smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC[C@H](NCc1ccccc1)c1ccccc1 ZINC000005310891 360485357 /nfs/dbraw/zinc/48/53/57/360485357.db2.gz GICYXFWFNKTIDW-KRWDZBQOSA-N 0 3 239.362 4.318 20 0 BIADHN CCC[C@@H](NCc1ccccc1)c1ccccc1 ZINC000005311102 387490575 /nfs/dbraw/zinc/49/05/75/387490575.db2.gz GICYXFWFNKTIDW-QGZVFWFLSA-N 0 3 239.362 4.318 20 0 BIADHN CC[C@@H](c1ccc(Cl)cc1)N1CCCCC1 ZINC000005599100 359659087 /nfs/dbraw/zinc/65/90/87/359659087.db2.gz KCSGAGUQRRQXDM-AWEZNQCLSA-N 0 3 237.774 4.277 20 0 BIADHN CC[C@H](c1ccc(Cl)cc1)N1CCCCC1 ZINC000005599374 346275867 /nfs/dbraw/zinc/27/58/67/346275867.db2.gz KCSGAGUQRRQXDM-CQSZACIVSA-N 0 3 237.774 4.277 20 0 BIADHN CC(C)N1Cc2ccccc2-c2ccccc2C1 ZINC000005760393 388345583 /nfs/dbraw/zinc/34/55/83/388345583.db2.gz KSOVYSBKYHLXBC-UHFFFAOYSA-N 0 3 237.346 4.078 20 0 BIADHN CCCN1Cc2ccccc2-c2ccccc2C1 ZINC000005834216 388346064 /nfs/dbraw/zinc/34/60/64/388346064.db2.gz ICTNMQZODOQNGI-UHFFFAOYSA-N 0 3 237.346 4.079 20 0 BIADHN C[C@H](Nc1ccnc2ccccc21)c1ccccc1 ZINC000013863980 343107410 /nfs/dbraw/zinc/10/74/10/343107410.db2.gz GVCMADXYHWUCRU-ZDUSSCGKSA-N 0 3 248.329 4.408 20 0 BIADHN C[C@@H]1CCC[C@@H](C)N1Cc1ccc(Cl)cc1 ZINC000014193924 344447187 /nfs/dbraw/zinc/44/71/87/344447187.db2.gz NKXNYHVCALWLKO-VXGBXAGGSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@@H]1CCC[C@H](C)N1Cc1ccc(Cl)cc1 ZINC000014193926 342878025 /nfs/dbraw/zinc/87/80/25/342878025.db2.gz NKXNYHVCALWLKO-TXEJJXNPSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@H]1CCC[C@H](C)N1Cc1ccc(Cl)cc1 ZINC000014193927 344447023 /nfs/dbraw/zinc/44/70/23/344447023.db2.gz NKXNYHVCALWLKO-RYUDHWBXSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@@H]1CCC[C@@H](C)N1Cc1ccccc1Cl ZINC000014193936 344447037 /nfs/dbraw/zinc/44/70/37/344447037.db2.gz JZFFRXVIQPCYLX-VXGBXAGGSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@@H]1CCC[C@H](C)N1Cc1ccccc1Cl ZINC000014193938 386585394 /nfs/dbraw/zinc/58/53/94/386585394.db2.gz JZFFRXVIQPCYLX-TXEJJXNPSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@H]1CCC[C@H](C)N1Cc1ccccc1Cl ZINC000014193939 344446956 /nfs/dbraw/zinc/44/69/56/344446956.db2.gz JZFFRXVIQPCYLX-RYUDHWBXSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@@H]1CCC[C@@H](C)N1Cc1cccc(Cl)c1 ZINC000014193961 344447194 /nfs/dbraw/zinc/44/71/94/344447194.db2.gz PJKYNIQNDYRIRL-VXGBXAGGSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@@H]1CCC[C@H](C)N1Cc1cccc(Cl)c1 ZINC000014193963 386584130 /nfs/dbraw/zinc/58/41/30/386584130.db2.gz PJKYNIQNDYRIRL-TXEJJXNPSA-N 0 3 237.774 4.103 20 0 BIADHN C[C@H]1CCC[C@H](C)N1Cc1cccc(Cl)c1 ZINC000014193964 344446958 /nfs/dbraw/zinc/44/69/58/344446958.db2.gz PJKYNIQNDYRIRL-RYUDHWBXSA-N 0 3 237.774 4.103 20 0 BIADHN CN(Cc1ccccc1Cl)C1CCCCC1 ZINC000014217962 344452156 /nfs/dbraw/zinc/45/21/56/344452156.db2.gz WBKOTVOJGLPVRM-UHFFFAOYSA-N 0 3 237.774 4.105 20 0 BIADHN CCN[C@@H](c1ccccc1)c1cc(C)ccc1C ZINC000019808032 170148387 /nfs/dbraw/zinc/14/83/87/170148387.db2.gz SREVBMFZXXLJKQ-KRWDZBQOSA-N 0 3 239.362 4.002 20 0 BIADHN CCN[C@H](c1ccccc1)c1cc(C)ccc1C ZINC000019808034 170163814 /nfs/dbraw/zinc/16/38/14/170163814.db2.gz SREVBMFZXXLJKQ-QGZVFWFLSA-N 0 3 239.362 4.002 20 0 BIADHN CCN[C@@H](c1ccccc1)c1ccc(C)cc1C ZINC000019808073 170148114 /nfs/dbraw/zinc/14/81/14/170148114.db2.gz MIGBXGQNPAXSSC-KRWDZBQOSA-N 0 3 239.362 4.002 20 0 BIADHN CCN[C@H](c1ccccc1)c1ccc(C)cc1C ZINC000019808074 170164886 /nfs/dbraw/zinc/16/48/86/170164886.db2.gz MIGBXGQNPAXSSC-QGZVFWFLSA-N 0 3 239.362 4.002 20 0 BIADHN Cc1ccc(CN[C@H](C)c2ccccc2)c(C)c1 ZINC000019878013 356486025 /nfs/dbraw/zinc/48/60/25/356486025.db2.gz PWGIVHUJRPFIHB-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2ccccc2)c(C)c1 ZINC000019878015 343259996 /nfs/dbraw/zinc/25/99/96/343259996.db2.gz PWGIVHUJRPFIHB-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2ccccc2)cc1 ZINC000019878179 385162603 /nfs/dbraw/zinc/16/26/03/385162603.db2.gz JXAPMVVMUTUUBF-CABCVRRESA-N 0 3 239.362 4.407 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2ccccc2)cc1 ZINC000019878181 385160399 /nfs/dbraw/zinc/16/03/99/385160399.db2.gz JXAPMVVMUTUUBF-GJZGRUSLSA-N 0 3 239.362 4.407 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2ccccc2)cc1 ZINC000019878183 385161140 /nfs/dbraw/zinc/16/11/40/385161140.db2.gz JXAPMVVMUTUUBF-HUUCEWRRSA-N 0 3 239.362 4.407 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccccc2)cc1 ZINC000019878185 385161169 /nfs/dbraw/zinc/16/11/69/385161169.db2.gz JXAPMVVMUTUUBF-LSDHHAIUSA-N 0 3 239.362 4.407 20 0 BIADHN CC[C@@H](N[C@@H](C)c1ccccc1)c1ccccc1 ZINC000019878187 347303591 /nfs/dbraw/zinc/30/35/91/347303591.db2.gz RIBGLDXRHURQOK-WMLDXEAASA-N 0 3 239.362 4.489 20 0 BIADHN CC[C@H](N[C@@H](C)c1ccccc1)c1ccccc1 ZINC000019878189 347303856 /nfs/dbraw/zinc/30/38/56/347303856.db2.gz RIBGLDXRHURQOK-YOEHRIQHSA-N 0 3 239.362 4.489 20 0 BIADHN CC[C@@H](N[C@H](C)c1ccccc1)c1ccccc1 ZINC000019878190 347303937 /nfs/dbraw/zinc/30/39/37/347303937.db2.gz RIBGLDXRHURQOK-RHSMWYFYSA-N 0 3 239.362 4.489 20 0 BIADHN CC[C@H](N[C@H](C)c1ccccc1)c1ccccc1 ZINC000019878191 347303644 /nfs/dbraw/zinc/30/36/44/347303644.db2.gz RIBGLDXRHURQOK-PBHICJAKSA-N 0 3 239.362 4.489 20 0 BIADHN C[C@@H](N[C@@H](C)c1cccs1)c1ccccc1 ZINC000019878293 342960861 /nfs/dbraw/zinc/96/08/61/342960861.db2.gz PNKMOYVPRXPJKO-NEPJUHHUSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@H](N[C@@H](C)c1ccccc1)c1cccs1 ZINC000019878295 384549463 /nfs/dbraw/zinc/54/94/63/384549463.db2.gz PNKMOYVPRXPJKO-RYUDHWBXSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@@H](N[C@H](C)c1ccccc1)c1cccs1 ZINC000019878297 342960827 /nfs/dbraw/zinc/96/08/27/342960827.db2.gz PNKMOYVPRXPJKO-VXGBXAGGSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccccc1)c1cccs1 ZINC000019878299 342960717 /nfs/dbraw/zinc/96/07/17/342960717.db2.gz PNKMOYVPRXPJKO-NWDGAFQWSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000019878325 342960916 /nfs/dbraw/zinc/96/09/16/342960916.db2.gz VUKXJACOTHKDES-OLZOCXBDSA-N 0 3 243.325 4.238 20 0 BIADHN C[C@H](N[C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000019878327 384550581 /nfs/dbraw/zinc/55/05/81/384550581.db2.gz VUKXJACOTHKDES-STQMWFEESA-N 0 3 243.325 4.238 20 0 BIADHN C[C@@H](N[C@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000019878329 342960822 /nfs/dbraw/zinc/96/08/22/342960822.db2.gz VUKXJACOTHKDES-CHWSQXEVSA-N 0 3 243.325 4.238 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccccc1)c1ccc(F)cc1 ZINC000019878331 342960775 /nfs/dbraw/zinc/96/07/75/342960775.db2.gz VUKXJACOTHKDES-QWHCGFSZSA-N 0 3 243.325 4.238 20 0 BIADHN C[C@@H](N[C@@H]1CCc2ccccc21)c1ccccc1 ZINC000019878372 342960653 /nfs/dbraw/zinc/96/06/53/342960653.db2.gz VGYGBIBUJVQRBO-CXAGYDPISA-N 0 3 237.346 4.025 20 0 BIADHN C[C@H](N[C@@H]1CCc2ccccc21)c1ccccc1 ZINC000019878374 342960804 /nfs/dbraw/zinc/96/08/04/342960804.db2.gz VGYGBIBUJVQRBO-SUMWQHHRSA-N 0 3 237.346 4.025 20 0 BIADHN C[C@@H](N[C@H]1CCc2ccccc21)c1ccccc1 ZINC000019878376 342960794 /nfs/dbraw/zinc/96/07/94/342960794.db2.gz VGYGBIBUJVQRBO-DYVFJYSZSA-N 0 3 237.346 4.025 20 0 BIADHN C[C@H](N[C@H]1CCc2ccccc21)c1ccccc1 ZINC000019878378 342960792 /nfs/dbraw/zinc/96/07/92/342960792.db2.gz VGYGBIBUJVQRBO-GUYCJALGSA-N 0 3 237.346 4.025 20 0 BIADHN Cc1ccccc1[C@H](C)N[C@H](C)c1ccccc1 ZINC000019878500 179339649 /nfs/dbraw/zinc/33/96/49/179339649.db2.gz HKFRNLJVIOYQOA-CABCVRRESA-N 0 3 239.362 4.407 20 0 BIADHN Cc1ccccc1[C@H](C)N[C@@H](C)c1ccccc1 ZINC000019878502 179339220 /nfs/dbraw/zinc/33/92/20/179339220.db2.gz HKFRNLJVIOYQOA-GJZGRUSLSA-N 0 3 239.362 4.407 20 0 BIADHN Cc1ccccc1[C@@H](C)N[C@H](C)c1ccccc1 ZINC000019878504 179322942 /nfs/dbraw/zinc/32/29/42/179322942.db2.gz HKFRNLJVIOYQOA-HUUCEWRRSA-N 0 3 239.362 4.407 20 0 BIADHN Cc1ccccc1[C@@H](C)N[C@@H](C)c1ccccc1 ZINC000019878506 179321117 /nfs/dbraw/zinc/32/11/17/179321117.db2.gz HKFRNLJVIOYQOA-LSDHHAIUSA-N 0 3 239.362 4.407 20 0 BIADHN C[C@@H](N[C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000019878717 342960707 /nfs/dbraw/zinc/96/07/07/342960707.db2.gz JGEBPQORUHCLCZ-OLZOCXBDSA-N 0 3 243.325 4.238 20 0 BIADHN C[C@H](N[C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000019878719 384549487 /nfs/dbraw/zinc/54/94/87/384549487.db2.gz JGEBPQORUHCLCZ-STQMWFEESA-N 0 3 243.325 4.238 20 0 BIADHN C[C@@H](N[C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000019878721 342960748 /nfs/dbraw/zinc/96/07/48/342960748.db2.gz JGEBPQORUHCLCZ-CHWSQXEVSA-N 0 3 243.325 4.238 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccccc1)c1cccc(F)c1 ZINC000019878722 342960817 /nfs/dbraw/zinc/96/08/17/342960817.db2.gz JGEBPQORUHCLCZ-QWHCGFSZSA-N 0 3 243.325 4.238 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2ccccc2)s1 ZINC000019878771 384548987 /nfs/dbraw/zinc/54/89/87/384548987.db2.gz YQDZRURWOJXNSA-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2ccccc2)s1 ZINC000019878772 384550100 /nfs/dbraw/zinc/55/01/00/384550100.db2.gz YQDZRURWOJXNSA-STQMWFEESA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2ccccc2)s1 ZINC000019878775 384550073 /nfs/dbraw/zinc/55/00/73/384550073.db2.gz YQDZRURWOJXNSA-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccccc2)s1 ZINC000019878777 384548698 /nfs/dbraw/zinc/54/86/98/384548698.db2.gz YQDZRURWOJXNSA-QWHCGFSZSA-N 0 3 245.391 4.468 20 0 BIADHN CCC(CC)N[C@H](c1ccco1)c1ccccc1 ZINC000019884011 168391076 /nfs/dbraw/zinc/39/10/76/168391076.db2.gz MYJJKSBYRZZGNA-INIZCTEOSA-N 0 3 243.350 4.147 20 0 BIADHN CCC(CC)N[C@@H](c1ccco1)c1ccccc1 ZINC000019884013 168392632 /nfs/dbraw/zinc/39/26/32/168392632.db2.gz MYJJKSBYRZZGNA-MRXNPFEDSA-N 0 3 243.350 4.147 20 0 BIADHN CCC(CC)N[C@@H](C)c1nc2ccccc2s1 ZINC000019884015 168391790 /nfs/dbraw/zinc/39/17/90/168391790.db2.gz JOCHKKPOXBJYIU-JTQLQIEISA-N 0 3 248.395 4.136 20 0 BIADHN CCC(CC)N[C@H](C)c1nc2ccccc2s1 ZINC000019884017 168392838 /nfs/dbraw/zinc/39/28/38/168392838.db2.gz JOCHKKPOXBJYIU-SNVBAGLBSA-N 0 3 248.395 4.136 20 0 BIADHN C[C@@H](NCC1CC1)c1cc(Cl)ccc1Cl ZINC000019884857 411068001 /nfs/dbraw/zinc/06/80/01/411068001.db2.gz SQVFWVSHZQVOEC-MRVPVSSYSA-N 0 3 244.165 4.054 20 0 BIADHN C[C@H](NCC1CC1)c1cc(Cl)ccc1Cl ZINC000019884858 411067043 /nfs/dbraw/zinc/06/70/43/411067043.db2.gz SQVFWVSHZQVOEC-QMMMGPOBSA-N 0 3 244.165 4.054 20 0 BIADHN C[C@@H](NCC1CC1)c1ccc(Cl)cc1Cl ZINC000019884859 384552041 /nfs/dbraw/zinc/55/20/41/384552041.db2.gz DNRNVSYXFPLTFI-MRVPVSSYSA-N 0 3 244.165 4.054 20 0 BIADHN C[C@H](NCC1CC1)c1ccc(Cl)cc1Cl ZINC000019884860 384554298 /nfs/dbraw/zinc/55/42/98/384554298.db2.gz DNRNVSYXFPLTFI-QMMMGPOBSA-N 0 3 244.165 4.054 20 0 BIADHN c1ccc(CNCc2ccc3ccccc3c2)cc1 ZINC000019885997 384993432 /nfs/dbraw/zinc/99/34/32/384993432.db2.gz XPANUQTWPHELLO-UHFFFAOYSA-N 0 3 247.341 4.130 20 0 BIADHN C[C@@H](NCc1ccccc1)c1ccc(Cl)cc1 ZINC000019899486 347311810 /nfs/dbraw/zinc/31/18/10/347311810.db2.gz OQEROPWWVOOSPE-GFCCVEGCSA-N 0 3 245.753 4.191 20 0 BIADHN C[C@H](NCc1ccccc1)c1ccc(Cl)cc1 ZINC000019899487 176877180 /nfs/dbraw/zinc/87/71/80/176877180.db2.gz OQEROPWWVOOSPE-LBPRGKRZSA-N 0 3 245.753 4.191 20 0 BIADHN CC[C@@H](NCc1ccccc1)c1ccc(F)cc1 ZINC000019899540 350829368 /nfs/dbraw/zinc/82/93/68/350829368.db2.gz XLKDAIWUVUWCBY-MRXNPFEDSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@H](NCc1ccccc1)c1ccc(F)cc1 ZINC000019899541 350829186 /nfs/dbraw/zinc/82/91/86/350829186.db2.gz XLKDAIWUVUWCBY-INIZCTEOSA-N 0 3 243.325 4.067 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccccc2)c(C)c1 ZINC000019899573 385192465 /nfs/dbraw/zinc/19/24/65/385192465.db2.gz ONLDPLDHAREDCE-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccccc2)c(C)c1 ZINC000019899574 385192625 /nfs/dbraw/zinc/19/26/25/385192625.db2.gz ONLDPLDHAREDCE-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc(C)c([C@@H](C)NCc2ccccc2)c1 ZINC000019899581 385190929 /nfs/dbraw/zinc/19/09/29/385190929.db2.gz GZGVEJHRMYMJGC-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc(C)c([C@H](C)NCc2ccccc2)c1 ZINC000019899582 347311772 /nfs/dbraw/zinc/31/17/72/347311772.db2.gz GZGVEJHRMYMJGC-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN CC[C@@H](NCc1ccccc1)c1ccc(C)cc1 ZINC000019899594 347376289 /nfs/dbraw/zinc/37/62/89/347376289.db2.gz SZIDELQHMZULEK-QGZVFWFLSA-N 0 3 239.362 4.236 20 0 BIADHN CC[C@H](NCc1ccccc1)c1ccc(C)cc1 ZINC000019899595 347311780 /nfs/dbraw/zinc/31/17/80/347311780.db2.gz SZIDELQHMZULEK-KRWDZBQOSA-N 0 3 239.362 4.236 20 0 BIADHN C[C@@H](NCc1ccccc1)c1cccc(Cl)c1 ZINC000019899638 347311691 /nfs/dbraw/zinc/31/16/91/347311691.db2.gz UWGZRPCTJSHASF-GFCCVEGCSA-N 0 3 245.753 4.191 20 0 BIADHN C[C@H](NCc1ccccc1)c1cccc(Cl)c1 ZINC000019899640 176877546 /nfs/dbraw/zinc/87/75/46/176877546.db2.gz UWGZRPCTJSHASF-LBPRGKRZSA-N 0 3 245.753 4.191 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccccc2)cc1C ZINC000019899654 385190635 /nfs/dbraw/zinc/19/06/35/385190635.db2.gz HLYJMKZMZLBZMW-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccccc2)cc1C ZINC000019899655 385192605 /nfs/dbraw/zinc/19/26/05/385192605.db2.gz HLYJMKZMZLBZMW-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN CCc1ccc([C@@H](C)NCc2ccccc2)cc1 ZINC000019899660 385191951 /nfs/dbraw/zinc/19/19/51/385191951.db2.gz JAVBUUXIVUJYGV-CQSZACIVSA-N 0 3 239.362 4.100 20 0 BIADHN CCc1ccc([C@H](C)NCc2ccccc2)cc1 ZINC000019899661 385191049 /nfs/dbraw/zinc/19/10/49/385191049.db2.gz JAVBUUXIVUJYGV-AWEZNQCLSA-N 0 3 239.362 4.100 20 0 BIADHN CCCCCN[C@@H](C)c1nc2ccccc2s1 ZINC000019901480 590039724 /nfs/dbraw/zinc/03/97/24/590039724.db2.gz XRPKQGGMYQPVLX-NSHDSACASA-N 0 3 248.395 4.137 20 0 BIADHN CCCCCN[C@H](C)c1nc2ccccc2s1 ZINC000019901481 590039539 /nfs/dbraw/zinc/03/95/39/590039539.db2.gz XRPKQGGMYQPVLX-LLVKDONJSA-N 0 3 248.395 4.137 20 0 BIADHN CCC[C@@H](C)N[C@@H](C)c1ccccc1Cl ZINC000019902718 169370998 /nfs/dbraw/zinc/37/09/98/169370998.db2.gz SWYLFCLWBTUEOO-MNOVXSKESA-N 0 3 225.763 4.179 20 0 BIADHN CCC[C@H](C)N[C@@H](C)c1ccccc1Cl ZINC000019902719 385362919 /nfs/dbraw/zinc/36/29/19/385362919.db2.gz SWYLFCLWBTUEOO-QWRGUYRKSA-N 0 3 225.763 4.179 20 0 BIADHN CCC[C@@H](C)N[C@H](C)c1ccccc1Cl ZINC000019902721 169371418 /nfs/dbraw/zinc/37/14/18/169371418.db2.gz SWYLFCLWBTUEOO-GHMZBOCLSA-N 0 3 225.763 4.179 20 0 BIADHN CCC[C@H](C)N[C@H](C)c1ccccc1Cl ZINC000019902723 385362385 /nfs/dbraw/zinc/36/23/85/385362385.db2.gz SWYLFCLWBTUEOO-WDEREUQCSA-N 0 3 225.763 4.179 20 0 BIADHN CCC[C@@H](C)N[C@H](c1ccco1)c1ccccc1 ZINC000019903007 169371677 /nfs/dbraw/zinc/37/16/77/169371677.db2.gz VFKXVIWARYUKTO-CJNGLKHVSA-N 0 3 243.350 4.147 20 0 BIADHN CCC[C@H](C)N[C@H](c1ccco1)c1ccccc1 ZINC000019903008 385187900 /nfs/dbraw/zinc/18/79/00/385187900.db2.gz VFKXVIWARYUKTO-BBRMVZONSA-N 0 3 243.350 4.147 20 0 BIADHN CCC[C@@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000019903009 169371669 /nfs/dbraw/zinc/37/16/69/169371669.db2.gz VFKXVIWARYUKTO-CZUORRHYSA-N 0 3 243.350 4.147 20 0 BIADHN CCC[C@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000019903010 385187082 /nfs/dbraw/zinc/18/70/82/385187082.db2.gz VFKXVIWARYUKTO-XJKSGUPXSA-N 0 3 243.350 4.147 20 0 BIADHN CCC[C@@H](C)N[C@@H](C)c1nc2ccccc2s1 ZINC000019903011 169370401 /nfs/dbraw/zinc/37/04/01/169370401.db2.gz AWXORKNCTJLHCP-MNOVXSKESA-N 0 3 248.395 4.136 20 0 BIADHN CCC[C@H](C)N[C@@H](C)c1nc2ccccc2s1 ZINC000019903012 169493962 /nfs/dbraw/zinc/49/39/62/169493962.db2.gz AWXORKNCTJLHCP-QWRGUYRKSA-N 0 3 248.395 4.136 20 0 BIADHN CCC[C@@H](C)N[C@H](C)c1nc2ccccc2s1 ZINC000019903013 169371754 /nfs/dbraw/zinc/37/17/54/169371754.db2.gz AWXORKNCTJLHCP-GHMZBOCLSA-N 0 3 248.395 4.136 20 0 BIADHN CCC[C@H](C)N[C@H](C)c1nc2ccccc2s1 ZINC000019903014 590040366 /nfs/dbraw/zinc/04/03/66/590040366.db2.gz AWXORKNCTJLHCP-WDEREUQCSA-N 0 3 248.395 4.136 20 0 BIADHN CC[C@@H](NCc1ccc(F)cc1)c1ccccc1 ZINC000019943562 356994749 /nfs/dbraw/zinc/99/47/49/356994749.db2.gz TXKFQAVGVLTFBN-MRXNPFEDSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@H](NCc1ccc(F)cc1)c1ccccc1 ZINC000019943565 356994483 /nfs/dbraw/zinc/99/44/83/356994483.db2.gz TXKFQAVGVLTFBN-INIZCTEOSA-N 0 3 243.325 4.067 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccc(F)cc2)s1 ZINC000019944065 178843820 /nfs/dbraw/zinc/84/38/20/178843820.db2.gz KPBJMFVMJZDBHE-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccc(F)cc2)s1 ZINC000019944068 384559916 /nfs/dbraw/zinc/55/99/16/384559916.db2.gz KPBJMFVMJZDBHE-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN CC[C@@H](NCc1ccccc1F)c1ccccc1 ZINC000019949852 356994525 /nfs/dbraw/zinc/99/45/25/356994525.db2.gz VWSYNPSDPKPPCO-MRXNPFEDSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@H](NCc1ccccc1F)c1ccccc1 ZINC000019949857 356994763 /nfs/dbraw/zinc/99/47/63/356994763.db2.gz VWSYNPSDPKPPCO-INIZCTEOSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@@H](NCc1ccc(C)cc1)c1ccccc1 ZINC000019962404 385235575 /nfs/dbraw/zinc/23/55/75/385235575.db2.gz LESGXVWIHXILLX-QGZVFWFLSA-N 0 3 239.362 4.236 20 0 BIADHN CC[C@H](NCc1ccc(C)cc1)c1ccccc1 ZINC000019962406 385236626 /nfs/dbraw/zinc/23/66/26/385236626.db2.gz LESGXVWIHXILLX-KRWDZBQOSA-N 0 3 239.362 4.236 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccc(C)cc2)s1 ZINC000019962716 385236201 /nfs/dbraw/zinc/23/62/01/385236201.db2.gz MQLCQBREPDLVIA-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccc(C)cc2)s1 ZINC000019962718 385236555 /nfs/dbraw/zinc/23/65/55/385236555.db2.gz MQLCQBREPDLVIA-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CC(C)CCCCCCN[C@@H](C)c1ccccn1 ZINC000020023622 590067364 /nfs/dbraw/zinc/06/73/64/590067364.db2.gz NKBRDVSYXNHACO-HNNXBMFYSA-N 0 3 248.414 4.339 20 0 BIADHN CC(C)CCCCCCN[C@H](C)c1ccccn1 ZINC000020023625 590067021 /nfs/dbraw/zinc/06/70/21/590067021.db2.gz NKBRDVSYXNHACO-OAHLLOKOSA-N 0 3 248.414 4.339 20 0 BIADHN CCc1ccc(CN[C@@H](C)c2ccccc2)s1 ZINC000020035501 385272536 /nfs/dbraw/zinc/27/25/36/385272536.db2.gz ZJLJZYBTNSTUCA-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1ccc(CN[C@H](C)c2ccccc2)s1 ZINC000020035504 385271789 /nfs/dbraw/zinc/27/17/89/385271789.db2.gz ZJLJZYBTNSTUCA-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccccc2)c(C)s1 ZINC000020086623 178228703 /nfs/dbraw/zinc/22/87/03/178228703.db2.gz XPZXLIQIEKYVPM-GFCCVEGCSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc([C@H](C)NCc2ccccc2)c(C)s1 ZINC000020086625 178252420 /nfs/dbraw/zinc/25/24/20/178252420.db2.gz XPZXLIQIEKYVPM-LBPRGKRZSA-N 0 3 245.391 4.216 20 0 BIADHN CC[C@@H](NCc1ccc(F)cc1)c1cccs1 ZINC000020090632 590073256 /nfs/dbraw/zinc/07/32/56/590073256.db2.gz LJGDLWOVBODCAU-CYBMUJFWSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@H](NCc1ccc(F)cc1)c1cccs1 ZINC000020090634 590073119 /nfs/dbraw/zinc/07/31/19/590073119.db2.gz LJGDLWOVBODCAU-ZDUSSCGKSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1ccccc1F)c1cccs1 ZINC000020091207 590072918 /nfs/dbraw/zinc/07/29/18/590072918.db2.gz HCLAFWFCTUZFLI-CYBMUJFWSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@H](NCc1ccccc1F)c1cccs1 ZINC000020091209 590073293 /nfs/dbraw/zinc/07/32/93/590073293.db2.gz HCLAFWFCTUZFLI-ZDUSSCGKSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1ccc(C)cc1)c1cccs1 ZINC000020092189 590073198 /nfs/dbraw/zinc/07/31/98/590073198.db2.gz YFXWWVNNSBTHGH-CQSZACIVSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@H](NCc1ccc(C)cc1)c1cccs1 ZINC000020092191 590072892 /nfs/dbraw/zinc/07/28/92/590072892.db2.gz YFXWWVNNSBTHGH-AWEZNQCLSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1ccsc1CN[C@H](C)c1ccc(F)cc1 ZINC000020095379 342969137 /nfs/dbraw/zinc/96/91/37/342969137.db2.gz HGYMFOLOQPFFST-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1CN[C@@H](C)c1ccc(F)cc1 ZINC000020095381 342969263 /nfs/dbraw/zinc/96/92/63/342969263.db2.gz HGYMFOLOQPFFST-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN C[C@@H](N[C@@H](C)c1cccs1)c1ccc(F)cc1 ZINC000020095517 342969131 /nfs/dbraw/zinc/96/91/31/342969131.db2.gz JQIIRKUSFUSVKK-MNOVXSKESA-N 0 3 249.354 4.299 20 0 BIADHN C[C@H](N[C@@H](C)c1ccc(F)cc1)c1cccs1 ZINC000020095519 384574291 /nfs/dbraw/zinc/57/42/91/384574291.db2.gz JQIIRKUSFUSVKK-QWRGUYRKSA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@H](C)c1ccc(F)cc1)c1cccs1 ZINC000020095520 342969210 /nfs/dbraw/zinc/96/92/10/342969210.db2.gz JQIIRKUSFUSVKK-GHMZBOCLSA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccc(F)cc1)c1cccs1 ZINC000020095521 342969165 /nfs/dbraw/zinc/96/91/65/342969165.db2.gz JQIIRKUSFUSVKK-WDEREUQCSA-N 0 3 249.354 4.299 20 0 BIADHN Cc1ccc(CN[C@H](C)c2ccc(F)cc2)s1 ZINC000020095903 342969244 /nfs/dbraw/zinc/96/92/44/342969244.db2.gz ZDEQOERBSZUXBR-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2ccc(F)cc2)s1 ZINC000020095905 342969230 /nfs/dbraw/zinc/96/92/30/342969230.db2.gz ZDEQOERBSZUXBR-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccccc1CN[C@H](C)c1ccccc1C ZINC000020126104 179284162 /nfs/dbraw/zinc/28/41/62/179284162.db2.gz SVJAIVASSFGMPW-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccccc1CN[C@@H](C)c1ccccc1C ZINC000020126105 179282855 /nfs/dbraw/zinc/28/28/55/179282855.db2.gz SVJAIVASSFGMPW-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccsc1CN[C@H](C)c1ccccc1C ZINC000020126130 179320888 /nfs/dbraw/zinc/32/08/88/179320888.db2.gz JAIHNEXBOOMDRV-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccsc1CN[C@@H](C)c1ccccc1C ZINC000020126131 179338233 /nfs/dbraw/zinc/33/82/33/179338233.db2.gz JAIHNEXBOOMDRV-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccccc1[C@@H](C)N[C@H](C)c1cccs1 ZINC000020126186 179322750 /nfs/dbraw/zinc/32/27/50/179322750.db2.gz GMZATXHAQPGUCX-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccccc1[C@@H](C)N[C@@H](C)c1cccs1 ZINC000020126187 179321962 /nfs/dbraw/zinc/32/19/62/179321962.db2.gz GMZATXHAQPGUCX-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc(CN[C@H](C)c2ccccc2C)s1 ZINC000020126332 590076640 /nfs/dbraw/zinc/07/66/40/590076640.db2.gz MSWCVHMMRXBBBI-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2ccccc2C)s1 ZINC000020126333 590076920 /nfs/dbraw/zinc/07/69/20/590076920.db2.gz MSWCVHMMRXBBBI-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN C[C@@H](N[C@@H]1CCc2ccccc21)c1cccs1 ZINC000020129762 342971026 /nfs/dbraw/zinc/97/10/26/342971026.db2.gz YDJOAHOVWSETEC-BXUZGUMPSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H](N[C@@H]1CCc2ccccc21)c1cccs1 ZINC000020129763 342971061 /nfs/dbraw/zinc/97/10/61/342971061.db2.gz YDJOAHOVWSETEC-SMDDNHRTSA-N 0 3 243.375 4.086 20 0 BIADHN Cc1ccc([C@@H](C)NCc2cccc(C)c2)s1 ZINC000020134356 259389239 /nfs/dbraw/zinc/38/92/39/259389239.db2.gz FIDHAHZJURLTSN-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@H](C)NCc2cccc(C)c2)s1 ZINC000020134358 259389260 /nfs/dbraw/zinc/38/92/60/259389260.db2.gz FIDHAHZJURLTSN-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CC[C@@H](NCc1cccc(C)c1)c1cccs1 ZINC000020134483 590077605 /nfs/dbraw/zinc/07/76/05/590077605.db2.gz VQPLCVXCAQPBIW-CQSZACIVSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@H](NCc1cccc(C)c1)c1cccs1 ZINC000020134487 590077286 /nfs/dbraw/zinc/07/72/86/590077286.db2.gz VQPLCVXCAQPBIW-AWEZNQCLSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1ccc([C@H](C)NC[C@H](C)c2ccccc2)o1 ZINC000020137212 590077109 /nfs/dbraw/zinc/07/71/09/590077109.db2.gz ULXXEYWYQIGYCV-JSGCOSHPSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1ccc([C@H](C)NC[C@@H](C)c2ccccc2)o1 ZINC000020137215 590077051 /nfs/dbraw/zinc/07/70/51/590077051.db2.gz ULXXEYWYQIGYCV-OCCSQVGLSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1ccc([C@@H](C)NC[C@H](C)c2ccccc2)o1 ZINC000020137217 590077179 /nfs/dbraw/zinc/07/71/79/590077179.db2.gz ULXXEYWYQIGYCV-GXTWGEPZSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1ccc([C@@H](C)NC[C@@H](C)c2ccccc2)o1 ZINC000020137221 590077545 /nfs/dbraw/zinc/07/75/45/590077545.db2.gz ULXXEYWYQIGYCV-TZMCWYRMSA-N 0 3 243.350 4.042 20 0 BIADHN CC[C@@H](NCc1cccs1)c1ccc(F)cc1 ZINC000020139156 342971676 /nfs/dbraw/zinc/97/16/76/342971676.db2.gz GBMUNOWYFTYEAH-CQSZACIVSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@H](NCc1cccs1)c1ccc(F)cc1 ZINC000020139159 342971645 /nfs/dbraw/zinc/97/16/45/342971645.db2.gz GBMUNOWYFTYEAH-AWEZNQCLSA-N 0 3 249.354 4.128 20 0 BIADHN Cc1ccc([C@@H](C)NCc2cccs2)c(C)c1 ZINC000020139237 259389197 /nfs/dbraw/zinc/38/91/97/259389197.db2.gz XYJBHXANLPEJCV-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@H](C)NCc2cccs2)c(C)c1 ZINC000020139240 259389365 /nfs/dbraw/zinc/38/93/65/259389365.db2.gz XYJBHXANLPEJCV-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(C)c([C@@H](C)NCc2cccs2)c1 ZINC000020139249 259389139 /nfs/dbraw/zinc/38/91/39/259389139.db2.gz UWUPVYXKNBTRTB-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(C)c([C@H](C)NCc2cccs2)c1 ZINC000020139252 259389308 /nfs/dbraw/zinc/38/93/08/259389308.db2.gz UWUPVYXKNBTRTB-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CC[C@@H](NCc1cccs1)c1ccc(C)cc1 ZINC000020139288 590078474 /nfs/dbraw/zinc/07/84/74/590078474.db2.gz GSMKUHUTVQTNQA-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@H](NCc1cccs1)c1ccc(C)cc1 ZINC000020139291 590078397 /nfs/dbraw/zinc/07/83/97/590078397.db2.gz GSMKUHUTVQTNQA-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1ccc([C@@H](C)NCc2cccs2)cc1C ZINC000020139427 259389203 /nfs/dbraw/zinc/38/92/03/259389203.db2.gz FXRGNLFJEOLERR-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@H](C)NCc2cccs2)cc1C ZINC000020139429 259389333 /nfs/dbraw/zinc/38/93/33/259389333.db2.gz FXRGNLFJEOLERR-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CCc1ccc([C@@H](C)NCc2cccs2)cc1 ZINC000020139442 590078197 /nfs/dbraw/zinc/07/81/97/590078197.db2.gz RJKKTXBDOKIOHW-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1ccc([C@H](C)NCc2cccs2)cc1 ZINC000020139446 590077935 /nfs/dbraw/zinc/07/79/35/590077935.db2.gz RJKKTXBDOKIOHW-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CC[C@@H](NCc1cccs1)c1cccs1 ZINC000020139586 590078247 /nfs/dbraw/zinc/07/82/47/590078247.db2.gz ZDBZXZAHTQRWLH-LLVKDONJSA-N 0 3 237.393 4.051 20 0 BIADHN CC[C@H](NCc1cccs1)c1cccs1 ZINC000020139588 590078345 /nfs/dbraw/zinc/07/83/45/590078345.db2.gz ZDBZXZAHTQRWLH-NSHDSACASA-N 0 3 237.393 4.051 20 0 BIADHN Cc1ccsc1CN[C@H](C)c1cccc(F)c1 ZINC000020147798 342972146 /nfs/dbraw/zinc/97/21/46/342972146.db2.gz NHJMEWXOYUBHNA-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1CN[C@@H](C)c1cccc(F)c1 ZINC000020147799 342972082 /nfs/dbraw/zinc/97/20/82/342972082.db2.gz NHJMEWXOYUBHNA-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(CN[C@H](C)c2cccc(F)c2)s1 ZINC000020148043 342972102 /nfs/dbraw/zinc/97/21/02/342972102.db2.gz ZXSUFAKASWRBFG-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2cccc(F)c2)s1 ZINC000020148044 342972066 /nfs/dbraw/zinc/97/20/66/342972066.db2.gz ZXSUFAKASWRBFG-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2cccs2)cc1 ZINC000020148243 384584765 /nfs/dbraw/zinc/58/47/65/384584765.db2.gz FWSFXJXEBRIFEZ-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2cccs2)cc1 ZINC000020148244 384586538 /nfs/dbraw/zinc/58/65/38/384586538.db2.gz FWSFXJXEBRIFEZ-STQMWFEESA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2cccs2)cc1 