@H](NC(=O)[C@H](C)N1CCC(Cn2ccnn2)CC1)c1cccc2ccccc21 ZINC000155617591 1423448893 /nfs/dbraw/zinc/44/88/93/1423448893.db2.gz BRKUNUZPPVHLNQ-MSOLQXFVSA-N 0 1 391.519 3.409 10 0 GGAEMN C[C@H](NC(=O)[C@H](C)N1CCC(Cn2ccnn2)CC1)c1cccc2ccccc21 ZINC000155617461 1423448943 /nfs/dbraw/zinc/44/89/43/1423448943.db2.gz BRKUNUZPPVHLNQ-ROUUACIJSA-N 0 1 391.519 3.409 10 0 GGAEMN c1oc(-c2ccccc2)nc1CN[C@@H](Cc1ccccc1)CN1CCOCC1 ZINC000156068831 1423659323 /nfs/dbraw/zinc/65/93/23/1423659323.db2.gz ARPJKQZTUDKSOY-NRFANRHFSA-N 0 1 377.488 3.375 10 0 GGAEMN COc1ccc([C@H](NC(=O)CN2CC[C@H](C)[C@@H](n3ccnc3)C2)C(C)C)cc1 ZINC000156432273 1423809805 /nfs/dbraw/zinc/80/98/05/1423809805.db2.gz BSDURJYCWWXUGE-RBDMOPTHSA-N 0 1 384.524 3.288 10 0 GGAEMN COc1cc(CNCc2cnn(C)c2C)cc(Br)c1OC(F)F ZINC000156614088 1423835705 /nfs/dbraw/zinc/83/57/05/1423835705.db2.gz AAMILVFFXCQZGO-UHFFFAOYSA-N 0 1 390.228 3.391 10 0 GGAEMN C[C@H]1CN(C2CCN(C(=O)Nc3cccnc3-c3ccccc3)CC2)CCO1 ZINC000157121222 1423931390 /nfs/dbraw/zinc/93/13/90/1423931390.db2.gz CRUSGIVFURBOFB-KRWDZBQOSA-N 0 1 380.492 3.466 10 0 GGAEMN COc1ccc(CN[C@H]2CCCN(CC(F)(F)F)C2=O)cc1Br ZINC000158333870 1424228926 /nfs/dbraw/zinc/22/89/26/1424228926.db2.gz BNNUESKFQDYPAW-LBPRGKRZSA-N 0 1 395.219 3.101 10 0 GGAEMN CCOc1cc(CN[C@@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1OC ZINC000159941952 1424554276 /nfs/dbraw/zinc/55/42/76/1424554276.db2.gz DIGHDKVWJVYXGD-FQEVSTJZSA-N 0 1 382.504 3.417 10 0 GGAEMN COc1ccc2c(c1)CCN2C(=O)NC1CCN([C@H](C)c2ccncc2)CC1 ZINC000161225210 1424667403 /nfs/dbraw/zinc/66/74/03/1424667403.db2.gz LEEWJNKJEXLIDC-MRXNPFEDSA-N 0 1 380.492 3.388 10 0 GGAEMN C[C@@H]([NH2+][C@H](C)c1ccc(Br)cc1Br)c1nnn[n-]1 ZINC000044925891 1424685539 /nfs/dbraw/zinc/68/55/39/1424685539.db2.gz NTXNFWYACVKYJC-RNFRBKRXSA-N 0 1 375.068 3.137 10 0 GGAEMN Cc1cc(=O)n(C)cc1NC(=O)NC[C@@H](c1cccc(Cl)c1)N1CCCC1 ZINC000161951222 1424802692 /nfs/dbraw/zinc/80/26/92/1424802692.db2.gz AIHPYMLEVJVYQW-SFHVURJKSA-N 0 1 388.899 3.306 10 0 GGAEMN Cc1oc(-c2ccccc2)nc1CC(=O)NCCc1nnc(-c2ccccc2)[nH]1 ZINC000162840975 1424895574 /nfs/dbraw/zinc/89/55/74/1424895574.db2.gz GJPCVKAUXQDPEB-UHFFFAOYSA-N 0 1 387.443 3.337 10 0 GGAEMN Brc1ccc2nc(CN3CCCN(c4ccccn4)CC3)[nH]c2c1 ZINC000162882552 1424899210 /nfs/dbraw/zinc/89/92/10/1424899210.db2.gz LNPBUVBIFIWMBC-UHFFFAOYSA-N 0 1 386.297 3.433 10 0 GGAEMN CCC[C@H]1CN(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)CCN1CCOC ZINC000162923197 1424906236 /nfs/dbraw/zinc/90/62/36/1424906236.db2.gz DXEJHXYWLWVAEY-RXVVDRJESA-N 0 1 399.539 3.076 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000162961520 1424913221 /nfs/dbraw/zinc/91/32/21/1424913221.db2.gz QBQGOTQGRVAGBD-LJQANCHMSA-N 0 1 392.459 3.002 10 0 GGAEMN CCC(=O)N(C1CCOCC1)C1CCN(Cc2cc(OC)cc(OC)c2)CC1 ZINC000169760495 1425248219 /nfs/dbraw/zinc/24/82/19/1425248219.db2.gz HKHHTGGJXXKMDQ-UHFFFAOYSA-N 0 1 390.524 3.086 10 0 GGAEMN CC(C)CN1CCN(C(=O)[C@@H]2CCc3ncc(-c4ccc(F)cc4)n3C2)CC1 ZINC000169761276 1425248450 /nfs/dbraw/zinc/24/84/50/1425248450.db2.gz ZUALLSHQNBWSHF-GOSISDBHSA-N 0 1 384.499 3.052 10 0 GGAEMN O=C(NC[C@H]1Cn2cccc2CN1Cc1ccccc1)c1n[nH]c2ccccc21 ZINC000169779191 1425255223 /nfs/dbraw/zinc/25/52/23/1425255223.db2.gz GUVKXUNNIAHMEJ-IBGZPJMESA-N 0 1 385.471 3.179 10 0 GGAEMN COc1cc(CN2CCCN(Cc3cscn3)CC2)ccc1OC(F)F ZINC000171241203 1425562315 /nfs/dbraw/zinc/56/23/15/1425562315.db2.gz CXFBBKMAACMUFO-UHFFFAOYSA-N 0 1 383.464 3.461 10 0 GGAEMN CN(C(=O)CN1CC[C@H](CNc2ccccn2)C1)[C@@H]1CCCc2ccccc21 ZINC000171645580 1425771065 /nfs/dbraw/zinc/77/10/65/1425771065.db2.gz LVLBREYSOIIBJK-WIYYLYMNSA-N 0 1 378.520 3.351 10 0 GGAEMN CN(C(=O)CN1CC[C@H](CNc2ccccn2)C1)[C@H]1CCCc2ccccc21 ZINC000171645584 1425771114 /nfs/dbraw/zinc/77/11/14/1425771114.db2.gz LVLBREYSOIIBJK-NQIIRXRSSA-N 0 1 378.520 3.351 10 0 GGAEMN COC(=O)c1ccc(C)c(NS(=O)(=O)c2cnc(Cl)c(Cl)c2)c1 ZINC000172356084 1426013004 /nfs/dbraw/zinc/01/30/04/1426013004.db2.gz LHLLLAWCMPTZDL-UHFFFAOYSA-N 0 1 375.233 3.284 10 0 GGAEMN COc1ccc(-c2ccc(C(=O)N3CCO[C@H](c4n[nH]c(C)n4)C3)c(F)c2)cc1 ZINC000173086722 1426336930 /nfs/dbraw/zinc/33/69/30/1426336930.db2.gz GLEGAUWMLLFHQF-IBGZPJMESA-N 0 1 396.422 3.142 10 0 GGAEMN CCN1CCN([C@@H]2CCN(C(=O)c3sc4ccc(OC)cc4c3C)C2)CC1 ZINC000173589307 1426752366 /nfs/dbraw/zinc/75/23/66/1426752366.db2.gz VRZBJESXDORNAX-MRXNPFEDSA-N 0 1 387.549 3.070 10 0 GGAEMN CCc1ccc(OC[C@@H](O)CN2CCc3c(cccc3N3CCOC3=O)C2)cc1 ZINC000174060321 1426980285 /nfs/dbraw/zinc/98/02/85/1426980285.db2.gz WKDLIIIOEZCFQK-IBGZPJMESA-N 0 1 396.487 3.004 10 0 GGAEMN Cc1ccc2c(=O)c(C(=O)N(C)Cc3nc(C(F)(F)F)cs3)c[n-]c2[nH+]1 ZINC000174101422 1427002813 /nfs/dbraw/zinc/00/28/13/1427002813.db2.gz MXLIEUORZXOJAO-UHFFFAOYSA-N 0 1 382.367 3.391 