ZINC000020148245 384584907 /nfs/dbraw/zinc/58/49/07/384584907.db2.gz FWSFXJXEBRIFEZ-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2cccs2)cc1 ZINC000020148246 384586758 /nfs/dbraw/zinc/58/67/58/384586758.db2.gz FWSFXJXEBRIFEZ-QWHCGFSZSA-N 0 3 245.391 4.468 20 0 BIADHN C[C@@H](N[C@@H]1CCCc2occc21)c1ccccc1 ZINC000020204143 342976499 /nfs/dbraw/zinc/97/64/99/342976499.db2.gz SMCMIKSQQKJNPM-IUODEOHRSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@H](N[C@@H]1CCCc2occc21)c1ccccc1 ZINC000020204146 384599228 /nfs/dbraw/zinc/59/92/28/384599228.db2.gz SMCMIKSQQKJNPM-SWLSCSKDSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@@H](N[C@H]1CCCc2occc21)c1ccccc1 ZINC000020204149 342976535 /nfs/dbraw/zinc/97/65/35/342976535.db2.gz SMCMIKSQQKJNPM-DOMZBBRYSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@H](N[C@H]1CCCc2occc21)c1ccccc1 ZINC000020204152 342976720 /nfs/dbraw/zinc/97/67/20/342976720.db2.gz SMCMIKSQQKJNPM-WFASDCNBSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@@H](N[C@@H]1CCCc2occc21)c1cccs1 ZINC000020204310 342976724 /nfs/dbraw/zinc/97/67/24/342976724.db2.gz SEYBCBVAGOMQJG-ZYHUDNBSSA-N 0 3 247.363 4.069 20 0 BIADHN C[C@H](N[C@@H]1CCCc2occc21)c1cccs1 ZINC000020204313 384600305 /nfs/dbraw/zinc/60/03/05/384600305.db2.gz SEYBCBVAGOMQJG-CMPLNLGQSA-N 0 3 247.363 4.069 20 0 BIADHN C[C@@H](N[C@H]1CCCc2occc21)c1cccs1 ZINC000020204316 342976816 /nfs/dbraw/zinc/97/68/16/342976816.db2.gz SEYBCBVAGOMQJG-PWSUYJOCSA-N 0 3 247.363 4.069 20 0 BIADHN C[C@H](N[C@H]1CCCc2occc21)c1cccs1 ZINC000020204319 342976826 /nfs/dbraw/zinc/97/68/26/342976826.db2.gz SEYBCBVAGOMQJG-JQWIXIFHSA-N 0 3 247.363 4.069 20 0 BIADHN Cc1cc([C@H](C)N[C@H](C)c2ccccc2)c(C)o1 ZINC000020437292 178257629 /nfs/dbraw/zinc/25/76/29/178257629.db2.gz SUZGSHZDQDYUQI-OLZOCXBDSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cc([C@H](C)N[C@@H](C)c2ccccc2)c(C)o1 ZINC000020437296 178253571 /nfs/dbraw/zinc/25/35/71/178253571.db2.gz SUZGSHZDQDYUQI-STQMWFEESA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cc([C@@H](C)N[C@H](C)c2ccccc2)c(C)o1 ZINC000020437299 178233063 /nfs/dbraw/zinc/23/30/63/178233063.db2.gz SUZGSHZDQDYUQI-CHWSQXEVSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cc([C@@H](C)N[C@@H](C)c2ccccc2)c(C)o1 ZINC000020437303 178231042 /nfs/dbraw/zinc/23/10/42/178231042.db2.gz SUZGSHZDQDYUQI-QWHCGFSZSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccc(C)cc2)c(C)o1 ZINC000020438389 178629115 /nfs/dbraw/zinc/62/91/15/178629115.db2.gz BGKSMBZUTXCPIE-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc([C@H](C)NCc2ccc(C)cc2)c(C)o1 ZINC000020438392 356744096 /nfs/dbraw/zinc/74/40/96/356744096.db2.gz BGKSMBZUTXCPIE-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN CC[C@@H](NCc1cccc(F)c1)c1cccs1 ZINC000020473290 590116101 /nfs/dbraw/zinc/11/61/01/590116101.db2.gz ZSYQNITZEKQLJM-CYBMUJFWSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@H](NCc1cccc(F)c1)c1cccs1 ZINC000020473291 590115944 /nfs/dbraw/zinc/11/59/44/590115944.db2.gz ZSYQNITZEKQLJM-ZDUSSCGKSA-N 0 3 249.354 4.128 20 0 BIADHN Cc1ccc([C@@H](C)NCc2cccc(F)c2)s1 ZINC000020473327 397965588 /nfs/dbraw/zinc/96/55/88/397965588.db2.gz PXZSTJFZKHQLNJ-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc([C@H](C)NCc2cccc(F)c2)s1 ZINC000020473328 397965615 /nfs/dbraw/zinc/96/56/15/397965615.db2.gz PXZSTJFZKHQLNJ-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN CC[C@@H](NCc1cccc(F)c1)c1ccccc1 ZINC000020473429 357009664 /nfs/dbraw/zinc/00/96/64/357009664.db2.gz ZTSKVPIEZYDERM-MRXNPFEDSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@H](NCc1cccc(F)c1)c1ccccc1 ZINC000020473430 171531603 /nfs/dbraw/zinc/53/16/03/171531603.db2.gz ZTSKVPIEZYDERM-INIZCTEOSA-N 0 3 243.325 4.067 20 0 BIADHN CCCCCC[C@@H](C)N[C@@H](C)c1ccccn1 ZINC000020520193 590117585 /nfs/dbraw/zinc/11/75/85/590117585.db2.gz VFRSFDTXQBXOMG-KGLIPLIRSA-N 0 3 234.387 4.091 20 0 BIADHN CCCCCC[C@H](C)N[C@@H](C)c1ccccn1 ZINC000020520194 590117711 /nfs/dbraw/zinc/11/77/11/590117711.db2.gz VFRSFDTXQBXOMG-KBPBESRZSA-N 0 3 234.387 4.091 20 0 BIADHN CCCCCC[C@@H](C)N[C@H](C)c1ccccn1 ZINC000020520195 590117460 /nfs/dbraw/zinc/11/74/60/590117460.db2.gz VFRSFDTXQBXOMG-ZIAGYGMSSA-N 0 3 234.387 4.091 20 0 BIADHN CCCCCC[C@H](C)N[C@H](C)c1ccccn1 ZINC000020520196 590117665 /nfs/dbraw/zinc/11/76/65/590117665.db2.gz VFRSFDTXQBXOMG-UONOGXRCSA-N 0 3 234.387 4.091 20 0 BIADHN CC(C)[C@@H](C)N[C@H](c1ccco1)c1ccccc1 ZINC000020522844 167383694 /nfs/dbraw/zinc/38/36/94/167383694.db2.gz AQCPBYUCCYNXPY-CJNGLKHVSA-N 0 3 243.350 4.003 20 0 BIADHN CC(C)[C@H](C)N[C@H](c1ccco1)c1ccccc1 ZINC000020522846 590118647 /nfs/dbraw/zinc/11/86/47/590118647.db2.gz AQCPBYUCCYNXPY-BBRMVZONSA-N 0 3 243.350 4.003 20 0 BIADHN CC(C)[C@@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000020522848 167385206 /nfs/dbraw/zinc/38/52/06/167385206.db2.gz AQCPBYUCCYNXPY-CZUORRHYSA-N 0 3 243.350 4.003 20 0 BIADHN CC(C)[C@H](C)N[C@@H](c1ccco1)c1ccccc1 ZINC000020522850 590118719 /nfs/dbraw/zinc/11/87/19/590118719.db2.gz AQCPBYUCCYNXPY-XJKSGUPXSA-N 0 3 243.350 4.003 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)CCC(C)C)o1 ZINC000020549175 259399640 /nfs/dbraw/zinc/39/96/40/259399640.db2.gz FKYFZUBKXJTVQQ-YPMHNXCESA-N 0 3 223.360 4.063 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)CCC(C)C)o1 ZINC000020549176 259399520 /nfs/dbraw/zinc/39/95/20/259399520.db2.gz FKYFZUBKXJTVQQ-AAEUAGOBSA-N 0 3 223.360 4.063 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)CCC(C)C)o1 ZINC000020549177 259399528 /nfs/dbraw/zinc/39/95/28/259399528.db2.gz FKYFZUBKXJTVQQ-DGCLKSJQSA-N 0 3 223.360 4.063 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)CCC(C)C)o1 ZINC000020549178 259399447 /nfs/dbraw/zinc/39/94/47/259399447.db2.gz FKYFZUBKXJTVQQ-WCQYABFASA-N 0 3 223.360 4.063 20 0 BIADHN CC[C@@H](NCc1cccc(C)c1)c1ccccc1 ZINC000020552277 357013505 /nfs/dbraw/zinc/01/35/05/357013505.db2.gz DZJMYJULAGYOIW-QGZVFWFLSA-N 0 3 239.362 4.236 20 0 BIADHN CC[C@H](NCc1cccc(C)c1)c1ccccc1 ZINC000020552278 171531672 /nfs/dbraw/zinc/53/16/72/171531672.db2.gz DZJMYJULAGYOIW-KRWDZBQOSA-N 0 3 239.362 4.236 20 0 BIADHN CC[C@@H](C)N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000020560108 385469164 /nfs/dbraw/zinc/46/91/64/385469164.db2.gz XVLIGARBTANPKO-BDAKNGLRSA-N 0 3 246.181 4.443 20 0 BIADHN CC[C@H](C)N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000020560110 385469169 /nfs/dbraw/zinc/46/91/69/385469169.db2.gz XVLIGARBTANPKO-IUCAKERBSA-N 0 3 246.181 4.443 20 0 BIADHN CC[C@@H](C)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000020560112 385469048 /nfs/dbraw/zinc/46/90/48/385469048.db2.gz XVLIGARBTANPKO-RKDXNWHRSA-N 0 3 246.181 4.443 20 0 BIADHN CC[C@H](C)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000020560114 259399987 /nfs/dbraw/zinc/39/99/87/259399987.db2.gz XVLIGARBTANPKO-DTWKUNHWSA-N 0 3 246.181 4.443 20 0 BIADHN C[C@H]1C[C@H]1c1ccc(CNC2CCC(C)CC2)o1 ZINC000021013566 357946437 /nfs/dbraw/zinc/94/64/37/357946437.db2.gz AQLINFABAHBGMR-PQNSMMMDSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@H]1C[C@@H]1c1ccc(CNC2CCC(C)CC2)o1 ZINC000021013567 357946076 /nfs/dbraw/zinc/94/60/76/357946076.db2.gz AQLINFABAHBGMR-GWIFJHRUSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@@H]1C[C@H]1c1ccc(CNC2CCC(C)CC2)o1 ZINC000021013568 357946282 /nfs/dbraw/zinc/94/62/82/357946282.db2.gz AQLINFABAHBGMR-HNQLUHSGSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@@H]1C[C@@H]1c1ccc(CNC2CCC(C)CC2)o1 ZINC000021013569 357946528 /nfs/dbraw/zinc/94/65/28/357946528.db2.gz AQLINFABAHBGMR-CTBQFLBTSA-N 0 3 247.382 4.071 20 0 BIADHN CCC[C@@H](C)NCc1cccc(Cl)c1Cl ZINC000021019305 349886463 /nfs/dbraw/zinc/88/64/63/349886463.db2.gz QQCZCICQEVDFQB-SECBINFHSA-N 0 3 246.181 4.272 20 0 BIADHN CCC[C@H](C)NCc1cccc(Cl)c1Cl ZINC000021019308 371357600 /nfs/dbraw/zinc/35/76/00/371357600.db2.gz QQCZCICQEVDFQB-VIFPVBQESA-N 0 3 246.181 4.272 20 0 BIADHN Cc1ccc([C@@H](C)NCCC2=CCCCC2)o1 ZINC000021039182 386214324 /nfs/dbraw/zinc/21/43/24/386214324.db2.gz YCEXLUJXUQMWKX-CYBMUJFWSA-N 0 3 233.355 4.129 20 0 BIADHN Cc1ccc([C@H](C)NCCC2=CCCCC2)o1 ZINC000021039189 386215304 /nfs/dbraw/zinc/21/53/04/386215304.db2.gz YCEXLUJXUQMWKX-ZDUSSCGKSA-N 0 3 233.355 4.129 20 0 BIADHN CCC[C@@H](C)NCc1ccc(Cl)cc1Cl ZINC000021506686 350001542 /nfs/dbraw/zinc/00/15/42/350001542.db2.gz HOMCKISFDBTEHV-SECBINFHSA-N 0 3 246.181 4.272 20 0 BIADHN CCC[C@H](C)NCc1ccc(Cl)cc1Cl ZINC000021506688 350001485 /nfs/dbraw/zinc/00/14/85/350001485.db2.gz HOMCKISFDBTEHV-VIFPVBQESA-N 0 3 246.181 4.272 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@@H](C)c1ccco1 ZINC000021786512 323100853 /nfs/dbraw/zinc/10/08/53/323100853.db2.gz HCWFGADOSFVXLK-OLZOCXBDSA-N 0 3 223.360 4.145 20 0 BIADHN CC(C)CCC[C@H](C)N[C@@H](C)c1ccco1 ZINC000021786516 323100837 /nfs/dbraw/zinc/10/08/37/323100837.db2.gz HCWFGADOSFVXLK-STQMWFEESA-N 0 3 223.360 4.145 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@H](C)c1ccco1 ZINC000021786519 323100817 /nfs/dbraw/zinc/10/08/17/323100817.db2.gz HCWFGADOSFVXLK-CHWSQXEVSA-N 0 3 223.360 4.145 20 0 BIADHN CC(C)CCC[C@H](C)N[C@H](C)c1ccco1 ZINC000021786523 323100807 /nfs/dbraw/zinc/10/08/07/323100807.db2.gz HCWFGADOSFVXLK-QWHCGFSZSA-N 0 3 223.360 4.145 20 0 BIADHN C[C@H](N[C@@H](C)c1ccsc1)c1ccsc1 ZINC000034257195 487706077 /nfs/dbraw/zinc/70/60/77/487706077.db2.gz NRFDVPUSCUQYLF-UWVGGRQHSA-N 0 3 237.393 4.221 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccsc1)c1ccsc1 ZINC000034257197 487706403 /nfs/dbraw/zinc/70/64/03/487706403.db2.gz NRFDVPUSCUQYLF-AOOOYVTPSA-N 0 3 237.393 4.221 20 0 BIADHN C[C@@H](N[C@H](C)c1ccsc1)c1ccsc1 ZINC000034257199 487706093 /nfs/dbraw/zinc/70/60/93/487706093.db2.gz NRFDVPUSCUQYLF-NXEZZACHSA-N 0 3 237.393 4.221 20 0 BIADHN Cc1cc([C@H](C)NCc2cccc(C)c2)c(C)o1 ZINC000034956890 179098379 /nfs/dbraw/zinc/09/83/79/179098379.db2.gz UDZKRQKWPYVHLJ-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc([C@@H](C)NCc2cccc(C)c2)c(C)o1 ZINC000034956891 179099324 /nfs/dbraw/zinc/09/93/24/179099324.db2.gz UDZKRQKWPYVHLJ-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN CC[C@H](NCc1ccsc1)c1ccc(C)cc1 ZINC000034996320 645857509 /nfs/dbraw/zinc/85/75/09/645857509.db2.gz XBMFZYMBPLJHJH-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1ccsc1)c1ccc(C)cc1 ZINC000034996321 645858124 /nfs/dbraw/zinc/85/81/24/645858124.db2.gz XBMFZYMBPLJHJH-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN CCc1ccc([C@H](C)NCc2ccsc2)cc1 ZINC000035009804 171839294 /nfs/dbraw/zinc/83/92/94/171839294.db2.gz GKJJEGHPFYXFOI-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN Cc1ccc(C)c([C@@H](C)NCc2ccsc2)c1 ZINC000035010593 387026290 /nfs/dbraw/zinc/02/62/90/387026290.db2.gz WQTPZIMJIIQCQU-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(C)c([C@H](C)NCc2ccsc2)c1 ZINC000035010595 356669723 /nfs/dbraw/zinc/66/97/23/356669723.db2.gz WQTPZIMJIIQCQU-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CCC[C@H](NCc1ccsc1)c1ccccc1 ZINC000035013116 358453220 /nfs/dbraw/zinc/45/32/20/358453220.db2.gz QOUZTZBSEHUZPY-HNNXBMFYSA-N 0 3 245.391 4.379 20 0 BIADHN CCC[C@@H](NCc1ccsc1)c1ccccc1 ZINC000035013118 387549786 /nfs/dbraw/zinc/54/97/86/387549786.db2.gz QOUZTZBSEHUZPY-OAHLLOKOSA-N 0 3 245.391 4.379 20 0 BIADHN CC(C)[C@H](NCc1cccs1)c1ccccc1 ZINC000035015797 187257435 /nfs/dbraw/zinc/25/74/35/187257435.db2.gz YMQVYLVPWUZCSY-HNNXBMFYSA-N 0 3 245.391 4.235 20 0 BIADHN CC(C)[C@@H](NCc1cccs1)c1ccccc1 ZINC000035015800 411181825 /nfs/dbraw/zinc/18/18/25/411181825.db2.gz YMQVYLVPWUZCSY-OAHLLOKOSA-N 0 3 245.391 4.235 20 0 BIADHN CC(C)[C@H](NCc1ccccc1)c1ccccc1 ZINC000035015809 322822843 /nfs/dbraw/zinc/82/28/43/322822843.db2.gz XESZTWHSVQXKKY-KRWDZBQOSA-N 0 3 239.362 4.174 20 0 BIADHN CC(C)[C@@H](NCc1ccccc1)c1ccccc1 ZINC000035015812 384393342 /nfs/dbraw/zinc/39/33/42/384393342.db2.gz XESZTWHSVQXKKY-QGZVFWFLSA-N 0 3 239.362 4.174 20 0 BIADHN Cc1ccc(CN[C@@H](c2ccccc2)C(C)C)o1 ZINC000035016058 358450468 /nfs/dbraw/zinc/45/04/68/358450468.db2.gz WISQRIDJLYTKLU-MRXNPFEDSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1ccc(CN[C@H](c2ccccc2)C(C)C)o1 ZINC000035016061 323394980 /nfs/dbraw/zinc/39/49/80/323394980.db2.gz WISQRIDJLYTKLU-INIZCTEOSA-N 0 3 243.350 4.075 20 0 BIADHN CC(C)[C@H](NCc1ccsc1)c1ccccc1 ZINC000035016122 188234055 /nfs/dbraw/zinc/23/40/55/188234055.db2.gz NWGOXCUVPRASPR-HNNXBMFYSA-N 0 3 245.391 4.235 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2ccccc2)cc1C ZINC000035043003 356703519 /nfs/dbraw/zinc/70/35/19/356703519.db2.gz BQEVRLMQOWXYAI-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc(CN[C@H](C)c2ccccc2)cc1C ZINC000035043006 178629414 /nfs/dbraw/zinc/62/94/14/178629414.db2.gz BQEVRLMQOWXYAI-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN CCN[C@@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000035101352 387553810 /nfs/dbraw/zinc/55/38/10/387553810.db2.gz SIEZDTQYDFQHON-HNNXBMFYSA-N 0 3 245.753 4.039 20 0 BIADHN CCN[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000035101353 387553595 /nfs/dbraw/zinc/55/35/95/387553595.db2.gz SIEZDTQYDFQHON-OAHLLOKOSA-N 0 3 245.753 4.039 20 0 BIADHN CCCCc1oc2ccccc2c1CNC1CC1 ZINC000035112325 169032675 /nfs/dbraw/zinc/03/26/75/169032675.db2.gz UNYDRIAUYQKRQE-UHFFFAOYSA-N 0 3 243.350 4.027 20 0 BIADHN CN[C@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000035117303 387555091 /nfs/dbraw/zinc/55/50/91/387555091.db2.gz BHVJQCGWCQJAHD-HNNXBMFYSA-N 0 3 245.391 4.180 20 0 BIADHN CN[C@@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000035117305 387554872 /nfs/dbraw/zinc/55/48/72/387554872.db2.gz BHVJQCGWCQJAHD-OAHLLOKOSA-N 0 3 245.391 4.180 20 0 BIADHN Cc1cc(NCCC(C)C)c2ccccc2n1 ZINC000035206350 178157865 /nfs/dbraw/zinc/15/78/65/178157865.db2.gz XJIMARINIDWSEX-UHFFFAOYSA-N 0 3 228.339 4.001 20 0 BIADHN CCC(CC)Nc1cc(C)nc2ccccc21 ZINC000035206363 168393846 /nfs/dbraw/zinc/39/38/46/168393846.db2.gz DMEGKVLTEMPGPZ-UHFFFAOYSA-N 0 3 228.339 4.144 20 0 BIADHN C[C@@H](Nc1ccnc2ccccc21)c1ccccc1 ZINC000035260655 384406480 /nfs/dbraw/zinc/40/64/80/384406480.db2.gz GVCMADXYHWUCRU-CYBMUJFWSA-N 0 3 248.329 4.408 20 0 BIADHN CN[C@@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000035465421 384412371 /nfs/dbraw/zinc/41/23/71/384412371.db2.gz DRKHPZSOOFETBZ-SFHVURJKSA-N 0 3 247.341 4.149 20 0 BIADHN CN[C@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000035465424 384411558 /nfs/dbraw/zinc/41/15/58/384411558.db2.gz DRKHPZSOOFETBZ-GOSISDBHSA-N 0 3 247.341 4.149 20 0 BIADHN CCN[C@@H](c1ccccc1)c1cccc(Cl)c1 ZINC000035540623 170148444 /nfs/dbraw/zinc/14/84/44/170148444.db2.gz NXAWUQLITOEOJL-HNNXBMFYSA-N 0 3 245.753 4.039 20 0 BIADHN CCN[C@H](c1ccccc1)c1cccc(Cl)c1 ZINC000035540624 170165389 /nfs/dbraw/zinc/16/53/89/170165389.db2.gz NXAWUQLITOEOJL-OAHLLOKOSA-N 0 3 245.753 4.039 20 0 BIADHN CCCN[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000035581918 387575514 /nfs/dbraw/zinc/57/55/14/387575514.db2.gz MFKPXSCQTUTSBP-ZDUSSCGKSA-N 0 3 241.325 4.052 20 0 BIADHN CCCN[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000035581919 387574544 /nfs/dbraw/zinc/57/45/44/387574544.db2.gz MFKPXSCQTUTSBP-CYBMUJFWSA-N 0 3 241.325 4.052 20 0 BIADHN CCCN[C@@H](C)c1cc(Cl)sc1Cl ZINC000035585357 384412913 /nfs/dbraw/zinc/41/29/13/384412913.db2.gz DCTZXYJSIUHADY-LURJTMIESA-N 0 3 238.183 4.116 20 0 BIADHN CCCN[C@H](C)c1cc(Cl)sc1Cl ZINC000035585358 384412569 /nfs/dbraw/zinc/41/25/69/384412569.db2.gz DCTZXYJSIUHADY-ZCFIWIBFSA-N 0 3 238.183 4.116 20 0 BIADHN CC[C@H](NC1CC1)c1ccc(Cl)cc1Cl ZINC000035624723 342890657 /nfs/dbraw/zinc/89/06/57/342890657.db2.gz LSXUHTUQMQIUHO-LBPRGKRZSA-N 0 3 244.165 4.197 20 0 BIADHN CC[C@@H](NC1CC1)c1ccc(Cl)cc1Cl ZINC000035624725 384414494 /nfs/dbraw/zinc/41/44/94/384414494.db2.gz LSXUHTUQMQIUHO-GFCCVEGCSA-N 0 3 244.165 4.197 20 0 BIADHN CCN[C@@H](CC)c1ccc(Cl)cc1Cl ZINC000035624749 170144259 /nfs/dbraw/zinc/14/42/59/170144259.db2.gz CWNFEXYNJDJZFO-NSHDSACASA-N 0 3 232.154 4.054 20 0 BIADHN CCN[C@H](CC)c1ccc(Cl)cc1Cl ZINC000035624751 170161803 /nfs/dbraw/zinc/16/18/03/170161803.db2.gz CWNFEXYNJDJZFO-LLVKDONJSA-N 0 3 232.154 4.054 20 0 BIADHN CCC[C@H](N[C@@H](C)c1ccco1)c1ccccc1 ZINC000035738712 358458679 /nfs/dbraw/zinc/45/86/79/358458679.db2.gz PILVPSIHFSRMQF-ZFWWWQNUSA-N 0 3 243.350 4.472 20 0 BIADHN CCC[C@@H](N[C@@H](C)c1ccco1)c1ccccc1 ZINC000035738713 169403763 /nfs/dbraw/zinc/40/37/63/169403763.db2.gz PILVPSIHFSRMQF-DZGCQCFKSA-N 0 3 243.350 4.472 20 0 BIADHN CCC[C@H](N[C@H](C)c1ccco1)c1ccccc1 ZINC000035738714 358458604 /nfs/dbraw/zinc/45/86/04/358458604.db2.gz PILVPSIHFSRMQF-HIFRSBDPSA-N 0 3 243.350 4.472 20 0 BIADHN CCC[C@@H](N[C@H](C)c1ccco1)c1ccccc1 ZINC000035738715 387553874 /nfs/dbraw/zinc/55/38/74/387553874.db2.gz PILVPSIHFSRMQF-UKRRQHHQSA-N 0 3 243.350 4.472 20 0 BIADHN CCCNCc1ccc(-c2ccc(CC)cc2)o1 ZINC000036818955 387701944 /nfs/dbraw/zinc/70/19/44/387701944.db2.gz WQDFWURBLXZWDQ-UHFFFAOYSA-N 0 3 243.350 4.009 20 0 BIADHN CCc1ccc(-c2ccc(CNC(C)C)o2)cc1 ZINC000036818957 323684267 /nfs/dbraw/zinc/68/42/67/323684267.db2.gz VIJPSTPRFVIBLU-UHFFFAOYSA-N 0 3 243.350 4.007 20 0 BIADHN CCCCC[C@@H](C)N[C@@H](C)c1csc(C)n1 ZINC000036915641 712515187 /nfs/dbraw/zinc/51/51/87/712515187.db2.gz RDWHAVDCHPGXJU-MNOVXSKESA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@H](C)N[C@@H](C)c1csc(C)n1 ZINC000036915642 712515382 /nfs/dbraw/zinc/51/53/82/712515382.db2.gz RDWHAVDCHPGXJU-QWRGUYRKSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@@H](C)N[C@H](C)c1csc(C)n1 ZINC000036915643 712515270 /nfs/dbraw/zinc/51/52/70/712515270.db2.gz RDWHAVDCHPGXJU-GHMZBOCLSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@H](C)N[C@H](C)c1csc(C)n1 ZINC000036915644 712515495 /nfs/dbraw/zinc/51/54/95/712515495.db2.gz RDWHAVDCHPGXJU-WDEREUQCSA-N 0 3 240.416 4.071 20 0 BIADHN CC[C@H](C)[C@@H](C)N[C@@H](C)c1cc(F)ccc1F ZINC000036921778 387873451 /nfs/dbraw/zinc/87/34/51/387873451.db2.gz UICSTMAEFZOXOI-AXFHLTTASA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](C)[C@H](C)N[C@@H](C)c1cc(F)ccc1F ZINC000036921780 387872857 /nfs/dbraw/zinc/87/28/57/387872857.db2.gz UICSTMAEFZOXOI-DCAQKATOSA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](N[C@@H](C)c1ccc(C)o1)c1ccccc1 ZINC000036960394 343328461 /nfs/dbraw/zinc/32/84/61/343328461.db2.gz SQHVVZHRUYXOGE-ZFWWWQNUSA-N 0 3 243.350 4.390 20 0 BIADHN CC[C@@H](N[C@@H](C)c1ccc(C)o1)c1ccccc1 ZINC000036960396 343328816 /nfs/dbraw/zinc/32/88/16/343328816.db2.gz SQHVVZHRUYXOGE-DZGCQCFKSA-N 0 3 243.350 4.390 20 0 BIADHN CC[C@H](N[C@H](C)c1ccc(C)o1)c1ccccc1 ZINC000036960398 343328514 /nfs/dbraw/zinc/32/85/14/343328514.db2.gz SQHVVZHRUYXOGE-HIFRSBDPSA-N 0 3 243.350 4.390 20 0 BIADHN CC[C@@H](N[C@H](C)c1ccc(C)o1)c1ccccc1 ZINC000036960400 170912542 /nfs/dbraw/zinc/91/25/42/170912542.db2.gz SQHVVZHRUYXOGE-UKRRQHHQSA-N 0 3 243.350 4.390 20 0 BIADHN CC(C)[C@H](N[C@@H](C)c1ccco1)c1ccccc1 ZINC000036967655 187259426 /nfs/dbraw/zinc/25/94/26/187259426.db2.gz QEXPVVWKRZHZSS-BBRMVZONSA-N 0 3 243.350 4.328 20 0 BIADHN CC(C)[C@@H](N[C@@H](C)c1ccco1)c1ccccc1 ZINC000036967657 383925123 /nfs/dbraw/zinc/92/51/23/383925123.db2.gz QEXPVVWKRZHZSS-XJKSGUPXSA-N 0 3 243.350 4.328 20 0 BIADHN CC(C)[C@H](N[C@H](C)c1ccco1)c1ccccc1 ZINC000036967659 187259467 /nfs/dbraw/zinc/25/94/67/187259467.db2.gz QEXPVVWKRZHZSS-CJNGLKHVSA-N 0 3 243.350 4.328 20 0 BIADHN CC(C)[C@@H](N[C@H](C)c1ccco1)c1ccccc1 ZINC000036967661 383925084 /nfs/dbraw/zinc/92/50/84/383925084.db2.gz QEXPVVWKRZHZSS-CZUORRHYSA-N 0 3 243.350 4.328 20 0 BIADHN CCCC(CCC)Nc1cccc(CN(C)C)c1 ZINC000036979803 388551707 /nfs/dbraw/zinc/55/17/07/388551707.db2.gz WHQCSZVDXORCAL-UHFFFAOYSA-N 0 3 248.414 4.129 20 0 BIADHN C[C@H](N[C@@H](c1ccccc1)C1CC1)c1ccco1 ZINC000037075300 383934054 /nfs/dbraw/zinc/93/40/54/383934054.db2.gz YLXPMAQWXBXDRV-LRDDRELGSA-N 0 3 241.334 4.082 20 0 BIADHN C[C@@H](N[C@@H](c1ccccc1)C1CC1)c1ccco1 ZINC000037075301 343332635 /nfs/dbraw/zinc/33/26/35/343332635.db2.gz YLXPMAQWXBXDRV-WBMJQRKESA-N 0 3 241.334 4.082 20 0 BIADHN C[C@H](N[C@H](c1ccccc1)C1CC1)c1ccco1 ZINC000037075302 343332619 /nfs/dbraw/zinc/33/26/19/343332619.db2.gz YLXPMAQWXBXDRV-BLLLJJGKSA-N 0 3 241.334 4.082 20 0 BIADHN C[C@@H](N[C@H](c1ccccc1)C1CC1)c1ccco1 ZINC000037075303 175922852 /nfs/dbraw/zinc/92/28/52/175922852.db2.gz YLXPMAQWXBXDRV-MLGOLLRUSA-N 0 3 241.334 4.082 20 0 BIADHN CC(C)C[C@@H](C)N[C@@H](C)c1ccc(F)cc1F ZINC000037118071 323176854 /nfs/dbraw/zinc/17/68/54/323176854.db2.gz XPBSNHWLDDPUMG-MNOVXSKESA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@H](C)N[C@@H](C)c1ccc(F)cc1F ZINC000037118072 323176745 /nfs/dbraw/zinc/17/67/45/323176745.db2.gz XPBSNHWLDDPUMG-QWRGUYRKSA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@@H](C)N[C@H](C)c1ccc(F)cc1F ZINC000037118073 323176810 /nfs/dbraw/zinc/17/68/10/323176810.db2.gz XPBSNHWLDDPUMG-GHMZBOCLSA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@H](C)N[C@H](C)c1ccc(F)cc1F ZINC000037118074 323176805 /nfs/dbraw/zinc/17/68/05/323176805.db2.gz XPBSNHWLDDPUMG-WDEREUQCSA-N 0 3 241.325 4.050 20 0 BIADHN Cc1cccc([C@@H](C)N[C@@H](C)c2ccccc2)c1 ZINC000037185811 388591001 /nfs/dbraw/zinc/59/10/01/388591001.db2.gz QEBLRCRVPWTVPJ-LSDHHAIUSA-N 0 3 239.362 4.407 20 0 BIADHN Cc1cccc([C@H](C)N[C@@H](C)c2ccccc2)c1 ZINC000037185812 388590943 /nfs/dbraw/zinc/59/09/43/388590943.db2.gz QEBLRCRVPWTVPJ-GJZGRUSLSA-N 0 3 239.362 4.407 20 0 BIADHN Cc1cccc([C@@H](C)N[C@H](C)c2ccccc2)c1 ZINC000037185813 324405464 /nfs/dbraw/zinc/40/54/64/324405464.db2.gz QEBLRCRVPWTVPJ-HUUCEWRRSA-N 0 3 239.362 4.407 20 0 BIADHN Cc1cccc([C@H](C)N[C@H](C)c2ccccc2)c1 ZINC000037185814 323191202 /nfs/dbraw/zinc/19/12/02/323191202.db2.gz QEBLRCRVPWTVPJ-CABCVRRESA-N 0 3 239.362 4.407 20 0 BIADHN CC[C@@H](C)N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000037186689 358469503 /nfs/dbraw/zinc/46/95/03/358469503.db2.gz KMWZWAVMOQACAV-PWSUYJOCSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@H](C)N[C@@H](CC(F)(F)F)c1ccccc1 ZINC000037186690 171345775 /nfs/dbraw/zinc/34/57/75/171345775.db2.gz KMWZWAVMOQACAV-JQWIXIFHSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@@H](C)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000037186691 358469978 /nfs/dbraw/zinc/46/99/78/358469978.db2.gz KMWZWAVMOQACAV-ZYHUDNBSSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@H](C)N[C@H](CC(F)(F)F)c1ccccc1 ZINC000037186692 171348003 /nfs/dbraw/zinc/34/80/03/171348003.db2.gz KMWZWAVMOQACAV-CMPLNLGQSA-N 0 3 245.288 4.068 20 0 BIADHN C[C@H](NC1CCCC1)c1ccc(F)cc1Cl ZINC000037186879 388591271 /nfs/dbraw/zinc/59/12/71/388591271.db2.gz LJFLUCPKIHRJJQ-VIFPVBQESA-N 0 3 241.737 4.072 20 0 BIADHN C[C@@H](NC1CCCC1)c1ccc(F)cc1Cl ZINC000037186880 388591475 /nfs/dbraw/zinc/59/14/75/388591475.db2.gz LJFLUCPKIHRJJQ-SECBINFHSA-N 0 3 241.737 4.072 20 0 BIADHN CCCCN[C@@H](CC(F)(F)F)c1ccccc1 ZINC000037198029 387560739 /nfs/dbraw/zinc/56/07/39/387560739.db2.gz SWGRKXRQSDJQFD-LBPRGKRZSA-N 0 3 245.288 4.070 20 0 BIADHN CCCCN[C@H](CC(F)(F)F)c1ccccc1 ZINC000037198030 387560594 /nfs/dbraw/zinc/56/05/94/387560594.db2.gz SWGRKXRQSDJQFD-GFCCVEGCSA-N 0 3 245.288 4.070 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2cccc(C)c2)cc1 ZINC000037214558 388599475 /nfs/dbraw/zinc/59/94/75/388599475.db2.gz QOXNBIJNSQDDKO-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc(CN[C@H](C)c2cccc(C)c2)cc1 ZINC000037214559 388599067 /nfs/dbraw/zinc/59/90/67/388599067.db2.gz QOXNBIJNSQDDKO-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cccc(CN[C@@H](C)c2cccc(C)c2)c1 ZINC000037230805 324461046 /nfs/dbraw/zinc/46/10/46/324461046.db2.gz FGFOOSQPNDBNSU-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cccc(CN[C@H](C)c2cccc(C)c2)c1 ZINC000037230806 388605837 /nfs/dbraw/zinc/60/58/37/388605837.db2.gz FGFOOSQPNDBNSU-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN C[C@H]1C[C@H]1c1ccc(CN[C@H]2CCC[C@@H](C)C2)o1 ZINC000037252786 398312741 /nfs/dbraw/zinc/31/27/41/398312741.db2.gz QUFAMELMGXATCJ-UKTARXLSSA-N 0 3 247.382 4.071 20 0 BIADHN CC(C)C[C@@H](C)N[C@@H](C)c1c(F)cccc1F ZINC000037264298 388625509 /nfs/dbraw/zinc/62/55/09/388625509.db2.gz SVQXNGBNNQLCAC-MNOVXSKESA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@H](C)N[C@@H](C)c1c(F)cccc1F ZINC000037264299 388625662 /nfs/dbraw/zinc/62/56/62/388625662.db2.gz SVQXNGBNNQLCAC-QWRGUYRKSA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@@H](C)N[C@H](C)c1c(F)cccc1F ZINC000037264300 324520927 /nfs/dbraw/zinc/52/09/27/324520927.db2.gz SVQXNGBNNQLCAC-GHMZBOCLSA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@H](C)N[C@H](C)c1c(F)cccc1F ZINC000037264301 324520830 /nfs/dbraw/zinc/52/08/30/324520830.db2.gz SVQXNGBNNQLCAC-WDEREUQCSA-N 0 3 241.325 4.050 20 0 BIADHN CCCC[C@@H](CC)CNCc1ccc(Cl)o1 ZINC000037486952 323284336 /nfs/dbraw/zinc/28/43/36/323284336.db2.gz MRRQXPHLHGPETA-LLVKDONJSA-N 0 3 243.778 4.239 20 0 BIADHN CCCC[C@H](CC)CNCc1ccc(Cl)o1 ZINC000037486953 323283957 /nfs/dbraw/zinc/28/39/57/323283957.db2.gz MRRQXPHLHGPETA-NSHDSACASA-N 0 3 243.778 4.239 20 0 BIADHN CC(C)CCC[C@@H](C)NCc1ccc(Cl)o1 ZINC000037487003 323284205 /nfs/dbraw/zinc/28/42/05/323284205.db2.gz LCEAKHOGJZBYOB-LLVKDONJSA-N 0 3 243.778 4.237 20 0 BIADHN CC(C)CCC[C@H](C)NCc1ccc(Cl)o1 ZINC000037487004 323284474 /nfs/dbraw/zinc/28/44/74/323284474.db2.gz LCEAKHOGJZBYOB-NSHDSACASA-N 0 3 243.778 4.237 20 0 BIADHN Clc1ccccc1CNCCC1CCCC1 ZINC000037492909 324570077 /nfs/dbraw/zinc/57/00/77/324570077.db2.gz UHVCBSWEDAXTOL-UHFFFAOYSA-N 0 3 237.774 4.010 20 0 BIADHN Cc1ccsc1CN[C@@H](C)c1ccccc1F ZINC000037494500 343347377 /nfs/dbraw/zinc/34/73/77/343347377.db2.gz DOQORYIDEHOGPF-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1CN[C@H](C)c1ccccc1F ZINC000037494501 343347200 /nfs/dbraw/zinc/34/72/00/343347200.db2.gz DOQORYIDEHOGPF-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN CC(C)(C)CC(C)(C)NCc1ccc(Cl)o1 ZINC000037502514 383981997 /nfs/dbraw/zinc/98/19/97/383981997.db2.gz CZUKMZGVTBFDPO-UHFFFAOYSA-N 0 3 243.778 4.237 20 0 BIADHN CCNC(c1cccc(C)c1)c1cccc(C)c1 ZINC000037535726 388645884 /nfs/dbraw/zinc/64/58/84/388645884.db2.gz MTVHNOWMLXKTJV-UHFFFAOYSA-N 0 3 239.362 4.002 20 0 BIADHN CC[C@H](NCc1ccccc1C)c1ccccc1 ZINC000037718860 358477453 /nfs/dbraw/zinc/47/74/53/358477453.db2.gz YVOOQXOXFBQFCE-KRWDZBQOSA-N 0 3 239.362 4.236 20 0 BIADHN CC[C@@H](NCc1ccccc1C)c1ccccc1 ZINC000037718861 358477496 /nfs/dbraw/zinc/47/74/96/358477496.db2.gz YVOOQXOXFBQFCE-QGZVFWFLSA-N 0 3 239.362 4.236 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccccc2C)s1 ZINC000037718932 322902921 /nfs/dbraw/zinc/90/29/21/322902921.db2.gz MQQVOUGYEMIEOI-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccccc2C)s1 ZINC000037718933 324572896 /nfs/dbraw/zinc/57/28/96/324572896.db2.gz MQQVOUGYEMIEOI-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc([C@H](C)NCc2ccccc2C)c(C)o1 ZINC000037718963 178252085 /nfs/dbraw/zinc/25/20/85/178252085.db2.gz VJJPPXPGQPSLJL-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccccc2C)c(C)o1 ZINC000037718964 178228499 /nfs/dbraw/zinc/22/84/99/178228499.db2.gz VJJPPXPGQPSLJL-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cccc([C@@H](C)NCc2ccccc2C)c1 