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(OC(F)F)c3ncccc23)[nH]1 ZINC000174205089 1427049528 /nfs/dbraw/zinc/04/95/28/1427049528.db2.gz DYJYZKGJHDZNGU-UHFFFAOYSA-N 0 1 379.392 3.384 10 0 GGAEMN O=C1COc2ccccc2N1CCCNCc1csc(-c2ccccn2)n1 ZINC000174521399 1427200777 /nfs/dbraw/zinc/20/07/77/1427200777.db2.gz IDZBWLFZRPIQBF-UHFFFAOYSA-N 0 1 380.473 3.110 10 0 GGAEMN COc1c(C)cnc(CN2CCC(N(C)C(=O)[C@@H](C)c3cccnc3)CC2)c1C ZINC000174611168 1427260911 /nfs/dbraw/zinc/26/09/11/1427260911.db2.gz QUNBEECSQMMPBH-KRWDZBQOSA-N 0 1 396.535 3.329 10 0 GGAEMN COc1ccc2[nH]cc(C3CCN(C(=O)CCSc4nnc(C)[nH]4)CC3)c2c1 ZINC000174663067 1427294720 /nfs/dbraw/zinc/29/47/20/1427294720.db2.gz ADDACKJWBNPDJZ-UHFFFAOYSA-N 0 1 399.520 3.491 10 0 GGAEMN COC(=O)c1sccc1S(=O)(=O)Nc1nc(C)c(Cl)cc1Cl ZINC000180211866 1429803161 /nfs/dbraw/zinc/80/31/61/1429803161.db2.gz PCCXHVCYDRFLJB-UHFFFAOYSA-N 0 1 381.262 3.346 10 0 GGAEMN CCc1nc2ccccc2n1C1CCN(C(=O)CCSc2nnc(C)[nH]2)CC1 ZINC000180278019 1429822531 /nfs/dbraw/zinc/82/25/31/1429822531.db2.gz CCYDARWKRDVIOM-UHFFFAOYSA-N 0 1 398.536 3.371 10 0 GGAEMN Cc1nc(CC(=O)N2CCC[C@@H](c3nnc(-c4ccccc4)[nH]3)C2)c(C)s1 ZINC000181328823 1430274368 /nfs/dbraw/zinc/27/43/68/1430274368.db2.gz GRYYJYAXUQTJRB-MRXNPFEDSA-N 0 1 381.505 3.494 10 0 GGAEMN CCOc1ccc(C(=O)N2CCC[C@@H](c3nnc(-c4ccccc4)[nH]3)C2)cn1 ZINC000181363063 1430282090 /nfs/dbraw/zinc/28/20/90/1430282090.db2.gz LCTOIMAQCMKNRU-QGZVFWFLSA-N 0 1 377.448 3.285 10 0 GGAEMN O=C(NCc1cccc(CO)c1)N1CCC[C@H](c2nnc(-c3ccccc3)[nH]2)C1 ZINC000181715347 1430345810 /nfs/dbraw/zinc/34/58/10/1430345810.db2.gz UCPOVFUNPZKIDN-IBGZPJMESA-N 0 1 391.475 3.053 10 0 GGAEMN CCCN(CCC)C(=O)c1ccc(NC(=O)c2cnc3n(C)[n-]cc-3c2=O)cc1 ZINC000181804993 1430364218 /nfs/dbraw/zinc/36/42/18/1430364218.db2.gz GGRUIGDPMZBDEV-UHFFFAOYSA-N 0 1 395.463 3.188 10 0 GGAEMN C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC(CC(=O)N(C)C)CC1 ZINC000182220351 1430431944 /nfs/dbraw/zinc/43/19/44/1430431944.db2.gz HWTAVDOPMWDXDM-CQSZACIVSA-N 0 1 397.922 3.016 10 0 GGAEMN Cc1cccc(Cc2cnc(NC(=O)CN3CCCC[C@H]3c3nnc[nH]3)s2)c1 ZINC000182690754 1430517825 /nfs/dbraw/zinc/51/78/25/1430517825.db2.gz YAINORQHEIESAP-KRWDZBQOSA-N 0 1 396.520 3.326 10 0 GGAEMN CCOC(=O)c1cnc(=NNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)[nH]c1C ZINC000182717584 1430525429 /nfs/dbraw/zinc/52/54/29/1430525429.db2.gz DUMFQURABXTVTQ-ZWKOTPCHSA-N 0 1 390.443 3.362 10 0 GGAEMN COc1ccc([C@H](C)NCc2cccc(N3CCCS3(=O)=O)c2)cc1F ZINC000185293626 1431101814 /nfs/dbraw/zinc/10/18/14/1431101814.db2.gz IAAJVYGLYDHNFK-AWEZNQCLSA-N 0 1 378.469 3.225 10 0 GGAEMN COC(=O)c1cc(F)ccc1CN1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000186026338 1431313648 /nfs/dbraw/zinc/31/36/48/1431313648.db2.gz AQXIMSMUKALYNC-JCGIZDLHSA-N 0 1 392.471 3.347 10 0 GGAEMN C[C@H](NC(=O)[C@H](C)N1CCC(Cn2cncn2)CC1)c1cccc2ccccc21 ZINC000186224189 1431356639 /nfs/dbraw/zinc/35/66/39/1431356639.db2.gz ACIKDXALSNOFMO-ROUUACIJSA-N 0 1 391.519 3.409 10 0 GGAEMN CC[N@@H+](CC(=O)[O-])C1CCN(C(=O)c2ccc(-c3ccsc3)nc2C)CC1 ZINC000186632815 1431474965 /nfs/dbraw/zinc/47/49/65/1431474965.db2.gz GBAKBFZRXURTRC-UHFFFAOYSA-N 0 1 387.505 3.130 10 0 GGAEMN Cc1nc(C)n(C[C@@H]2CCCN(C(=O)c3cc(-c4ccc(C)c(C)c4)[nH]n3)C2)n1 ZINC000187069308 1431605399 /nfs/dbraw/zinc/60/53/99/1431605399.db2.gz USZXEPLVWHLOAJ-GOSISDBHSA-N 0 1 392.507 3.454 10 0 GGAEMN C[C@@H](C(F)(F)F)S(=O)(=O)NC1CCC(Oc2ncccc2Cl)CC1 ZINC000188617917 1431903833 /nfs/dbraw/zinc/90/38/33/1431903833.db2.gz UUJPQDIMWBNDEN-WHXUTIOJSA-N 0 1 386.823 3.295 10 0 GGAEMN C[C@H](C(F)(F)F)S(=O)(=O)NC1CCC(Oc2ncccc2Cl)CC1 ZINC000188617939 1431904784 /nfs/dbraw/zinc/90/47/84/1431904784.db2.gz UUJPQDIMWBNDEN-KPPDAEKUSA-N 0 1 386.823 3.295 10 0 GGAEMN Cc1nnc(SCCC(=O)N(C)CCOc2ccc(C(F)(F)F)cc2)[nH]1 ZINC000189067847 1432038649 /nfs/dbraw/zinc/03/86/49/1432038649.db2.gz CVEMDWYKGKSRJK-UHFFFAOYSA-N 0 1 388.415 3.152 10 0 GGAEMN O=C(NCCc1nnc(-c2ccccc2)[nH]1)c1ccnc(OCc2ccccc2)c1 ZINC000189792896 1432236873 /nfs/dbraw/zinc/23/68/73/1432236873.db2.gz LMVTXIOPADUCIE-UHFFFAOYSA-N 0 1 399.454 3.418 10 0 GGAEMN CCc1n[nH]c(C2CCN([C@@H](C)C(=O)Nc3cc(Cl)ccc3OC)CC2)n1 ZINC000190666267 1432437189 /nfs/dbraw/zinc/43/71/89/1432437189.db2.gz NHOFKFUWFLQXJG-LBPRGKRZSA-N 0 1 391.903 3.236 10 0 GGAEMN CCc1nnc(C2CCN([C@@H](C)C(=O)Nc3cc(Cl)ccc3OC)CC2)[nH]1 ZINC000190666267 1432437196 /nfs/dbraw/zinc/43/71/96/1432437196.db2.gz NHOFKFUWFLQXJG-LBPRGKRZSA-N 0 1 391.903 3.236 10 0 GGAEMN O=C(CN[C@H]1CCCc2c(O)cccc21)Nc1ccc(N2CCCCC2)nc1 ZINC000192354455 1432835643 /nfs/dbraw/zinc/83/56/43/1432835643.db2.gz BKPDWYQPZVCLOI-IBGZPJMESA-N 0 1 380.492 3.383 10 0 GGAEMN Cc1nnc(SCCC(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)[nH]1 ZINC000192547938 1432858013 /nfs/dbraw/zinc/85/80/13/1432858013.db2.gz IABWRNYGKLKXHB-UHFFFAOYSA-N 0 1 375.498 3.023 10 0 GGAEMN CCCNC(=O)C1CCN([C@H](C)C(=O)N(C)Cc2c(F)cccc2Cl)CC1 ZINC000192839378 1432897333 /nfs/dbraw/zinc/89/73/33/1432897333.db2.gz FXJGHKHWSNRRFO-CQSZACIVSA-N 0 1 397.922 3.064 10 0 GGAEMN C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)N1CCC[C@H](c2cc[nH]n2)C1 ZINC000193588672 1433024661 /nfs/dbraw/zinc/02/46/61/1433024661.db2.gz AMTVNJPQVZSRSP-KGLIPLIRSA-N 0 1 378.879 3.429 10 0 GGAEMN O=C(Nc1ccccc1-c1nc(-c2ccccc2)n[nH]1)[C@@H]1CCCCC(=O)N1 ZINC000193863662 1433075130 /nfs/dbraw/zinc/07/51/30/1433075130.db2.gz CMCCLMKGBIIVQB-KRWDZBQOSA-N 0 1 375.432 3.136 10 0 GGAEMN COc1ccc(CN2CCC(NC(=O)N[C@H]3COc4ccccc43)CC2)cc1F ZINC000194687335 1433215803 /nfs/dbraw/zinc/21/58/03/1433215803.db2.gz BVWMNSQMUQSJLF-IBGZPJMESA-N 0 1 399.466 3.232 10 0 GGAEMN Cc1ccc2nc([C@@H]3CCCN3C(=O)C(=O)Nc3ccc4c(c3)CCO4)[nH]c2c1 ZINC000194696126 1433216640 /nfs/dbraw/zinc/21/66/40/1433216640.db2.gz HOOAHMLDTFLMFY-SFHVURJKSA-N 0 1 390.443 3.108 10 0 GGAEMN O=C([C@@H]1Cc2ccccc2CN1)N1CCC(c2nc(-c3ccccc3)no2)CC1 ZINC000237985756 1433438271 /nfs/dbraw/zinc/43/82/71/1433438271.db2.gz IEPQYXVBVXQPBA-FQEVSTJZSA-N 0 1 388.471 3.157 10 0 GGAEMN Cc1cc(S(=O)(=O)Nc2ccc(N3CCN(C)CC3)cc2)ccc1Cl ZINC000242770515 1433447413 /nfs/dbraw/zinc/44/74/13/1433447413.db2.gz DRPJUFGSECUKFW-UHFFFAOYSA-N 0 1 379.913 3.201 10 0 GGAEMN COCCCN1CCN(C(=O)Nc2ccc(OCc3ccccc3)cc2)CC1 ZINC000244385289 1433452748 /nfs/dbraw/zinc/45/27/48/1433452748.db2.gz YDNDJKGGNROFMM-UHFFFAOYSA-N 0 1 383.492 3.452 10 0 GGAEMN CCCC(=O)NC[C@@H]1CCCN([C@@H](C)C(=O)N2c3ccccc3CC[C@H]2C)C1 ZINC000245389017 1433457732 /nfs/dbraw/zinc/45/77/32/1433457732.db2.gz GGZIGRTZAOZDGG-QYZOEREBSA-N 0 1 385.552 3.371 10 0 GGAEMN Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N(C)C[C@@H]1CCCC[C@H]1O ZINC000245527005 1433481367 /nfs/dbraw/zinc/48/13/67/1433481367.db2.gz AWAUOGSYBUJFIE-CMKODMSKSA-N 0 1 384.524 3.299 10 0 GGAEMN CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000245557285 1433484807 /nfs/dbraw/zinc/48/48/07/1433484807.db2.gz ATRXPYDRROUYMO-FUHIMQAGSA-N 0 1 398.507 3.358 10 0 GGAEMN C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)N1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000246063913 1433563503 /nfs/dbraw/zinc/56/35/03/1433563503.db2.gz ANEXWMYGJPMREL-ZHALLVOQSA-N 