ZINC000037719065 388646820 /nfs/dbraw/zinc/64/68/20/388646820.db2.gz OEHRJLRGASUQED-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cccc([C@H](C)NCc2ccccc2C)c1 ZINC000037719066 324572799 /nfs/dbraw/zinc/57/27/99/324572799.db2.gz OEHRJLRGASUQED-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN CCC(CC)CN[C@@H](C)c1c(F)cccc1F ZINC000037771741 168362715 /nfs/dbraw/zinc/36/27/15/168362715.db2.gz BAFWBKJPJQMJFI-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN CCC(CC)CN[C@H](C)c1c(F)cccc1F ZINC000037771742 168365030 /nfs/dbraw/zinc/36/50/30/168365030.db2.gz BAFWBKJPJQMJFI-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN CC[C@H](C)[C@@H](C)N[C@@H](C)c1c(F)cccc1F ZINC000037771993 171367020 /nfs/dbraw/zinc/36/70/20/171367020.db2.gz QQJCEWJJPXOBSP-AXFHLTTASA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](C)[C@H](C)N[C@@H](C)c1c(F)cccc1F ZINC000037771995 171390254 /nfs/dbraw/zinc/39/02/54/171390254.db2.gz QQJCEWJJPXOBSP-DCAQKATOSA-N 0 3 241.325 4.050 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccsc2)c(C)c1 ZINC000037772094 388647175 /nfs/dbraw/zinc/64/71/75/388647175.db2.gz HUXIRLGJCACUHF-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccsc2)c(C)c1 ZINC000037772095 388647648 /nfs/dbraw/zinc/64/76/48/388647648.db2.gz HUXIRLGJCACUHF-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Clc1ccc(Cl)c(CNC2CCCC2)c1 ZINC000037927316 357409010 /nfs/dbraw/zinc/40/90/10/357409010.db2.gz UDOVITWXKYIUPZ-UHFFFAOYSA-N 0 3 244.165 4.026 20 0 BIADHN Cc1cc(C)cc(CN[C@@H](C)c2ccccc2)c1 ZINC000037978541 188354661 /nfs/dbraw/zinc/35/46/61/188354661.db2.gz JCWHVZSSLMAGMX-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cc(C)cc(CN[C@H](C)c2ccccc2)c1 ZINC000037978542 348014962 /nfs/dbraw/zinc/01/49/62/348014962.db2.gz JCWHVZSSLMAGMX-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN CC(C)CCCNCc1c(F)cccc1Cl ZINC000037984992 386109134 /nfs/dbraw/zinc/10/91/34/386109134.db2.gz JZPGRRAOWHYQIU-UHFFFAOYSA-N 0 3 243.753 4.005 20 0 BIADHN CC(C)CCCN[C@@H](C)c1c(F)cccc1F ZINC000038093324 166815334 /nfs/dbraw/zinc/81/53/34/166815334.db2.gz CZEBOUOJUAKIDQ-NSHDSACASA-N 0 3 241.325 4.052 20 0 BIADHN CC(C)CCCN[C@H](C)c1c(F)cccc1F ZINC000038093325 388652583 /nfs/dbraw/zinc/65/25/83/388652583.db2.gz CZEBOUOJUAKIDQ-LLVKDONJSA-N 0 3 241.325 4.052 20 0 BIADHN CC(C)(C)CNCc1ccc(Cl)cc1Cl ZINC000040492359 388417748 /nfs/dbraw/zinc/41/77/48/388417748.db2.gz ICTASWNSIFHNJB-UHFFFAOYSA-N 0 3 246.181 4.129 20 0 BIADHN C[C@H](NCC(C)(C)C)c1ccccc1Cl ZINC000040492449 387799256 /nfs/dbraw/zinc/79/92/56/387799256.db2.gz GYUNJGGRKLGLLH-JTQLQIEISA-N 0 3 225.763 4.037 20 0 BIADHN C[C@@H](NCC(C)(C)C)c1ccccc1Cl ZINC000040492451 322832157 /nfs/dbraw/zinc/83/21/57/322832157.db2.gz GYUNJGGRKLGLLH-SNVBAGLBSA-N 0 3 225.763 4.037 20 0 BIADHN CC(C)(C)CNCc1c(Cl)cccc1Cl ZINC000040492640 387798600 /nfs/dbraw/zinc/79/86/00/387798600.db2.gz ZEGPIBPNHDVXJG-UHFFFAOYSA-N 0 3 246.181 4.129 20 0 BIADHN CC(C)(C)CNCc1cccc(Cl)c1Cl ZINC000040492674 387798076 /nfs/dbraw/zinc/79/80/76/387798076.db2.gz OPJYNDSQBKHHBD-UHFFFAOYSA-N 0 3 246.181 4.129 20 0 BIADHN Cc1cc(NCC(C)(C)C)c2ccccc2n1 ZINC000040494105 322832881 /nfs/dbraw/zinc/83/28/81/322832881.db2.gz HEQDOGAKRBIGKD-UHFFFAOYSA-N 0 3 228.339 4.001 20 0 BIADHN CCc1ccc([C@@H](C)NCc2ccccc2)s1 ZINC000041202227 384613979 /nfs/dbraw/zinc/61/39/79/384613979.db2.gz DJHGWUXXFAHZSP-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1ccc([C@H](C)NCc2ccccc2)s1 ZINC000041202230 322834871 /nfs/dbraw/zinc/83/48/71/322834871.db2.gz DJHGWUXXFAHZSP-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CC[C@@H](C)CN[C@H](c1ccco1)c1ccccc1 ZINC000041640164 322836283 /nfs/dbraw/zinc/83/62/83/322836283.db2.gz RLPBRFQUPOMTNL-CJNGLKHVSA-N 0 3 243.350 4.005 20 0 BIADHN CC[C@H](C)CN[C@H](c1ccco1)c1ccccc1 ZINC000041640166 384630772 /nfs/dbraw/zinc/63/07/72/384630772.db2.gz RLPBRFQUPOMTNL-BBRMVZONSA-N 0 3 243.350 4.005 20 0 BIADHN CC[C@@H](C)CN[C@@H](c1ccco1)c1ccccc1 ZINC000041640168 384632459 /nfs/dbraw/zinc/63/24/59/384632459.db2.gz RLPBRFQUPOMTNL-CZUORRHYSA-N 0 3 243.350 4.005 20 0 BIADHN CC[C@H](C)CN[C@@H](c1ccco1)c1ccccc1 ZINC000041640170 322836488 /nfs/dbraw/zinc/83/64/88/322836488.db2.gz RLPBRFQUPOMTNL-XJKSGUPXSA-N 0 3 243.350 4.005 20 0 BIADHN Cc1ccc(CNc2ccnc3ccccc32)cc1 ZINC000041720405 322836224 /nfs/dbraw/zinc/83/62/24/322836224.db2.gz WNPFYNQMKBJWIO-UHFFFAOYSA-N 0 3 248.329 4.155 20 0 BIADHN Cc1ccccc1CNc1ccnc2ccccc21 ZINC000041720795 322836340 /nfs/dbraw/zinc/83/63/40/322836340.db2.gz JYMVICGUGOIGEY-UHFFFAOYSA-N 0 3 248.329 4.155 20 0 BIADHN Cc1cccc(CNc2ccnc3ccccc32)c1 ZINC000041720801 322836484 /nfs/dbraw/zinc/83/64/84/322836484.db2.gz WBWBVXRUTNALDI-UHFFFAOYSA-N 0 3 248.329 4.155 20 0 BIADHN Cc1ccc(C)c(CN[C@@H](C)c2ccccc2)c1 ZINC000042221625 384634309 /nfs/dbraw/zinc/63/43/09/384634309.db2.gz MMFYTQOIZGPDQS-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1ccc(C)c(CN[C@H](C)c2ccccc2)c1 ZINC000042221626 384635922 /nfs/dbraw/zinc/63/59/22/384635922.db2.gz MMFYTQOIZGPDQS-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN C[C@@H](CCN[C@@H](C)c1ccco1)c1ccccc1 ZINC000043533429 322840133 /nfs/dbraw/zinc/84/01/33/322840133.db2.gz OGCYAVVUXUBKMY-KBPBESRZSA-N 0 3 243.350 4.124 20 0 BIADHN C[C@H](CCN[C@@H](C)c1ccco1)c1ccccc1 ZINC000043533431 384649728 /nfs/dbraw/zinc/64/97/28/384649728.db2.gz OGCYAVVUXUBKMY-KGLIPLIRSA-N 0 3 243.350 4.124 20 0 BIADHN C[C@@H](NCC[C@H](C)c1ccccc1)c1ccco1 ZINC000043533433 322840219 /nfs/dbraw/zinc/84/02/19/322840219.db2.gz OGCYAVVUXUBKMY-UONOGXRCSA-N 0 3 243.350 4.124 20 0 BIADHN C[C@H](CCN[C@H](C)c1ccco1)c1ccccc1 ZINC000043533434 322840214 /nfs/dbraw/zinc/84/02/14/322840214.db2.gz OGCYAVVUXUBKMY-ZIAGYGMSSA-N 0 3 243.350 4.124 20 0 BIADHN CC(C)c1ccc(CNCc2ccsc2)cc1 ZINC000044349686 167597469 /nfs/dbraw/zinc/59/74/69/167597469.db2.gz SXVNQNFQMDIKDX-UHFFFAOYSA-N 0 3 245.391 4.161 20 0 BIADHN C[C@H](NC1CCC1)c1ccc(Cl)cc1Cl ZINC000044480056 384332583 /nfs/dbraw/zinc/33/25/83/384332583.db2.gz QRZBEEBGWLOHKL-QMMMGPOBSA-N 0 3 244.165 4.197 20 0 BIADHN C[C@@H](NC1CCC1)c1ccc(Cl)cc1Cl ZINC000044480058 384332487 /nfs/dbraw/zinc/33/24/87/384332487.db2.gz QRZBEEBGWLOHKL-MRVPVSSYSA-N 0 3 244.165 4.197 20 0 BIADHN Cc1cc([C@H](C)NCc2sccc2C)c(C)o1 ZINC000044729308 178251748 /nfs/dbraw/zinc/25/17/48/178251748.db2.gz IANBBLYFSNFOFL-NSHDSACASA-N 0 3 249.379 4.117 20 0 BIADHN Cc1cc([C@@H](C)NCc2sccc2C)c(C)o1 ZINC000044729309 178229558 /nfs/dbraw/zinc/22/95/58/178229558.db2.gz IANBBLYFSNFOFL-LLVKDONJSA-N 0 3 249.379 4.117 20 0 BIADHN Cc1cc([C@H](C)NCc2ccc(C)s2)c(C)o1 ZINC000044729520 178249895 /nfs/dbraw/zinc/24/98/95/178249895.db2.gz PMKIGIGBAXOIDN-NSHDSACASA-N 0 3 249.379 4.117 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccc(C)s2)c(C)o1 ZINC000044729521 178228384 /nfs/dbraw/zinc/22/83/84/178228384.db2.gz PMKIGIGBAXOIDN-LLVKDONJSA-N 0 3 249.379 4.117 20 0 BIADHN CCCC1CCC(NCc2ccc(C)o2)CC1 ZINC000049543326 343017987 /nfs/dbraw/zinc/01/79/87/343017987.db2.gz WZUCMBACAPMZOC-UHFFFAOYSA-N 0 3 235.371 4.037 20 0 BIADHN Cc1cc(CN[C@@H](C)c2ccccc2)c(C)s1 ZINC000049684784 178030774 /nfs/dbraw/zinc/03/07/74/178030774.db2.gz ZLQSKRJWULWCMZ-LBPRGKRZSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(CN[C@H](C)c2ccccc2)c(C)s1 ZINC000049684785 178039195 /nfs/dbraw/zinc/03/91/95/178039195.db2.gz ZLQSKRJWULWCMZ-GFCCVEGCSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(CN[C@@H](C)c2ccccc2)c1C ZINC000049824952 179097777 /nfs/dbraw/zinc/09/77/77/179097777.db2.gz CTANLEPZHPHXLW-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cccc(CN[C@H](C)c2ccccc2)c1C ZINC000049824953 179099283 /nfs/dbraw/zinc/09/92/83/179099283.db2.gz CTANLEPZHPHXLW-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN c1csc(CN[C@@H](c2cccs2)C2CC2)c1 ZINC000049956806 384686260 /nfs/dbraw/zinc/68/62/60/384686260.db2.gz CMRVPSLUZJOVND-CYBMUJFWSA-N 0 3 249.404 4.051 20 0 BIADHN c1csc(CN[C@H](c2cccs2)C2CC2)c1 ZINC000049956807 384687226 /nfs/dbraw/zinc/68/72/26/384687226.db2.gz CMRVPSLUZJOVND-ZDUSSCGKSA-N 0 3 249.404 4.051 20 0 BIADHN CC[C@H](NCc1sccc1C)c1ccccc1 ZINC000050198390 358718659 /nfs/dbraw/zinc/71/86/59/358718659.db2.gz MCHIJXDAAGGDKV-AWEZNQCLSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1sccc1C)c1ccccc1 ZINC000050198392 358718294 /nfs/dbraw/zinc/71/82/94/358718294.db2.gz MCHIJXDAAGGDKV-CQSZACIVSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@H](NCc1ccc(C)s1)c1ccccc1 ZINC000050198398 387791692 /nfs/dbraw/zinc/79/16/92/387791692.db2.gz RPIQAPWQHRHOBK-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1ccc(C)s1)c1ccccc1 ZINC000050198400 358718648 /nfs/dbraw/zinc/71/86/48/358718648.db2.gz RPIQAPWQHRHOBK-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1ccc(CN[C@H](C)c2cccc(C)c2)s1 ZINC000050225311 384690387 /nfs/dbraw/zinc/69/03/87/384690387.db2.gz IFPBKXMMALYBIR-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2cccc(C)c2)s1 ZINC000050225312 384690455 /nfs/dbraw/zinc/69/04/55/384690455.db2.gz IFPBKXMMALYBIR-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN C[C@H](N[C@@H](C)c1ccccc1)c1ccsc1 ZINC000050337362 384619504 /nfs/dbraw/zinc/61/95/04/384619504.db2.gz BFYCDZJXILUOQK-RYUDHWBXSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccsc1)c1ccccc1 ZINC000050337364 384617120 /nfs/dbraw/zinc/61/71/20/384617120.db2.gz BFYCDZJXILUOQK-NEPJUHHUSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccccc1)c1ccsc1 ZINC000050337367 384617398 /nfs/dbraw/zinc/61/73/98/384617398.db2.gz BFYCDZJXILUOQK-NWDGAFQWSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@@H](N[C@H](C)c1ccccc1)c1ccsc1 ZINC000050337371 384618776 /nfs/dbraw/zinc/61/87/76/384618776.db2.gz BFYCDZJXILUOQK-VXGBXAGGSA-N 0 3 231.364 4.160 20 0 BIADHN C[C@H](N[C@@H](C)c1ccc(F)cc1)c1ccsc1 ZINC000050338482 176889735 /nfs/dbraw/zinc/88/97/35/176889735.db2.gz ZNRKFAFWURDYKH-QWRGUYRKSA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccsc1)c1ccc(F)cc1 ZINC000050338487 487940132 /nfs/dbraw/zinc/94/01/32/487940132.db2.gz ZNRKFAFWURDYKH-MNOVXSKESA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccc(F)cc1)c1ccsc1 ZINC000050338488 487940140 /nfs/dbraw/zinc/94/01/40/487940140.db2.gz ZNRKFAFWURDYKH-WDEREUQCSA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@H](C)c1ccc(F)cc1)c1ccsc1 ZINC000050338491 487940178 /nfs/dbraw/zinc/94/01/78/487940178.db2.gz ZNRKFAFWURDYKH-GHMZBOCLSA-N 0 3 249.354 4.299 20 0 BIADHN Cc1ccccc1[C@@H](C)N[C@@H](C)c1ccsc1 ZINC000050338767 179321179 /nfs/dbraw/zinc/32/11/79/179321179.db2.gz CIMPNRMEJOWOQO-QWHCGFSZSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccccc1[C@H](C)N[C@@H](C)c1ccsc1 ZINC000050338769 179339760 /nfs/dbraw/zinc/33/97/60/179339760.db2.gz CIMPNRMEJOWOQO-STQMWFEESA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccccc1[C@@H](C)N[C@H](C)c1ccsc1 ZINC000050338772 179323070 /nfs/dbraw/zinc/32/30/70/179323070.db2.gz CIMPNRMEJOWOQO-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccccc1[C@H](C)N[C@H](C)c1ccsc1 ZINC000050338775 179338790 /nfs/dbraw/zinc/33/87/90/179338790.db2.gz CIMPNRMEJOWOQO-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN C[C@H](N[C@@H]1CCc2ccccc21)c1ccsc1 ZINC000050338890 384618805 /nfs/dbraw/zinc/61/88/05/384618805.db2.gz KWIRYZSHXZZAHR-XHDPSFHLSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@@H](N[C@@H]1CCc2ccccc21)c1ccsc1 ZINC000050338894 384617750 /nfs/dbraw/zinc/61/77/50/384617750.db2.gz KWIRYZSHXZZAHR-IAQYHMDHSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H](N[C@H]1CCc2ccccc21)c1ccsc1 ZINC000050338896 176926702 /nfs/dbraw/zinc/92/67/02/176926702.db2.gz KWIRYZSHXZZAHR-NHYWBVRUSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@@H](N[C@H]1CCc2ccccc21)c1ccsc1 ZINC000050338898 384617269 /nfs/dbraw/zinc/61/72/69/384617269.db2.gz KWIRYZSHXZZAHR-ABAIWWIYSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H](N[C@@H](C)c1cccc(F)c1)c1ccsc1 ZINC000050339286 487940922 /nfs/dbraw/zinc/94/09/22/487940922.db2.gz HMDQUJIBMOIUDO-QWRGUYRKSA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccsc1)c1cccc(F)c1 ZINC000050339289 487941023 /nfs/dbraw/zinc/94/10/23/487941023.db2.gz HMDQUJIBMOIUDO-MNOVXSKESA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@@H](C)c1cccc(F)c1)c1ccsc1 ZINC000050339292 487941115 /nfs/dbraw/zinc/94/11/15/487941115.db2.gz HMDQUJIBMOIUDO-WDEREUQCSA-N 0 3 249.354 4.299 20 0 BIADHN C[C@@H](N[C@H](C)c1cccc(F)c1)c1ccsc1 ZINC000050339295 487941317 /nfs/dbraw/zinc/94/13/17/487941317.db2.gz HMDQUJIBMOIUDO-GHMZBOCLSA-N 0 3 249.354 4.299 20 0 BIADHN C[C@H](N[C@@H](C)c1cccs1)c1ccsc1 ZINC000050339311 384193763 /nfs/dbraw/zinc/19/37/63/384193763.db2.gz UDEPMADDVJTXQR-UWVGGRQHSA-N 0 3 237.393 4.221 20 0 BIADHN C[C@@H](N[C@@H](C)c1cccs1)c1ccsc1 ZINC000050339313 384193991 /nfs/dbraw/zinc/19/39/91/384193991.db2.gz UDEPMADDVJTXQR-ZJUUUORDSA-N 0 3 237.393 4.221 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccsc1)c1cccs1 ZINC000050339316 384193665 /nfs/dbraw/zinc/19/36/65/384193665.db2.gz UDEPMADDVJTXQR-VHSXEESVSA-N 0 3 237.393 4.221 20 0 BIADHN C[C@@H](N[C@H](C)c1cccs1)c1ccsc1 ZINC000050339319 175921249 /nfs/dbraw/zinc/92/12/49/175921249.db2.gz UDEPMADDVJTXQR-NXEZZACHSA-N 0 3 237.393 4.221 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccsc2)cc1 ZINC000050343730 384617436 /nfs/dbraw/zinc/61/74/36/384617436.db2.gz LNRDQGJVTCGVFQ-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2ccsc2)cc1 ZINC000050343731 384617597 /nfs/dbraw/zinc/61/75/97/384617597.db2.gz LNRDQGJVTCGVFQ-STQMWFEESA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2ccsc2)cc1 ZINC000050343734 384617788 /nfs/dbraw/zinc/61/77/88/384617788.db2.gz LNRDQGJVTCGVFQ-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2ccsc2)cc1 ZINC000050343737 384617283 /nfs/dbraw/zinc/61/72/83/384617283.db2.gz LNRDQGJVTCGVFQ-QWHCGFSZSA-N 0 3 245.391 4.468 20 0 BIADHN CCC[C@@H](CC)Nc1ccnc2ccccc21 ZINC000050405684 322850044 /nfs/dbraw/zinc/85/00/44/322850044.db2.gz ZDOZLNNDHAXOKT-GFCCVEGCSA-N 0 3 228.339 4.225 20 0 BIADHN CCC[C@H](CC)Nc1ccnc2ccccc21 ZINC000050405686 322849965 /nfs/dbraw/zinc/84/99/65/322849965.db2.gz ZDOZLNNDHAXOKT-LBPRGKRZSA-N 0 3 228.339 4.225 20 0 BIADHN Cc1cc(CN[C@@H](C)c2cccs2)ccc1F ZINC000050544752 178030924 /nfs/dbraw/zinc/03/09/24/178030924.db2.gz JPYOWUHUQXNVOE-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc(CN[C@H](C)c2cccs2)ccc1F ZINC000050544753 178038105 /nfs/dbraw/zinc/03/81/05/178038105.db2.gz JPYOWUHUQXNVOE-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN C[C@H](NC/C=C/c1ccccc1)c1cccs1 ZINC000051789969 384704067 /nfs/dbraw/zinc/70/40/67/384704067.db2.gz PEASAGKHYDLVMD-NEXMIYJRSA-N 0 3 243.375 4.112 20 0 BIADHN C[C@@H](NC/C=C/c1ccccc1)c1cccs1 ZINC000051789971 322851099 /nfs/dbraw/zinc/85/10/99/322851099.db2.gz PEASAGKHYDLVMD-OMDQHUAHSA-N 0 3 243.375 4.112 20 0 BIADHN CCc1ccccc1CN[C@@H](C)c1ccccc1 ZINC000052199997 384709381 /nfs/dbraw/zinc/70/93/81/384709381.db2.gz UTPNGNNZUSWDFX-AWEZNQCLSA-N 0 3 239.362 4.100 20 0 BIADHN CCc1ccccc1CN[C@H](C)c1ccccc1 ZINC000052200000 384709270 /nfs/dbraw/zinc/70/92/70/384709270.db2.gz UTPNGNNZUSWDFX-CQSZACIVSA-N 0 3 239.362 4.100 20 0 BIADHN CCc1ccccc1CN[C@@H](C)c1cccs1 ZINC000052200536 384710939 /nfs/dbraw/zinc/71/09/39/384710939.db2.gz VCDHXUMZKVUJNP-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1ccccc1CN[C@H](C)c1cccs1 ZINC000052200540 384709668 /nfs/dbraw/zinc/70/96/68/384709668.db2.gz VCDHXUMZKVUJNP-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN C[C@H](NC1CCC1)c1cc(Cl)ccc1Cl ZINC000052207033 322852486 /nfs/dbraw/zinc/85/24/86/322852486.db2.gz WQOMHIQFJPGKDF-QMMMGPOBSA-N 0 3 244.165 4.197 20 0 BIADHN C[C@@H](NC1CCC1)c1cc(Cl)ccc1Cl ZINC000052207036 384710271 /nfs/dbraw/zinc/71/02/71/384710271.db2.gz WQOMHIQFJPGKDF-MRVPVSSYSA-N 0 3 244.165 4.197 20 0 BIADHN C[C@@H](c1ccc(F)cc1)N(C)Cc1ccccc1 ZINC000052804395 487935897 /nfs/dbraw/zinc/93/58/97/487935897.db2.gz BKGFRQGSYQJFID-ZDUSSCGKSA-N 0 3 243.325 4.019 20 0 BIADHN C[C@H](c1ccc(F)cc1)N(C)Cc1ccccc1 ZINC000052804396 487935840 /nfs/dbraw/zinc/93/58/40/487935840.db2.gz BKGFRQGSYQJFID-CYBMUJFWSA-N 0 3 243.325 4.019 20 0 BIADHN C[C@@H](c1cccs1)N(C)Cc1cccc(F)c1 ZINC000053427971 491083048 /nfs/dbraw/zinc/08/30/48/491083048.db2.gz ZDTVQXMGTARDNP-NSHDSACASA-N 0 3 249.354 4.080 20 0 BIADHN C[C@H](c1cccs1)N(C)Cc1cccc(F)c1 ZINC000053427974 491083028 /nfs/dbraw/zinc/08/30/28/491083028.db2.gz ZDTVQXMGTARDNP-LLVKDONJSA-N 0 3 249.354 4.080 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2cccs2)cc1 ZINC000053428052 491083081 /nfs/dbraw/zinc/08/30/81/491083081.db2.gz VBKBLDRRUBHCJO-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2cccs2)cc1 ZINC000053428056 491083119 /nfs/dbraw/zinc/08/31/19/491083119.db2.gz VBKBLDRRUBHCJO-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccccc1CN(C)[C@@H](C)c1cccs1 ZINC000053428119 491083087 /nfs/dbraw/zinc/08/30/87/491083087.db2.gz XAZVFIFMMLZQGC-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccccc1CN(C)[C@H](C)c1cccs1 ZINC000053428123 491083133 /nfs/dbraw/zinc/08/31/33/491083133.db2.gz XAZVFIFMMLZQGC-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1cccc(CN(C)[C@@H](C)c2cccs2)c1 ZINC000053428429 363286227 /nfs/dbraw/zinc/28/62/27/363286227.db2.gz UVRNCCXILQMGDW-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1cccc(CN(C)[C@H](C)c2cccs2)c1 ZINC000053428433 363286739 /nfs/dbraw/zinc/28/67/39/363286739.db2.gz UVRNCCXILQMGDW-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN C[C@@H](c1cccs1)N(C)Cc1ccc(F)cc1 ZINC000053428454 491083141 /nfs/dbraw/zinc/08/31/41/491083141.db2.gz AALMCMIHTOFLHS-NSHDSACASA-N 0 3 249.354 4.080 20 0 BIADHN C[C@H](c1cccs1)N(C)Cc1ccc(F)cc1 ZINC000053428457 491083149 /nfs/dbraw/zinc/08/31/49/491083149.db2.gz AALMCMIHTOFLHS-LLVKDONJSA-N 0 3 249.354 4.080 20 0 BIADHN CC(C)C1CCC(N[C@@H](C)c2ccco2)CC1 ZINC000054554825 384736843 /nfs/dbraw/zinc/73/68/43/384736843.db2.gz MNPPNRDVOJMUAM-HSBZDZAISA-N 0 3 235.371 4.145 20 0 BIADHN CC(C)C1CCC(N[C@H](C)c2ccco2)CC1 ZINC000054554826 322856633 /nfs/dbraw/zinc/85/66/33/322856633.db2.gz MNPPNRDVOJMUAM-IYXRBSQSSA-N 0 3 235.371 4.145 20 0 BIADHN CCCN[C@@H](C)c1cccc(Cl)c1Cl ZINC000055224160 384740823 /nfs/dbraw/zinc/74/08/23/384740823.db2.gz KHQPIIZHEBZSRI-QMMMGPOBSA-N 0 3 232.154 4.054 20 0 BIADHN CCCN[C@H](C)c1cccc(Cl)c1Cl ZINC000055224162 322856856 /nfs/dbraw/zinc/85/68/56/322856856.db2.gz KHQPIIZHEBZSRI-MRVPVSSYSA-N 0 3 232.154 4.054 20 0 BIADHN CC[C@@H]1c2ccsc2CCN1CC=C(C)C ZINC000057625934 368498247 /nfs/dbraw/zinc/49/82/47/368498247.db2.gz WGYXVYMMEIISDW-CYBMUJFWSA-N 0 3 235.396 4.024 20 0 BIADHN CC[C@H]1c2ccsc2CCN1CC=C(C)C ZINC000057625938 368497513 /nfs/dbraw/zinc/49/75/13/368497513.db2.gz WGYXVYMMEIISDW-ZDUSSCGKSA-N 0 3 235.396 4.024 20 0 BIADHN CC(C)=CCN(C)Cc1csc2ccccc12 ZINC000058591351 368516361 /nfs/dbraw/zinc/51/63/61/368516361.db2.gz QFOSNCFNNGYPOE-UHFFFAOYSA-N 0 3 245.391 4.299 20 0 BIADHN CCC[C@@H](C)N(C)Cc1ccc(F)cc1Cl ZINC000058773616 411265346 /nfs/dbraw/zinc/26/53/46/411265346.db2.gz KVZONOPNBKSJGK-SNVBAGLBSA-N 0 3 243.753 4.100 20 0 BIADHN CCC[C@H](C)N(C)Cc1ccc(F)cc1Cl ZINC000058773617 411265295 /nfs/dbraw/zinc/26/52/95/411265295.db2.gz KVZONOPNBKSJGK-JTQLQIEISA-N 0 3 243.753 4.100 20 0 BIADHN CC[C@@H]1CCCCN1Cc1cccc(Cl)c1 ZINC000058874213 368522893 /nfs/dbraw/zinc/52/28/93/368522893.db2.gz AUYBORVJFXETAY-CQSZACIVSA-N 0 3 237.774 4.105 20 0 BIADHN CC[C@H]1CCCCN1Cc1ccccc1Cl ZINC000058874215 372107620 /nfs/dbraw/zinc/10/76/20/372107620.db2.gz FMMCHKAVYSAXID-ZDUSSCGKSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@H](c1ccccc1Cl)N1CCC[C@H](C)C1 ZINC000058874519 351861721 /nfs/dbraw/zinc/86/17/21/351861721.db2.gz MUBFTDUNQYSHSC-NWDGAFQWSA-N 0 3 237.774 4.133 20 0 BIADHN CCCCN(C)[C@H](C)c1ccccc1Cl ZINC000058875034 385032838 /nfs/dbraw/zinc/03/28/38/385032838.db2.gz BGGWZHTZVULYSO-LLVKDONJSA-N 0 3 225.763 4.133 20 0 BIADHN C[C@@H](c1ccccc1Cl)N1CCC(C)CC1 ZINC000058875278 368523850 /nfs/dbraw/zinc/52/38/50/368523850.db2.gz JSZSJNDNPVHPCL-LBPRGKRZSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](NCCC(C)(C)C)c1ccc(F)cc1F ZINC000059313048 384750227 /nfs/dbraw/zinc/75/02/27/384750227.db2.gz AOKXSMSOFFOVLC-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN C[C@@H](NCCC(C)(C)C)c1ccc(F)cc1F ZINC000059313049 384752319 /nfs/dbraw/zinc/75/23/19/384752319.db2.gz AOKXSMSOFFOVLC-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN CCC[C@H](NCCC(F)(F)F)c1ccccc1 ZINC000059382867 358920253 /nfs/dbraw/zinc/92/02/53/358920253.db2.gz MACKBPDUZGDLEI-LBPRGKRZSA-N 0 3 245.288 4.070 20 0 BIADHN CCC[C@@H](NCCC(F)(F)F)c1ccccc1 ZINC000059382868 358920471 /nfs/dbraw/zinc/92/04/71/358920471.db2.gz MACKBPDUZGDLEI-GFCCVEGCSA-N 0 3 245.288 4.070 20 0 BIADHN c1csc([C@H](NCc2ccsc2)C2CC2)c1 ZINC000059798815 358920551 /nfs/dbraw/zinc/92/05/51/358920551.db2.gz XJBXVWHXQWFWTK-CYBMUJFWSA-N 0 3 249.404 4.051 20 0 BIADHN c1csc([C@@H](NCc2ccsc2)C2CC2)c1 ZINC000059798816 358920462 /nfs/dbraw/zinc/92/04/62/358920462.db2.gz XJBXVWHXQWFWTK-ZDUSSCGKSA-N 0 3 249.404 4.051 20 0 BIADHN CC[C@H](NCc1ccsc1)c1ccc(F)cc1 ZINC000059917868 324020724 /nfs/dbraw/zinc/02/07/24/324020724.db2.gz KUKVBMWOQRSPSP-AWEZNQCLSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1ccsc1)c1ccc(F)cc1 ZINC000059917869 324021134 /nfs/dbraw/zinc/02/11/34/324021134.db2.gz KUKVBMWOQRSPSP-CQSZACIVSA-N 0 3 249.354 4.128 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccsc2)cc1C ZINC000059917892 324020998 /nfs/dbraw/zinc/02/09/98/324020998.db2.gz NOHWWHKBIPFNJJ-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccsc2)cc1C ZINC000059917893 324020927 /nfs/dbraw/zinc/02/09/27/324020927.db2.gz NOHWWHKBIPFNJJ-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN C[C@@H](c1ccc(Cl)cc1)N1CCCCCC1 ZINC000060459795 369485019 /nfs/dbraw/zinc/48/50/19/369485019.db2.gz YKZLJGICORUIEU-LBPRGKRZSA-N 0 3 237.774 4.277 20 0 BIADHN C[C@H](c1ccc(Cl)cc1)N1CCC[C@H](C)C1 ZINC000060460120 368542933 /nfs/dbraw/zinc/54/29/33/368542933.db2.gz UPWGCOHBEOUFEL-NWDGAFQWSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1cccc(Cl)c1)N1CCC[C@H](C)C1 ZINC000060460138 368543097 /nfs/dbraw/zinc/54/30/97/368543097.db2.gz XRQGAUFVNGZJTI-NWDGAFQWSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1ccc(Cl)cc1)N1CCC(C)CC1 ZINC000060460657 368542860 /nfs/dbraw/zinc/54/28/60/368542860.db2.gz GCVMUNDGZPJTGG-GFCCVEGCSA-N 0 3 237.774 4.133 20 0 BIADHN CC[C@@H](C)[C@H](C)N(Cc1ccccc1F)C1CC1 ZINC000060562500 369493501 /nfs/dbraw/zinc/49/35/01/369493501.db2.gz CLSXURAADLWZEY-OLZOCXBDSA-N 0 3 249.373 4.225 20 0 BIADHN CC[C@H](c1ccccc1)N(C)Cc1ccc(C)o1 ZINC000060876140 368554901 /nfs/dbraw/zinc/55/49/01/368554901.db2.gz RSADVZBAUSUTNL-MRXNPFEDSA-N 0 3 243.350 4.171 20 0 BIADHN CCCCN(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000060960248 411181725 /nfs/dbraw/zinc/18/17/25/411181725.db2.gz HVCIYLNNIROGEB-SWLSCSKDSA-N 0 3 247.382 4.168 20 0 BIADHN CN(Cc1ccc(Cl)s1)CC1CCCC1 ZINC000060961314 343721853 /nfs/dbraw/zinc/72/18/53/343721853.db2.gz VVCVNFTZEDNIIX-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CCCN(C)[C@H](C)c1ccc(Cl)cc1Cl ZINC000060975697 368557049 /nfs/dbraw/zinc/55/70/49/368557049.db2.gz DKXHPILJYJEQPZ-SECBINFHSA-N 0 3 246.181 4.396 20 0 BIADHN Fc1ccccc1CN(C1CC1)C1CCCCC1 ZINC000061163131 411506301 /nfs/dbraw/zinc/50/63/01/411506301.db2.gz HTHWEBZMYSNWDH-UHFFFAOYSA-N 0 3 247.357 4.123 20 0 BIADHN CCN(CC=C(C)C)Cc1cccc(Cl)c1 ZINC000061254489 368560925 /nfs/dbraw/zinc/56/09/25/368560925.db2.gz GRFKHZADDFVWRF-UHFFFAOYSA-N 0 3 237.774 4.128 20 0 BIADHN Cc1ccc([C@@H](C)N(C)Cc2ccccc2)cc1 ZINC000061255807 411505613 /nfs/dbraw/zinc/50/56/13/411505613.db2.gz IUBLTQIGQHLTNX-OAHLLOKOSA-N 0 3 239.362 4.188 20 0 BIADHN CCN(Cc1ccccc1Cl)C1CCCC1 ZINC000061256240 387226362 /nfs/dbraw/zinc/22/63/62/387226362.db2.gz HQSDSUOUFZHLLK-UHFFFAOYSA-N 0 3 237.774 4.105 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2ccsc2)c(C)c1 ZINC000061360590 322858839 /nfs/dbraw/zinc/85/88/39/322858839.db2.gz IYAUNBGRDIJNGF-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(CN[C@H](C)c2ccsc2)c(C)c1 ZINC000061360591 384753528 /nfs/dbraw/zinc/75/35/28/384753528.db2.gz IYAUNBGRDIJNGF-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN CCc1ccc(CN[C@@H](C)c2ccsc2)cc1 ZINC000061360616 487470915 /nfs/dbraw/zinc/47/09/15/487470915.db2.gz YESULDOLBDZMHZ-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1ccc(CN[C@H](C)c2ccsc2)cc1 ZINC000061360617 487470760 /nfs/dbraw/zinc/47/07/60/487470760.db2.gz YESULDOLBDZMHZ-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN Cc1cccc([C@@H](C)N[C@@H](C)c2ccsc2)c1 ZINC000061361537 179181576 /nfs/dbraw/zinc/18/15/76/179181576.db2.gz UXMVAICIXOLBLF-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1cccc([C@H](C)N[C@@H](C)c2ccsc2)c1 ZINC000061361538 179196493 /nfs/dbraw/zinc/19/64/93/179196493.db2.gz UXMVAICIXOLBLF-STQMWFEESA-N 0 3 245.391 4.468 20 0 BIADHN Cc1cccc([C@@H](C)N[C@H](C)c2ccsc2)c1 ZINC000061361539 179181906 /nfs/dbraw/zinc/18/19/06/179181906.db2.gz UXMVAICIXOLBLF-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1cccc([C@H](C)N[C@H](C)c2ccsc2)c1 ZINC000061361540 179197603 /nfs/dbraw/zinc/19/76/03/179197603.db2.gz UXMVAICIXOLBLF-QWHCGFSZSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2ccsc2)cc1C ZINC000061361581 487472101 /nfs/dbraw/zinc/47/21/01/487472101.db2.gz RIAHPZITBPARIH-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(CN[C@H](C)c2ccsc2)cc1C ZINC000061361582 487471863 /nfs/dbraw/zinc/47/18/63/487471863.db2.gz RIAHPZITBPARIH-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(F)ccc1CN[C@@H](C)c1ccsc1 ZINC000061361723 487472060 /nfs/dbraw/zinc/47/20/60/487472060.db2.gz QVNUPYHLZGHZES-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc(F)ccc1CN[C@H](C)c1ccsc1 ZINC000061361724 487471939 /nfs/dbraw/zinc/47/19/39/487471939.db2.gz QVNUPYHLZGHZES-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc(CN[C@@H](C)c2ccsc2)ccc1F ZINC000061361725 178030994 /nfs/dbraw/zinc/03/09/94/178030994.db2.gz DSPXOZHYLBOEHZ-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc(CN[C@H](C)c2ccsc2)ccc1F ZINC000061361726 178037868 /nfs/dbraw/zinc/03/78/68/178037868.db2.gz DSPXOZHYLBOEHZ-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN CCc1ccccc1CN[C@@H](C)c1ccsc1 ZINC000061361777 384753891 /nfs/dbraw/zinc/75/38/91/384753891.db2.gz GOZJOIPLEWGZHI-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1ccccc1CN[C@H](C)c1ccsc1 ZINC000061361778 322858767 /nfs/dbraw/zinc/85/87/67/322858767.db2.gz GOZJOIPLEWGZHI-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN Cc1cccc(CN[C@@H](C)c2ccsc2)c1C ZINC000061361870 487471818 /nfs/dbraw/zinc/47/18/18/487471818.db2.gz KLKQJVKHVGTLEK-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(CN[C@H](C)c2ccsc2)c1C ZINC000061361871 487472279 /nfs/dbraw/zinc/47/22/79/487472279.db2.gz KLKQJVKHVGTLEK-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(C)c(CN[C@@H](C)c2ccsc2)c1 ZINC000061361890 487472269 /nfs/dbraw/zinc/47/22/69/487472269.db2.gz CLXMOSKFRCNDNQ-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(C)c(CN[C@H](C)c2ccsc2)c1 ZINC000061361891 487472136 /nfs/dbraw/zinc/47/21/36/487472136.db2.gz CLXMOSKFRCNDNQ-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(C)cc(CN[C@@H](C)c2ccsc2)c1 ZINC000061361898 487471856 /nfs/dbraw/zinc/47/18/56/487471856.db2.gz HWYVEXBFFRAQPN-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(C)cc(CN[C@H](C)c2ccsc2)c1 ZINC000061361899 487472090 /nfs/dbraw/zinc/47/20/90/487472090.db2.gz HWYVEXBFFRAQPN-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN C[C@H](NC/C=C/c1ccccc1)c1ccsc1 ZINC000061362714 384753674 /nfs/dbraw/zinc/75/36/74/384753674.db2.gz LFNJAAMOPJSDOW-LJLILKBBSA-N 0 3 243.375 4.112 20 0 BIADHN C[C@@H](NC/C=C/c1ccccc1)c1ccsc1 ZINC000061362715 322858886 /nfs/dbraw/zinc/85/88/86/322858886.db2.gz LFNJAAMOPJSDOW-OQHXTRMZSA-N 0 3 243.375 4.112 20 0 BIADHN CCN(Cc1ccccc1)Cc1ccccc1C ZINC000061758234 368569053 /nfs/dbraw/zinc/56/90/53/368569053.db2.gz CTTRETOQCBUZCO-UHFFFAOYSA-N 0 3 239.362 4.017 20 0 BIADHN C[C@H](c1ccccc1)N(C)Cc1ccc(F)cc1 ZINC000061778868 368570650 /nfs/dbraw/zinc/57/06/50/368570650.db2.gz UHMFDOFCSOQZOJ-CYBMUJFWSA-N 0 3 243.325 4.019 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2ccccc2)cc1 ZINC000061779477 369849117 /nfs/dbraw/zinc/84/91/17/369849117.db2.gz VQRTXNRVNUKRMF-OAHLLOKOSA-N 0 3 239.362 4.188 20 0 BIADHN C[C@@H](c1ccccc1)N(C)Cc1cccc(F)c1 ZINC000061780619 369850102 /nfs/dbraw/zinc/85/01/02/369850102.db2.gz WHZDGVALWWYTCH-ZDUSSCGKSA-N 0 3 243.325 4.019 20 0 BIADHN CCN(Cc1cccs1)Cc1ccc(C)cc1 ZINC000061785377 368569824 /nfs/dbraw/zinc/56/98/24/368569824.db2.gz AHRWIEFULIVUOU-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN CCN(Cc1cccs1)Cc1ccccc1C ZINC000061785590 360680182 /nfs/dbraw/zinc/68/01/82/360680182.db2.gz CGHCFULUFVIIHX-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN Cc1cccc(CN(C)[C@@H](C)c2ccccc2)c1 ZINC000061801550 538782854 /nfs/dbraw/zinc/78/28/54/538782854.db2.gz WWAZBODZRABPNQ-HNNXBMFYSA-N 0 3 239.362 4.188 20 0 BIADHN C[C@H](NCCC(C)(C)C)c1cc(F)ccc1F ZINC000061839175 322859189 /nfs/dbraw/zinc/85/91/89/322859189.db2.gz WPBJGNVTQVUITM-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN C[C@@H](NCCC(C)(C)C)c1cc(F)ccc1F ZINC000061839176 322859173 /nfs/dbraw/zinc/85/91/73/322859173.db2.gz WPBJGNVTQVUITM-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN C[C@H](NCCC(C)(C)C)c1c(F)cccc1F ZINC000061839530 322859216 /nfs/dbraw/zinc/85/92/16/322859216.db2.gz AKAPQZYRAWVIKX-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN C[C@@H](NCCC(C)(C)C)c1c(F)cccc1F ZINC000061839531 384754844 /nfs/dbraw/zinc/75/48/44/384754844.db2.gz AKAPQZYRAWVIKX-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN CC(C)C[C@H](NCc1ccoc1)c1ccccc1 ZINC000062103402 187396529 /nfs/dbraw/zinc/39/65/29/187396529.db2.gz YMHUJCDJXONRQB-INIZCTEOSA-N 0 3 243.350 4.157 20 0 BIADHN CC(C)C[C@@H](NCc1ccoc1)c1ccccc1 ZINC000062103403 387849696 /nfs/dbraw/zinc/84/96/96/387849696.db2.gz YMHUJCDJXONRQB-MRXNPFEDSA-N 0 3 243.350 4.157 20 0 BIADHN CC(C)(C)[C@H](NCc1ccoc1)c1ccccc1 ZINC000062103610 641022067 /nfs/dbraw/zinc/02/20/67/641022067.db2.gz JUHAEXPZZJJRMR-OAHLLOKOSA-N 0 3 243.350 4.157 20 0 BIADHN CC(C)(C)[C@@H](NCc1ccoc1)c1ccccc1 ZINC000062103611 641021552 /nfs/dbraw/zinc/02/15/52/641021552.db2.gz JUHAEXPZZJJRMR-HNNXBMFYSA-N 0 3 243.350 4.157 20 0 BIADHN Cc1ccc(CNC(C)(C)c2ccccc2)s1 ZINC000063519434 368587978 /nfs/dbraw/zinc/58/79/78/368587978.db2.gz GVVADCYUPGWMEV-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN CC(C)[C@@H]1CCCN1Cc1ccc(Cl)s1 ZINC000063618372 368589882 /nfs/dbraw/zinc/58/98/82/368589882.db2.gz DJVWFHFGDHQMKO-NSHDSACASA-N 0 3 243.803 4.022 20 0 BIADHN Cc1ccc([C@H]2CCCN2C/C=C/Cl)cc1C ZINC000064517672 643139427 /nfs/dbraw/zinc/13/94/27/643139427.db2.gz OABLFWCIMCYDNB-SGJXGLNRSA-N 0 3 249.785 4.193 20 0 BIADHN Clc1ccccc1CN(C1CC1)C1CCCC1 ZINC000064807844 368614423 /nfs/dbraw/zinc/61/44/23/368614423.db2.gz HHCPYHQMJZOGHR-UHFFFAOYSA-N 0 3 249.785 4.247 20 0 BIADHN CC(C)=CCN(Cc1ccc(C)s1)C(C)C ZINC000065161992 342846813 /nfs/dbraw/zinc/84/68/13/342846813.db2.gz HZRPZWYHQKRDHG-UHFFFAOYSA-N 0 3 237.412 4.233 20 0 BIADHN Cc1ccccc1CNC(C)(C)c1ccccc1 ZINC000065275133 342968122 /nfs/dbraw/zinc/96/81/22/342968122.db2.gz XUOXCVIYDMUMNC-UHFFFAOYSA-N 0 3 239.362 4.020 20 0 BIADHN CCN(Cc1ccccc1Cl)[C@@H](C)C(C)C ZINC000065298849 368620441 /nfs/dbraw/zinc/62/04/41/368620441.db2.gz ATIVXDSPBBXITA-LBPRGKRZSA-N 0 3 239.790 4.206 20 0 BIADHN CCCC[C@@H](CC)Nc1cccc(CN(C)C)c1 ZINC000069373063 388835151 /nfs/dbraw/zinc/83/51/51/388835151.db2.gz ADAKUKUGHJUJHV-OAHLLOKOSA-N 0 3 248.414 4.129 20 0 BIADHN CCCC[C@H](CC)Nc1cccc(CN(C)C)c1 ZINC000069373065 388835200 /nfs/dbraw/zinc/83/52/00/388835200.db2.gz ADAKUKUGHJUJHV-HNNXBMFYSA-N 0 3 248.414 4.129 20 0 BIADHN Cc1ccccc1[C@H](NCc1ccco1)C(C)C ZINC000069911384 323153720 /nfs/dbraw/zinc/15/37/20/323153720.db2.gz IBEFRTNWWFBZKW-MRXNPFEDSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1ccccc1[C@@H](NCc1ccco1)C(C)C ZINC000069911385 323153754 /nfs/dbraw/zinc/15/37/54/323153754.db2.gz IBEFRTNWWFBZKW-INIZCTEOSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1ccsc1[C@@H](C)N[C@@H](C)c1ccccc1 ZINC000070089520 384078008 /nfs/dbraw/zinc/07/80/08/384078008.db2.gz KJQMGRNAOBWUJU-QWHCGFSZSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccsc1[C@H](C)N[C@@H](C)c1ccccc1 ZINC000070089521 384076947 /nfs/dbraw/zinc/07/69/47/384076947.db2.gz KJQMGRNAOBWUJU-STQMWFEESA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccsc1[C@@H](C)N[C@H](C)c1ccccc1 ZINC000070089522 384078018 /nfs/dbraw/zinc/07/80/18/384078018.db2.gz KJQMGRNAOBWUJU-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccsc1[C@H](C)N[C@H](C)c1ccccc1 ZINC000070089523 384078238 /nfs/dbraw/zinc/07/82/38/384078238.db2.gz KJQMGRNAOBWUJU-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1ccsc1[C@@H](C)NCc1ccc(F)cc1 ZINC000070089735 384078310 /nfs/dbraw/zinc/07/83/10/384078310.db2.gz YTESPXBFTGILPK-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1[C@H](C)NCc1ccc(F)cc1 ZINC000070089736 384077670 /nfs/dbraw/zinc/07/76/70/384077670.db2.gz YTESPXBFTGILPK-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1[C@@H](C)NCc1ccccc1F ZINC000070089742 384078535 /nfs/dbraw/zinc/07/85/35/384078535.db2.gz BWNCWAJSTCTBMG-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1[C@H](C)NCc1ccccc1F ZINC000070089743 384077021 /nfs/dbraw/zinc/07/70/21/384077021.db2.gz BWNCWAJSTCTBMG-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1[C@H](C)NCc1ccc(C)cc1 ZINC000070089780 323164947 /nfs/dbraw/zinc/16/49/47/323164947.db2.gz PPQJLHQJDSABNK-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccsc1[C@@H](C)NCc1ccc(C)cc1 ZINC000070089781 323164827 /nfs/dbraw/zinc/16/48/27/323164827.db2.gz PPQJLHQJDSABNK-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccsc1[C@H](C)NCc1cccc(C)c1 ZINC000070089985 388875938 /nfs/dbraw/zinc/87/59/38/388875938.db2.gz MHCSABDEAKCZGN-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccsc1[C@@H](C)NCc1cccc(C)c1 ZINC000070089986 388876531 /nfs/dbraw/zinc/87/65/31/388876531.db2.gz MHCSABDEAKCZGN-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccsc1[C@@H](C)NCc1cccc(F)c1 ZINC000070090146 384077558 /nfs/dbraw/zinc/07/75/58/384077558.db2.gz HCLLIYOUUTUXIK-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1[C@H](C)NCc1cccc(F)c1 ZINC000070090147 384077545 /nfs/dbraw/zinc/07/75/45/384077545.db2.gz HCLLIYOUUTUXIK-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1[C@H](C)NCc1ccccc1C ZINC000070091568 323165884 /nfs/dbraw/zinc/16/58/84/323165884.db2.gz HOCYLIZKMVDFPF-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccsc1[C@@H](C)NCc1ccccc1C ZINC000070091569 323165808 /nfs/dbraw/zinc/16/58/08/323165808.db2.gz HOCYLIZKMVDFPF-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN CCCC(CCC)N[C@@H](CC)c1nccs1 ZINC000070717192 323221985 /nfs/dbraw/zinc/22/19/85/323221985.db2.gz RFDFLFFPCVBYHO-LBPRGKRZSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC(CCC)N[C@H](CC)c1nccs1 ZINC000070717194 323222051 /nfs/dbraw/zinc/22/20/51/323222051.db2.gz RFDFLFFPCVBYHO-GFCCVEGCSA-N 0 3 240.416 4.153 20 0 BIADHN CC[C@H](N[C@@H](C)CCC(C)C)c1nccs1 ZINC000070717271 359061892 /nfs/dbraw/zinc/06/18/92/359061892.db2.gz RDEXFJLGKADQCQ-RYUDHWBXSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@@H](N[C@@H](C)CCC(C)C)c1nccs1 ZINC000070717272 359061748 /nfs/dbraw/zinc/06/17/48/359061748.db2.gz RDEXFJLGKADQCQ-NWDGAFQWSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](N[C@H](C)CCC(C)C)c1nccs1 ZINC000070717274 359062508 /nfs/dbraw/zinc/06/25/08/359062508.db2.gz RDEXFJLGKADQCQ-NEPJUHHUSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@@H](N[C@H](C)CCC(C)C)c1nccs1 ZINC000070717275 134923340 /nfs/dbraw/zinc/92/33/40/134923340.db2.gz RDEXFJLGKADQCQ-VXGBXAGGSA-N 0 3 240.416 4.009 20 0 BIADHN CCCCC[C@@H](C)N[C@@H](CC)c1nccs1 ZINC000070717399 643064625 /nfs/dbraw/zinc/06/46/25/643064625.db2.gz DQXPGEBFBQHIBZ-NEPJUHHUSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCC[C@H](C)N[C@@H](CC)c1nccs1 ZINC000070717401 643064541 /nfs/dbraw/zinc/06/45/41/643064541.db2.gz DQXPGEBFBQHIBZ-RYUDHWBXSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCC[C@@H](C)N[C@H](CC)c1nccs1 ZINC000070717402 643065305 /nfs/dbraw/zinc/06/53/05/643065305.db2.gz DQXPGEBFBQHIBZ-VXGBXAGGSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCC[C@H](C)N[C@H](CC)c1nccs1 ZINC000070717403 643065905 /nfs/dbraw/zinc/06/59/05/643065905.db2.gz DQXPGEBFBQHIBZ-NWDGAFQWSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@@H](CC)N[C@@H](CC)c1nccs1 ZINC000070717545 325025570 /nfs/dbraw/zinc/02/55/70/325025570.db2.gz AUQKYJFVWMBDTR-NEPJUHHUSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@H](CC)N[C@@H](CC)c1nccs1 ZINC000070717547 325025609 /nfs/dbraw/zinc/02/56/09/325025609.db2.gz AUQKYJFVWMBDTR-RYUDHWBXSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@@H](CC)N[C@H](CC)c1nccs1 ZINC000070717549 325026176 /nfs/dbraw/zinc/02/61/76/325026176.db2.gz AUQKYJFVWMBDTR-VXGBXAGGSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@H](CC)N[C@H](CC)c1nccs1 ZINC000070717550 325026316 /nfs/dbraw/zinc/02/63/16/325026316.db2.gz AUQKYJFVWMBDTR-NWDGAFQWSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCCC[C@@H](C)N[C@@H](C)c1nccs1 ZINC000070732200 642442312 /nfs/dbraw/zinc/44/23/12/642442312.db2.gz DNWPASPCSFSORZ-NEPJUHHUSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCCC[C@H](C)N[C@@H](C)c1nccs1 ZINC000070732201 642440636 /nfs/dbraw/zinc/44/06/36/642440636.db2.gz DNWPASPCSFSORZ-RYUDHWBXSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCCC[C@@H](C)N[C@H](C)c1nccs1 ZINC000070732202 642439718 /nfs/dbraw/zinc/43/97/18/642439718.db2.gz DNWPASPCSFSORZ-VXGBXAGGSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCCC[C@H](C)N[C@H](C)c1nccs1 ZINC000070732203 642441753 /nfs/dbraw/zinc/44/17/53/642441753.db2.gz DNWPASPCSFSORZ-NWDGAFQWSA-N 0 3 240.416 4.153 20 0 BIADHN CC[C@@H](C)C[C@@H](CC)N[C@@H](C)c1nccs1 ZINC000070732306 325026747 /nfs/dbraw/zinc/02/67/47/325026747.db2.gz DIKQLVFQLHVPKA-GRYCIOLGSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](C[C@@H](C)CC)N[C@@H](C)c1nccs1 ZINC000070732307 325027089 /nfs/dbraw/zinc/02/70/89/325027089.db2.gz DIKQLVFQLHVPKA-SDDRHHMPSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@@H](C)C[C@H](CC)N[C@@H](C)c1nccs1 ZINC000070732308 325026948 /nfs/dbraw/zinc/02/69/48/325026948.db2.gz DIKQLVFQLHVPKA-WOPDTQHZSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](C)C[C@H](CC)N[C@@H](C)c1nccs1 ZINC000070732309 325026821 /nfs/dbraw/zinc/02/68/21/325026821.db2.gz DIKQLVFQLHVPKA-SRVKXCTJSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC(CCC)N[C@@H](C)c1nc(C)cs1 ZINC000070732546 325025488 /nfs/dbraw/zinc/02/54/88/325025488.db2.gz BYMJFDFTJDVRCM-NSHDSACASA-N 0 3 240.416 4.071 20 0 BIADHN CCCC(CCC)N[C@H](C)c1nc(C)cs1 ZINC000070732547 325025541 /nfs/dbraw/zinc/02/55/41/325025541.db2.gz BYMJFDFTJDVRCM-LLVKDONJSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@@H](C)N[C@@H](C)c1nc(C)cs1 ZINC000070732730 643067754 /nfs/dbraw/zinc/06/77/54/643067754.db2.gz RBZUTBYCSQIFFT-PWSUYJOCSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@H](C)N[C@@H](C)c1nc(C)cs1 ZINC000070732731 643067099 /nfs/dbraw/zinc/06/70/99/643067099.db2.gz RBZUTBYCSQIFFT-JQWIXIFHSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@@H](C)N[C@H](C)c1nc(C)cs1 ZINC000070732732 643067606 /nfs/dbraw/zinc/06/76/06/643067606.db2.gz RBZUTBYCSQIFFT-ZYHUDNBSSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@H](C)N[C@H](C)c1nc(C)cs1 ZINC000070732733 643068192 /nfs/dbraw/zinc/06/81/92/643068192.db2.gz RBZUTBYCSQIFFT-CMPLNLGQSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@@H](CC)N[C@@H](C)c1nc(C)cs1 ZINC000070732784 325025399 /nfs/dbraw/zinc/02/53/99/325025399.db2.gz WHTCEXMZFCPOOO-NWDGAFQWSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@H](CC)N[C@@H](C)c1nc(C)cs1 ZINC000070732785 325025459 /nfs/dbraw/zinc/02/54/59/325025459.db2.gz WHTCEXMZFCPOOO-RYUDHWBXSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@@H](CC)N[C@H](C)c1nc(C)cs1 ZINC000070732786 325025563 /nfs/dbraw/zinc/02/55/63/325025563.db2.gz WHTCEXMZFCPOOO-VXGBXAGGSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@H](CC)N[C@H](C)c1nc(C)cs1 ZINC000070732787 325025586 /nfs/dbraw/zinc/02/55/86/325025586.db2.gz WHTCEXMZFCPOOO-NEPJUHHUSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@@H](CC)CN[C@@H](C)c1nccs1 ZINC000070733166 325025617 /nfs/dbraw/zinc/02/56/17/325025617.db2.gz CMKCPUMDMFPKCJ-NWDGAFQWSA-N 0 3 240.416 4.010 20 0 BIADHN CCCC[C@H](CC)CN[C@@H](C)c1nccs1 ZINC000070733167 325025133 /nfs/dbraw/zinc/02/51/33/325025133.db2.gz CMKCPUMDMFPKCJ-RYUDHWBXSA-N 0 3 240.416 4.010 20 0 BIADHN CCCC[C@@H](CC)CN[C@H](C)c1nccs1 ZINC000070733168 325025605 /nfs/dbraw/zinc/02/56/05/325025605.db2.gz CMKCPUMDMFPKCJ-VXGBXAGGSA-N 0 3 240.416 4.010 20 0 BIADHN CCCC[C@H](CC)CN[C@H](C)c1nccs1 ZINC000070733169 325025104 /nfs/dbraw/zinc/02/51/04/325025104.db2.gz CMKCPUMDMFPKCJ-NEPJUHHUSA-N 0 3 240.416 4.010 20 0 BIADHN CC[C@@H]1CC[C@@H](NCc2ccccc2Cl)C1 ZINC000070747910 325028262 /nfs/dbraw/zinc/02/82/62/325028262.db2.gz PEZZBGCFDQGTNO-DGCLKSJQSA-N 0 3 237.774 4.008 20 0 BIADHN CC[C@H]1CC[C@@H](NCc2ccccc2Cl)C1 ZINC000070747913 325028192 /nfs/dbraw/zinc/02/81/92/325028192.db2.gz PEZZBGCFDQGTNO-WCQYABFASA-N 0 3 237.774 4.008 20 0 BIADHN Cc1cc(N[C@@H]2CCC[C@@H]2C)c2ccccc2n1 ZINC000071208312 388886967 /nfs/dbraw/zinc/88/69/67/388886967.db2.gz UZFUJHMZGAISAB-SMDDNHRTSA-N 0 3 240.350 4.144 20 0 BIADHN Cc1cc(N[C@H]2CCC[C@@H]2C)c2ccccc2n1 ZINC000071208313 178188833 /nfs/dbraw/zinc/18/88/33/178188833.db2.gz UZFUJHMZGAISAB-FZMZJTMJSA-N 0 3 240.350 4.144 20 0 BIADHN Cc1cc(N[C@@H]2CCC[C@H]2C)c2ccccc2n1 ZINC000071208314 388887055 /nfs/dbraw/zinc/88/70/55/388887055.db2.gz UZFUJHMZGAISAB-BXUZGUMPSA-N 0 3 240.350 4.144 20 0 BIADHN Cc1cc(N[C@H]2CCC[C@H]2C)c2ccccc2n1 ZINC000071208315 178188917 /nfs/dbraw/zinc/18/89/17/178188917.db2.gz UZFUJHMZGAISAB-RISCZKNCSA-N 0 3 240.350 4.144 20 0 BIADHN CCCCN(C)[C@@H](C)c1ccccc1Cl ZINC000071793790 388899247 /nfs/dbraw/zinc/89/92/47/388899247.db2.gz BGGWZHTZVULYSO-NSHDSACASA-N 0 3 225.763 4.133 20 0 BIADHN CCCCN(Cc1ccco1)Cc1cccs1 ZINC000071809470 490316997 /nfs/dbraw/zinc/31/69/97/490316997.db2.gz AMOOZMDCSCFBJU-UHFFFAOYSA-N 0 3 249.379 4.143 20 0 BIADHN CCCCN(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000071912828 411987371 /nfs/dbraw/zinc/98/73/71/411987371.db2.gz HVCIYLNNIROGEB-WFASDCNBSA-N 0 3 247.382 4.168 20 0 BIADHN C[C@@H](c1ccc(F)cc1)N(C)Cc1cccs1 ZINC000072894445 325179893 /nfs/dbraw/zinc/17/98/93/325179893.db2.gz BELOOPFWHICZEM-NSHDSACASA-N 0 3 249.354 4.080 20 0 BIADHN C[C@H](c1ccc(F)cc1)N(C)Cc1cccs1 ZINC000072894447 325180066 /nfs/dbraw/zinc/18/00/66/325180066.db2.gz BELOOPFWHICZEM-LLVKDONJSA-N 0 3 249.354 4.080 20 0 BIADHN Cc1cccc(C(C)(C)NCc2cccs2)c1 ZINC000076764119 325354785 /nfs/dbraw/zinc/35/47/85/325354785.db2.gz PQQYHADLEHXTCL-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN Cc1cccc(C(C)(C)NCc2ccsc2)c1 ZINC000076764322 370350319 /nfs/dbraw/zinc/35/03/19/370350319.db2.gz ATAKZBZAWHKREX-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN Cc1cccc(C(C)(C)NCc2ccccc2)c1 ZINC000076764357 325354896 /nfs/dbraw/zinc/35/48/96/325354896.db2.gz XUBMPTXPGPGSQW-UHFFFAOYSA-N 0 3 239.362 4.020 20 0 BIADHN C[C@@H](c1cccc(F)c1)N(C)Cc1cccs1 ZINC000079876266 345047837 /nfs/dbraw/zinc/04/78/37/345047837.db2.gz BOIOEGJLQWSKHP-NSHDSACASA-N 0 3 249.354 4.080 20 0 BIADHN C[C@H](c1cccc(F)c1)N(C)Cc1cccs1 ZINC000079876267 345048053 /nfs/dbraw/zinc/04/80/53/345048053.db2.gz BOIOEGJLQWSKHP-LLVKDONJSA-N 0 3 249.354 4.080 20 0 BIADHN Cc1cc(N[C@H]2CC=CCC2)c2ccccc2n1 ZINC000080120231 325473525 /nfs/dbraw/zinc/47/35/25/325473525.db2.gz XMFZENATVLOKJW-ZDUSSCGKSA-N 0 3 238.334 4.064 20 0 BIADHN Cc1cc(N[C@@H]2CC=CCC2)c2ccccc2n1 ZINC000080120235 388553242 /nfs/dbraw/zinc/55/32/42/388553242.db2.gz XMFZENATVLOKJW-CYBMUJFWSA-N 0 3 238.334 4.064 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@@H](C)c1nccs1 ZINC000083142479 388046533 /nfs/dbraw/zinc/04/65/33/388046533.db2.gz BRNJWXQXVAZMTG-NEPJUHHUSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@H](C)N[C@@H](C)c1nccs1 ZINC000083142480 388046486 /nfs/dbraw/zinc/04/64/86/388046486.db2.gz BRNJWXQXVAZMTG-RYUDHWBXSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@H](C)c1nccs1 ZINC000083142482 349579550 /nfs/dbraw/zinc/57/95/50/349579550.db2.gz BRNJWXQXVAZMTG-VXGBXAGGSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@H](C)N[C@H](C)c1nccs1 ZINC000083142485 349579182 /nfs/dbraw/zinc/57/91/82/349579182.db2.gz BRNJWXQXVAZMTG-NWDGAFQWSA-N 0 3 240.416 4.009 20 0 BIADHN Cc1cccc(C)c1CN[C@@H](C)c1ccccc1 ZINC000083367374 179037258 /nfs/dbraw/zinc/03/72/58/179037258.db2.gz ZGLSNMBOKVHMMS-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cccc(C)c1CN[C@H](C)c1ccccc1 ZINC000083367375 179039279 /nfs/dbraw/zinc/03/92/79/179039279.db2.gz ZGLSNMBOKVHMMS-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN CC(C)(C)CCNCc1c(F)cccc1Cl ZINC000083372189 387406041 /nfs/dbraw/zinc/40/60/41/387406041.db2.gz OETBBHLXEQXSKS-UHFFFAOYSA-N 0 3 243.753 4.005 20 0 BIADHN CCC(CC)CNCc1c(F)cccc1Cl ZINC000083372190 168361721 /nfs/dbraw/zinc/36/17/21/168361721.db2.gz YBFYUYZIBUPPGI-UHFFFAOYSA-N 0 3 243.753 4.005 20 0 BIADHN CC[C@H](C)C[C@@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000083863524 387426444 /nfs/dbraw/zinc/42/64/44/387426444.db2.gz SUGKPTNFRJDHER-LOWVWBTDSA-N 0 3 223.360 4.063 20 0 BIADHN CC[C@H](C)C[C@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000083863526 387426795 /nfs/dbraw/zinc/42/67/95/387426795.db2.gz SUGKPTNFRJDHER-GVXVVHGQSA-N 0 3 223.360 4.063 20 0 BIADHN C[C@H](N[C@H]1CC=CCC1)c1ccccc1Cl ZINC000084066178 256759918 /nfs/dbraw/zinc/75/99/18/256759918.db2.gz UDUSDQPKOMDNNE-RYUDHWBXSA-N 0 3 235.758 4.099 20 0 BIADHN C[C@@H](N[C@H]1CC=CCC1)c1ccccc1Cl ZINC000084066179 387439696 /nfs/dbraw/zinc/43/96/96/387439696.db2.gz UDUSDQPKOMDNNE-NEPJUHHUSA-N 0 3 235.758 4.099 20 0 BIADHN C[C@H](N[C@@H]1CC=CCC1)c1ccccc1Cl ZINC000084066180 387439752 /nfs/dbraw/zinc/43/97/52/387439752.db2.gz UDUSDQPKOMDNNE-NWDGAFQWSA-N 0 3 235.758 4.099 20 0 BIADHN C[C@@H](N[C@@H]1CC=CCC1)c1ccccc1Cl ZINC000084066181 387438821 /nfs/dbraw/zinc/43/88/21/387438821.db2.gz UDUSDQPKOMDNNE-VXGBXAGGSA-N 0 3 235.758 4.099 20 0 BIADHN CC(C)(C)CC(C)(C)NC/C(Cl)=C/Cl ZINC000085978581 643870351 /nfs/dbraw/zinc/87/03/51/643870351.db2.gz YYDMPEHAJJFCCS-TWGQIWQCSA-N 0 3 238.202 4.110 20 0 BIADHN Cc1ccc([C@@H](C)NCc2cccs2)cc1F ZINC000088254679 383891102 /nfs/dbraw/zinc/89/11/02/383891102.db2.gz NMWZKDMZOCJJTP-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc([C@H](C)NCc2cccs2)cc1F ZINC000088254680 383892635 /nfs/dbraw/zinc/89/26/35/383892635.db2.gz NMWZKDMZOCJJTP-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc([C@@H](C)NCc2ccsc2)cc1F ZINC000088255108 383891810 /nfs/dbraw/zinc/89/18/10/383891810.db2.gz MWLCEAWNUKKALH-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc([C@H](C)NCc2ccsc2)cc1F ZINC000088255109 388527341 /nfs/dbraw/zinc/52/73/41/388527341.db2.gz MWLCEAWNUKKALH-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN CCC[C@@H](C)N[C@@H](C)c1csc(C(C)C)n1 ZINC000090048513 491122552 /nfs/dbraw/zinc/12/25/52/491122552.db2.gz JRLQMASVENIXSU-MNOVXSKESA-N 0 3 240.416 4.106 20 0 BIADHN CCC[C@H](C)N[C@@H](C)c1csc(C(C)C)n1 ZINC000090048514 491122574 /nfs/dbraw/zinc/12/25/74/491122574.db2.gz JRLQMASVENIXSU-QWRGUYRKSA-N 0 3 240.416 4.106 20 0 BIADHN CCC[C@@H](C)N[C@H](C)c1csc(C(C)C)n1 ZINC000090048515 491122576 /nfs/dbraw/zinc/12/25/76/491122576.db2.gz JRLQMASVENIXSU-GHMZBOCLSA-N 0 3 240.416 4.106 20 0 BIADHN CCC[C@H](C)N[C@H](C)c1csc(C(C)C)n1 ZINC000090048516 491122562 /nfs/dbraw/zinc/12/25/62/491122562.db2.gz JRLQMASVENIXSU-WDEREUQCSA-N 0 3 240.416 4.106 20 0 BIADHN CCC(CC)N[C@@H](C)c1csc(C(C)C)n1 ZINC000090049691 256554326 /nfs/dbraw/zinc/55/43/26/256554326.db2.gz ABTKPHJSUOJUBF-JTQLQIEISA-N 0 3 240.416 4.106 20 0 BIADHN CCC(CC)N[C@H](C)c1csc(C(C)C)n1 ZINC000090049693 256553757 /nfs/dbraw/zinc/55/37/57/256553757.db2.gz ABTKPHJSUOJUBF-SNVBAGLBSA-N 0 3 240.416 4.106 20 0 BIADHN CCC(CC)(CC)CN[C@@H](C)c1nccs1 ZINC000090400227 384045850 /nfs/dbraw/zinc/04/58/50/384045850.db2.gz ZUGKWKSVOLYLFE-NSHDSACASA-N 0 3 240.416 4.010 20 0 BIADHN CCC(CC)(CC)CN[C@H](C)c1nccs1 ZINC000090400230 384044796 /nfs/dbraw/zinc/04/47/96/384044796.db2.gz ZUGKWKSVOLYLFE-LLVKDONJSA-N 0 3 240.416 4.010 20 0 BIADHN Cc1ccsc1CN[C@H](C)c1cccc(C)c1 ZINC000091437039 384125647 /nfs/dbraw/zinc/12/56/47/384125647.db2.gz CJTYFCUTFUVKBO-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccsc1CN[C@@H](C)c1cccc(C)c1 ZINC000091437040 256583467 /nfs/dbraw/zinc/58/34/67/256583467.db2.gz CJTYFCUTFUVKBO-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN C[C@@H](CCC(C)(C)C)N[C@@H](C)c1nccs1 ZINC000091726611 384141223 /nfs/dbraw/zinc/14/12/23/384141223.db2.gz LKDFQSOASSJBOV-QWRGUYRKSA-N 0 3 240.416 4.009 20 0 BIADHN C[C@H](CCC(C)(C)C)N[C@@H](C)c1nccs1 ZINC000091726612 384141761 /nfs/dbraw/zinc/14/17/61/384141761.db2.gz LKDFQSOASSJBOV-MNOVXSKESA-N 0 3 240.416 4.009 20 0 BIADHN C[C@@H](N[C@@H](C)CCC(C)(C)C)c1nccs1 ZINC000091726613 384141877 /nfs/dbraw/zinc/14/18/77/384141877.db2.gz LKDFQSOASSJBOV-WDEREUQCSA-N 0 3 240.416 4.009 20 0 BIADHN C[C@H](CCC(C)(C)C)N[C@H](C)c1nccs1 ZINC000091726614 384140974 /nfs/dbraw/zinc/14/09/74/384140974.db2.gz LKDFQSOASSJBOV-GHMZBOCLSA-N 0 3 240.416 4.009 20 0 BIADHN Cc1ccc(CN(Cc2ccoc2)C(C)C)s1 ZINC000092485323 631555417 /nfs/dbraw/zinc/55/54/17/631555417.db2.gz VEMLGACNKNNTLI-UHFFFAOYSA-N 0 3 249.379 4.060 20 0 BIADHN C[C@H](NCCCCC(C)(C)C)c1nccs1 ZINC000093405054 386199235 /nfs/dbraw/zinc/19/92/35/386199235.db2.gz VXVFNPXAYMPXLM-NSHDSACASA-N 0 3 240.416 4.010 20 0 BIADHN C[C@@H](NCCCCC(C)(C)C)c1nccs1 ZINC000093405055 259447970 /nfs/dbraw/zinc/44/79/70/259447970.db2.gz VXVFNPXAYMPXLM-LLVKDONJSA-N 0 3 240.416 4.010 20 0 BIADHN C[C@H](N[C@@H]1CCCc2ccccc21)c1ccoc1 ZINC000094867632 325790335 /nfs/dbraw/zinc/79/03/35/325790335.db2.gz HDHVUISDNQHZJN-BLLLJJGKSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@@H](N[C@@H]1CCCc2ccccc21)c1ccoc1 ZINC000094867633 388874478 /nfs/dbraw/zinc/87/44/78/388874478.db2.gz HDHVUISDNQHZJN-MLGOLLRUSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@H](N[C@H]1CCCc2ccccc21)c1ccoc1 ZINC000094867634 325790248 /nfs/dbraw/zinc/79/02/48/325790248.db2.gz HDHVUISDNQHZJN-LRDDRELGSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@@H](N[C@H]1CCCc2ccccc21)c1ccoc1 ZINC000094867635 325790377 /nfs/dbraw/zinc/79/03/77/325790377.db2.gz HDHVUISDNQHZJN-WBMJQRKESA-N 0 3 241.334 4.008 20 0 BIADHN CCc1ccc([C@@H](C)N[C@@H](C)c2ccoc2)cc1 ZINC000094868026 537853203 /nfs/dbraw/zinc/85/32/03/537853203.db2.gz VFUSWSRLGWDUBW-OLZOCXBDSA-N 0 3 243.350 4.254 20 0 BIADHN CCc1ccc([C@H](C)N[C@@H](C)c2ccoc2)cc1 ZINC000094868027 583171297 /nfs/dbraw/zinc/17/12/97/583171297.db2.gz VFUSWSRLGWDUBW-STQMWFEESA-N 0 3 243.350 4.254 20 0 BIADHN CCc1ccc([C@@H](C)N[C@H](C)c2ccoc2)cc1 ZINC000094868028 583171019 /nfs/dbraw/zinc/17/10/19/583171019.db2.gz VFUSWSRLGWDUBW-CHWSQXEVSA-N 0 3 243.350 4.254 20 0 BIADHN CCc1ccc([C@H](C)N[C@H](C)c2ccoc2)cc1 ZINC000094868029 583171194 /nfs/dbraw/zinc/17/11/94/583171194.db2.gz VFUSWSRLGWDUBW-QWHCGFSZSA-N 0 3 243.350 4.254 20 0 BIADHN CC(C)[C@H](N[C@@H](C)c1ccoc1)c1ccccc1 ZINC000094868050 384987824 /nfs/dbraw/zinc/98/78/24/384987824.db2.gz JQLJNSQYOPGTOT-BBRMVZONSA-N 0 3 243.350 4.328 20 0 BIADHN CC(C)[C@@H](N[C@@H](C)c1ccoc1)c1ccccc1 ZINC000094868051 322977696 /nfs/dbraw/zinc/97/76/96/322977696.db2.gz JQLJNSQYOPGTOT-XJKSGUPXSA-N 0 3 243.350 4.328 20 0 BIADHN CC(C)[C@H](N[C@H](C)c1ccoc1)c1ccccc1 ZINC000094868052 384987498 /nfs/dbraw/zinc/98/74/98/384987498.db2.gz JQLJNSQYOPGTOT-CJNGLKHVSA-N 0 3 243.350 4.328 20 0 BIADHN CC(C)[C@@H](N[C@H](C)c1ccoc1)c1ccccc1 ZINC000094868053 384987544 /nfs/dbraw/zinc/98/75/44/384987544.db2.gz JQLJNSQYOPGTOT-CZUORRHYSA-N 0 3 243.350 4.328 20 0 BIADHN CC[C@H](N[C@@H](C)c1ccoc1)c1ccc(C)cc1 ZINC000094868298 325790747 /nfs/dbraw/zinc/79/07/47/325790747.db2.gz BKUKUFUNNBXUCV-BBRMVZONSA-N 0 3 243.350 4.390 20 0 BIADHN CC[C@@H](N[C@@H](C)c1ccoc1)c1ccc(C)cc1 ZINC000094868299 388874175 /nfs/dbraw/zinc/87/41/75/388874175.db2.gz BKUKUFUNNBXUCV-XJKSGUPXSA-N 0 3 243.350 4.390 20 0 BIADHN CC[C@H](N[C@H](C)c1ccoc1)c1ccc(C)cc1 ZINC000094868300 388874963 /nfs/dbraw/zinc/87/49/63/388874963.db2.gz BKUKUFUNNBXUCV-CJNGLKHVSA-N 0 3 243.350 4.390 20 0 BIADHN CC[C@@H](N[C@H](C)c1ccoc1)c1ccc(C)cc1 ZINC000094868301 325791070 /nfs/dbraw/zinc/79/10/70/325791070.db2.gz BKUKUFUNNBXUCV-CZUORRHYSA-N 0 3 243.350 4.390 20 0 BIADHN CCC[C@H](N[C@@H](C)c1ccoc1)c1ccccc1 ZINC000094868362 388875016 /nfs/dbraw/zinc/87/50/16/388875016.db2.gz AYURCUZECITEFZ-BBRMVZONSA-N 0 3 243.350 4.472 20 0 BIADHN CCC[C@@H](N[C@@H](C)c1ccoc1)c1ccccc1 ZINC000094868363 388875010 /nfs/dbraw/zinc/87/50/10/388875010.db2.gz AYURCUZECITEFZ-XJKSGUPXSA-N 0 3 243.350 4.472 20 0 BIADHN CCC[C@H](N[C@H](C)c1ccoc1)c1ccccc1 ZINC000094868364 325790823 /nfs/dbraw/zinc/79/08/23/325790823.db2.gz AYURCUZECITEFZ-CJNGLKHVSA-N 0 3 243.350 4.472 20 0 BIADHN CCC[C@@H](N[C@H](C)c1ccoc1)c1ccccc1 ZINC000094868365 388875052 /nfs/dbraw/zinc/87/50/52/388875052.db2.gz AYURCUZECITEFZ-CZUORRHYSA-N 0 3 243.350 4.472 20 0 BIADHN C[C@H](N[C@@H](c1ccccc1)C1CC1)c1ccoc1 ZINC000094868442 388874664 /nfs/dbraw/zinc/87/46/64/388874664.db2.gz WTIGJRYCPBKMIE-LRDDRELGSA-N 0 3 241.334 4.082 20 0 BIADHN C[C@@H](N[C@@H](c1ccccc1)C1CC1)c1ccoc1 ZINC000094868443 325790573 /nfs/dbraw/zinc/79/05/73/325790573.db2.gz WTIGJRYCPBKMIE-WBMJQRKESA-N 0 3 241.334 4.082 20 0 BIADHN C[C@H](N[C@H](c1ccccc1)C1CC1)c1ccoc1 ZINC000094868444 388874638 /nfs/dbraw/zinc/87/46/38/388874638.db2.gz WTIGJRYCPBKMIE-BLLLJJGKSA-N 0 3 241.334 4.082 20 0 BIADHN C[C@@H](N[C@H](c1ccccc1)C1CC1)c1ccoc1 ZINC000094868445 388874123 /nfs/dbraw/zinc/87/41/23/388874123.db2.gz WTIGJRYCPBKMIE-MLGOLLRUSA-N 0 3 241.334 4.082 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccoc2)c(C)c1 ZINC000094868928 583171305 /nfs/dbraw/zinc/17/13/05/583171305.db2.gz GSGANYSKJSUJSO-UONOGXRCSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2ccoc2)c(C)c1 ZINC000094868929 