0 1 393.535 3.160 10 0 GGAEMN CN(C(=O)CN1CC[C@@H](CNc2ccccn2)C1)[C@H]1CCCc2ccccc21 ZINC000246126504 1433571977 /nfs/dbraw/zinc/57/19/77/1433571977.db2.gz LVLBREYSOIIBJK-RXVVDRJESA-N 0 1 378.520 3.351 10 0 GGAEMN COCCN1[C@H](C)CN([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C[C@@H]1C ZINC000246550489 1433629948 /nfs/dbraw/zinc/62/99/48/1433629948.db2.gz DLFKPBPTHCWINS-IYWMVGAKSA-N 0 1 397.563 3.447 10 0 GGAEMN O=C(NC1CC1)c1cc(N2CCN(Cc3ccccc3)CC2)nc2ccccc21 ZINC000247729599 1433748237 /nfs/dbraw/zinc/74/82/37/1433748237.db2.gz GPJKVYOBKHEJBY-UHFFFAOYSA-N 0 1 386.499 3.449 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1 ZINC000249331095 1433841358 /nfs/dbraw/zinc/84/13/58/1433841358.db2.gz HOYKAFANLVXRFT-CEXWTWQISA-N 0 1 397.563 3.183 10 0 GGAEMN C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)N1CCN(CC(C)(C)O)[C@H](C)C1 ZINC000249331095 1433841359 /nfs/dbraw/zinc/84/13/59/1433841359.db2.gz HOYKAFANLVXRFT-CEXWTWQISA-N 0 1 397.563 3.183 10 0 GGAEMN C[C@@H]1C[N@@H+](Cc2cc(Br)cc(Br)c2[O-])CC[C@H]1O ZINC000249528151 1433846372 /nfs/dbraw/zinc/84/63/72/1433846372.db2.gz AFBOSVYGJYLEJA-PRHODGIISA-N 0 1 379.092 3.120 10 0 GGAEMN Cc1nn2c(N=NCc3cccc(C(F)(F)F)c3)nc3ccccc3c2nc1=O ZINC000254509229 1433871436 /nfs/dbraw/zinc/87/14/36/1433871436.db2.gz AGDFFOHSAJPPEW-UHFFFAOYSA-N 0 1 398.348 3.411 10 0 GGAEMN c1c[nH]c(-c2nnc(N=NCc3ccc(N4CCOCC4)cc3)c3ccccc32)n1 ZINC000254761592 1433871973 /nfs/dbraw/zinc/87/19/73/1433871973.db2.gz FAVBKZLVHLCDQV-UHFFFAOYSA-N 0 1 399.458 3.303 10 0 GGAEMN COCCN1CC2(CCN(C(=O)c3ccccc3F)CC2)[C@@H]1c1ccncc1 ZINC000257174021 1433893241 /nfs/dbraw/zinc/89/32/41/1433893241.db2.gz BIZDODQBLCHNKJ-FQEVSTJZSA-N 0 1 383.467 3.146 10 0 GGAEMN Cc1cnc(CO[C@@H]2CCCN(C(=O)c3cc(-c4ccc(F)cc4)[nH]n3)C2)n1C ZINC000257176053 1433893352 /nfs/dbraw/zinc/89/33/52/1433893352.db2.gz RPMNUVLNSHRVSX-QGZVFWFLSA-N 0 1 397.454 3.079 10 0 GGAEMN Cc1cnc(CC2CCN(C(=O)[C@H]3CCOC3)CC2)n1Cc1ccc(F)cc1 ZINC000257189096 1433894273 /nfs/dbraw/zinc/89/42/73/1433894273.db2.gz HOZMEPOTVJULLT-IBGZPJMESA-N 0 1 385.483 3.197 10 0 GGAEMN CNC(=O)c1cccc(NC(=O)[C@H](C)N2CCC(n3c(C)ccc3C)CC2)c1 ZINC000263661590 1434016942 /nfs/dbraw/zinc/01/69/42/1434016942.db2.gz DTDOJAUYXYGGKF-KRWDZBQOSA-N 0 1 382.508 3.129 10 0 GGAEMN CC(C)[C@@H](C)N1Cc2cccc(NC(=O)C(=O)N(C)C[C@@H]3CCCCO3)c2C1 ZINC000263942452 1434051482 /nfs/dbraw/zinc/05/14/82/1434051482.db2.gz DHFDFVQUJKFMIS-AEFFLSMTSA-N 0 1 387.524 3.013 10 0 GGAEMN Cc1n[nH]c(CCNC(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)n1 ZINC000267139787 1434410129 /nfs/dbraw/zinc/41/01/29/1434410129.db2.gz GXIHCXDFDUIMJD-PMACEKPBSA-N 0 1 376.460 3.155 10 0 GGAEMN CN(C)Cc1ccsc1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000268081968 1434493416 /nfs/dbraw/zinc/49/34/16/1434493416.db2.gz GQODJTRHLUFVFZ-CQSZACIVSA-N 0 1 381.542 3.187 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N1CCC[C@H](c2nc(C)n[nH]2)C1 ZINC000268433454 1434522353 /nfs/dbraw/zinc/52/23/53/1434522353.db2.gz FSMORDYXTDQGLJ-WFASDCNBSA-N 0 1 395.463 3.269 10 0 GGAEMN CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N1CCC[C@H](c2nnc(C)[nH]2)C1 ZINC000268433454 1434522356 /nfs/dbraw/zinc/52/23/56/1434522356.db2.gz FSMORDYXTDQGLJ-WFASDCNBSA-N 0 1 395.463 3.269 10 0 GGAEMN COc1ccc2[nH]c3c(c2c1)C[C@@H](N[C@H]1CS(=O)(=O)c2ccccc21)CC3 ZINC000272814077 1434933128 /nfs/dbraw/zinc/93/31/28/1434933128.db2.gz CEERUSPWTMNIPJ-RBZFPXEDSA-N 0 1 382.485 3.152 10 0 GGAEMN Cc1nn(C)c(Cl)c1/C=C/C(=O)N1CC[C@H](n2c(C)nc3c2CCCC3)C1 ZINC000275217349 1435123677 /nfs/dbraw/zinc/12/36/77/1435123677.db2.gz COKAELXILRZBHJ-HVHJFMEUSA-N 0 1 387.915 3.252 10 0 GGAEMN COc1c(O)cccc1CN(C)C[C@@H]1C[C@H](F)CN1Cc1scnc1C ZINC000280479123 1435667305 /nfs/dbraw/zinc/66/73/05/1435667305.db2.gz DIDNIVJVCNNGGY-HOTGVXAUSA-N 0 1 379.501 3.210 10 0 GGAEMN Cc1cc([C@@H]2CCCN(C(=O)[C@H](NC(=O)c3cccc(C)c3)C(C)C)C2)n[nH]1 ZINC000282380230 1435845145 /nfs/dbraw/zinc/84/51/45/1435845145.db2.gz CUBUXIVKRVZBCX-UYAOXDASSA-N 0 1 382.508 3.187 10 0 GGAEMN C[C@H](C[C@H]1CCCCCN1C(=O)OC(C)(C)C)[NH2+]CCCCc1nnn[n-]1 ZINC000708195123 1447102964 /nfs/dbraw/zinc/10/29/64/1447102964.db2.gz KLMAPPIWOORKKS-HZPDHXFCSA-N 0 1 380.537 3.070 10 0 GGAEMN COc1ccccc1[C@@H]1CCCN(C(=O)c2cccc(Nc3nn[n-]n3)c2)CC1 ZINC000913775249 1450245457 /nfs/dbraw/zinc/24/54/57/1450245457.db2.gz DEHAGRHOHQVHDV-OAHLLOKOSA-N 0 1 392.463 3.362 10 0 GGAEMN Cc1cc(N2CCN(CCOc3ccccc3)CC2)nc(-c2ccncc2)n1 ZINC000057825497 721959459 /nfs/dbraw/zinc/95/94/59/721959459.db2.gz LTFUOYKQSXBPGT-UHFFFAOYSA-N 0 1 375.476 3.048 10 0 GGAEMN Cc1cc(N2CCN(CCOc3ccccc3)CC2)nc(-c2ccccn2)n1 ZINC000591651937 721959539 /nfs/dbraw/zinc/95/95/39/721959539.db2.gz VWNNDUIDROXOFF-UHFFFAOYSA-N 0 1 375.476 3.048 10 0 GGAEMN