583171336 /nfs/dbraw/zinc/17/13/36/583171336.db2.gz GSGANYSKJSUJSO-KBPBESRZSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2ccoc2)c(C)c1 ZINC000094868930 583171213 /nfs/dbraw/zinc/17/12/13/583171213.db2.gz GSGANYSKJSUJSO-ZIAGYGMSSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2ccoc2)c(C)c1 ZINC000094868931 583171078 /nfs/dbraw/zinc/17/10/78/583171078.db2.gz GSGANYSKJSUJSO-KGLIPLIRSA-N 0 3 243.350 4.308 20 0 BIADHN CC[C@H](N[C@@H](C)c1ccoc1)c1ccccc1 ZINC000094869234 343153775 /nfs/dbraw/zinc/15/37/75/343153775.db2.gz TVUDEYQMBAMAGA-WFASDCNBSA-N 0 3 229.323 4.082 20 0 BIADHN CC[C@@H](N[C@@H](C)c1ccoc1)c1ccccc1 ZINC000094869235 343154077 /nfs/dbraw/zinc/15/40/77/343154077.db2.gz TVUDEYQMBAMAGA-SWLSCSKDSA-N 0 3 229.323 4.082 20 0 BIADHN CC[C@H](N[C@H](C)c1ccoc1)c1ccccc1 ZINC000094869236 343153946 /nfs/dbraw/zinc/15/39/46/343153946.db2.gz TVUDEYQMBAMAGA-DOMZBBRYSA-N 0 3 229.323 4.082 20 0 BIADHN CC[C@@H](N[C@H](C)c1ccoc1)c1ccccc1 ZINC000094869237 343153862 /nfs/dbraw/zinc/15/38/62/343153862.db2.gz TVUDEYQMBAMAGA-IUODEOHRSA-N 0 3 229.323 4.082 20 0 BIADHN Cc1cscc1CN[C@@H](C)c1ccc(F)cc1 ZINC000094877409 386966449 /nfs/dbraw/zinc/96/64/49/386966449.db2.gz FBYJDHOKUILIFL-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cscc1CN[C@H](C)c1ccc(F)cc1 ZINC000094877410 386966494 /nfs/dbraw/zinc/96/64/94/386966494.db2.gz FBYJDHOKUILIFL-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cscc1CN[C@@H](C)c1cccc(F)c1 ZINC000094877505 386965513 /nfs/dbraw/zinc/96/55/13/386965513.db2.gz SYVGXQLZAFGRJE-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cscc1CN[C@H](C)c1cccc(F)c1 ZINC000094877506 386966547 /nfs/dbraw/zinc/96/65/47/386966547.db2.gz SYVGXQLZAFGRJE-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN CC[C@H](NCc1cscc1C)c1ccccc1 ZINC000094877604 135620431 /nfs/dbraw/zinc/62/04/31/135620431.db2.gz TVKKUQCQCLROJD-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1cscc1C)c1ccccc1 ZINC000094877605 517778718 /nfs/dbraw/zinc/77/87/18/517778718.db2.gz TVKKUQCQCLROJD-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1cscc1CN[C@H](C)c1ccc(C)cc1 ZINC000094877884 386966037 /nfs/dbraw/zinc/96/60/37/386966037.db2.gz ZEJNCYUUQDJNLY-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cscc1CN[C@@H](C)c1ccc(C)cc1 ZINC000094877885 256640267 /nfs/dbraw/zinc/64/02/67/256640267.db2.gz ZEJNCYUUQDJNLY-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cscc1CN[C@H](C)c1ccccc1C ZINC000094878271 386965950 /nfs/dbraw/zinc/96/59/50/386965950.db2.gz LYGLJORDUKALSY-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cscc1CN[C@@H](C)c1ccccc1C ZINC000094878272 386965149 /nfs/dbraw/zinc/96/51/49/386965149.db2.gz LYGLJORDUKALSY-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cscc1CN[C@H](C)c1cccc(C)c1 ZINC000094878323 256640105 /nfs/dbraw/zinc/64/01/05/256640105.db2.gz UZVOEWXQVLQMFT-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cscc1CN[C@@H](C)c1cccc(C)c1 ZINC000094878324 386965564 /nfs/dbraw/zinc/96/55/64/386965564.db2.gz UZVOEWXQVLQMFT-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc(F)cc1CN[C@@H](C)c1ccsc1 ZINC000097848945 537920480 /nfs/dbraw/zinc/92/04/80/537920480.db2.gz NIGSOTPZHAKYQQ-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(F)cc1CN[C@H](C)c1ccsc1 ZINC000097848946 537920523 /nfs/dbraw/zinc/92/05/23/537920523.db2.gz NIGSOTPZHAKYQQ-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2ccsc2)cc1F ZINC000104330145 178622873 /nfs/dbraw/zinc/62/28/73/178622873.db2.gz XESVALYYCRDQGP-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(CN[C@H](C)c2ccsc2)cc1F ZINC000104330149 387510841 /nfs/dbraw/zinc/51/08/41/387510841.db2.gz XESVALYYCRDQGP-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(CN[C@@H](C)c2cccs2)cc1F ZINC000104337837 387508790 /nfs/dbraw/zinc/50/87/90/387508790.db2.gz DDLMJGMRVREDRO-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccc(CN[C@H](C)c2cccs2)cc1F ZINC000104337841 387507197 /nfs/dbraw/zinc/50/71/97/387507197.db2.gz DDLMJGMRVREDRO-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Clc1ccc(CN2CCCCCCC2)s1 ZINC000105021702 588082260 /nfs/dbraw/zinc/08/22/60/588082260.db2.gz HMPNJRXTYOAPCX-UHFFFAOYSA-N 0 3 243.803 4.168 20 0 BIADHN Cc1cc(C)cc([C@@H](C)NCc2cccs2)c1 ZINC000107319877 177915234 /nfs/dbraw/zinc/91/52/34/177915234.db2.gz BOSIHVHVHYVXPD-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(C)cc([C@H](C)NCc2cccs2)c1 ZINC000107319879 588346743 /nfs/dbraw/zinc/34/67/43/588346743.db2.gz BOSIHVHVHYVXPD-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(C)cc([C@@H](C)NCc2ccsc2)c1 ZINC000107319881 588347000 /nfs/dbraw/zinc/34/70/00/588347000.db2.gz GERJCDSQFCGEFO-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(C)cc([C@H](C)NCc2ccsc2)c1 ZINC000107319883 588346603 /nfs/dbraw/zinc/34/66/03/588346603.db2.gz GERJCDSQFCGEFO-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(C)cc([C@@H](C)NCc2ccccc2)c1 ZINC000107320026 588346800 /nfs/dbraw/zinc/34/68/00/588346800.db2.gz ZSHMZTWIAIZDRR-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cc(C)cc([C@H](C)NCc2ccccc2)c1 ZINC000107320028 588346820 /nfs/dbraw/zinc/34/68/20/588346820.db2.gz ZSHMZTWIAIZDRR-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN CC[C@](C)(NCc1ccc(C)o1)c1ccccc1 ZINC000107717526 588401045 /nfs/dbraw/zinc/40/10/45/588401045.db2.gz WYFFLFDKMUJRQU-INIZCTEOSA-N 0 3 243.350 4.003 20 0 BIADHN CC[C@@](C)(NCc1ccc(C)o1)c1ccccc1 ZINC000107717530 588400803 /nfs/dbraw/zinc/40/08/03/588400803.db2.gz WYFFLFDKMUJRQU-MRXNPFEDSA-N 0 3 243.350 4.003 20 0 BIADHN CC[C@](C)(NCc1cccs1)c1ccccc1 ZINC000107717905 588400877 /nfs/dbraw/zinc/40/08/77/588400877.db2.gz SVYWXRLXQAJDCF-HNNXBMFYSA-N 0 3 245.391 4.163 20 0 BIADHN CC[C@@](C)(NCc1cccs1)c1ccccc1 ZINC000107717908 588401037 /nfs/dbraw/zinc/40/10/37/588401037.db2.gz SVYWXRLXQAJDCF-OAHLLOKOSA-N 0 3 245.391 4.163 20 0 BIADHN CC[C@](C)(NCc1ccsc1)c1ccccc1 ZINC000107717918 588400740 /nfs/dbraw/zinc/40/07/40/588400740.db2.gz WRFHMYSWLGRBEL-HNNXBMFYSA-N 0 3 245.391 4.163 20 0 BIADHN CC[C@@](C)(NCc1ccsc1)c1ccccc1 ZINC000107717921 588401084 /nfs/dbraw/zinc/40/10/84/588401084.db2.gz WRFHMYSWLGRBEL-OAHLLOKOSA-N 0 3 245.391 4.163 20 0 BIADHN CC[C@](C)(NCc1ccccc1)c1ccccc1 ZINC000107717998 588401040 /nfs/dbraw/zinc/40/10/40/588401040.db2.gz PXXWYFJTPBSBOK-KRWDZBQOSA-N 0 3 239.362 4.102 20 0 BIADHN CC[C@@](C)(NCc1ccccc1)c1ccccc1 ZINC000107718000 588400793 /nfs/dbraw/zinc/40/07/93/588400793.db2.gz PXXWYFJTPBSBOK-QGZVFWFLSA-N 0 3 239.362 4.102 20 0 BIADHN Fc1ccc([C@@H]2CCCN2[C@H]2C=CCCC2)cc1 ZINC000110929534 370001892 /nfs/dbraw/zinc/00/18/92/370001892.db2.gz ZSDJOFKDMNYDAG-HOTGVXAUSA-N 0 3 245.341 4.071 20 0 BIADHN Fc1ccc([C@H]2CCCN2[C@H]2C=CCCC2)cc1 ZINC000110929536 370001271 /nfs/dbraw/zinc/00/12/71/370001271.db2.gz ZSDJOFKDMNYDAG-JKSUJKDBSA-N 0 3 245.341 4.071 20 0 BIADHN C[C@H](N[C@H]1C=CCCC1)c1ccccc1Cl ZINC000110933536 323154726 /nfs/dbraw/zinc/15/47/26/323154726.db2.gz WDFQVENMTOTHBV-RYUDHWBXSA-N 0 3 235.758 4.099 20 0 BIADHN C[C@@H](N[C@H]1C=CCCC1)c1ccccc1Cl ZINC000110933539 323154650 /nfs/dbraw/zinc/15/46/50/323154650.db2.gz WDFQVENMTOTHBV-NEPJUHHUSA-N 0 3 235.758 4.099 20 0 BIADHN C[C@H](N[C@@H]1C=CCCC1)c1ccccc1Cl ZINC000110933542 323154759 /nfs/dbraw/zinc/15/47/59/323154759.db2.gz WDFQVENMTOTHBV-NWDGAFQWSA-N 0 3 235.758 4.099 20 0 BIADHN C[C@@H](N[C@@H]1C=CCCC1)c1ccccc1Cl ZINC000110933545 323154696 /nfs/dbraw/zinc/15/46/96/323154696.db2.gz WDFQVENMTOTHBV-VXGBXAGGSA-N 0 3 235.758 4.099 20 0 BIADHN CC[C@@H]1c2ccsc2CCN1[C@H]1C=CCCC1 ZINC000110934266 370001946 /nfs/dbraw/zinc/00/19/46/370001946.db2.gz JFKPRAJCVWMIMI-GXTWGEPZSA-N 0 3 247.407 4.166 20 0 BIADHN CC[C@H]1c2ccsc2CCN1[C@H]1C=CCCC1 ZINC000110934269 370001577 /nfs/dbraw/zinc/00/15/77/370001577.db2.gz JFKPRAJCVWMIMI-JSGCOSHPSA-N 0 3 247.407 4.166 20 0 BIADHN C[C@@H](c1ccccc1Cl)N(C)[C@H]1C=CCCC1 ZINC000110936954 370001332 /nfs/dbraw/zinc/00/13/32/370001332.db2.gz IXDXJIOTKZOCJM-STQMWFEESA-N 0 3 249.785 4.442 20 0 BIADHN C[C@H](c1ccccc1Cl)N(C)[C@H]1C=CCCC1 ZINC000110936955 370001141 /nfs/dbraw/zinc/00/11/41/370001141.db2.gz IXDXJIOTKZOCJM-OLZOCXBDSA-N 0 3 249.785 4.442 20 0 BIADHN C[C@@H]1C[C@@H]1c1ccc(CNCC2(C)CCCC2)o1 ZINC000111618189 588764836 /nfs/dbraw/zinc/76/48/36/588764836.db2.gz OILPFMYZKZMSMA-OCCSQVGLSA-N 0 3 247.382 4.073 20 0 BIADHN C[C@H]1C[C@@H]1c1ccc(CNCC2(C)CCCC2)o1 ZINC000111618191 588764752 /nfs/dbraw/zinc/76/47/52/588764752.db2.gz OILPFMYZKZMSMA-JSGCOSHPSA-N 0 3 247.382 4.073 20 0 BIADHN C[C@@H]1C[C@H]1c1ccc(CNCC2(C)CCCC2)o1 ZINC000111618194 588764829 /nfs/dbraw/zinc/76/48/29/588764829.db2.gz OILPFMYZKZMSMA-TZMCWYRMSA-N 0 3 247.382 4.073 20 0 BIADHN C[C@H]1C[C@H]1c1ccc(CNCC2(C)CCCC2)o1 ZINC000111618196 588764773 /nfs/dbraw/zinc/76/47/73/588764773.db2.gz OILPFMYZKZMSMA-GXTWGEPZSA-N 0 3 247.382 4.073 20 0 BIADHN CC[C@H](NCc1cc(C)oc1C)c1ccccc1 ZINC000114501706 588874877 /nfs/dbraw/zinc/87/48/77/588874877.db2.gz QEVIOIWQBNDICM-INIZCTEOSA-N 0 3 243.350 4.137 20 0 BIADHN CC[C@@H](NCc1cc(C)oc1C)c1ccccc1 ZINC000114501707 588874902 /nfs/dbraw/zinc/87/49/02/588874902.db2.gz QEVIOIWQBNDICM-MRXNPFEDSA-N 0 3 243.350 4.137 20 0 BIADHN Cc1cccc([C@@H](C)NCc2ccsc2)c1C ZINC000115630189 645669145 /nfs/dbraw/zinc/66/91/45/645669145.db2.gz AGJXHNBIXZPTMN-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc([C@H](C)NCc2ccsc2)c1C ZINC000115630191 645668513 /nfs/dbraw/zinc/66/85/13/645668513.db2.gz AGJXHNBIXZPTMN-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN C[C@@H](c1ccco1)N(Cc1ccccc1)C1CC1 ZINC000119187770 176032400 /nfs/dbraw/zinc/03/24/00/176032400.db2.gz WVXCGGOHFDALSB-ZDUSSCGKSA-N 0 3 241.334 4.005 20 0 BIADHN C[C@H](c1ccco1)N(Cc1ccccc1)C1CC1 ZINC000119187890 177047285 /nfs/dbraw/zinc/04/72/85/177047285.db2.gz WVXCGGOHFDALSB-CYBMUJFWSA-N 0 3 241.334 4.005 20 0 BIADHN C[C@H](NCCCCC(C)(C)C)c1cncs1 ZINC000119510906 387135907 /nfs/dbraw/zinc/13/59/07/387135907.db2.gz OPBYVQZPPWPPMR-NSHDSACASA-N 0 3 240.416 4.010 20 0 BIADHN C[C@@H](NCCCCC(C)(C)C)c1cncs1 ZINC000119511044 387136266 /nfs/dbraw/zinc/13/62/66/387136266.db2.gz OPBYVQZPPWPPMR-LLVKDONJSA-N 0 3 240.416 4.010 20 0 BIADHN Cc1cc(C)c(CN[C@@H](C)c2ccoc2)c(C)c1 ZINC000121234009 324006556 /nfs/dbraw/zinc/00/65/56/324006556.db2.gz MAFRYBHUQZPVLB-AWEZNQCLSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc(C)c(CN[C@H](C)c2ccoc2)c(C)c1 ZINC000121234174 324007024 /nfs/dbraw/zinc/00/70/24/324007024.db2.gz MAFRYBHUQZPVLB-CQSZACIVSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccoc2)cc1C ZINC000121548212 490099295 /nfs/dbraw/zinc/09/92/95/490099295.db2.gz LNSARFXQKJNXEC-KGLIPLIRSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2ccoc2)cc1C ZINC000121548377 490099316 /nfs/dbraw/zinc/09/93/16/490099316.db2.gz LNSARFXQKJNXEC-KBPBESRZSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2ccoc2)cc1C ZINC000121548510 490100544 /nfs/dbraw/zinc/10/05/44/490100544.db2.gz LNSARFXQKJNXEC-ZIAGYGMSSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2ccoc2)cc1C ZINC000121548687 490100564 /nfs/dbraw/zinc/10/05/64/490100564.db2.gz LNSARFXQKJNXEC-UONOGXRCSA-N 0 3 243.350 4.308 20 0 BIADHN CCCC(C)(C)NCc1ccccc1Cl ZINC000122370742 323094354 /nfs/dbraw/zinc/09/43/54/323094354.db2.gz HPSWPBHYMYURSO-UHFFFAOYSA-N 0 3 225.763 4.008 20 0 BIADHN C[C@H](NCCCC1CC1)c1ccccc1Cl ZINC000124860032 371244978 /nfs/dbraw/zinc/24/49/78/371244978.db2.gz WROUNSDWINBEPM-NSHDSACASA-N 0 3 237.774 4.181 20 0 BIADHN C[C@@H](NCCCC1CC1)c1ccccc1Cl ZINC000124860242 371244675 /nfs/dbraw/zinc/24/46/75/371244675.db2.gz WROUNSDWINBEPM-LLVKDONJSA-N 0 3 237.774 4.181 20 0 BIADHN CCCC(CCC)N[C@@H](C)c1ncc(C)s1 ZINC000125211168 388669199 /nfs/dbraw/zinc/66/91/99/388669199.db2.gz MDUSCELSFUPVES-NSHDSACASA-N 0 3 240.416 4.071 20 0 BIADHN CCCC(CCC)N[C@H](C)c1ncc(C)s1 ZINC000125211410 324635574 /nfs/dbraw/zinc/63/55/74/324635574.db2.gz MDUSCELSFUPVES-LLVKDONJSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@@H](C)N[C@@H](C)c1ncc(C)s1 ZINC000125252018 590159668 /nfs/dbraw/zinc/15/96/68/590159668.db2.gz XUVCACFQNKNFRN-PWSUYJOCSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@H](C)N[C@@H](C)c1ncc(C)s1 ZINC000125252238 590159656 /nfs/dbraw/zinc/15/96/56/590159656.db2.gz XUVCACFQNKNFRN-JQWIXIFHSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@@H](C)N[C@H](C)c1ncc(C)s1 ZINC000125252428 590159319 /nfs/dbraw/zinc/15/93/19/590159319.db2.gz XUVCACFQNKNFRN-ZYHUDNBSSA-N 0 3 240.416 4.071 20 0 BIADHN CCCCC[C@H](C)N[C@H](C)c1ncc(C)s1 ZINC000125252639 590159700 /nfs/dbraw/zinc/15/97/00/590159700.db2.gz XUVCACFQNKNFRN-CMPLNLGQSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@@H](CC)N[C@@H](C)c1ncc(C)s1 ZINC000125272381 388670753 /nfs/dbraw/zinc/67/07/53/388670753.db2.gz RFLCFTQDXDSCBL-NWDGAFQWSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@H](CC)N[C@@H](C)c1ncc(C)s1 ZINC000125272627 388670336 /nfs/dbraw/zinc/67/03/36/388670336.db2.gz RFLCFTQDXDSCBL-RYUDHWBXSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@@H](CC)N[C@H](C)c1ncc(C)s1 ZINC000125272865 388671125 /nfs/dbraw/zinc/67/11/25/388671125.db2.gz RFLCFTQDXDSCBL-VXGBXAGGSA-N 0 3 240.416 4.071 20 0 BIADHN CCCC[C@H](CC)N[C@H](C)c1ncc(C)s1 ZINC000125273049 388671135 /nfs/dbraw/zinc/67/11/35/388671135.db2.gz RFLCFTQDXDSCBL-NEPJUHHUSA-N 0 3 240.416 4.071 20 0 BIADHN C[C@@H](c1cccs1)N(C)Cc1cccs1 ZINC000126654712 343713185 /nfs/dbraw/zinc/71/31/85/343713185.db2.gz DZRKQMAHYMJHKJ-JTQLQIEISA-N 0 3 237.393 4.003 20 0 BIADHN C[C@H](c1cccs1)N(C)Cc1cccs1 ZINC000126654948 343713108 /nfs/dbraw/zinc/71/31/08/343713108.db2.gz DZRKQMAHYMJHKJ-SNVBAGLBSA-N 0 3 237.393 4.003 20 0 BIADHN Cc1cc2cc([C@@H](C)NCCCF)oc2cc1C ZINC000126895551 343717498 /nfs/dbraw/zinc/71/74/98/343717498.db2.gz OOKUGGMFJJDKQC-GFCCVEGCSA-N 0 3 249.329 4.060 20 0 BIADHN Cc1cc2cc([C@H](C)NCCCF)oc2cc1C ZINC000126895782 343717114 /nfs/dbraw/zinc/71/71/14/343717114.db2.gz OOKUGGMFJJDKQC-LBPRGKRZSA-N 0 3 249.329 4.060 20 0 BIADHN CCCCCC(C)(C)CNCc1ccc(C)cn1 ZINC000127044691 590551163 /nfs/dbraw/zinc/55/11/63/590551163.db2.gz JNTAUUGIIUXKBC-UHFFFAOYSA-N 0 3 248.414 4.086 20 0 BIADHN C[C@@H](c1ccncc1)N(C)CCCC1CCCC1 ZINC000127670518 388729502 /nfs/dbraw/zinc/72/95/02/388729502.db2.gz XBXQDXKRCFBIJY-AWEZNQCLSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@H](c1ccncc1)N(C)CCCC1CCCC1 ZINC000127670732 323005589 /nfs/dbraw/zinc/00/55/89/323005589.db2.gz XBXQDXKRCFBIJY-CQSZACIVSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@H](NCCCCC(C)(C)C)c1cscn1 ZINC000127842252 388732349 /nfs/dbraw/zinc/73/23/49/388732349.db2.gz IAHAETFNCKOPNQ-NSHDSACASA-N 0 3 240.416 4.010 20 0 BIADHN C[C@@H](NCCCCC(C)(C)C)c1cscn1 ZINC000127842451 323005790 /nfs/dbraw/zinc/00/57/90/323005790.db2.gz IAHAETFNCKOPNQ-LLVKDONJSA-N 0 3 240.416 4.010 20 0 BIADHN C[C@@H](CCC(C)(C)C)N[C@@H](C)c1cscn1 ZINC000127860280 388732732 /nfs/dbraw/zinc/73/27/32/388732732.db2.gz GOFSNZHNVYRWIR-QWRGUYRKSA-N 0 3 240.416 4.009 20 0 BIADHN C[C@H](CCC(C)(C)C)N[C@@H](C)c1cscn1 ZINC000127860496 388733269 /nfs/dbraw/zinc/73/32/69/388733269.db2.gz GOFSNZHNVYRWIR-MNOVXSKESA-N 0 3 240.416 4.009 20 0 BIADHN C[C@@H](N[C@@H](C)CCC(C)(C)C)c1cscn1 ZINC000127860706 324791743 /nfs/dbraw/zinc/79/17/43/324791743.db2.gz GOFSNZHNVYRWIR-WDEREUQCSA-N 0 3 240.416 4.009 20 0 BIADHN C[C@H](CCC(C)(C)C)N[C@H](C)c1cscn1 ZINC000127860983 388732898 /nfs/dbraw/zinc/73/28/98/388732898.db2.gz GOFSNZHNVYRWIR-GHMZBOCLSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC[C@H](CCC)N[C@@H](C)c1cscn1 ZINC000127889290 490563586 /nfs/dbraw/zinc/56/35/86/490563586.db2.gz SXBDBFKJIIHCHM-RYUDHWBXSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@@H](CCC)N[C@H](C)c1cscn1 ZINC000127889524 490564915 /nfs/dbraw/zinc/56/49/15/490564915.db2.gz SXBDBFKJIIHCHM-VXGBXAGGSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@H](CCC)N[C@H](C)c1cscn1 ZINC000127889763 490519453 /nfs/dbraw/zinc/51/94/53/490519453.db2.gz SXBDBFKJIIHCHM-NEPJUHHUSA-N 0 3 240.416 4.153 20 0 BIADHN C[C@@H](c1cccnc1)N(C)CCCC1CCCC1 ZINC000127898823 388733158 /nfs/dbraw/zinc/73/31/58/388733158.db2.gz FAMORSYSBSUEJX-AWEZNQCLSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@H](c1cccnc1)N(C)CCCC1CCCC1 ZINC000127899041 323005937 /nfs/dbraw/zinc/00/59/37/323005937.db2.gz FAMORSYSBSUEJX-CQSZACIVSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@@H](c1ccccn1)N(C)CCCC1CCCC1 ZINC000128126444 388738863 /nfs/dbraw/zinc/73/88/63/388738863.db2.gz IQFWRSIIKBKFAN-AWEZNQCLSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@H](c1ccccn1)N(C)CCCC1CCCC1 ZINC000128126651 388738851 /nfs/dbraw/zinc/73/88/51/388738851.db2.gz IQFWRSIIKBKFAN-CQSZACIVSA-N 0 3 246.398 4.045 20 0 BIADHN CCc1ccc([C@@H](CC)NCc2ccoc2)cc1 ZINC000129306780 388829627 /nfs/dbraw/zinc/82/96/27/388829627.db2.gz HCLHFZSVAXSBHC-MRXNPFEDSA-N 0 3 243.350 4.083 20 0 BIADHN CCc1ccc([C@H](CC)NCc2ccoc2)cc1 ZINC000129306940 388829233 /nfs/dbraw/zinc/82/92/33/388829233.db2.gz HCLHFZSVAXSBHC-INIZCTEOSA-N 0 3 243.350 4.083 20 0 BIADHN C[C@@H]1CC[C@H](NCc2ccoc2)c2ccccc21 ZINC000129311545 176233477 /nfs/dbraw/zinc/23/34/77/176233477.db2.gz IFJINXNFZSVDTH-WBMJQRKESA-N 0 3 241.334 4.008 20 0 BIADHN C[C@H]1CC[C@H](NCc2ccoc2)c2ccccc21 ZINC000129311727 177205095 /nfs/dbraw/zinc/20/50/95/177205095.db2.gz IFJINXNFZSVDTH-LRDDRELGSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@@H]1CC[C@@H](NCc2ccoc2)c2ccccc21 ZINC000129311927 176212939 /nfs/dbraw/zinc/21/29/39/176212939.db2.gz IFJINXNFZSVDTH-MLGOLLRUSA-N 0 3 241.334 4.008 20 0 BIADHN C[C@H]1CC[C@@H](NCc2ccoc2)c2ccccc21 ZINC000129312129 177193130 /nfs/dbraw/zinc/19/31/30/177193130.db2.gz IFJINXNFZSVDTH-BLLLJJGKSA-N 0 3 241.334 4.008 20 0 BIADHN Cc1cc(C)c([C@@H](C)NCc2ccoc2)cc1C ZINC000129315991 388832008 /nfs/dbraw/zinc/83/20/08/388832008.db2.gz SLUYIDOCLGHXNM-CQSZACIVSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc(C)c([C@H](C)NCc2ccoc2)cc1C ZINC000129316212 388831343 /nfs/dbraw/zinc/83/13/43/388831343.db2.gz SLUYIDOCLGHXNM-AWEZNQCLSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1ccc(CN(Cc2ccco2)C(C)C)s1 ZINC000129626208 388859936 /nfs/dbraw/zinc/85/99/36/388859936.db2.gz KBOUULWDEMPCKV-UHFFFAOYSA-N 0 3 249.379 4.060 20 0 BIADHN CCN[C@@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000129737376 388869953 /nfs/dbraw/zinc/86/99/53/388869953.db2.gz DVTNZMKCBUYOMQ-GFCCVEGCSA-N 0 3 244.165 4.054 20 0 BIADHN CCN[C@H](c1c(Cl)cccc1Cl)C1CC1 ZINC000129737585 388869460 /nfs/dbraw/zinc/86/94/60/388869460.db2.gz DVTNZMKCBUYOMQ-LBPRGKRZSA-N 0 3 244.165 4.054 20 0 BIADHN Cc1ccc([C@@H](C)NCCCC(C)(C)C)o1 ZINC000129963743 324998347 /nfs/dbraw/zinc/99/83/47/324998347.db2.gz LQARMTZLTAVBJS-GFCCVEGCSA-N 0 3 223.360 4.065 20 0 BIADHN Cc1ccc([C@H](C)NCCCC(C)(C)C)o1 ZINC000129963951 388877734 /nfs/dbraw/zinc/87/77/34/388877734.db2.gz LQARMTZLTAVBJS-LBPRGKRZSA-N 0 3 223.360 4.065 20 0 BIADHN C[C@H](NC1CCCC1)c1c(F)cccc1Cl ZINC000130415200 490385416 /nfs/dbraw/zinc/38/54/16/490385416.db2.gz QLIXCEHMHUBBPN-VIFPVBQESA-N 0 3 241.737 4.072 20 0 BIADHN C[C@@H](NC1CCCC1)c1c(F)cccc1Cl ZINC000130415403 490385160 /nfs/dbraw/zinc/38/51/60/490385160.db2.gz QLIXCEHMHUBBPN-SECBINFHSA-N 0 3 241.737 4.072 20 0 BIADHN CC(C)[C@@H](C)N[C@@H](C)c1c(F)cccc1Cl ZINC000130415623 325050008 /nfs/dbraw/zinc/05/00/08/325050008.db2.gz DVOXPEUUQWPUQC-ZJUUUORDSA-N 0 3 243.753 4.174 20 0 BIADHN CC(C)[C@H](C)N[C@@H](C)c1c(F)cccc1Cl ZINC000130415811 325050569 /nfs/dbraw/zinc/05/05/69/325050569.db2.gz DVOXPEUUQWPUQC-UWVGGRQHSA-N 0 3 243.753 4.174 20 0 BIADHN CC(C)[C@@H](C)N[C@H](C)c1c(F)cccc1Cl ZINC000130416008 325050343 /nfs/dbraw/zinc/05/03/43/325050343.db2.gz DVOXPEUUQWPUQC-NXEZZACHSA-N 0 3 243.753 4.174 20 0 BIADHN CC(C)[C@H](C)N[C@H](C)c1c(F)cccc1Cl ZINC000130416221 325050366 /nfs/dbraw/zinc/05/03/66/325050366.db2.gz DVOXPEUUQWPUQC-VHSXEESVSA-N 0 3 243.753 4.174 20 0 BIADHN CC(C)CC(C)(C)CN[C@@H](C)c1ccco1 ZINC000130554214 325066717 /nfs/dbraw/zinc/06/67/17/325066717.db2.gz FNTDSXNOJXMUNK-LBPRGKRZSA-N 0 3 223.360 4.003 20 0 BIADHN CC(C)CC(C)(C)CN[C@H](C)c1ccco1 ZINC000130554430 325066319 /nfs/dbraw/zinc/06/63/19/325066319.db2.gz FNTDSXNOJXMUNK-GFCCVEGCSA-N 0 3 223.360 4.003 20 0 BIADHN Cc1cc([C@@H](C)N[C@H]2C=CCCC2)c(C)s1 ZINC000130674874 325079173 /nfs/dbraw/zinc/07/91/73/325079173.db2.gz IBWXTMNQFDZNCF-YPMHNXCESA-N 0 3 235.396 4.124 20 0 BIADHN Cc1cc([C@H](C)N[C@H]2C=CCCC2)c(C)s1 ZINC000130675068 325079028 /nfs/dbraw/zinc/07/90/28/325079028.db2.gz IBWXTMNQFDZNCF-AAEUAGOBSA-N 0 3 235.396 4.124 20 0 BIADHN Cc1cc([C@@H](C)N[C@@H]2C=CCCC2)c(C)s1 ZINC000130675308 325079564 /nfs/dbraw/zinc/07/95/64/325079564.db2.gz IBWXTMNQFDZNCF-DGCLKSJQSA-N 0 3 235.396 4.124 20 0 BIADHN Cc1cc([C@H](C)N[C@@H]2C=CCCC2)c(C)s1 ZINC000130675507 325079553 /nfs/dbraw/zinc/07/95/53/325079553.db2.gz IBWXTMNQFDZNCF-WCQYABFASA-N 0 3 235.396 4.124 20 0 BIADHN C[C@@H](N[C@H]1C=CCCC1)c1cccc(Cl)c1 ZINC000130695833 325080482 /nfs/dbraw/zinc/08/04/82/325080482.db2.gz VPSZEWUGFDCWFO-RISCZKNCSA-N 0 3 235.758 4.099 20 0 BIADHN C[C@@H](N[C@@H]1C=CCCC1)c1cccc(Cl)c1 ZINC000130696243 325080750 /nfs/dbraw/zinc/08/07/50/325080750.db2.gz VPSZEWUGFDCWFO-BXUZGUMPSA-N 0 3 235.758 4.099 20 0 BIADHN CCC(CC)(CC)CN[C@@H](C)c1ccco1 ZINC000130770638 325085782 /nfs/dbraw/zinc/08/57/82/325085782.db2.gz AJNCCQGYMXVOFP-LBPRGKRZSA-N 0 3 223.360 4.147 20 0 BIADHN CCC(CC)(CC)CN[C@H](C)c1ccco1 ZINC000130770885 325085854 /nfs/dbraw/zinc/08/58/54/325085854.db2.gz AJNCCQGYMXVOFP-GFCCVEGCSA-N 0 3 223.360 4.147 20 0 BIADHN CCC(CC)(CC)CN[C@@H](C)c1cscn1 ZINC000130771144 325085994 /nfs/dbraw/zinc/08/59/94/325085994.db2.gz OAKLLOJFWACDPH-NSHDSACASA-N 0 3 240.416 4.010 20 0 BIADHN CCC(CC)(CC)CN[C@H](C)c1cscn1 ZINC000130771342 325085730 /nfs/dbraw/zinc/08/57/30/325085730.db2.gz OAKLLOJFWACDPH-LLVKDONJSA-N 0 3 240.416 4.010 20 0 BIADHN CCCCCN[C@@H](C)c1csc(C(C)C)n1 ZINC000132482191 191032000 /nfs/dbraw/zinc/03/20/00/191032000.db2.gz OCRHPHUWDALOQJ-NSHDSACASA-N 0 3 240.416 4.107 20 0 BIADHN CCCCCN[C@H](C)c1csc(C(C)C)n1 ZINC000132482396 191032143 /nfs/dbraw/zinc/03/21/43/191032143.db2.gz OCRHPHUWDALOQJ-LLVKDONJSA-N 0 3 240.416 4.107 20 0 BIADHN Cc1cc(NC[C@@H](C)C2CC2)c2ccccc2n1 ZINC000132805586 371924795 /nfs/dbraw/zinc/92/47/95/371924795.db2.gz CDYIWAGHZZUHTG-LLVKDONJSA-N 0 3 240.350 4.001 20 0 BIADHN Cc1cc(NC[C@H](C)C2CC2)c2ccccc2n1 ZINC000132805816 371924972 /nfs/dbraw/zinc/92/49/72/371924972.db2.gz CDYIWAGHZZUHTG-NSHDSACASA-N 0 3 240.350 4.001 20 0 BIADHN Clc1oc2ccccc2c1CNC1CCCC1 ZINC000133133824 191038310 /nfs/dbraw/zinc/03/83/10/191038310.db2.gz QUOLXXVQARLBLH-UHFFFAOYSA-N 0 3 249.741 4.118 20 0 BIADHN CC(C)(C)CCNc1ccnc2ccccc21 ZINC000134508142 325362320 /nfs/dbraw/zinc/36/23/20/325362320.db2.gz ICCHGIMMONMFBN-UHFFFAOYSA-N 0 3 228.339 4.083 20 0 BIADHN CCCC(C)(C)NCc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000134519683 325363066 /nfs/dbraw/zinc/36/30/66/325363066.db2.gz NBTYITMFJMWSDD-WCQYABFASA-N 0 3 235.371 4.071 20 0 BIADHN CCCC(C)(C)NCc1ccc([C@H]2C[C@@H]2C)o1 ZINC000134519706 323206474 /nfs/dbraw/zinc/20/64/74/323206474.db2.gz NBTYITMFJMWSDD-AAEUAGOBSA-N 0 3 235.371 4.071 20 0 BIADHN CCCC(C)(C)NCc1ccc([C@@H]2C[C@H]2C)o1 ZINC000134519728 325363351 /nfs/dbraw/zinc/36/33/51/325363351.db2.gz NBTYITMFJMWSDD-DGCLKSJQSA-N 0 3 235.371 4.071 20 0 BIADHN CCCC(C)(C)NCc1ccc([C@H]2C[C@H]2C)o1 ZINC000134519748 323206515 /nfs/dbraw/zinc/20/65/15/323206515.db2.gz NBTYITMFJMWSDD-YPMHNXCESA-N 0 3 235.371 4.071 20 0 BIADHN CCC[C@H](NCc1occc1C)c1ccccc1 ZINC000135131141 358822115 /nfs/dbraw/zinc/82/21/15/358822115.db2.gz OEXFMURKGPCLNG-HNNXBMFYSA-N 0 3 243.350 4.219 20 0 BIADHN CCC[C@@H](NCc1occc1C)c1ccccc1 ZINC000135131160 358822372 /nfs/dbraw/zinc/82/23/72/358822372.db2.gz OEXFMURKGPCLNG-OAHLLOKOSA-N 0 3 243.350 4.219 20 0 BIADHN Cc1ccoc1CN[C@@H](c1ccccc1)C(C)C ZINC000135135157 325396826 /nfs/dbraw/zinc/39/68/26/325396826.db2.gz LSMZQKLXXLIRFI-MRXNPFEDSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1ccoc1CN[C@H](c1ccccc1)C(C)C ZINC000135135174 325396817 /nfs/dbraw/zinc/39/68/17/325396817.db2.gz LSMZQKLXXLIRFI-INIZCTEOSA-N 0 3 243.350 4.075 20 0 BIADHN CCCC1CCC(NCc2occc2C)CC1 ZINC000135162085 325398189 /nfs/dbraw/zinc/39/81/89/325398189.db2.gz RAVKREDWTFJGMC-UHFFFAOYSA-N 0 3 235.371 4.037 20 0 BIADHN CCCC[C@H](NCc1ccoc1)c1ccccc1 ZINC000135458129 134745841 /nfs/dbraw/zinc/74/58/41/134745841.db2.gz HYXXNAIFXZUSAQ-INIZCTEOSA-N 0 3 243.350 4.301 20 0 BIADHN CCCC[C@@H](NCc1ccoc1)c1ccccc1 ZINC000135458150 358839670 /nfs/dbraw/zinc/83/96/70/358839670.db2.gz HYXXNAIFXZUSAQ-MRXNPFEDSA-N 0 3 243.350 4.301 20 0 BIADHN CC[C@@H]1CCCCN1Cc1ccc(Cl)cc1 ZINC000140515639 372703136 /nfs/dbraw/zinc/70/31/36/372703136.db2.gz RHHYGHRDGHIPAD-CQSZACIVSA-N 0 3 237.774 4.105 20 0 BIADHN CC[C@H]1CCCCN1Cc1ccc(Cl)cc1 ZINC000140515809 372703628 /nfs/dbraw/zinc/70/36/28/372703628.db2.gz RHHYGHRDGHIPAD-AWEZNQCLSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@@H](NC/C=C\Cl)c1cccc2ccccc21 ZINC000147830812 583768160 /nfs/dbraw/zinc/76/81/60/583768160.db2.gz JRAHNGWTQOEDCO-DUWGPSABSA-N 0 3 245.753 4.243 20 0 BIADHN CCCCN(C)Cc1ccc(Cl)c(Cl)c1 ZINC000149664771 347412944 /nfs/dbraw/zinc/41/29/44/347412944.db2.gz HRADYHUJSKEGMG-UHFFFAOYSA-N 0 3 246.181 4.225 20 0 BIADHN C[C@@H](c1ccco1)N(C)CCCCC(F)(F)F ZINC000151331889 176032301 /nfs/dbraw/zinc/03/23/01/176032301.db2.gz MKOBAFIZKONHRY-JTQLQIEISA-N 0 3 249.276 4.005 20 0 BIADHN C[C@H](c1ccco1)N(C)CCCCC(F)(F)F ZINC000151331961 177047476 /nfs/dbraw/zinc/04/74/76/177047476.db2.gz MKOBAFIZKONHRY-SNVBAGLBSA-N 0 3 249.276 4.005 20 0 BIADHN CC(C)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000151978922 191114007 /nfs/dbraw/zinc/11/40/07/191114007.db2.gz KHHYOQJSYPQFLP-QMMMGPOBSA-N 0 3 232.154 4.052 20 0 BIADHN CC(C)N[C@H](C)c1cccc(Cl)c1Cl ZINC000151978991 201187742 /nfs/dbraw/zinc/18/77/42/201187742.db2.gz KHHYOQJSYPQFLP-MRVPVSSYSA-N 0 3 232.154 4.052 20 0 BIADHN Cc1ccc([C@@H](C)CN[C@@H](C)c2ccco2)cc1 ZINC000152015192 323099655 /nfs/dbraw/zinc/09/96/55/323099655.db2.gz BIBKIYANALTEPB-KBPBESRZSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1ccc([C@H](C)CN[C@@H](C)c2ccco2)cc1 ZINC000152015284 323099734 /nfs/dbraw/zinc/09/97/34/323099734.db2.gz BIBKIYANALTEPB-KGLIPLIRSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1ccc([C@@H](C)CN[C@H](C)c2ccco2)cc1 ZINC000152015366 323099684 /nfs/dbraw/zinc/09/96/84/323099684.db2.gz BIBKIYANALTEPB-UONOGXRCSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1ccc([C@H](C)CN[C@H](C)c2ccco2)cc1 ZINC000152015418 323099732 /nfs/dbraw/zinc/09/97/32/323099732.db2.gz BIBKIYANALTEPB-ZIAGYGMSSA-N 0 3 243.350 4.042 20 0 BIADHN C[C@@H](CCC1CCCC1)N[C@@H](C)c1ccccn1 ZINC000152410010 541453252 /nfs/dbraw/zinc/45/32/52/541453252.db2.gz SWXXDXPRGPXVEX-KBPBESRZSA-N 0 3 246.398 4.091 20 0 BIADHN C[C@H](CCC1CCCC1)N[C@@H](C)c1ccccn1 ZINC000152410063 541453174 /nfs/dbraw/zinc/45/31/74/541453174.db2.gz SWXXDXPRGPXVEX-KGLIPLIRSA-N 0 3 246.398 4.091 20 0 BIADHN CCC[C@@H](C)[C@@H](CC)N[C@@H](C)c1nccs1 ZINC000153380589 201235112 /nfs/dbraw/zinc/23/51/12/201235112.db2.gz DFANQTSKFQVNGY-GRYCIOLGSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](C)[C@@H](CC)N[C@@H](C)c1nccs1 ZINC000153380711 201235087 /nfs/dbraw/zinc/23/50/87/201235087.db2.gz DFANQTSKFQVNGY-SDDRHHMPSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@@H](C)[C@H](CC)N[C@@H](C)c1nccs1 ZINC000153380816 201235015 /nfs/dbraw/zinc/23/50/15/201235015.db2.gz DFANQTSKFQVNGY-WOPDTQHZSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](C)[C@H](CC)N[C@@H](C)c1nccs1 ZINC000153380933 201234214 /nfs/dbraw/zinc/23/42/14/201234214.db2.gz DFANQTSKFQVNGY-SRVKXCTJSA-N 0 3 240.416 4.009 20 0 BIADHN c1cc(CN2CCC[C@@H]2c2ccsc2)cs1 ZINC000153565903 326102248 /nfs/dbraw/zinc/10/22/48/326102248.db2.gz BVSWAYJKVYGGEE-CYBMUJFWSA-N 0 3 249.404 4.147 20 0 BIADHN c1cc(CN2CCC[C@H]2c2ccsc2)cs1 ZINC000153566009 326102439 /nfs/dbraw/zinc/10/24/39/326102439.db2.gz BVSWAYJKVYGGEE-ZDUSSCGKSA-N 0 3 249.404 4.147 20 0 BIADHN Cc1cc(C)cc([C@@H](C)N[C@@H](C)c2ccoc2)c1 ZINC000155918987 326214684 /nfs/dbraw/zinc/21/46/84/326214684.db2.gz WEOJPQZQJUXRIK-UONOGXRCSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cc(C)cc([C@H](C)N[C@@H](C)c2ccoc2)c1 ZINC000155919104 326214817 /nfs/dbraw/zinc/21/48/17/326214817.db2.gz WEOJPQZQJUXRIK-KBPBESRZSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cc(C)cc([C@@H](C)N[C@H](C)c2ccoc2)c1 ZINC000155919207 326215003 /nfs/dbraw/zinc/21/50/03/326215003.db2.gz WEOJPQZQJUXRIK-ZIAGYGMSSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cc(C)cc([C@H](C)N[C@H](C)c2ccoc2)c1 ZINC000155919326 326214674 /nfs/dbraw/zinc/21/46/74/326214674.db2.gz WEOJPQZQJUXRIK-KGLIPLIRSA-N 0 3 243.350 4.308 20 0 BIADHN C[C@H](NCCCCC1CCCC1)c1ccccn1 ZINC000159256652 326393446 /nfs/dbraw/zinc/39/34/46/326393446.db2.gz HPERFYJFRFNKBF-AWEZNQCLSA-N 0 3 246.398 4.093 20 0 BIADHN C[C@@H](NCCCCC1CCCC1)c1ccccn1 ZINC000159256791 326393344 /nfs/dbraw/zinc/39/33/44/326393344.db2.gz HPERFYJFRFNKBF-CQSZACIVSA-N 0 3 246.398 4.093 20 0 BIADHN Cc1cc(CN[C@H](C)c2ccccc2C)c(C)o1 ZINC000159632630 641692049 /nfs/dbraw/zinc/69/20/49/641692049.db2.gz OPPNPLUQXCFEEF-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc(CN[C@@H](C)c2ccccc2C)c(C)o1 ZINC000159632728 641691187 /nfs/dbraw/zinc/69/11/87/641691187.db2.gz OPPNPLUQXCFEEF-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN CC1(NCc2c(Cl)oc3ccccc32)CCC1 ZINC000161026877 323143278 /nfs/dbraw/zinc/14/32/78/323143278.db2.gz BJCQUJIKRDYGTB-UHFFFAOYSA-N 0 3 249.741 4.118 20 0 BIADHN CCCCCC[C@@H](C)N[C@@H](C)c1cscn1 ZINC000161125878 711678582 /nfs/dbraw/zinc/67/85/82/711678582.db2.gz ZHNQXPZKRCJTIP-NEPJUHHUSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCCC[C@H](C)N[C@@H](C)c1cscn1 ZINC000161125997 711810669 /nfs/dbraw/zinc/81/06/69/711810669.db2.gz ZHNQXPZKRCJTIP-RYUDHWBXSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCCC[C@@H](C)N[C@H](C)c1cscn1 ZINC000161126111 711810679 /nfs/dbraw/zinc/81/06/79/711810679.db2.gz ZHNQXPZKRCJTIP-VXGBXAGGSA-N 0 3 240.416 4.153 20 0 BIADHN CCCCCC[C@H](C)N[C@H](C)c1cscn1 ZINC000161126236 711810702 /nfs/dbraw/zinc/81/07/02/711810702.db2.gz ZHNQXPZKRCJTIP-NWDGAFQWSA-N 0 3 240.416 4.153 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@@H](C)c1cscn1 ZINC000161129087 323148814 /nfs/dbraw/zinc/14/88/14/323148814.db2.gz HNRRCMGMIKFDSK-NEPJUHHUSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@H](C)N[C@@H](C)c1cscn1 ZINC000161129206 323148664 /nfs/dbraw/zinc/14/86/64/323148664.db2.gz HNRRCMGMIKFDSK-RYUDHWBXSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@H](C)c1cscn1 ZINC000161129329 323148737 /nfs/dbraw/zinc/14/87/37/323148737.db2.gz HNRRCMGMIKFDSK-VXGBXAGGSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@H](C)N[C@H](C)c1cscn1 ZINC000161129433 323075834 /nfs/dbraw/zinc/07/58/34/323075834.db2.gz HNRRCMGMIKFDSK-NWDGAFQWSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC[C@@H](CC)CN[C@@H](C)c1cscn1 ZINC000161133842 323148831 /nfs/dbraw/zinc/14/88/31/323148831.db2.gz ANYDRHBTHZPDHC-NWDGAFQWSA-N 0 3 240.416 4.010 20 0 BIADHN CCCC[C@H](CC)CN[C@@H](C)c1cscn1 ZINC000161133959 323149009 /nfs/dbraw/zinc/14/90/09/323149009.db2.gz ANYDRHBTHZPDHC-RYUDHWBXSA-N 0 3 240.416 4.010 20 0 BIADHN CCCC[C@@H](CC)CN[C@H](C)c1cscn1 ZINC000161134107 323148959 /nfs/dbraw/zinc/14/89/59/323148959.db2.gz ANYDRHBTHZPDHC-VXGBXAGGSA-N 0 3 240.416 4.010 20 0 BIADHN CCCC[C@H](CC)CN[C@H](C)c1cscn1 ZINC000161134230 323149006 /nfs/dbraw/zinc/14/90/06/323149006.db2.gz ANYDRHBTHZPDHC-NEPJUHHUSA-N 0 3 240.416 4.010 20 0 BIADHN Cc1cccc([C@@H](C)CN[C@@H](C)c2ccco2)c1 ZINC000162133002 323595266 /nfs/dbraw/zinc/59/52/66/323595266.db2.gz IFHZJYGQHSBDOQ-KBPBESRZSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1cccc([C@H](C)CN[C@@H](C)c2ccco2)c1 ZINC000162133118 387319487 /nfs/dbraw/zinc/31/94/87/387319487.db2.gz IFHZJYGQHSBDOQ-KGLIPLIRSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1cccc([C@@H](C)CN[C@H](C)c2ccco2)c1 ZINC000162133234 323595450 /nfs/dbraw/zinc/59/54/50/323595450.db2.gz IFHZJYGQHSBDOQ-UONOGXRCSA-N 0 3 243.350 4.042 20 0 BIADHN Cc1cccc([C@H](C)CN[C@H](C)c2ccco2)c1 ZINC000162133326 323595528 /nfs/dbraw/zinc/59/55/28/323595528.db2.gz IFHZJYGQHSBDOQ-ZIAGYGMSSA-N 0 3 243.350 4.042 20 0 BIADHN c1csc([C@@H]2CCCN2Cc2ccsc2)c1 ZINC000162716597 387517324 /nfs/dbraw/zinc/51/73/24/387517324.db2.gz LKICPDCODGIGSK-LBPRGKRZSA-N 0 3 249.404 4.147 20 0 BIADHN c1csc([C@H]2CCCN2Cc2ccsc2)c1 ZINC000162716733 387517030 /nfs/dbraw/zinc/51/70/30/387517030.db2.gz LKICPDCODGIGSK-GFCCVEGCSA-N 0 3 249.404 4.147 20 0 BIADHN C[C@@H](CCCC(F)(F)F)N[C@@H](C)c1ccco1 ZINC000163251211 202319408 /nfs/dbraw/zinc/31/94/08/202319408.db2.gz WGRZHVRBZXBFDU-UWVGGRQHSA-N 0 3 249.276 4.051 20 0 BIADHN C[C@H](CCCC(F)(F)F)N[C@@H](C)c1ccco1 ZINC000163251299 202318368 /nfs/dbraw/zinc/31/83/68/202318368.db2.gz WGRZHVRBZXBFDU-ZJUUUORDSA-N 0 3 249.276 4.051 20 0 BIADHN C[C@@H](N[C@@H](C)CCCC(F)(F)F)c1ccco1 ZINC000163251366 202319197 /nfs/dbraw/zinc/31/91/97/202319197.db2.gz WGRZHVRBZXBFDU-VHSXEESVSA-N 0 3 249.276 4.051 20 0 BIADHN C[C@H](CCCC(F)(F)F)N[C@H](C)c1ccco1 ZINC000163251439 202319312 /nfs/dbraw/zinc/31/93/12/202319312.db2.gz WGRZHVRBZXBFDU-NXEZZACHSA-N 0 3 249.276 4.051 20 0 BIADHN CC[C@H](NCc1ccccc1)c1ccccc1F ZINC000163456002 386601219 /nfs/dbraw/zinc/60/12/19/386601219.db2.gz JXGAKGKNFWVYSQ-INIZCTEOSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@@H](NCc1ccccc1)c1ccccc1F ZINC000163456112 386523519 /nfs/dbraw/zinc/52/35/19/386523519.db2.gz JXGAKGKNFWVYSQ-MRXNPFEDSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@H](NCc1cccs1)c1ccccc1F ZINC000163458206 386166948 /nfs/dbraw/zinc/16/69/48/386166948.db2.gz BHJXWSQUQZRAGU-AWEZNQCLSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1cccs1)c1ccccc1F ZINC000163458315 353352984 /nfs/dbraw/zinc/35/29/84/353352984.db2.gz BHJXWSQUQZRAGU-CQSZACIVSA-N 0 3 249.354 4.128 20 0 BIADHN Cc1cc(CN[C@H](C)c2ccc(C)cc2)c(C)o1 ZINC000163652986 640401846 /nfs/dbraw/zinc/40/18/46/640401846.db2.gz KYZYJZOUTKSGAF-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc(CN[C@@H](C)c2ccc(C)cc2)c(C)o1 ZINC000163653082 640401247 /nfs/dbraw/zinc/40/12/47/640401247.db2.gz KYZYJZOUTKSGAF-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN CC(C)(C)CCCCNCc1ccc(Cl)o1 ZINC000163877483 388097941 /nfs/dbraw/zinc/09/79/41/388097941.db2.gz BDLMGDDPTVPHNZ-UHFFFAOYSA-N 0 3 243.778 4.239 20 0 BIADHN C[C@@H](CCC(C)(C)C)NCc1ccc(Cl)o1 ZINC000164181122 388166698 /nfs/dbraw/zinc/16/66/98/388166698.db2.gz SLQWQEMTNCBXRK-JTQLQIEISA-N 0 3 243.778 4.237 20 0 BIADHN C[C@H](CCC(C)(C)C)NCc1ccc(Cl)o1 ZINC000164181226 388166354 /nfs/dbraw/zinc/16/63/54/388166354.db2.gz SLQWQEMTNCBXRK-SNVBAGLBSA-N 0 3 243.778 4.237 20 0 BIADHN CC(C)CN(C)Cc1ccc(Cl)cc1Cl ZINC000165320546 345719927 /nfs/dbraw/zinc/71/99/27/345719927.db2.gz HZTZCZXFNATINE-UHFFFAOYSA-N 0 3 246.181 4.081 20 0 BIADHN CC1CC(NC2c3ccccc3-c3ccccc32)C1 ZINC000166253235 203387128 /nfs/dbraw/zinc/38/71/28/203387128.db2.gz JVMAKSGMGCFTGZ-UHFFFAOYSA-N 0 3 249.357 4.145 20 0 BIADHN CC[C@@H](C)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000166320113 203387693 /nfs/dbraw/zinc/38/76/93/203387693.db2.gz VXNPVTRLFANXQQ-BDAKNGLRSA-N 0 3 246.181 4.443 20 0 BIADHN CC[C@H](C)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000166320244 203387217 /nfs/dbraw/zinc/38/72/17/203387217.db2.gz VXNPVTRLFANXQQ-IUCAKERBSA-N 0 3 246.181 4.443 20 0 BIADHN CC[C@@H](C)N[C@H](C)c1cccc(Cl)c1Cl ZINC000166320355 203387243 /nfs/dbraw/zinc/38/72/43/203387243.db2.gz VXNPVTRLFANXQQ-RKDXNWHRSA-N 0 3 246.181 4.443 20 0 BIADHN CC[C@H](C)N[C@H](C)c1cccc(Cl)c1Cl ZINC000166320461 203387162 /nfs/dbraw/zinc/38/71/62/203387162.db2.gz VXNPVTRLFANXQQ-DTWKUNHWSA-N 0 3 246.181 4.443 20 0 BIADHN CC[C@H](NCc1ccccc1)c1cccc(F)c1 ZINC000166388620 398003118 /nfs/dbraw/zinc/00/31/18/398003118.db2.gz TVNRRMVPNMFYLN-INIZCTEOSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@@H](NCc1ccccc1)c1cccc(F)c1 ZINC000166388742 398002938 /nfs/dbraw/zinc/00/29/38/398002938.db2.gz TVNRRMVPNMFYLN-MRXNPFEDSA-N 0 3 243.325 4.067 20 0 BIADHN CC[C@H](NCc1cccs1)c1cccc(F)c1 ZINC000166431325 386929476 /nfs/dbraw/zinc/92/94/76/386929476.db2.gz ZTYBTNVRDRJXBV-AWEZNQCLSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1cccs1)c1cccc(F)c1 ZINC000166431456 355459628 /nfs/dbraw/zinc/45/96/28/355459628.db2.gz ZTYBTNVRDRJXBV-CQSZACIVSA-N 0 3 249.354 4.128 20 0 BIADHN CC(C)=CCC[C@H](C)N[C@@H](C)c1ccco1 ZINC000166510798 527426574 /nfs/dbraw/zinc/42/65/74/527426574.db2.gz XAKVFTJUEKTEDR-STQMWFEESA-N 0 3 221.344 4.065 20 0 BIADHN CC(C)=CCC[C@@H](C)N[C@@H](C)c1ccco1 ZINC000166510919 527418363 /nfs/dbraw/zinc/41/83/63/527418363.db2.gz XAKVFTJUEKTEDR-OLZOCXBDSA-N 0 3 221.344 4.065 20 0 BIADHN CC(C)=CCC[C@H](C)N[C@H](C)c1ccco1 ZINC000166511039 527425890 /nfs/dbraw/zinc/42/58/90/527425890.db2.gz XAKVFTJUEKTEDR-QWHCGFSZSA-N 0 3 221.344 4.065 20 0 BIADHN CC(C)=CCC[C@@H](C)N[C@H](C)c1ccco1 ZINC000166511160 527418414 /nfs/dbraw/zinc/41/84/14/527418414.db2.gz XAKVFTJUEKTEDR-CHWSQXEVSA-N 0 3 221.344 4.065 20 0 BIADHN CC[C@H](NCc1ccsc1)c1cccc(F)c1 ZINC000166582385 385256564 /nfs/dbraw/zinc/25/65/64/385256564.db2.gz RBPQMVYANZFYLF-AWEZNQCLSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1ccsc1)c1cccc(F)c1 ZINC000166582516 346682252 /nfs/dbraw/zinc/68/22/52/346682252.db2.gz RBPQMVYANZFYLF-CQSZACIVSA-N 0 3 249.354 4.128 20 0 BIADHN C[C@H](NCCCCC(C)(C)C)c1ccco1 ZINC000167273666 206146434 /nfs/dbraw/zinc/14/64/34/206146434.db2.gz UGWWFOFIOVQWPF-LBPRGKRZSA-N 0 3 223.360 4.147 20 0 BIADHN C[C@@H](NCCCCC(C)(C)C)c1ccco1 ZINC000167273773 206145719 /nfs/dbraw/zinc/14/57/19/206145719.db2.gz UGWWFOFIOVQWPF-GFCCVEGCSA-N 0 3 223.360 4.147 20 0 BIADHN C[C@H](NCCCCC(C)(C)C)c1ccoc1 ZINC000167274759 326439788 /nfs/dbraw/zinc/43/97/88/326439788.db2.gz IEODGSRJEFILOK-LBPRGKRZSA-N 0 3 223.360 4.147 20 0 BIADHN C[C@@H](NCCCCC(C)(C)C)c1ccoc1 ZINC000167274861 388439356 /nfs/dbraw/zinc/43/93/56/388439356.db2.gz IEODGSRJEFILOK-GFCCVEGCSA-N 0 3 223.360 4.147 20 0 BIADHN C[C@@H](CCC(C)(C)C)N[C@@H](C)c1ccco1 ZINC000167890694 206022735 /nfs/dbraw/zinc/02/27/35/206022735.db2.gz UMVGEKZVSSZSDQ-RYUDHWBXSA-N 0 3 223.360 4.145 20 0 BIADHN C[C@H](CCC(C)(C)C)N[C@@H](C)c1ccco1 ZINC000167890776 206146918 /nfs/dbraw/zinc/14/69/18/206146918.db2.gz UMVGEKZVSSZSDQ-NEPJUHHUSA-N 0 3 223.360 4.145 20 0 BIADHN C[C@@H](N[C@@H](C)CCC(C)(C)C)c1ccco1 ZINC000167890875 206148303 /nfs/dbraw/zinc/14/83/03/206148303.db2.gz UMVGEKZVSSZSDQ-NWDGAFQWSA-N 0 3 223.360 4.145 20 0 BIADHN C[C@H](CCC(C)(C)C)N[C@H](C)c1ccco1 ZINC000167890967 206147783 /nfs/dbraw/zinc/14/77/83/206147783.db2.gz UMVGEKZVSSZSDQ-VXGBXAGGSA-N 0 3 223.360 4.145 20 0 BIADHN CC(C)C[C@H](NCc1ccoc1)c1cccs1 ZINC000171132280 385470440 /nfs/dbraw/zinc/47/04/40/385470440.db2.gz OHFGOMSRQLOORO-ZDUSSCGKSA-N 0 3 249.379 4.218 20 0 BIADHN CC(C)C[C@@H](NCc1ccoc1)c1cccs1 ZINC000171132284 385469349 /nfs/dbraw/zinc/46/93/49/385469349.db2.gz OHFGOMSRQLOORO-CYBMUJFWSA-N 0 3 249.379 4.218 20 0 BIADHN c1csc(CN2CCC[C@@H]2c2cccs2)c1 ZINC000175250969 388428133 /nfs/dbraw/zinc/42/81/33/388428133.db2.gz FEODVPDZEXYJCZ-GFCCVEGCSA-N 0 3 249.404 4.147 20 0 BIADHN c1csc(CN2CCC[C@H]2c2cccs2)c1 ZINC000175250986 388428115 /nfs/dbraw/zinc/42/81/15/388428115.db2.gz FEODVPDZEXYJCZ-LBPRGKRZSA-N 0 3 249.404 4.147 20 0 BIADHN C[C@@H](c1ccccn1)N(C)CCC1CCCCC1 ZINC000177098807 388475275 /nfs/dbraw/zinc/47/52/75/388475275.db2.gz JRGYNSDYCRLYJO-AWEZNQCLSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@H](c1ccccn1)N(C)CCC1CCCCC1 ZINC000177098828 388475396 /nfs/dbraw/zinc/47/53/96/388475396.db2.gz JRGYNSDYCRLYJO-CQSZACIVSA-N 0 3 246.398 4.045 20 0 BIADHN Cc1cccc([C@@H](C)N[C@@H](C)c2ccoc2)c1C ZINC000178338604 366114977 /nfs/dbraw/zinc/11/49/77/366114977.db2.gz DMPAWPFYSBYJEC-UONOGXRCSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cccc([C@H](C)N[C@@H](C)c2ccoc2)c1C ZINC000178338616 366114868 /nfs/dbraw/zinc/11/48/68/366114868.db2.gz DMPAWPFYSBYJEC-KBPBESRZSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cccc([C@@H](C)N[C@H](C)c2ccoc2)c1C ZINC000178338629 366115156 /nfs/dbraw/zinc/11/51/56/366115156.db2.gz DMPAWPFYSBYJEC-ZIAGYGMSSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cccc([C@H](C)N[C@H](C)c2ccoc2)c1C ZINC000178338641 366114128 /nfs/dbraw/zinc/11/41/28/366114128.db2.gz DMPAWPFYSBYJEC-KGLIPLIRSA-N 0 3 243.350 4.308 20 0 BIADHN CCCCN(CC)[C@@H](C)c1nc2ccccc2o1 ZINC000180902507 384286610 /nfs/dbraw/zinc/28/66/10/384286610.db2.gz OVSULYWARRWPBS-LBPRGKRZSA-N 0 3 246.354 4.011 20 0 BIADHN CCCCN(CC)[C@H](C)c1nc2ccccc2o1 ZINC000180902524 384286872 /nfs/dbraw/zinc/28/68/72/384286872.db2.gz OVSULYWARRWPBS-GFCCVEGCSA-N 0 3 246.354 4.011 20 0 BIADHN CCc1c2ccccc2oc1[C@@H](C)NCCCF ZINC000182028381 366860657 /nfs/dbraw/zinc/86/06/57/366860657.db2.gz NBSGKMGSSFXJAJ-LLVKDONJSA-N 0 3 249.329 4.005 20 0 BIADHN CCc1c2ccccc2oc1[C@H](C)NCCCF ZINC000182028400 366860112 /nfs/dbraw/zinc/86/01/12/366860112.db2.gz NBSGKMGSSFXJAJ-NSHDSACASA-N 0 3 249.329 4.005 20 0 BIADHN CC(C)=CCN[C@@H](C)c1ccc(Cl)s1 ZINC000183002884 527444910 /nfs/dbraw/zinc/44/49/10/527444910.db2.gz QNISTXFYQWXDNV-VIFPVBQESA-N 0 3 229.776 4.018 20 0 BIADHN CC(C)=CCN[C@H](C)c1ccc(Cl)s1 ZINC000183002903 385499702 /nfs/dbraw/zinc/49/97/02/385499702.db2.gz QNISTXFYQWXDNV-SECBINFHSA-N 0 3 229.776 4.018 20 0 BIADHN C[C@H](NCCC1=CCCCCC1)c1ccccn1 ZINC000184573517 256846816 /nfs/dbraw/zinc/84/68/16/256846816.db2.gz UNWKRTLBTGEFJI-AWEZNQCLSA-N 0 3 244.382 4.013 20 0 BIADHN C[C@@H](NCCC1=CCCCCC1)c1ccccn1 ZINC000184573533 388578947 /nfs/dbraw/zinc/57/89/47/388578947.db2.gz UNWKRTLBTGEFJI-CQSZACIVSA-N 0 3 244.382 4.013 20 0 BIADHN CC(C)=CCN[C@@H](C)c1csc(Cl)c1 ZINC000188446697 386552651 /nfs/dbraw/zinc/55/26/51/386552651.db2.gz OOYUPGHEZDPJPQ-VIFPVBQESA-N 0 3 229.776 4.018 20 0 BIADHN CC(C)=CCN[C@H](C)c1csc(Cl)c1 ZINC000188446717 386553921 /nfs/dbraw/zinc/55/39/21/386553921.db2.gz OOYUPGHEZDPJPQ-SECBINFHSA-N 0 3 229.776 4.018 20 0 BIADHN CCc1cccc(CN[C@@H](C)c2cccs2)c1 ZINC000189937101 388645196 /nfs/dbraw/zinc/64/51/96/388645196.db2.gz IKISVVDCGHORLV-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1cccc(CN[C@H](C)c2cccs2)c1 ZINC000189937120 388644916 /nfs/dbraw/zinc/64/49/16/388644916.db2.gz IKISVVDCGHORLV-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN CCC[C@H](NCc1ccccc1)c1ccsc1 ZINC000191182717 386772784 /nfs/dbraw/zinc/77/27/84/386772784.db2.gz GBPXJUWCKXRDAG-HNNXBMFYSA-N 0 3 245.391 4.379 20 0 BIADHN CCC[C@@H](NCc1ccccc1)c1ccsc1 ZINC000191182733 386772538 /nfs/dbraw/zinc/77/25/38/386772538.db2.gz GBPXJUWCKXRDAG-OAHLLOKOSA-N 0 3 245.391 4.379 20 0 BIADHN CCN(Cc1ccccc1)Cc1cccc(C)c1 ZINC000201196447 384206026 /nfs/dbraw/zinc/20/60/26/384206026.db2.gz DXRRJCFAKXPIRL-UHFFFAOYSA-N 0 3 239.362 4.017 20 0 BIADHN CC(C)c1cccc(CNCc2ccccc2)c1 ZINC000205274479 363083556 /nfs/dbraw/zinc/08/35/56/363083556.db2.gz BNPSATQCSHCGGW-UHFFFAOYSA-N 0 3 239.362 4.100 20 0 BIADHN Cc1ccc([C@@H](C)N(C)Cc2cccs2)cc1 ZINC000206571282 355935322 /nfs/dbraw/zinc/93/53/22/355935322.db2.gz PGZMQTRGVSNNAY-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccc([C@H](C)N(C)Cc2cccs2)cc1 ZINC000206571329 345734527 /nfs/dbraw/zinc/73/45/27/345734527.db2.gz PGZMQTRGVSNNAY-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN CC(C)(C)CC(C)(C)NC/C(Cl)=C\Cl ZINC000211227320 711579948 /nfs/dbraw/zinc/57/99/48/711579948.db2.gz YYDMPEHAJJFCCS-RMKNXTFCSA-N 0 3 238.202 4.110 20 0 BIADHN C[C@H](NC/C=C\c1ccccc1)c1ccsc1 ZINC000211907342 384068513 /nfs/dbraw/zinc/06/85/13/384068513.db2.gz LFNJAAMOPJSDOW-UJZCVKTISA-N 0 3 243.375 4.112 20 0 BIADHN C[C@@H](NC/C=C\c1ccccc1)c1ccsc1 ZINC000211907434 384067626 /nfs/dbraw/zinc/06/76/26/384067626.db2.gz LFNJAAMOPJSDOW-DMTLFAOVSA-N 0 3 243.375 4.112 20 0 BIADHN C[C@H](NC/C=C\Cl)c1cccc2ccccc21 ZINC000214991258 591909836 /nfs/dbraw/zinc/90/98/36/591909836.db2.gz JRAHNGWTQOEDCO-JSJZCHLLSA-N 0 3 245.753 4.243 20 0 BIADHN C[C@H](NC/C=C/Cl)c1cccc2ccccc21 ZINC000214991303 591909983 /nfs/dbraw/zinc/90/99/83/591909983.db2.gz JRAHNGWTQOEDCO-DJTWPOEFSA-N 0 3 245.753 4.243 20 0 BIADHN Cc1cccc(C)c1CN[C@@H](C)c1cccs1 ZINC000215361902 398312572 /nfs/dbraw/zinc/31/25/72/398312572.db2.gz UFAFQCVTRISXFN-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(C)c1CN[C@H](C)c1cccs1 ZINC000215361943 398312547 /nfs/dbraw/zinc/31/25/47/398312547.db2.gz UFAFQCVTRISXFN-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(C)c1CN[C@@H](C)c1ccsc1 ZINC000215396702 491088366 /nfs/dbraw/zinc/08/83/66/491088366.db2.gz GBWQLBCHJFUILR-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(C)c1CN[C@H](C)c1ccsc1 ZINC000215396748 490204146 /nfs/dbraw/zinc/20/41/46/490204146.db2.gz GBWQLBCHJFUILR-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN CC(C)N(Cc1ccsc1)Cc1ccccc1 ZINC000215662210 384507430 /nfs/dbraw/zinc/50/74/30/384507430.db2.gz BXPKBNXYWWKJLW-UHFFFAOYSA-N 0 3 245.391 4.159 20 0 BIADHN CCN(Cc1cccs1)[C@@H](C)c1ccccc1 ZINC000215911294 323080526 /nfs/dbraw/zinc/08/05/26/323080526.db2.gz XXXOOGIMVWSVOM-ZDUSSCGKSA-N 0 3 245.391 4.331 20 0 BIADHN CCN(Cc1cccs1)[C@H](C)c1ccccc1 ZINC000215911339 323080531 /nfs/dbraw/zinc/08/05/31/323080531.db2.gz XXXOOGIMVWSVOM-CYBMUJFWSA-N 0 3 245.391 4.331 20 0 BIADHN CC(C)N(Cc1cccs1)Cc1ccccc1 ZINC000216347612 323101155 /nfs/dbraw/zinc/10/11/55/323101155.db2.gz YTJOGRFMMRPVPH-UHFFFAOYSA-N 0 3 245.391 4.159 20 0 BIADHN CC(C)=CCN[C@@H](C)c1cc2ccccc2o1 ZINC000219387656 388591313 /nfs/dbraw/zinc/59/13/13/388591313.db2.gz RVJLCTJPXKOKPY-LBPRGKRZSA-N 0 3 229.323 4.050 20 0 BIADHN CC(C)=CCN[C@H](C)c1cc2ccccc2o1 ZINC000219387726 388591113 /nfs/dbraw/zinc/59/11/13/388591113.db2.gz RVJLCTJPXKOKPY-GFCCVEGCSA-N 0 3 229.323 4.050 20 0 BIADHN C[C@H](NC/C=C\c1ccccc1)c1cccs1 ZINC000220563457 388606466 /nfs/dbraw/zinc/60/64/66/388606466.db2.gz PEASAGKHYDLVMD-QGOGUYACSA-N 0 3 243.375 4.112 20 0 BIADHN C[C@@H](NC/C=C\c1ccccc1)c1cccs1 ZINC000220563508 259310395 /nfs/dbraw/zinc/31/03/95/259310395.db2.gz PEASAGKHYDLVMD-WYOARUQKSA-N 0 3 243.375 4.112 20 0 BIADHN C[C@@H](NC1CCC1)c1cccc(Cl)c1Cl ZINC000221990589 357181315 /nfs/dbraw/zinc/18/13/15/357181315.db2.gz MKXZWLULFQHOIK-MRVPVSSYSA-N 0 3 244.165 4.197 20 0 BIADHN C[C@H](NC1CCC1)c1cccc(Cl)c1Cl ZINC000221990647 357181229 /nfs/dbraw/zinc/18/12/29/357181229.db2.gz MKXZWLULFQHOIK-QMMMGPOBSA-N 0 3 244.165 4.197 20 0 BIADHN CC[C@H](C)[C@@H](C)N[C@@H](C)c1cccc(F)c1F ZINC000222719307 388644256 /nfs/dbraw/zinc/64/42/56/388644256.db2.gz GBVGWSGAZMKKOB-AXFHLTTASA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](C)[C@H](C)N[C@@H](C)c1cccc(F)c1F ZINC000222719425 388644368 /nfs/dbraw/zinc/64/43/68/388644368.db2.gz GBVGWSGAZMKKOB-DCAQKATOSA-N 0 3 241.325 4.050 20 0 BIADHN CCCC[C@@H](C)N[C@@H](C)c1cccc(F)c1F ZINC000222720072 388643442 /nfs/dbraw/zinc/64/34/42/388643442.db2.gz XPBVHJHDVRDVRU-MNOVXSKESA-N 0 3 241.325 4.194 20 0 BIADHN CCCC[C@H](C)N[C@@H](C)c1cccc(F)c1F ZINC000222720140 388643810 /nfs/dbraw/zinc/64/38/10/388643810.db2.gz XPBVHJHDVRDVRU-QWRGUYRKSA-N 0 3 241.325 4.194 20 0 BIADHN CCCC[C@@H](C)N[C@H](C)c1cccc(F)c1F ZINC000222720196 388644092 /nfs/dbraw/zinc/64/40/92/388644092.db2.gz XPBVHJHDVRDVRU-GHMZBOCLSA-N 0 3 241.325 4.194 20 0 BIADHN CCCC[C@H](C)N[C@H](C)c1cccc(F)c1F ZINC000222720257 388643903 /nfs/dbraw/zinc/64/39/03/388643903.db2.gz XPBVHJHDVRDVRU-WDEREUQCSA-N 0 3 241.325 4.194 20 0 BIADHN CC(C)C[C@@H](C)N[C@@H](C)c1cccc(F)c1F ZINC000222721354 388644037 /nfs/dbraw/zinc/64/40/37/388644037.db2.gz WOFCOMAUFYMIJV-MNOVXSKESA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@H](C)N[C@@H](C)c1cccc(F)c1F ZINC000222721412 388644455 /nfs/dbraw/zinc/64/44/55/388644455.db2.gz WOFCOMAUFYMIJV-QWRGUYRKSA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@@H](C)N[C@H](C)c1cccc(F)c1F ZINC000222721473 388644016 /nfs/dbraw/zinc/64/40/16/388644016.db2.gz WOFCOMAUFYMIJV-GHMZBOCLSA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)C[C@H](C)N[C@H](C)c1cccc(F)c1F ZINC000222721528 388643958 /nfs/dbraw/zinc/64/39/58/388643958.db2.gz WOFCOMAUFYMIJV-WDEREUQCSA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@@H](N[C@@H](C)CC(F)(F)F)c1ccccc1 ZINC000222916145 535807993 /nfs/dbraw/zinc/80/79/93/535807993.db2.gz IDGFXVZGSOIIOX-CMPLNLGQSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@H](N[C@@H](C)CC(F)(F)F)c1ccccc1 ZINC000222916201 134336154 /nfs/dbraw/zinc/33/61/54/134336154.db2.gz IDGFXVZGSOIIOX-JQWIXIFHSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@@H](N[C@H](C)CC(F)(F)F)c1ccccc1 ZINC000222916258 134336412 /nfs/dbraw/zinc/33/64/12/134336412.db2.gz IDGFXVZGSOIIOX-ZYHUDNBSSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@H](N[C@H](C)CC(F)(F)F)c1ccccc1 ZINC000222916316 134336161 /nfs/dbraw/zinc/33/61/61/134336161.db2.gz IDGFXVZGSOIIOX-PWSUYJOCSA-N 0 3 245.288 4.068 20 0 BIADHN CCCC[C@@H](CCC)N[C@@H](C)c1nccs1 ZINC000223279726 388649638 /nfs/dbraw/zinc/64/96/38/388649638.db2.gz HHKKCAPTCFEDMK-NWDGAFQWSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@H](CCC)N[C@@H](C)c1nccs1 ZINC000223279779 388649436 /nfs/dbraw/zinc/64/94/36/388649436.db2.gz HHKKCAPTCFEDMK-RYUDHWBXSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@@H](CCC)N[C@H](C)c1nccs1 ZINC000223279842 388649660 /nfs/dbraw/zinc/64/96/60/388649660.db2.gz HHKKCAPTCFEDMK-VXGBXAGGSA-N 0 3 240.416 4.153 20 0 BIADHN CCCC[C@H](CCC)N[C@H](C)c1nccs1 ZINC000223279890 259565010 /nfs/dbraw/zinc/56/50/10/259565010.db2.gz HHKKCAPTCFEDMK-NEPJUHHUSA-N 0 3 240.416 4.153 20 0 BIADHN CC(C)=CCN[C@@H](C)c1ccc(OC(C)C)cc1 ZINC000223645886 388656076 /nfs/dbraw/zinc/65/60/76/388656076.db2.gz XZGLVUCQZWCCTC-AWEZNQCLSA-N 0 3 247.382 4.091 20 0 BIADHN CC(C)=CCN[C@H](C)c1ccc(OC(C)C)cc1 ZINC000223645952 388655444 /nfs/dbraw/zinc/65/54/44/388655444.db2.gz XZGLVUCQZWCCTC-CQSZACIVSA-N 0 3 247.382 4.091 20 0 BIADHN CSc1ccc([C@@H](C)NCC=C(C)C)cc1 ZINC000223667880 388656724 /nfs/dbraw/zinc/65/67/24/388656724.db2.gz QZYSUUOSOBFNLY-GFCCVEGCSA-N 0 3 235.396 4.025 20 0 BIADHN CSc1ccc([C@H](C)NCC=C(C)C)cc1 ZINC000223667932 388656783 /nfs/dbraw/zinc/65/67/83/388656783.db2.gz QZYSUUOSOBFNLY-LBPRGKRZSA-N 0 3 235.396 4.025 20 0 BIADHN CC(C)=CCN[C@@H](C)c1ccc(F)c(Cl)c1 ZINC000223687720 388656472 /nfs/dbraw/zinc/65/64/72/388656472.db2.gz RDSRZPBRWJOPKE-JTQLQIEISA-N 0 3 241.737 4.096 20 0 BIADHN CC(C)=CCN[C@H](C)c1ccc(F)c(Cl)c1 ZINC000223687772 388657002 /nfs/dbraw/zinc/65/70/02/388657002.db2.gz RDSRZPBRWJOPKE-SNVBAGLBSA-N 0 3 241.737 4.096 20 0 BIADHN CC(C)=CCN[C@@H](C)c1ccc(Cl)c(F)c1 ZINC000223831587 358227283 /nfs/dbraw/zinc/22/72/83/358227283.db2.gz LDJSDVXYIDRTFJ-JTQLQIEISA-N 0 3 241.737 4.096 20 0 BIADHN CC(C)=CCN[C@H](C)c1ccc(Cl)c(F)c1 ZINC000223831640 358227003 /nfs/dbraw/zinc/22/70/03/358227003.db2.gz LDJSDVXYIDRTFJ-SNVBAGLBSA-N 0 3 241.737 4.096 20 0 BIADHN C[C@@H](NCCC(C)(C)C)c1cccc(F)c1F ZINC000223945447 388659625 /nfs/dbraw/zinc/65/96/25/388659625.db2.gz GHPYXDMTUQAMBY-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN C[C@H](NCCC(C)(C)C)c1cccc(F)c1F ZINC000223945498 259343964 /nfs/dbraw/zinc/34/39/64/259343964.db2.gz GHPYXDMTUQAMBY-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN CCC[C@@H](CC)N[C@@H](C)c1cccc(F)c1F ZINC000224774205 388670712 /nfs/dbraw/zinc/67/07/12/388670712.db2.gz XXXKBJGMFNZCMC-WDEREUQCSA-N 0 3 241.325 4.194 20 0 BIADHN CCC[C@H](CC)N[C@@H](C)c1cccc(F)c1F ZINC000224774248 388670071 /nfs/dbraw/zinc/67/00/71/388670071.db2.gz XXXKBJGMFNZCMC-QWRGUYRKSA-N 0 3 241.325 4.194 20 0 BIADHN CCC[C@@H](CC)N[C@H](C)c1cccc(F)c1F ZINC000224774299 386151538 /nfs/dbraw/zinc/15/15/38/386151538.db2.gz XXXKBJGMFNZCMC-GHMZBOCLSA-N 0 3 241.325 4.194 20 0 BIADHN CCC[C@H](CC)N[C@H](C)c1cccc(F)c1F ZINC000224774343 388670159 /nfs/dbraw/zinc/67/01/59/388670159.db2.gz XXXKBJGMFNZCMC-MNOVXSKESA-N 0 3 241.325 4.194 20 0 BIADHN Cc1ccc(F)c(CNCCC2=CCCCC2)c1 ZINC000227280412 388746990 /nfs/dbraw/zinc/74/69/90/388746990.db2.gz AZHXPIOCALKPMX-UHFFFAOYSA-N 0 3 247.357 4.114 20 0 BIADHN Cc1ccc(F)c(CN[C@@H](C)CCC(C)C)c1 ZINC000227280717 383983730 /nfs/dbraw/zinc/98/37/30/383983730.db2.gz FUVDUNTXFZEFQK-ZDUSSCGKSA-N 0 3 237.362 4.048 20 0 BIADHN Cc1ccc(F)c(CN[C@H](C)CCC(C)C)c1 ZINC000227280720 383983072 /nfs/dbraw/zinc/98/30/72/383983072.db2.gz FUVDUNTXFZEFQK-CYBMUJFWSA-N 0 3 237.362 4.048 20 0 BIADHN C[C@@H](NCC1CC1)c1cccc(Cl)c1Cl ZINC000227530344 388751964 /nfs/dbraw/zinc/75/19/64/388751964.db2.gz UVMZDQXJLATXOS-MRVPVSSYSA-N 0 3 244.165 4.054 20 0 BIADHN C[C@H](NCC1CC1)c1cccc(Cl)c1Cl ZINC000227530346 388752004 /nfs/dbraw/zinc/75/20/04/388752004.db2.gz UVMZDQXJLATXOS-QMMMGPOBSA-N 0 3 244.165 4.054 20 0 BIADHN C[C@@H](NCC1(C2CC2)CC1)c1ccccc1Cl ZINC000228812339 388774799 /nfs/dbraw/zinc/77/47/99/388774799.db2.gz BHHIQEICZWDFSW-LLVKDONJSA-N 0 3 249.785 4.181 20 0 BIADHN C[C@H](NCC1(C2CC2)CC1)c1ccccc1Cl ZINC000228812351 388774481 /nfs/dbraw/zinc/77/44/81/388774481.db2.gz BHHIQEICZWDFSW-NSHDSACASA-N 0 3 249.785 4.181 20 0 BIADHN Fc1ccc([C@@H]2CCCN2[C@@H]2C=CCCC2)cc1 ZINC000229487523 372155831 /nfs/dbraw/zinc/15/58/31/372155831.db2.gz ZSDJOFKDMNYDAG-CVEARBPZSA-N 0 3 245.341 4.071 20 0 BIADHN Fc1ccc([C@H]2CCCN2[C@@H]2C=CCCC2)cc1 ZINC000229487537 372156528 /nfs/dbraw/zinc/15/65/28/372156528.db2.gz ZSDJOFKDMNYDAG-HZPDHXFCSA-N 0 3 245.341 4.071 20 0 BIADHN CC[C@@H]1c2ccsc2CCN1[C@@H]1C=CCCC1 ZINC000229491604 372157679 /nfs/dbraw/zinc/15/76/79/372157679.db2.gz JFKPRAJCVWMIMI-TZMCWYRMSA-N 0 3 247.407 4.166 20 0 BIADHN CC[C@H]1c2ccsc2CCN1[C@@H]1C=CCCC1 ZINC000229491619 372158348 /nfs/dbraw/zinc/15/83/48/372158348.db2.gz JFKPRAJCVWMIMI-OCCSQVGLSA-N 0 3 247.407 4.166 20 0 BIADHN C[C@@H](c1ccccc1Cl)N(C)[C@@H]1C=CCCC1 ZINC000229495061 372157876 /nfs/dbraw/zinc/15/78/76/372157876.db2.gz IXDXJIOTKZOCJM-QWHCGFSZSA-N 0 3 249.785 4.442 20 0 BIADHN C[C@H](c1ccccc1Cl)N(C)[C@@H]1C=CCCC1 ZINC000229495074 372158404 /nfs/dbraw/zinc/15/84/04/372158404.db2.gz IXDXJIOTKZOCJM-CHWSQXEVSA-N 0 3 249.785 4.442 20 0 BIADHN CCC(C)(C)CN[C@@H](C)c1cc(F)ccc1F ZINC000232970441 388860791 /nfs/dbraw/zinc/86/07/91/388860791.db2.gz KOMSUTCOYVINMX-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN CCC(C)(C)CN[C@@H](C)c1ccc(F)cc1F ZINC000232972409 388860718 /nfs/dbraw/zinc/86/07/18/388860718.db2.gz ACNBGELEVKYNLE-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN CCC(C)(C)CN[C@@H](C)c1cccc(F)c1F ZINC000232973706 388861045 /nfs/dbraw/zinc/86/10/45/388861045.db2.gz INZOZLIWUXCUKD-JTQLQIEISA-N 0 3 241.325 4.052 20 0 BIADHN CCC(C)(C)CN[C@H](C)c1cc(F)ccc1F ZINC000232992511 388861005 /nfs/dbraw/zinc/86/10/05/388861005.db2.gz KOMSUTCOYVINMX-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN CCC(C)(C)CN[C@H](C)c1ccc(F)cc1F ZINC000232993851 259659561 /nfs/dbraw/zinc/65/95/61/259659561.db2.gz ACNBGELEVKYNLE-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN CCC(C)(C)CN[C@H](C)c1cccc(F)c1F ZINC000232994829 388860749 /nfs/dbraw/zinc/86/07/49/388860749.db2.gz INZOZLIWUXCUKD-SNVBAGLBSA-N 0 3 241.325 4.052 20 0 BIADHN CCCOc1ccc([C@@H](C)NCC=C(C)C)cc1 ZINC000233245130 398115261 /nfs/dbraw/zinc/11/52/61/398115261.db2.gz ONIKXXDKANEGGM-CQSZACIVSA-N 0 3 247.382 4.092 20 0 BIADHN CCCOc1ccc([C@H](C)NCC=C(C)C)cc1 ZINC000233246236 398115028 /nfs/dbraw/zinc/11/50/28/398115028.db2.gz ONIKXXDKANEGGM-AWEZNQCLSA-N 0 3 247.382 4.092 20 0 BIADHN C[C@H](c1ccccc1Cl)N1CCC(C)CC1 ZINC000247827798 325596808 /nfs/dbraw/zinc/59/68/08/325596808.db2.gz JSZSJNDNPVHPCL-GFCCVEGCSA-N 0 3 237.774 4.133 20 0 BIADHN CCCCCN(C)Cc1ccc(Cl)s1 ZINC000248259039 537817592 /nfs/dbraw/zinc/81/75/92/537817592.db2.gz LWSREGIYQPUQOP-UHFFFAOYSA-N 0 3 231.792 4.024 20 0 BIADHN CCCCN(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000249848147 487724944 /nfs/dbraw/zinc/72/49/44/487724944.db2.gz HVCIYLNNIROGEB-DOMZBBRYSA-N 0 3 247.382 4.168 20 0 BIADHN CCCCN(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000249848158 487724680 /nfs/dbraw/zinc/72/46/80/487724680.db2.gz HVCIYLNNIROGEB-IUODEOHRSA-N 0 3 247.382 4.168 20 0 BIADHN C[C@@H]1C[C@@H]1c1ccc(CN[C@H]2CCC[C@@H](C)C2)o1 ZINC000251874879 362973569 /nfs/dbraw/zinc/97/35/69/362973569.db2.gz QUFAMELMGXATCJ-CXTNEJHOSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@@H]1C[C@H]1c1ccc(CN[C@H]2CCC[C@@H](C)C2)o1 ZINC000251874880 362973460 /nfs/dbraw/zinc/97/34/60/362973460.db2.gz QUFAMELMGXATCJ-GUIRCDHDSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@H]1C[C@@H]1c1ccc(CN[C@H]2CCC[C@@H](C)C2)o1 ZINC000251874881 362973492 /nfs/dbraw/zinc/97/34/92/362973492.db2.gz QUFAMELMGXATCJ-OSFYFWSMSA-N 0 3 247.382 4.071 20 0 BIADHN CC[C@H](C)[C@H](C)N[C@H](C)c1c(F)cccc1F ZINC000251925559 384919326 /nfs/dbraw/zinc/91/93/26/384919326.db2.gz QQJCEWJJPXOBSP-GARJFASQSA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](C)[C@@H](C)N[C@H](C)c1c(F)cccc1F ZINC000251925562 384918757 /nfs/dbraw/zinc/91/87/57/384918757.db2.gz QQJCEWJJPXOBSP-HBNTYKKESA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](C)C[C@@H](C)N[C@H](C)c1ccc(C)o1 ZINC000251943658 325683760 /nfs/dbraw/zinc/68/37/60/325683760.db2.gz SUGKPTNFRJDHER-DMDPSCGWSA-N 0 3 223.360 4.063 20 0 BIADHN CC[C@H](C)C[C@H](C)N[C@H](C)c1ccc(C)o1 ZINC000251943661 325683677 /nfs/dbraw/zinc/68/36/77/325683677.db2.gz SUGKPTNFRJDHER-GMXVVIOVSA-N 0 3 223.360 4.063 20 0 BIADHN CC[C@H]1CCCCN1Cc1ccc(Cl)s1 ZINC000252370689 644848027 /nfs/dbraw/zinc/84/80/27/644848027.db2.gz YRYCVUSHWGONAP-JTQLQIEISA-N 0 3 243.803 4.166 20 0 BIADHN CC[C@@H]1CCCCN1Cc1ccc(Cl)s1 ZINC000252370690 644847955 /nfs/dbraw/zinc/84/79/55/644847955.db2.gz YRYCVUSHWGONAP-SNVBAGLBSA-N 0 3 243.803 4.166 20 0 BIADHN CC[C@H](C)[C@H](C)N[C@H](C)c1cc(F)ccc1F ZINC000252392173 322872164 /nfs/dbraw/zinc/87/21/64/322872164.db2.gz UICSTMAEFZOXOI-GARJFASQSA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](C)[C@@H](C)N[C@H](C)c1cc(F)ccc1F ZINC000252392174 384921565 /nfs/dbraw/zinc/92/15/65/384921565.db2.gz UICSTMAEFZOXOI-HBNTYKKESA-N 0 3 241.325 4.050 20 0 BIADHN Cc1ccsc1CN(C)[C@H](C)c1ccccc1 ZINC000253599587 388823077 /nfs/dbraw/zinc/82/30/77/388823077.db2.gz RLCDKCIKBPIOOK-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccsc1CN(C)[C@@H](C)c1ccccc1 ZINC000253599589 388822668 /nfs/dbraw/zinc/82/26/68/388822668.db2.gz RLCDKCIKBPIOOK-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN CC[C@H]1CCCCN1Cc1cccc(Cl)c1 ZINC000253605090 388823131 /nfs/dbraw/zinc/82/31/31/388823131.db2.gz AUYBORVJFXETAY-AWEZNQCLSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@@H]1C[C@H](NCc2cccs2)c2ccccc21 ZINC000264532498 388991395 /nfs/dbraw/zinc/99/13/95/388991395.db2.gz JPJYMGFTURZXHV-ABAIWWIYSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@@H]1C[C@@H](NCc2cccs2)c2ccccc21 ZINC000264532501 176377594 /nfs/dbraw/zinc/37/75/94/176377594.db2.gz JPJYMGFTURZXHV-IAQYHMDHSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H]1C[C@H](NCc2cccs2)c2ccccc21 ZINC000264532504 177370054 /nfs/dbraw/zinc/37/00/54/177370054.db2.gz JPJYMGFTURZXHV-NHYWBVRUSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H]1C[C@@H](NCc2cccs2)c2ccccc21 ZINC000264532507 177333101 /nfs/dbraw/zinc/33/31/01/177333101.db2.gz JPJYMGFTURZXHV-XHDPSFHLSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@@H]1C[C@H](NCc2ccsc2)c2ccccc21 ZINC000264550357 388992515 /nfs/dbraw/zinc/99/25/15/388992515.db2.gz ZKYUOFMSNXRHRY-ABAIWWIYSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@@H]1C[C@@H](NCc2ccsc2)c2ccccc21 ZINC000264550361 176377962 /nfs/dbraw/zinc/37/79/62/176377962.db2.gz ZKYUOFMSNXRHRY-IAQYHMDHSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H]1C[C@H](NCc2ccsc2)c2ccccc21 ZINC000264550367 177370723 /nfs/dbraw/zinc/37/07/23/177370723.db2.gz ZKYUOFMSNXRHRY-NHYWBVRUSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H]1C[C@@H](NCc2ccsc2)c2ccccc21 ZINC000264550371 177333370 /nfs/dbraw/zinc/33/33/70/177333370.db2.gz ZKYUOFMSNXRHRY-XHDPSFHLSA-N 0 3 243.375 4.086 20 0 BIADHN C[C@H](NC1(c2ccccc2)CC1)c1ccccc1 ZINC000272006219 385867606 /nfs/dbraw/zinc/86/76/06/385867606.db2.gz PCZZNAWDKVYXQL-AWEZNQCLSA-N 0 3 237.346 4.027 20 0 BIADHN C[C@@H](NC1(c2ccccc2)CC1)c1ccccc1 ZINC000272006221 385867745 /nfs/dbraw/zinc/86/77/45/385867745.db2.gz PCZZNAWDKVYXQL-CQSZACIVSA-N 0 3 237.346 4.027 20 0 BIADHN C[C@@H](NC1(c2ccccc2)CC1)c1cccs1 ZINC000272010764 385867449 /nfs/dbraw/zinc/86/74/49/385867449.db2.gz QDLDKOSQOFRDKI-GFCCVEGCSA-N 0 3 243.375 4.088 20 0 BIADHN C[C@H](NC1(c2ccccc2)CC1)c1cccs1 ZINC000272010765 176826577 /nfs/dbraw/zinc/82/65/77/176826577.db2.gz QDLDKOSQOFRDKI-LBPRGKRZSA-N 0 3 243.375 4.088 20 0 BIADHN C[C@@H](NC1(c2ccccc2)CC1)c1ccsc1 ZINC000272019966 385867591 /nfs/dbraw/zinc/86/75/91/385867591.db2.gz RPIYFGOMQGUMNU-GFCCVEGCSA-N 0 3 243.375 4.088 20 0 BIADHN C[C@H](NC1(c2ccccc2)CC1)c1ccsc1 ZINC000272019968 385867715 /nfs/dbraw/zinc/86/77/15/385867715.db2.gz RPIYFGOMQGUMNU-LBPRGKRZSA-N 0 3 243.375 4.088 20 0 BIADHN Cc1ccccc1C(C)(C)NCc1ccsc1 ZINC000292985776 179255226 /nfs/dbraw/zinc/25/52/26/179255226.db2.gz LPKHVWATDMJBCD-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN Cc1ccccc1C(C)(C)NCc1cccs1 ZINC000293010743 179255499 /nfs/dbraw/zinc/25/54/99/179255499.db2.gz PSICYIRVLDZKTN-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN Cc1sccc1CNC(C)(C)c1ccccc1 ZINC000293645246 388355835 /nfs/dbraw/zinc/35/58/35/388355835.db2.gz SAAFETVNZXZTLP-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN C[C@@H](NCCC(C)(F)F)c1cccc(Cl)c1 ZINC000294093171 388395245 /nfs/dbraw/zinc/39/52/45/388395245.db2.gz BHXJVMJNIHDREE-SECBINFHSA-N 0 3 247.716 4.036 20 0 BIADHN C[C@H](NCCC(C)(F)F)c1cccc(Cl)c1 ZINC000294093177 388395442 /nfs/dbraw/zinc/39/54/42/388395442.db2.gz BHXJVMJNIHDREE-VIFPVBQESA-N 0 3 247.716 4.036 20 0 BIADHN C[C@@H](NCCC(C)(F)F)c1ccccc1Cl ZINC000294095801 384508743 /nfs/dbraw/zinc/50/87/43/384508743.db2.gz BOOVVZXCMUYVCB-SECBINFHSA-N 0 3 247.716 4.036 20 0 BIADHN C[C@H](NCCC(C)(F)F)c1ccccc1Cl ZINC000294095806 384507854 /nfs/dbraw/zinc/50/78/54/384507854.db2.gz BOOVVZXCMUYVCB-VIFPVBQESA-N 0 3 247.716 4.036 20 0 BIADHN CC[C@H](NCc1ccc(F)cc1)c1ccsc1 ZINC000294165568 388395590 /nfs/dbraw/zinc/39/55/90/388395590.db2.gz BQGNDJQJMLZESY-AWEZNQCLSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1ccc(F)cc1)c1ccsc1 ZINC000294165571 364775519 /nfs/dbraw/zinc/77/55/19/364775519.db2.gz BQGNDJQJMLZESY-CQSZACIVSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1cccs1)c1ccsc1 ZINC000294185553 345386750 /nfs/dbraw/zinc/38/67/50/345386750.db2.gz FCYLFRFRPBEWHO-GFCCVEGCSA-N 0 3 237.393 4.051 20 0 BIADHN CC[C@H](NCc1cccs1)c1ccsc1 ZINC000294185555 384311335 /nfs/dbraw/zinc/31/13/35/384311335.db2.gz FCYLFRFRPBEWHO-LBPRGKRZSA-N 0 3 237.393 4.051 20 0 BIADHN CC[C@@H](NCc1ccsc1)c1ccsc1 ZINC000294190397 170903773 /nfs/dbraw/zinc/90/37/73/170903773.db2.gz FQJDXGIRJXRWFS-GFCCVEGCSA-N 0 3 237.393 4.051 20 0 BIADHN CC[C@H](NCc1ccsc1)c1ccsc1 ZINC000294190402 384331369 /nfs/dbraw/zinc/33/13/69/384331369.db2.gz FQJDXGIRJXRWFS-LBPRGKRZSA-N 0 3 237.393 4.051 20 0 BIADHN Cc1cc([C@@H](C)N[C@H](C)c2ccccc2)cs1 ZINC000294229448 178232357 /nfs/dbraw/zinc/23/23/57/178232357.db2.gz ODHXWDGYGAZQHT-CHWSQXEVSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1cc([C@H](C)N[C@H](C)c2ccccc2)cs1 ZINC000294229450 178257036 /nfs/dbraw/zinc/25/70/36/178257036.db2.gz ODHXWDGYGAZQHT-OLZOCXBDSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1cc([C@@H](C)N[C@@H](C)c2ccccc2)cs1 ZINC000294229454 178230309 /nfs/dbraw/zinc/23/03/09/178230309.db2.gz ODHXWDGYGAZQHT-QWHCGFSZSA-N 0 3 245.391 4.468 20 0 BIADHN Cc1cc([C@H](C)N[C@@H](C)c2ccccc2)cs1 ZINC000294229457 178254499 /nfs/dbraw/zinc/25/44/99/178254499.db2.gz ODHXWDGYGAZQHT-STQMWFEESA-N 0 3 245.391 4.468 20 0 BIADHN C[C@@H](NCCC(C)(F)F)c1ccc(Cl)cc1 ZINC000294245486 398343813 /nfs/dbraw/zinc/34/38/13/398343813.db2.gz PPHDNCNWMWJHJP-SECBINFHSA-N 0 3 247.716 4.036 20 0 BIADHN C[C@H](NCCC(C)(F)F)c1ccc(Cl)cc1 ZINC000294245488 398343765 /nfs/dbraw/zinc/34/37/65/398343765.db2.gz PPHDNCNWMWJHJP-VIFPVBQESA-N 0 3 247.716 4.036 20 0 BIADHN Cc1cc([C@@H](C)NCc2cccc(F)c2)cs1 ZINC000294263707 178228968 /nfs/dbraw/zinc/22/89/68/178228968.db2.gz REWIZUPECOFSQA-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc([C@H](C)NCc2cccc(F)c2)cs1 ZINC000294263711 178251837 /nfs/dbraw/zinc/25/18/37/178251837.db2.gz REWIZUPECOFSQA-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccc(F)cc2)cs1 ZINC000294360002 178229053 /nfs/dbraw/zinc/22/90/53/178229053.db2.gz ZWPIWFGFPFAOEL-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc([C@H](C)NCc2ccc(F)cc2)cs1 ZINC000294360008 178249958 /nfs/dbraw/zinc/24/99/58/178249958.db2.gz ZWPIWFGFPFAOEL-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1ccsc1CNC(C)(C)c1ccccc1 ZINC000299478687 386456477 /nfs/dbraw/zinc/45/64/77/386456477.db2.gz ZWXCVKSHQIGARO-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN CC[C@H](C)[C@H](C)N[C@H](C)c1cccc(F)c1F ZINC000300413699 529242486 /nfs/dbraw/zinc/24/24/86/529242486.db2.gz GBVGWSGAZMKKOB-GARJFASQSA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@H](C)[C@@H](C)N[C@H](C)c1cccc(F)c1F ZINC000300413700 529207174 /nfs/dbraw/zinc/20/71/74/529207174.db2.gz GBVGWSGAZMKKOB-HBNTYKKESA-N 0 3 241.325 4.050 20 0 BIADHN CC[C@@H](NCCCC(C)(C)C)c1nccs1 ZINC000300781276 384924182 /nfs/dbraw/zinc/92/41/82/384924182.db2.gz SPJDUMDHNILNLC-LLVKDONJSA-N 0 3 240.416 4.010 20 0 BIADHN CC[C@H](NCCCC(C)(C)C)c1nccs1 ZINC000300781279 384922464 /nfs/dbraw/zinc/92/24/64/384922464.db2.gz SPJDUMDHNILNLC-NSHDSACASA-N 0 3 240.416 4.010 20 0 BIADHN Cc1ccc(CNC(C)(C)c2ccccc2)cc1 ZINC000301220099 534053222 /nfs/dbraw/zinc/05/32/22/534053222.db2.gz DJPVNVBWIQPTDK-UHFFFAOYSA-N 0 3 239.362 4.020 20 0 BIADHN CC[C@@H]1CCCCN1Cc1ccccc1Cl ZINC000301604044 369378454 /nfs/dbraw/zinc/37/84/54/369378454.db2.gz FMMCHKAVYSAXID-CYBMUJFWSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@@H](c1ccccc1Cl)N1CCC[C@@H](C)C1 ZINC000301605498 369378905 /nfs/dbraw/zinc/37/89/05/369378905.db2.gz MUBFTDUNQYSHSC-NEPJUHHUSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1ccccc1Cl)N1CCC[C@H](C)C1 ZINC000301605499 349287151 /nfs/dbraw/zinc/28/71/51/349287151.db2.gz MUBFTDUNQYSHSC-RYUDHWBXSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1ccccc1Cl)N1CCC[C@@H](C)C1 ZINC000301605500 349287203 /nfs/dbraw/zinc/28/72/03/349287203.db2.gz MUBFTDUNQYSHSC-VXGBXAGGSA-N 0 3 237.774 4.133 20 0 BIADHN Cc1ccc2nccc(NCc3ccccc3)c2c1 ZINC000302149992 386907235 /nfs/dbraw/zinc/90/72/35/386907235.db2.gz JXZMXNJQHFYYOY-UHFFFAOYSA-N 0 3 248.329 4.155 20 0 BIADHN CCN(Cc1cccs1)Cc1cccc(C)c1 ZINC000302737502 528854220 /nfs/dbraw/zinc/85/42/20/528854220.db2.gz JTOKOMPHBGMERQ-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN Cc1ccccc1CN(C)[C@@H](C)c1ccccc1 ZINC000302740880 534810075 /nfs/dbraw/zinc/81/00/75/534810075.db2.gz KCPINVGWGBVIMN-HNNXBMFYSA-N 0 3 239.362 4.188 20 0 BIADHN Cc1ccccc1CN(C)[C@H](C)c1ccccc1 ZINC000302740881 534810737 /nfs/dbraw/zinc/81/07/37/534810737.db2.gz KCPINVGWGBVIMN-OAHLLOKOSA-N 0 3 239.362 4.188 20 0 BIADHN Cc1cccc(CN(C)[C@H](C)c2ccccc2)c1 ZINC000302744598 356625751 /nfs/dbraw/zinc/62/57/51/356625751.db2.gz WWAZBODZRABPNQ-OAHLLOKOSA-N 0 3 239.362 4.188 20 0 BIADHN CCCCN(C)[C@H](C)c1nc2ccccc2s1 ZINC000302745689 323154557 /nfs/dbraw/zinc/15/45/57/323154557.db2.gz QEIFHMBKJKFTKM-LLVKDONJSA-N 0 3 248.395 4.089 20 0 BIADHN CCCCN(C)[C@@H](C)c1nc2ccccc2s1 ZINC000302745690 323154598 /nfs/dbraw/zinc/15/45/98/323154598.db2.gz QEIFHMBKJKFTKM-NSHDSACASA-N 0 3 248.395 4.089 20 0 BIADHN C[C@@H](c1ccccc1)N(C)Cc1ccc(F)cc1 ZINC000302748668 534102082 /nfs/dbraw/zinc/10/20/82/534102082.db2.gz UHMFDOFCSOQZOJ-ZDUSSCGKSA-N 0 3 243.325 4.019 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2ccccc2)cc1 ZINC000302750286 350093726 /nfs/dbraw/zinc/09/37/26/350093726.db2.gz VQRTXNRVNUKRMF-HNNXBMFYSA-N 0 3 239.362 4.188 20 0 BIADHN C[C@H](c1ccccc1)N(C)Cc1cccc(F)c1 ZINC000302750366 356626086 /nfs/dbraw/zinc/62/60/86/356626086.db2.gz WHZDGVALWWYTCH-CYBMUJFWSA-N 0 3 243.325 4.019 20 0 BIADHN CCCN(CCC)Cc1ccc(F)cc1Cl ZINC000302805571 490601981 /nfs/dbraw/zinc/60/19/81/490601981.db2.gz CGOXYFJTQBGCAC-UHFFFAOYSA-N 0 3 243.753 4.101 20 0 BIADHN CCCCN(CC)Cc1ccc(Cl)s1 ZINC000302831618 490605168 /nfs/dbraw/zinc/60/51/68/490605168.db2.gz CABAKGRQYFHALB-UHFFFAOYSA-N 0 3 231.792 4.024 20 0 BIADHN CCCCN(CC)Cc1ccc(F)cc1Cl ZINC000302832170 490604975 /nfs/dbraw/zinc/60/49/75/490604975.db2.gz GCAPLHAOWJURKA-UHFFFAOYSA-N 0 3 243.753 4.101 20 0 BIADHN CCN(CCC(C)C)Cc1ccc(Cl)s1 ZINC000302850598 490608466 /nfs/dbraw/zinc/60/84/66/490608466.db2.gz WKEKJSYDHWEQMI-UHFFFAOYSA-N 0 3 245.819 4.270 20 0 BIADHN CC(C)[C@H](c1ccccc1)N(C)C/C=C/Cl ZINC000303453206 644826918 /nfs/dbraw/zinc/82/69/18/644826918.db2.gz DGLGEBMMQPLFCZ-DNGMOHDESA-N 0 3 237.774 4.068 20 0 BIADHN CC(C)[C@@H](c1ccccc1)N(C)C/C=C/Cl ZINC000303453636 644826930 /nfs/dbraw/zinc/82/69/30/644826930.db2.gz DGLGEBMMQPLFCZ-RNVIBTMRSA-N 0 3 237.774 4.068 20 0 BIADHN CCCCCN(C)[C@H](C)c1cc(F)ccc1F ZINC000303682528 388859483 /nfs/dbraw/zinc/85/94/83/388859483.db2.gz JMQBVTLYLDMTDU-LLVKDONJSA-N 0 3 241.325 4.148 20 0 BIADHN CCCCCN(C)[C@@H](C)c1cc(F)ccc1F ZINC000303682529 388859534 /nfs/dbraw/zinc/85/95/34/388859534.db2.gz JMQBVTLYLDMTDU-NSHDSACASA-N 0 3 241.325 4.148 20 0 BIADHN Cc1cccc(C)c1CN(C)[C@@H](C)c1ccco1 ZINC000303780518 369436315 /nfs/dbraw/zinc/43/63/15/369436315.db2.gz SJBNEAIXLQVRPL-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1cccc(C)c1CN(C)[C@H](C)c1ccco1 ZINC000303780520 369435607 /nfs/dbraw/zinc/43/56/07/369435607.db2.gz SJBNEAIXLQVRPL-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN C[C@@H](NCCCCCF)c1ccccc1Cl ZINC000304461007 229351757 /nfs/dbraw/zinc/35/17/57/229351757.db2.gz ZYLIVMFJGNHATR-LLVKDONJSA-N 0 3 243.753 4.130 20 0 BIADHN C[C@H](NCCCCCF)c1ccccc1Cl ZINC000304461009 229352080 /nfs/dbraw/zinc/35/20/80/229352080.db2.gz ZYLIVMFJGNHATR-NSHDSACASA-N 0 3 243.753 4.130 20 0 BIADHN C[C@@H]1C[C@@H](NCc2ccccc2)c2ccccc21 ZINC000307235837 533652275 /nfs/dbraw/zinc/65/22/75/533652275.db2.gz DMNQRFHPMLCLEX-CXAGYDPISA-N 0 3 237.346 4.025 20 0 BIADHN C[C@@H]1C[C@H](NCc2ccccc2)c2ccccc21 ZINC000307235838 386450647 /nfs/dbraw/zinc/45/06/47/386450647.db2.gz DMNQRFHPMLCLEX-DYVFJYSZSA-N 0 3 237.346 4.025 20 0 BIADHN C[C@H]1C[C@H](NCc2ccccc2)c2ccccc21 ZINC000307235840 386449568 /nfs/dbraw/zinc/44/95/68/386449568.db2.gz DMNQRFHPMLCLEX-GUYCJALGSA-N 0 3 237.346 4.025 20 0 BIADHN C[C@H]1C[C@@H](NCc2ccccc2)c2ccccc21 ZINC000307235841 386456032 /nfs/dbraw/zinc/45/60/32/386456032.db2.gz DMNQRFHPMLCLEX-SUMWQHHRSA-N 0 3 237.346 4.025 20 0 BIADHN CCC(C)(CC)NCc1cscc1Cl ZINC000308510991 491136752 /nfs/dbraw/zinc/13/67/52/491136752.db2.gz KXFFNMCOOQTBMA-UHFFFAOYSA-N 0 3 231.792 4.070 20 0 BIADHN CCCC(C)(C)NCc1cscc1Cl ZINC000308573081 491137208 /nfs/dbraw/zinc/13/72/08/491137208.db2.gz CQPRFDDMCDNJIB-UHFFFAOYSA-N 0 3 231.792 4.070 20 0 BIADHN CCCC(C)(C)NCc1ccsc1Cl ZINC000308573655 388443478 /nfs/dbraw/zinc/44/34/78/388443478.db2.gz CUWOBIYRYUOCGH-UHFFFAOYSA-N 0 3 231.792 4.070 20 0 BIADHN CCC(C)(CC)NCc1ccsc1Cl ZINC000308616392 388444786 /nfs/dbraw/zinc/44/47/86/388444786.db2.gz RUFPKZUTEFBBGZ-UHFFFAOYSA-N 0 3 231.792 4.070 20 0 BIADHN C[C@@H](NCC(C)(C)C1=CCCC1)c1ccco1 ZINC000308759760 388448960 /nfs/dbraw/zinc/44/89/60/388448960.db2.gz VEUDBIYXAIYWOX-GFCCVEGCSA-N 0 3 233.355 4.067 20 0 BIADHN C[C@H](NCC(C)(C)C1=CCCC1)c1ccco1 ZINC000308759761 388448875 /nfs/dbraw/zinc/44/88/75/388448875.db2.gz VEUDBIYXAIYWOX-LBPRGKRZSA-N 0 3 233.355 4.067 20 0 BIADHN C[C@H](CCC1CC1)NCc1cscc1Cl ZINC000308875558 491139365 /nfs/dbraw/zinc/13/93/65/491139365.db2.gz SECQUAOECDPZGC-SECBINFHSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H](CCC1CC1)NCc1cscc1Cl ZINC000308875565 491139347 /nfs/dbraw/zinc/13/93/47/491139347.db2.gz SECQUAOECDPZGC-VIFPVBQESA-N 0 3 243.803 4.070 20 0 BIADHN C[C@H]1CC[C@H](NCc2ccsc2Cl)CC1 ZINC000308907465 533764997 /nfs/dbraw/zinc/76/49/97/533764997.db2.gz CXLXEEWBJUBXPU-HOMQSWHASA-N 0 3 243.803 4.070 20 0 BIADHN CC(C)(C)C(C)(C)NCc1cscc1Cl ZINC000308942119 410822616 /nfs/dbraw/zinc/82/26/16/410822616.db2.gz QVIJJUUZVJWTFB-UHFFFAOYSA-N 0 3 245.819 4.316 20 0 BIADHN CC(C)(C)C(C)(C)NCc1ccsc1Cl ZINC000308947716 527619676 /nfs/dbraw/zinc/61/96/76/527619676.db2.gz SWXPRDPNPPOYHD-UHFFFAOYSA-N 0 3 245.819 4.316 20 0 BIADHN CC[C@@H](F)CN[C@@H](CC)c1ccc(Cl)s1 ZINC000308965052 529553208 /nfs/dbraw/zinc/55/32/08/529553208.db2.gz UVHIQFRBRXXGCZ-BDAKNGLRSA-N 0 3 249.782 4.190 20 0 BIADHN CC[C@@H](NC[C@@H](F)CC)c1ccc(Cl)s1 ZINC000308965054 529173494 /nfs/dbraw/zinc/17/34/94/529173494.db2.gz UVHIQFRBRXXGCZ-DTWKUNHWSA-N 0 3 249.782 4.190 20 0 BIADHN CC[C@H](F)CN[C@@H](CC)c1ccc(Cl)s1 ZINC000308965055 529438510 /nfs/dbraw/zinc/43/85/10/529438510.db2.gz UVHIQFRBRXXGCZ-IUCAKERBSA-N 0 3 249.782 4.190 20 0 BIADHN CC[C@@H](F)CN[C@H](CC)c1ccc(Cl)s1 ZINC000308965056 529554204 /nfs/dbraw/zinc/55/42/04/529554204.db2.gz UVHIQFRBRXXGCZ-RKDXNWHRSA-N 0 3 249.782 4.190 20 0 BIADHN C[C@H](CCC1CC1)NCc1ccsc1Cl ZINC000309010183 533826103 /nfs/dbraw/zinc/82/61/03/533826103.db2.gz RNYRPLXYJXXTRI-SECBINFHSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H](CCC1CC1)NCc1ccsc1Cl ZINC000309010185 229298016 /nfs/dbraw/zinc/29/80/16/229298016.db2.gz RNYRPLXYJXXTRI-VIFPVBQESA-N 0 3 243.803 4.070 20 0 BIADHN C/C=C/CN[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000309045179 410208248 /nfs/dbraw/zinc/20/82/48/410208248.db2.gz OAKDWSJDKQJYSA-CDAZIORVSA-N 0 3 244.165 4.220 20 0 BIADHN C/C=C/CN[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000309045180 410208178 /nfs/dbraw/zinc/20/81/78/410208178.db2.gz OAKDWSJDKQJYSA-NWALNABHSA-N 0 3 244.165 4.220 20 0 BIADHN C/C=C\CN[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000309045181 410208113 /nfs/dbraw/zinc/20/81/13/410208113.db2.gz OAKDWSJDKQJYSA-TYRPZCRBSA-N 0 3 244.165 4.220 20 0 BIADHN C/C=C\CN[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000309045182 410208402 /nfs/dbraw/zinc/20/84/02/410208402.db2.gz OAKDWSJDKQJYSA-ZBJFTSOASA-N 0 3 244.165 4.220 20 0 BIADHN CCCC1(CNCc2ccsc2Cl)CC1 ZINC000309089476 528060080 /nfs/dbraw/zinc/06/00/80/528060080.db2.gz BQPVBNSLAVUVEW-UHFFFAOYSA-N 0 3 243.803 4.071 20 0 BIADHN CC1(C)CC[C@H](NCc2cscc2Cl)C1 ZINC000309116502 491144957 /nfs/dbraw/zinc/14/49/57/491144957.db2.gz LSVUVCVWQTWDHK-JTQLQIEISA-N 0 3 243.803 4.070 20 0 BIADHN CC1(C)CC[C@@H](NCc2cscc2Cl)C1 ZINC000309116503 491144993 /nfs/dbraw/zinc/14/49/93/491144993.db2.gz LSVUVCVWQTWDHK-SNVBAGLBSA-N 0 3 243.803 4.070 20 0 BIADHN CC1(NCc2ccsc2Cl)CCCCC1 ZINC000309117066 528032240 /nfs/dbraw/zinc/03/22/40/528032240.db2.gz LZFZCVXSCJFOLO-UHFFFAOYSA-N 0 3 243.803 4.214 20 0 BIADHN C[C@H]1CCCC[C@H]1NCc1ccsc1Cl ZINC000309140843 385108540 /nfs/dbraw/zinc/10/85/40/385108540.db2.gz TUMXYUATGVZBQG-GXSJLCMTSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H]1CCCC[C@@H]1NCc1ccsc1Cl ZINC000309140846 385109843 /nfs/dbraw/zinc/10/98/43/385109843.db2.gz TUMXYUATGVZBQG-KOLCDFICSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H]1CCCC[C@H]1NCc1ccsc1Cl ZINC000309140848 385433314 /nfs/dbraw/zinc/43/33/14/385433314.db2.gz TUMXYUATGVZBQG-MWLCHTKSSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@H]1CCCC[C@@H]1NCc1ccsc1Cl ZINC000309140850 385109144 /nfs/dbraw/zinc/10/91/44/385109144.db2.gz TUMXYUATGVZBQG-ONGXEEELSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@H](N[C@H]1CCC1(C)C)c1ccccc1Cl ZINC000309301577 259312110 /nfs/dbraw/zinc/31/21/10/259312110.db2.gz MDGMXZRPTXUZDV-GWCFXTLKSA-N 0 3 237.774 4.179 20 0 BIADHN C[C@H](N[C@@H]1CCC1(C)C)c1ccccc1Cl ZINC000309301578 259312321 /nfs/dbraw/zinc/31/23/21/259312321.db2.gz MDGMXZRPTXUZDV-GXFFZTMASA-N 0 3 237.774 4.179 20 0 BIADHN C[C@@H](N[C@H]1CCC1(C)C)c1ccccc1Cl ZINC000309301579 259312247 /nfs/dbraw/zinc/31/22/47/259312247.db2.gz MDGMXZRPTXUZDV-MFKMUULPSA-N 0 3 237.774 4.179 20 0 BIADHN C[C@@H](N[C@@H]1CCC1(C)C)c1ccccc1Cl ZINC000309301580 259312165 /nfs/dbraw/zinc/31/21/65/259312165.db2.gz MDGMXZRPTXUZDV-ZWNOBZJWSA-N 0 3 237.774 4.179 20 0 BIADHN C[C@@H](N[C@H]1C[C@@H](C)[C@H]1C)c1ccccc1Cl ZINC000309423386 384046188 /nfs/dbraw/zinc/04/61/88/384046188.db2.gz YGYBLCZJVFEMEP-BIAAXOCRSA-N 0 3 237.774 4.035 20 0 BIADHN C[C@@H](N[C@H]1C[C@@H](C)[C@@H]1C)c1ccccc1Cl ZINC000309423389 384047055 /nfs/dbraw/zinc/04/70/55/384047055.db2.gz YGYBLCZJVFEMEP-DEKYYXRVSA-N 0 3 237.774 4.035 20 0 BIADHN C[C@@H](N[C@@H]1C[C@@H](C)[C@@H]1C)c1ccccc1Cl ZINC000309423391 384047384 /nfs/dbraw/zinc/04/73/84/384047384.db2.gz YGYBLCZJVFEMEP-FBKDDSFISA-N 0 3 237.774 4.035 20 0 BIADHN C[C@@H](N[C@@H]1C[C@@H](C)[C@H]1C)c1ccccc1Cl ZINC000309423395 384045891 /nfs/dbraw/zinc/04/58/91/384045891.db2.gz YGYBLCZJVFEMEP-ZHSDAYTOSA-N 0 3 237.774 4.035 20 0 BIADHN C[C@H](NC1CC(C)(C)C1)c1ccccc1Cl ZINC000309558051 388456200 /nfs/dbraw/zinc/45/62/00/388456200.db2.gz KFACDGKBZFOREJ-JTQLQIEISA-N 0 3 237.774 4.179 20 0 BIADHN C[C@@H](NC1CC(C)(C)C1)c1ccccc1Cl ZINC000309558052 388456977 /nfs/dbraw/zinc/45/69/77/388456977.db2.gz KFACDGKBZFOREJ-SNVBAGLBSA-N 0 3 237.774 4.179 20 0 BIADHN CC(C)=CCC[C@@H](C)NCc1ccc(Cl)o1 ZINC000309586093 384157831 /nfs/dbraw/zinc/15/78/31/384157831.db2.gz RVMCHYFINLZDKL-LLVKDONJSA-N 0 3 241.762 4.158 20 0 BIADHN CC(C)=CCC[C@H](C)NCc1ccc(Cl)o1 ZINC000309586098 384158869 /nfs/dbraw/zinc/15/88/69/384158869.db2.gz RVMCHYFINLZDKL-NSHDSACASA-N 0 3 241.762 4.158 20 0 BIADHN CC[C@H]1CC[C@H]1N[C@@H](C)c1ccccc1Cl ZINC000309714595 384217072 /nfs/dbraw/zinc/21/70/72/384217072.db2.gz SDURQLWWNHRXHW-COPLHBTASA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@@H]1CC[C@@H]1N[C@H](C)c1ccccc1Cl ZINC000309714597 384217572 /nfs/dbraw/zinc/21/75/72/384217572.db2.gz SDURQLWWNHRXHW-GYSYKLTISA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@@H]1CC[C@H]1N[C@H](C)c1ccccc1Cl ZINC000309714599 384216143 /nfs/dbraw/zinc/21/61/43/384216143.db2.gz SDURQLWWNHRXHW-JTNHKYCSSA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@@H]1CC[C@H]1N[C@@H](C)c1ccccc1Cl ZINC000309714601 388461944 /nfs/dbraw/zinc/46/19/44/388461944.db2.gz SDURQLWWNHRXHW-MISXGVKJSA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@H]1CC[C@@H]1N[C@@H](C)c1ccccc1Cl ZINC000309714603 388462125 /nfs/dbraw/zinc/46/21/25/388462125.db2.gz SDURQLWWNHRXHW-MJVIPROJSA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@H]1CC[C@@H]1N[C@H](C)c1ccccc1Cl ZINC000309714606 388462097 /nfs/dbraw/zinc/46/20/97/388462097.db2.gz SDURQLWWNHRXHW-SUNKGSAMSA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@H]1CC[C@H]1N[C@H](C)c1ccccc1Cl ZINC000309714608 388462419 /nfs/dbraw/zinc/46/24/19/388462419.db2.gz SDURQLWWNHRXHW-UHIISALHSA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@@H]1CC[C@@H]1N[C@@H](C)c1ccccc1Cl ZINC000309714610 388462331 /nfs/dbraw/zinc/46/23/31/388462331.db2.gz SDURQLWWNHRXHW-WDMOLILDSA-N 0 3 237.774 4.179 20 0 BIADHN CCC(C)(C)CCN[C@H](C)c1ccc(C)o1 ZINC000309788070 384401969 /nfs/dbraw/zinc/40/19/69/384401969.db2.gz OOHMNVGKZBWMMC-GFCCVEGCSA-N 0 3 223.360 4.065 20 0 BIADHN CCC(C)(C)CCN[C@@H](C)c1ccc(C)o1 ZINC000309788073 384403980 /nfs/dbraw/zinc/40/39/80/384403980.db2.gz OOHMNVGKZBWMMC-LBPRGKRZSA-N 0 3 223.360 4.065 20 0 BIADHN CCC1CC(N[C@@H](C)c2ccccc2Cl)C1 ZINC000310012178 388473265 /nfs/dbraw/zinc/47/32/65/388473265.db2.gz IYIHEVJBHYHMPT-UNXYVOJBSA-N 0 3 237.774 4.179 20 0 BIADHN CCC1CC(N[C@H](C)c2ccccc2Cl)C1 ZINC000310012179 388473260 /nfs/dbraw/zinc/47/32/60/388473260.db2.gz IYIHEVJBHYHMPT-VOMCLLRMSA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@@H](F)CN[C@H](CC)c1ccc(Cl)cc1 ZINC000310027584 384792697 /nfs/dbraw/zinc/79/26/97/384792697.db2.gz QBMPGLGFFGPVTO-CHWSQXEVSA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@@H](F)CN[C@@H](CC)c1ccc(Cl)cc1 ZINC000310027586 384792602 /nfs/dbraw/zinc/79/26/02/384792602.db2.gz QBMPGLGFFGPVTO-OLZOCXBDSA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@@H](NC[C@@H](F)CC)c1ccc(Cl)cc1 ZINC000310027588 384793640 /nfs/dbraw/zinc/79/36/40/384793640.db2.gz QBMPGLGFFGPVTO-QWHCGFSZSA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@H](F)CN[C@@H](CC)c1ccc(Cl)cc1 ZINC000310027589 384793676 /nfs/dbraw/zinc/79/36/76/384793676.db2.gz QBMPGLGFFGPVTO-STQMWFEESA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@H](N[C@H]1CCC1(C)C)c1ccccc1F ZINC000310182852 384881083 /nfs/dbraw/zinc/88/10/83/384881083.db2.gz OAOPLGCDVQMOFS-KBPBESRZSA-N 0 3 235.346 4.055 20 0 BIADHN CC[C@@H](N[C@H]1CCC1(C)C)c1ccccc1F ZINC000310182853 347240444 /nfs/dbraw/zinc/24/04/44/347240444.db2.gz OAOPLGCDVQMOFS-KGLIPLIRSA-N 0 3 235.346 4.055 20 0 BIADHN CC[C@H](N[C@@H]1CCC1(C)C)c1ccccc1F ZINC000310182854 384879875 /nfs/dbraw/zinc/87/98/75/384879875.db2.gz OAOPLGCDVQMOFS-UONOGXRCSA-N 0 3 235.346 4.055 20 0 BIADHN CC[C@@H](N[C@@H]1CCC1(C)C)c1ccccc1F ZINC000310182861 347240606 /nfs/dbraw/zinc/24/06/06/347240606.db2.gz OAOPLGCDVQMOFS-ZIAGYGMSSA-N 0 3 235.346 4.055 20 0 BIADHN Cc1cc(CN[C@@H](C)c2cccc(C)c2)cs1 ZINC000310240361 388478689 /nfs/dbraw/zinc/47/86/89/388478689.db2.gz BKSXUKSFTHRLJM-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc(CNC(C)(C)c2ccccc2)cs1 ZINC000310267852 388478292 /nfs/dbraw/zinc/47/82/92/388478292.db2.gz HQVYSHSGWFPJAI-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN C[C@H](CCC(C)(C)C)NCc1ccccc1F ZINC000310311767 384767412 /nfs/dbraw/zinc/76/74/12/384767412.db2.gz UYNKZHMOXDHRLW-GFCCVEGCSA-N 0 3 237.362 4.130 20 0 BIADHN C[C@@H](CCC(C)(C)C)NCc1ccccc1F ZINC000310311772 384766456 /nfs/dbraw/zinc/76/64/56/384766456.db2.gz UYNKZHMOXDHRLW-LBPRGKRZSA-N 0 3 237.362 4.130 20 0 BIADHN CC[C@H](NCc1cccs1)c1cccc(C)c1 ZINC000310322200 384975721 /nfs/dbraw/zinc/97/57/21/384975721.db2.gz VJLUQWBRGRSYCY-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1cccs1)c1cccc(C)c1 ZINC000310322201 347263733 /nfs/dbraw/zinc/26/37/33/347263733.db2.gz VJLUQWBRGRSYCY-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1sccc1CN[C@H](C)c1ccc(C)cc1 ZINC000310327123 388481024 /nfs/dbraw/zinc/48/10/24/388481024.db2.gz AVLKQLFBJBOWDS-GFCCVEGCSA-N 0 3 245.391 4.216 20 0 BIADHN CC[C@H](NCc1ccsc1)c1cccc(C)c1 ZINC000310407274 385047805 /nfs/dbraw/zinc/04/78/05/385047805.db2.gz KWYKGIPJEXIMKV-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1ccsc1)c1cccc(C)c1 ZINC000310407278 347279641 /nfs/dbraw/zinc/27/96/41/347279641.db2.gz KWYKGIPJEXIMKV-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1cccc(CNC(C)(C)c2ccccc2)c1 ZINC000310820689 388489020 /nfs/dbraw/zinc/48/90/20/388489020.db2.gz GKTQQKWALOLRRM-UHFFFAOYSA-N 0 3 239.362 4.020 20 0 BIADHN Cc1occc1CN[C@H](c1ccccc1)C(C)C ZINC000321347967 387125894 /nfs/dbraw/zinc/12/58/94/387125894.db2.gz BKZNIYJWLYZNDK-INIZCTEOSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1occc1CN[C@@H](c1ccccc1)C(C)C ZINC000321347969 387126891 /nfs/dbraw/zinc/12/68/91/387126891.db2.gz BKZNIYJWLYZNDK-MRXNPFEDSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1occc1CN[C@H](C)c1cc(C)ccc1C ZINC000321367709 635201395 /nfs/dbraw/zinc/20/13/95/635201395.db2.gz DOIKGWWIXWUOAB-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@@H](C)c1cc(C)ccc1C ZINC000321367710 635201630 /nfs/dbraw/zinc/20/16/30/635201630.db2.gz DOIKGWWIXWUOAB-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN CCc1ccc([C@@H](C)NCc2ccoc2C)cc1 ZINC000321487697 537857223 /nfs/dbraw/zinc/85/72/23/537857223.db2.gz FRZJLAQXWJOCLF-GFCCVEGCSA-N 0 3 243.350 4.001 20 0 BIADHN CCc1ccc([C@H](C)NCc2ccoc2C)cc1 ZINC000321487699 537857338 /nfs/dbraw/zinc/85/73/38/537857338.db2.gz FRZJLAQXWJOCLF-LBPRGKRZSA-N 0 3 243.350 4.001 20 0 BIADHN Cc1occc1CN[C@H](C)c1ccc(C)cc1C ZINC000321493135 387263803 /nfs/dbraw/zinc/26/38/03/387263803.db2.gz GHDOCNNSQAHMKW-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@@H](C)c1ccc(C)cc1C ZINC000321493136 387263343 /nfs/dbraw/zinc/26/33/43/387263343.db2.gz GHDOCNNSQAHMKW-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN CCC[C@H](NCc1ccoc1C)c1ccccc1 ZINC000321538322 387271775 /nfs/dbraw/zinc/27/17/75/387271775.db2.gz QECCVNGCAKVMMU-INIZCTEOSA-N 0 3 243.350 4.219 20 0 BIADHN CCC[C@@H](NCc1ccoc1C)c1ccccc1 ZINC000321538323 387273062 /nfs/dbraw/zinc/27/30/62/387273062.db2.gz QECCVNGCAKVMMU-MRXNPFEDSA-N 0 3 243.350 4.219 20 0 BIADHN CC[C@H](NCc1ccoc1C)c1ccc(C)cc1 ZINC000321605297 387284274 /nfs/dbraw/zinc/28/42/74/387284274.db2.gz QKTHSJHDQKBOCI-INIZCTEOSA-N 0 3 243.350 4.137 20 0 BIADHN CC[C@@H](NCc1ccoc1C)c1ccc(C)cc1 ZINC000321605299 357638729 /nfs/dbraw/zinc/63/87/29/357638729.db2.gz QKTHSJHDQKBOCI-MRXNPFEDSA-N 0 3 243.350 4.137 20 0 BIADHN C[C@H]1CC[C@H](NCc2ccoc2)c2sccc21 ZINC000334669600 354409812 /nfs/dbraw/zinc/40/98/12/354409812.db2.gz ONJAMJCEZLEMRU-GWCFXTLKSA-N 0 3 247.363 4.069 20 0 BIADHN C[C@H]1CC[C@@H](NCc2ccoc2)c2sccc21 ZINC000334669601 354409995 /nfs/dbraw/zinc/40/99/95/354409995.db2.gz ONJAMJCEZLEMRU-GXFFZTMASA-N 0 3 247.363 4.069 20 0 BIADHN C[C@@H]1CC[C@H](NCc2ccoc2)c2sccc21 ZINC000334669602 354409835 /nfs/dbraw/zinc/40/98/35/354409835.db2.gz ONJAMJCEZLEMRU-MFKMUULPSA-N 0 3 247.363 4.069 20 0 BIADHN C[C@@H]1CC[C@@H](NCc2ccoc2)c2sccc21 ZINC000334669603 354409861 /nfs/dbraw/zinc/40/98/61/354409861.db2.gz ONJAMJCEZLEMRU-ZWNOBZJWSA-N 0 3 247.363 4.069 20 0 BIADHN CC[C@@H](NC1CCC1)c1cccc(Cl)c1F ZINC000336678098 385617375 /nfs/dbraw/zinc/61/73/75/385617375.db2.gz CFRGTEKUPGWONZ-GFCCVEGCSA-N 0 3 241.737 4.072 20 0 BIADHN CC[C@H](NC1CCC1)c1cccc(Cl)c1F ZINC000336678103 385617036 /nfs/dbraw/zinc/61/70/36/385617036.db2.gz CFRGTEKUPGWONZ-LBPRGKRZSA-N 0 3 241.737 4.072 20 0 BIADHN CCC[C@@H](NCC=C(C)C)c1ccsc1 ZINC000336722356 169399465 /nfs/dbraw/zinc/39/94/65/169399465.db2.gz DXBHIKYSBZHPAP-CYBMUJFWSA-N 0 3 223.385 4.145 20 0 BIADHN CCC[C@H](NCC=C(C)C)c1ccsc1 ZINC000336722410 386160317 /nfs/dbraw/zinc/16/03/17/386160317.db2.gz DXBHIKYSBZHPAP-ZDUSSCGKSA-N 0 3 223.385 4.145 20 0 BIADHN CC[C@H](NCc1csc(C)c1)c1ccccc1 ZINC000336724831 397964254 /nfs/dbraw/zinc/96/42/54/397964254.db2.gz ZKXLGSGRIRHFDS-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1csc(C)c1)c1ccccc1 ZINC000336724838 351407813 /nfs/dbraw/zinc/40/78/13/351407813.db2.gz ZKXLGSGRIRHFDS-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@H](NCc1ccccc1)c1cccc(C)c1 ZINC000336725031 385828831 /nfs/dbraw/zinc/82/88/31/385828831.db2.gz XLCUPSAAEMRDQD-KRWDZBQOSA-N 0 3 239.362 4.236 20 0 BIADHN CC[C@@H](NCc1ccccc1)c1cccc(C)c1 ZINC000336725041 170903400 /nfs/dbraw/zinc/90/34/00/170903400.db2.gz XLCUPSAAEMRDQD-QGZVFWFLSA-N 0 3 239.362 4.236 20 0 BIADHN CC[C@H](NCc1ccsc1C)c1ccccc1 ZINC000336732050 388471324 /nfs/dbraw/zinc/47/13/24/388471324.db2.gz ZFQKAHHXORRKHU-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1ccsc1C)c1ccccc1 ZINC000336732051 365366415 /nfs/dbraw/zinc/36/64/15/365366415.db2.gz ZFQKAHHXORRKHU-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](F)CN[C@H](CC)c1cccc(Cl)c1 ZINC000336750720 386003871 /nfs/dbraw/zinc/00/38/71/386003871.db2.gz ZRMUAOVXWFGQTK-CHWSQXEVSA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@@H](F)CN[C@@H](CC)c1cccc(Cl)c1 ZINC000336750722 386003239 /nfs/dbraw/zinc/00/32/39/386003239.db2.gz ZRMUAOVXWFGQTK-OLZOCXBDSA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@@H](NC[C@@H](F)CC)c1cccc(Cl)c1 ZINC000336750724 171475292 /nfs/dbraw/zinc/47/52/92/171475292.db2.gz ZRMUAOVXWFGQTK-QWHCGFSZSA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@H](F)CN[C@@H](CC)c1cccc(Cl)c1 ZINC000336750727 386003257 /nfs/dbraw/zinc/00/32/57/386003257.db2.gz ZRMUAOVXWFGQTK-STQMWFEESA-N 0 3 243.753 4.129 20 0 BIADHN CC[C@@H](c1ccccc1)N(C)Cc1ccoc1C ZINC000338991515 350724357 /nfs/dbraw/zinc/72/43/57/350724357.db2.gz VCLRJHCONUXVES-INIZCTEOSA-N 0 3 243.350 4.171 20 0 BIADHN CC[C@H](c1ccccc1)N(C)Cc1ccoc1C ZINC000338991516 386192496 /nfs/dbraw/zinc/19/24/96/386192496.db2.gz VCLRJHCONUXVES-MRXNPFEDSA-N 0 3 243.350 4.171 20 0 BIADHN c1csc(CN2CCC[C@@H]2c2ccsc2)c1 ZINC000339146421 386269639 /nfs/dbraw/zinc/26/96/39/386269639.db2.gz PLTQEIKORBVVIW-CYBMUJFWSA-N 0 3 249.404 4.147 20 0 BIADHN c1csc(CN2CCC[C@H]2c2ccsc2)c1 ZINC000339146436 386270827 /nfs/dbraw/zinc/27/08/27/386270827.db2.gz PLTQEIKORBVVIW-ZDUSSCGKSA-N 0 3 249.404 4.147 20 0 BIADHN CC(C)(C)C1CC(N[C@@H]2CCCc3occc32)C1 ZINC000340452077 398122823 /nfs/dbraw/zinc/12/28/23/398122823.db2.gz RMRPBMRVAUOMBO-ORHYLEIMSA-N 0 3 247.382 4.071 20 0 BIADHN CC(C)(C)C1CC(N[C@H]2CCCc3occc32)C1 ZINC000340452078 398123004 /nfs/dbraw/zinc/12/30/04/398123004.db2.gz RMRPBMRVAUOMBO-YIZWMMSDSA-N 0 3 247.382 4.071 20 0 BIADHN CC(C)CC[C@@H](NCC[C@H](C)F)c1ccoc1 ZINC000340466769 385852937 /nfs/dbraw/zinc/85/29/37/385852937.db2.gz DZVANNJHBSRAQV-GXTWGEPZSA-N 0 3 241.350 4.095 20 0 BIADHN CC(C)CC[C@H](NCC[C@H](C)F)c1ccoc1 ZINC000340466778 352377996 /nfs/dbraw/zinc/37/79/96/352377996.db2.gz DZVANNJHBSRAQV-JSGCOSHPSA-N 0 3 241.350 4.095 20 0 BIADHN CC(C)CC[C@H](NCC[C@@H](C)F)c1ccoc1 ZINC000340466783 352378133 /nfs/dbraw/zinc/37/81/33/352378133.db2.gz DZVANNJHBSRAQV-OCCSQVGLSA-N 0 3 241.350 4.095 20 0 BIADHN CC(C)CC[C@@H](NCC[C@@H](C)F)c1ccoc1 ZINC000340466790 166897837 /nfs/dbraw/zinc/89/78/37/166897837.db2.gz DZVANNJHBSRAQV-TZMCWYRMSA-N 0 3 241.350 4.095 20 0 BIADHN CCC[C@H](N[C@H]1CCC[C@H]1F)c1ccccc1 ZINC000340525361 386127505 /nfs/dbraw/zinc/12/75/05/386127505.db2.gz IASYBTDESVXBJW-ILXRZTDVSA-N 0 3 235.346 4.008 20 0 BIADHN CCC[C@H](N[C@H]1CCC[C@@H]1F)c1ccccc1 ZINC000340525362 386125955 /nfs/dbraw/zinc/12/59/55/386125955.db2.gz IASYBTDESVXBJW-KKUMJFAQSA-N 0 3 235.346 4.008 20 0 BIADHN CCC[C@H](N[C@@H]1CCC[C@H]1F)c1ccccc1 ZINC000340525363 386127768 /nfs/dbraw/zinc/12/77/68/386127768.db2.gz IASYBTDESVXBJW-QLFBSQMISA-N 0 3 235.346 4.008 20 0 BIADHN CCC[C@H](N[C@@H]1CCC[C@@H]1F)c1ccccc1 ZINC000340525365 386127918 /nfs/dbraw/zinc/12/79/18/386127918.db2.gz IASYBTDESVXBJW-SOUVJXGZSA-N 0 3 235.346 4.008 20 0 BIADHN C[C@@H]1CC[C@H](N[C@@H]2CCC[C@H]2F)c2ccccc21 ZINC000340530386 176234280 /nfs/dbraw/zinc/23/42/80/176234280.db2.gz NHFGWBPUMNCRKN-BQDHKBFISA-N 0 3 247.357 4.105 20 0 BIADHN C[C@@H]1CC[C@H](N[C@H]2CCC[C@H]2F)c2ccccc21 ZINC000340530389 176234638 /nfs/dbraw/zinc/23/46/38/176234638.db2.gz NHFGWBPUMNCRKN-FWYOQMDTSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@@H]1CC[C@H](N[C@@H]2CCC[C@@H]2F)c2ccccc21 ZINC000340530393 176234476 /nfs/dbraw/zinc/23/44/76/176234476.db2.gz NHFGWBPUMNCRKN-IPOQPSJVSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@@H]1CC[C@H](N[C@H]2CCC[C@@H]2F)c2ccccc21 ZINC000340530396 176234601 /nfs/dbraw/zinc/23/46/01/176234601.db2.gz NHFGWBPUMNCRKN-MEYUZBJRSA-N 0 3 247.357 4.105 20 0 BIADHN CCC[C@H](N[C@H]1CCC[C@H]1F)c1ccsc1 ZINC000340532522 388492502 /nfs/dbraw/zinc/49/25/02/388492502.db2.gz RCAAQRACOCNPMI-AGIUHOORSA-N 0 3 241.375 4.070 20 0 BIADHN CCC[C@H](N[C@H]1CCC[C@@H]1F)c1ccsc1 ZINC000340532526 386153589 /nfs/dbraw/zinc/15/35/89/386153589.db2.gz RCAAQRACOCNPMI-AVGNSLFASA-N 0 3 241.375 4.070 20 0 BIADHN CCC[C@H](N[C@@H]1CCC[C@H]1F)c1ccsc1 ZINC000340532528 386154809 /nfs/dbraw/zinc/15/48/09/386154809.db2.gz RCAAQRACOCNPMI-FRRDWIJNSA-N 0 3 241.375 4.070 20 0 BIADHN CCC[C@H](N[C@@H]1CCC[C@@H]1F)c1ccsc1 ZINC000340532531 388492929 /nfs/dbraw/zinc/49/29/29/388492929.db2.gz RCAAQRACOCNPMI-RWMBFGLXSA-N 0 3 241.375 4.070 20 0 BIADHN Cc1occc1CN[C@H](C)c1c(C)cccc1C ZINC000342510709 135285254 /nfs/dbraw/zinc/28/52/54/135285254.db2.gz VMJHEYVNCSOTDI-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@@H](C)c1c(C)cccc1C ZINC000342510711 135285340 /nfs/dbraw/zinc/28/53/40/135285340.db2.gz VMJHEYVNCSOTDI-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN CC[C@H](NCc1cc(C)cs1)c1ccccc1 ZINC000344607869 365712934 /nfs/dbraw/zinc/71/29/34/365712934.db2.gz GPFWULOUUKWCRE-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1cc(C)cs1)c1ccccc1 ZINC000344607870 365713375 /nfs/dbraw/zinc/71/33/75/365713375.db2.gz GPFWULOUUKWCRE-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1csc(CN[C@H](C)c2cc(C)oc2C)c1 ZINC000344620572 385287000 /nfs/dbraw/zinc/28/70/00/385287000.db2.gz JLMRFEAPRNHVJI-LLVKDONJSA-N 0 3 249.379 4.117 20 0 BIADHN Cc1csc(CN[C@@H](C)c2cc(C)oc2C)c1 ZINC000344620577 385287150 /nfs/dbraw/zinc/28/71/50/385287150.db2.gz JLMRFEAPRNHVJI-NSHDSACASA-N 0 3 249.379 4.117 20 0 BIADHN c1cc(CN2CCC[C@H]2c2ccccc2)cs1 ZINC000349747217 355422542 /nfs/dbraw/zinc/42/25/42/355422542.db2.gz IYDVWIRKFYORNU-HNNXBMFYSA-N 0 3 243.375 4.085 20 0 BIADHN c1cc(CN2CCC[C@@H]2c2ccccc2)cs1 ZINC000349747218 355422373 /nfs/dbraw/zinc/42/23/73/355422373.db2.gz IYDVWIRKFYORNU-OAHLLOKOSA-N 0 3 243.375 4.085 20 0 BIADHN Cc1ccsc1CN(Cc1ccco1)C(C)C ZINC000349830172 355488169 /nfs/dbraw/zinc/48/81/69/355488169.db2.gz FIIFUANKBUBWNV-UHFFFAOYSA-N 0 3 249.379 4.060 20 0 BIADHN C[C@H](c1ccccc1)N(Cc1ccco1)C1CC1 ZINC000349921463 355527913 /nfs/dbraw/zinc/52/79/13/355527913.db2.gz XFWDLMYDVNRNJA-CYBMUJFWSA-N 0 3 241.334 4.005 20 0 BIADHN C[C@@H](c1ccccc1)N(Cc1ccco1)C1CC1 ZINC000349921464 355527403 /nfs/dbraw/zinc/52/74/03/355527403.db2.gz XFWDLMYDVNRNJA-ZDUSSCGKSA-N 0 3 241.334 4.005 20 0 BIADHN Cc1sccc1CN1CC[C@H]1c1ccccc1 ZINC000350122167 355608325 /nfs/dbraw/zinc/60/83/25/355608325.db2.gz LKTDLAYCVHVZTB-HNNXBMFYSA-N 0 3 243.375 4.004 20 0 BIADHN Cc1sccc1CN1CC[C@@H]1c1ccccc1 ZINC000350122171 355607812 /nfs/dbraw/zinc/60/78/12/355607812.db2.gz LKTDLAYCVHVZTB-OAHLLOKOSA-N 0 3 243.375 4.004 20 0 BIADHN CCN(Cc1ccsc1C)Cc1ccccc1 ZINC000350178067 355620687 /nfs/dbraw/zinc/62/06/87/355620687.db2.gz WLEGDYOTYLGCKF-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN Cc1ccoc1CN(Cc1cccs1)C(C)C ZINC000350301275 136358119 /nfs/dbraw/zinc/35/81/19/136358119.db2.gz MOPOGFJFAWYNCA-UHFFFAOYSA-N 0 3 249.379 4.060 20 0 BIADHN c1sc2ccccc2c1CN1CCC12CCC2 ZINC000353651630 387251066 /nfs/dbraw/zinc/25/10/66/387251066.db2.gz HGULQODKMNYWSX-UHFFFAOYSA-N 0 3 243.375 4.030 20 0 BIADHN C[C@@H](N(C)Cc1ccc([C@H]2C[C@H]2C)o1)C1(C)CC1 ZINC000355080182 387477712 /nfs/dbraw/zinc/47/77/12/387477712.db2.gz LZHDRUDOBGYSRG-BZPMIXESSA-N 0 3 247.382 4.023 20 0 BIADHN C[C@H](N(C)Cc1ccc([C@H]2C[C@H]2C)o1)C1(C)CC1 ZINC000355080184 387476753 /nfs/dbraw/zinc/47/67/53/387476753.db2.gz LZHDRUDOBGYSRG-DYEKYZERSA-N 0 3 247.382 4.023 20 0 BIADHN C[C@H](N(C)Cc1ccc([C@@H]2C[C@H]2C)o1)C1(C)CC1 ZINC000355080185 387477959 /nfs/dbraw/zinc/47/79/59/387477959.db2.gz LZHDRUDOBGYSRG-MBNYWOFBSA-N 0 3 247.382 4.023 20 0 BIADHN C[C@@H](N(C)Cc1ccc([C@@H]2C[C@H]2C)o1)C1(C)CC1 ZINC000355080186 187374900 /nfs/dbraw/zinc/37/49/00/187374900.db2.gz LZHDRUDOBGYSRG-YRGRVCCFSA-N 0 3 247.382 4.023 20 0 BIADHN CC[C@@]1(C)C[C@@H]1c1nc(C2CCCCC2)no1 ZINC000355774487 171207299 /nfs/dbraw/zinc/20/72/99/171207299.db2.gz SFULRCYEWFQLNF-RISCZKNCSA-N 0 3 234.343 4.021 20 0 BIADHN Cc1occc1CN[C@H](C)c1cc(C)cc(C)c1 ZINC000358016192 386878755 /nfs/dbraw/zinc/87/87/55/386878755.db2.gz LXZFDSOFBIEKBF-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@@H](C)c1cc(C)cc(C)c1 ZINC000358016196 386878872 /nfs/dbraw/zinc/87/88/72/386878872.db2.gz LXZFDSOFBIEKBF-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@H](C)c1cccc(C)c1C ZINC000358023802 179182252 /nfs/dbraw/zinc/18/22/52/179182252.db2.gz XUHDEVPBEHLUNF-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@@H](C)c1cccc(C)c1C ZINC000358023804 179196008 /nfs/dbraw/zinc/19/60/08/179196008.db2.gz XUHDEVPBEHLUNF-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@H](C)c1ccc(C)c(C)c1 ZINC000358030530 386881914 /nfs/dbraw/zinc/88/19/14/386881914.db2.gz ZYPXAODXHQPXHR-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1occc1CN[C@@H](C)c1ccc(C)c(C)c1 ZINC000358030531 386881532 /nfs/dbraw/zinc/88/15/32/386881532.db2.gz ZYPXAODXHQPXHR-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN c1coc(CN2CCCC[C@H]2c2ccccc2)c1 ZINC000358298483 538840981 /nfs/dbraw/zinc/84/09/81/538840981.db2.gz LXJILQSXZZXDCW-INIZCTEOSA-N 0 3 241.334 4.007 20 0 BIADHN c1coc(CN2CCCC[C@@H]2c2ccccc2)c1 ZINC000358298484 538840089 /nfs/dbraw/zinc/84/00/89/538840089.db2.gz LXJILQSXZZXDCW-MRXNPFEDSA-N 0 3 241.334 4.007 20 0 BIADHN Cc1occc1CN(C)[C@H](C)c1ccccc1C ZINC000361629543 179318336 /nfs/dbraw/zinc/31/83/36/179318336.db2.gz LAJULWSIRQXICI-CYBMUJFWSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1occc1CN(C)[C@@H](C)c1ccccc1C ZINC000361629559 179333702 /nfs/dbraw/zinc/33/37/02/179333702.db2.gz LAJULWSIRQXICI-ZDUSSCGKSA-N 0 3 243.350 4.089 20 0 BIADHN CCC1(CC)CCN([C@@H](C)c2cccnc2)CC1 ZINC000362595338 387638665 /nfs/dbraw/zinc/63/86/65/387638665.db2.gz BYQDEMFRMZHABF-AWEZNQCLSA-N 0 3 246.398 4.045 20 0 BIADHN CCC1(CC)CCN([C@H](C)c2cccnc2)CC1 ZINC000362595339 387638694 /nfs/dbraw/zinc/63/86/94/387638694.db2.gz BYQDEMFRMZHABF-CQSZACIVSA-N 0 3 246.398 4.045 20 0 BIADHN CCC1(CC)CCN([C@@H](C)c2ccccn2)CC1 ZINC000362596335 387637593 /nfs/dbraw/zinc/63/75/93/387637593.db2.gz MBLSXXZBEBQRHP-AWEZNQCLSA-N 0 3 246.398 4.045 20 0 BIADHN CCC1(CC)CCN([C@H](C)c2ccccn2)CC1 ZINC000362596336 387638313 /nfs/dbraw/zinc/63/83/13/387638313.db2.gz MBLSXXZBEBQRHP-CQSZACIVSA-N 0 3 246.398 4.045 20 0 BIADHN CC[C@H](N[C@@H]1CCCC[C@H]1F)c1cccs1 ZINC000378672392 385461051 /nfs/dbraw/zinc/46/10/51/385461051.db2.gz LFYAXCLEIPFTFV-GRYCIOLGSA-N 0 3 241.375 4.070 20 0 BIADHN CC[C@@H](N[C@@H]1CCCC[C@H]1F)c1cccs1 ZINC000378672393 356651413 /nfs/dbraw/zinc/65/14/13/356651413.db2.gz LFYAXCLEIPFTFV-IJLUTSLNSA-N 0 3 241.375 4.070 20 0 BIADHN Cc1csc(CN[C@H](C)c2ccccc2C)c1 ZINC000379258138 356438250 /nfs/dbraw/zinc/43/82/50/356438250.db2.gz GDTXEUWKWYMYCO-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1csc(CN[C@@H](C)c2ccccc2C)c1 ZINC000379258139 356437707 /nfs/dbraw/zinc/43/77/07/356437707.db2.gz GDTXEUWKWYMYCO-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1csc(CN[C@H](C)c2cccc(C)c2)c1 ZINC000379272226 356440661 /nfs/dbraw/zinc/44/06/61/356440661.db2.gz MVCOQVLKDLLCDM-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1csc(CN[C@@H](C)c2cccc(C)c2)c1 ZINC000379272227 356440258 /nfs/dbraw/zinc/44/02/58/356440258.db2.gz MVCOQVLKDLLCDM-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CCCC(C)(C)NCc1sccc1Cl ZINC000379483665 358502153 /nfs/dbraw/zinc/50/21/53/358502153.db2.gz CAKBFSKXFXKKOV-UHFFFAOYSA-N 0 3 231.792 4.070 20 0 BIADHN Cc1cc(CN[C@@H](C)c2ccc(C)cc2)cs1 ZINC000379750150 361487606 /nfs/dbraw/zinc/48/76/06/361487606.db2.gz JUJLHOAGJPIRMP-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CCC1(CNCc2sccc2Cl)CCC1 ZINC000379781056 365258474 /nfs/dbraw/zinc/25/84/74/365258474.db2.gz CGSAHZVKUWVCFZ-UHFFFAOYSA-N 0 3 243.803 4.071 20 0 BIADHN CCCC1(CNCc2sccc2Cl)CC1 ZINC000379821093 365281706 /nfs/dbraw/zinc/28/17/06/365281706.db2.gz STBLRYCYLKKCMZ-UHFFFAOYSA-N 0 3 243.803 4.071 20 0 BIADHN CC(C)(C)C(C)(C)NCc1sccc1Cl ZINC000379872985 365331586 /nfs/dbraw/zinc/33/15/86/365331586.db2.gz RIOVTDMFVHPHJY-UHFFFAOYSA-N 0 3 245.819 4.316 20 0 BIADHN Cc1sccc1CN[C@@H](C)c1ccc(C)cc1 ZINC000379891282 365337657 /nfs/dbraw/zinc/33/76/57/365337657.db2.gz AVLKQLFBJBOWDS-LBPRGKRZSA-N 0 3 245.391 4.216 20 0 BIADHN CC1(C)CC[C@H](NCc2ccsc2Cl)C1 ZINC000380018266 365811174 /nfs/dbraw/zinc/81/11/74/365811174.db2.gz NPMDITCGDURMOQ-JTQLQIEISA-N 0 3 243.803 4.070 20 0 BIADHN CC1(C)CC[C@@H](NCc2ccsc2Cl)C1 ZINC000380018269 365811118 /nfs/dbraw/zinc/81/11/18/365811118.db2.gz NPMDITCGDURMOQ-SNVBAGLBSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@H](CCC1CC1)NCc1sccc1Cl ZINC000380038186 365821857 /nfs/dbraw/zinc/82/18/57/365821857.db2.gz SRRUTUUKLMSCPE-SECBINFHSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H](CCC1CC1)NCc1sccc1Cl ZINC000380038191 365822480 /nfs/dbraw/zinc/82/24/80/365822480.db2.gz SRRUTUUKLMSCPE-VIFPVBQESA-N 0 3 243.803 4.070 20 0 BIADHN CC(C)=CCCN[C@@H](C)c1csc(Cl)c1 ZINC000380063693 365836743 /nfs/dbraw/zinc/83/67/43/365836743.db2.gz BMJBJFFKXYBTFR-JTQLQIEISA-N 0 3 243.803 4.408 20 0 BIADHN CC(C)=CCCN[C@H](C)c1csc(Cl)c1 ZINC000380063694 365836671 /nfs/dbraw/zinc/83/66/71/365836671.db2.gz BMJBJFFKXYBTFR-SNVBAGLBSA-N 0 3 243.803 4.408 20 0 BIADHN C[C@H]1CCC[C@@H](NCc2ccsc2Cl)C1 ZINC000380097836 365876858 /nfs/dbraw/zinc/87/68/58/365876858.db2.gz KVDHGTPKSPOXKV-GXSJLCMTSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H]1CCC[C@H](NCc2ccsc2Cl)C1 ZINC000380097837 365877334 /nfs/dbraw/zinc/87/73/34/365877334.db2.gz KVDHGTPKSPOXKV-KOLCDFICSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H]1CCC[C@@H](NCc2ccsc2Cl)C1 ZINC000380097841 343092591 /nfs/dbraw/zinc/09/25/91/343092591.db2.gz KVDHGTPKSPOXKV-MWLCHTKSSA-N 0 3 243.803 4.070 20 0 BIADHN C[C@H]1CCC[C@H](NCc2ccsc2Cl)C1 ZINC000380097842 365877982 /nfs/dbraw/zinc/87/79/82/365877982.db2.gz KVDHGTPKSPOXKV-ONGXEEELSA-N 0 3 243.803 4.070 20 0 BIADHN CC[C@H](NCC=C(C)C)c1ccc(Cl)s1 ZINC000380178288 347529087 /nfs/dbraw/zinc/52/90/87/347529087.db2.gz KTGXSVNRQGOHLE-JTQLQIEISA-N 0 3 243.803 4.408 20 0 BIADHN CC[C@@H](NCC=C(C)C)c1ccc(Cl)s1 ZINC000380178294 347535279 /nfs/dbraw/zinc/53/52/79/347535279.db2.gz KTGXSVNRQGOHLE-SNVBAGLBSA-N 0 3 243.803 4.408 20 0 BIADHN CC[C@@H](NC/C=C\Cl)c1cccc(Cl)c1 ZINC000380197467 712714516 /nfs/dbraw/zinc/71/45/16/712714516.db2.gz RNFUWXBCAVMRMV-DJFZKKHWSA-N 0 3 244.165 4.133 20 0 BIADHN CC[C@H](NC/C=C\Cl)c1cccc(Cl)c1 ZINC000380197469 712714473 /nfs/dbraw/zinc/71/44/73/712714473.db2.gz RNFUWXBCAVMRMV-KMSCOEIWSA-N 0 3 244.165 4.133 20 0 BIADHN CC[C@H](NC/C=C/Cl)c1cccc(Cl)c1 ZINC000380197472 712714495 /nfs/dbraw/zinc/71/44/95/712714495.db2.gz RNFUWXBCAVMRMV-NTYUQYKDSA-N 0 3 244.165 4.133 20 0 BIADHN CC[C@@H](NC/C=C/Cl)c1cccc(Cl)c1 ZINC000380197474 712714507 /nfs/dbraw/zinc/71/45/07/712714507.db2.gz RNFUWXBCAVMRMV-RPTYSRGTSA-N 0 3 244.165 4.133 20 0 BIADHN CC1(NCc2cscc2Cl)CCCCC1 ZINC000380221213 538987582 /nfs/dbraw/zinc/98/75/82/538987582.db2.gz JHRBWPKCQUMLPW-UHFFFAOYSA-N 0 3 243.803 4.214 20 0 BIADHN CC(C)c1ccc([C@H](C)NC/C=C/Cl)cc1 ZINC000381041759 710598790 /nfs/dbraw/zinc/59/87/90/710598790.db2.gz DTRXHFHZEZPKQH-KFRNIWOLSA-N 0 3 237.774 4.213 20 0 BIADHN CC(C)c1ccc([C@@H](C)NC/C=C/Cl)cc1 ZINC000381041763 710598916 /nfs/dbraw/zinc/59/89/16/710598916.db2.gz DTRXHFHZEZPKQH-OXFRDRNISA-N 0 3 237.774 4.213 20 0 BIADHN CC(C)c1ccc([C@H](C)NC/C=C\Cl)cc1 ZINC000381041772 710599279 /nfs/dbraw/zinc/59/92/79/710599279.db2.gz DTRXHFHZEZPKQH-REPPVQDKSA-N 0 3 237.774 4.213 20 0 BIADHN CC(C)c1ccc([C@@H](C)NC/C=C\Cl)cc1 ZINC000381041776 710598736 /nfs/dbraw/zinc/59/87/36/710598736.db2.gz DTRXHFHZEZPKQH-TWLAMCEISA-N 0 3 237.774 4.213 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccc(C)cc2)cs1 ZINC000381327884 367380866 /nfs/dbraw/zinc/38/08/66/367380866.db2.gz AOLGAWHAFZRVHO-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc([C@H](C)NCc2ccc(C)cc2)cs1 ZINC000381327886 367380827 /nfs/dbraw/zinc/38/08/27/367380827.db2.gz AOLGAWHAFZRVHO-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccccc2C)cs1 ZINC000381328838 367381249 /nfs/dbraw/zinc/38/12/49/367381249.db2.gz AUWMAKKPVCLPNI-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc([C@H](C)NCc2ccccc2C)cs1 ZINC000381328840 367381538 /nfs/dbraw/zinc/38/15/38/367381538.db2.gz AUWMAKKPVCLPNI-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc([C@@H](C)NCc2cccc(C)c2)cs1 ZINC000381366909 367389291 /nfs/dbraw/zinc/38/92/91/367389291.db2.gz LNEZLOWSTCYXGT-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cc([C@H](C)NCc2cccc(C)c2)cs1 ZINC000381366910 367389232 /nfs/dbraw/zinc/38/92/32/367389232.db2.gz LNEZLOWSTCYXGT-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CSc1ccccc1[C@@H](C)NCC=C(C)C ZINC000381369396 367389397 /nfs/dbraw/zinc/38/93/97/367389397.db2.gz HVVHSFXDDXRITR-GFCCVEGCSA-N 0 3 235.396 4.025 20 0 BIADHN CCCC[C@H](C)[C@H](C)N[C@@H](C)c1nccs1 ZINC000381388660 367392730 /nfs/dbraw/zinc/39/27/30/367392730.db2.gz NKWYZNJBPCTLJE-SRVKXCTJSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC[C@H](C)[C@@H](C)N[C@@H](C)c1nccs1 ZINC000381388662 367392477 /nfs/dbraw/zinc/39/24/77/367392477.db2.gz NKWYZNJBPCTLJE-TUAOUCFPSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@@H](F)CN[C@@H](CC(C)C)c1cccs1 ZINC000381415951 367397571 /nfs/dbraw/zinc/39/75/71/367397571.db2.gz WCODEVDGCPRCOP-NEPJUHHUSA-N 0 3 243.391 4.173 20 0 BIADHN CC[C@H](F)CN[C@H](CC(C)C)c1cccs1 ZINC000381415953 345826376 /nfs/dbraw/zinc/82/63/76/345826376.db2.gz WCODEVDGCPRCOP-NWDGAFQWSA-N 0 3 243.391 4.173 20 0 BIADHN CC[C@H](F)CN[C@@H](CC(C)C)c1cccs1 ZINC000381415954 345826328 /nfs/dbraw/zinc/82/63/28/345826328.db2.gz WCODEVDGCPRCOP-RYUDHWBXSA-N 0 3 243.391 4.173 20 0 BIADHN CC[C@@H](F)CN[C@H](CC(C)C)c1cccs1 ZINC000381415956 345827012 /nfs/dbraw/zinc/82/70/12/345827012.db2.gz WCODEVDGCPRCOP-VXGBXAGGSA-N 0 3 243.391 4.173 20 0 BIADHN C[C@H](N[C@@H]1C[C@@H](C)[C@H]1C)c1ccccc1Cl ZINC000381437426 345893201 /nfs/dbraw/zinc/89/32/01/345893201.db2.gz YGYBLCZJVFEMEP-NJBDSQKTSA-N 0 3 237.774 4.035 20 0 BIADHN C[C@H](N[C@@H]1C[C@@H](C)[C@@H]1C)c1ccccc1Cl ZINC000381437428 345893171 /nfs/dbraw/zinc/89/31/71/345893171.db2.gz YGYBLCZJVFEMEP-YAMSLAJTSA-N 0 3 237.774 4.035 20 0 BIADHN C[C@@H](NCC(C)(C)C(C)(C)C)c1ccco1 ZINC000381616742 367439314 /nfs/dbraw/zinc/43/93/14/367439314.db2.gz VSROWWVUFDIADE-LLVKDONJSA-N 0 3 223.360 4.003 20 0 BIADHN C[C@H](NCC(C)(C)C(C)(C)C)c1ccco1 ZINC000381616744 367439121 /nfs/dbraw/zinc/43/91/21/367439121.db2.gz VSROWWVUFDIADE-NSHDSACASA-N 0 3 223.360 4.003 20 0 BIADHN CC[C@H](NCc1cccc(F)c1)c1ccsc1 ZINC000382086339 367484504 /nfs/dbraw/zinc/48/45/04/367484504.db2.gz GLKFPSAZOXWDBP-AWEZNQCLSA-N 0 3 249.354 4.128 20 0 BIADHN CC[C@@H](NCc1cccc(F)c1)c1ccsc1 ZINC000382086343 367484394 /nfs/dbraw/zinc/48/43/94/367484394.db2.gz GLKFPSAZOXWDBP-CQSZACIVSA-N 0 3 249.354 4.128 20 0 BIADHN CC(C)C1(N[C@H](C)c2csc(Cl)c2)CC1 ZINC000382118264 347191252 /nfs/dbraw/zinc/19/12/52/347191252.db2.gz SVGCEIQKBSUJDF-SECBINFHSA-N 0 3 243.803 4.241 20 0 BIADHN CC(C)C1(N[C@@H](C)c2csc(Cl)c2)CC1 ZINC000382118265 347191303 /nfs/dbraw/zinc/19/13/03/347191303.db2.gz SVGCEIQKBSUJDF-VIFPVBQESA-N 0 3 243.803 4.241 20 0 BIADHN CC[C@H](NCc1cccc(C)c1)c1ccsc1 ZINC000382142289 367489512 /nfs/dbraw/zinc/48/95/12/367489512.db2.gz QVFDTZLJTOCINM-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1cccc(C)c1)c1ccsc1 ZINC000382142293 367489913 /nfs/dbraw/zinc/48/99/13/367489913.db2.gz QVFDTZLJTOCINM-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@H](NCc1ccccc1C)c1ccsc1 ZINC000382157849 367491730 /nfs/dbraw/zinc/49/17/30/367491730.db2.gz UBGRZLYRGYMBBO-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1ccccc1C)c1ccsc1 ZINC000382157880 367491866 /nfs/dbraw/zinc/49/18/66/367491866.db2.gz UBGRZLYRGYMBBO-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN CC(C)C1(N[C@H](C)c2ccccc2Cl)CC1 ZINC000382182653 367495492 /nfs/dbraw/zinc/49/54/92/367495492.db2.gz ZUQIFJZTVXVBCJ-LLVKDONJSA-N 0 3 237.774 4.179 20 0 BIADHN CC(C)C1(N[C@@H](C)c2ccccc2Cl)CC1 ZINC000382182654 367495134 /nfs/dbraw/zinc/49/51/34/367495134.db2.gz ZUQIFJZTVXVBCJ-NSHDSACASA-N 0 3 237.774 4.179 20 0 BIADHN CC[C@H](NCc1ccc(C)cc1)c1ccsc1 ZINC000382182955 384796064 /nfs/dbraw/zinc/79/60/64/384796064.db2.gz XZFWMPWADPTTLI-HNNXBMFYSA-N 0 3 245.391 4.297 20 0 BIADHN CC[C@@H](NCc1ccc(C)cc1)c1ccsc1 ZINC000382182958 384796627 /nfs/dbraw/zinc/79/66/27/384796627.db2.gz XZFWMPWADPTTLI-OAHLLOKOSA-N 0 3 245.391 4.297 20 0 BIADHN Cc1csc(CN[C@H](C)c2cccc(F)c2)c1 ZINC000383051133 367591332 /nfs/dbraw/zinc/59/13/32/367591332.db2.gz AMAZSTYGRPTVJY-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1csc(CN[C@@H](C)c2cccc(F)c2)c1 ZINC000383051135 367591816 /nfs/dbraw/zinc/59/18/16/367591816.db2.gz AMAZSTYGRPTVJY-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1csc(CN[C@H](C)c2ccc(C)cc2)c1 ZINC000383063926 367592840 /nfs/dbraw/zinc/59/28/40/367592840.db2.gz DHPOPFTXIPSGGY-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1csc(CN[C@@H](C)c2ccc(C)cc2)c1 ZINC000383063944 367592700 /nfs/dbraw/zinc/59/27/00/367592700.db2.gz DHPOPFTXIPSGGY-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1ccc([C@@H](C)NCCC(C)(C)C2CC2)o1 ZINC000383188816 367605834 /nfs/dbraw/zinc/60/58/34/367605834.db2.gz RGUCCGNXKBSYLZ-GFCCVEGCSA-N 0 3 235.371 4.065 20 0 BIADHN Cc1ccc([C@H](C)NCCC(C)(C)C2CC2)o1 ZINC000383188827 367605265 /nfs/dbraw/zinc/60/52/65/367605265.db2.gz RGUCCGNXKBSYLZ-LBPRGKRZSA-N 0 3 235.371 4.065 20 0 BIADHN Cc1cc(CN[C@H](C)c2ccc(C)cc2)cs1 ZINC000383339098 367615084 /nfs/dbraw/zinc/61/50/84/367615084.db2.gz JUJLHOAGJPIRMP-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN CC[C@@H](N[C@H](C)CC(C)(C)C)c1nccs1 ZINC000384675530 367715407 /nfs/dbraw/zinc/71/54/07/367715407.db2.gz ZAFRKULQLJKGQB-GHMZBOCLSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](N[C@H](C)CC(C)(C)C)c1nccs1 ZINC000384675531 367714978 /nfs/dbraw/zinc/71/49/78/367714978.db2.gz ZAFRKULQLJKGQB-MNOVXSKESA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](N[C@@H](C)CC(C)(C)C)c1nccs1 ZINC000384675532 367715153 /nfs/dbraw/zinc/71/51/53/367715153.db2.gz ZAFRKULQLJKGQB-QWRGUYRKSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@@H](N[C@@H](C)CC(C)(C)C)c1nccs1 ZINC000384675533 367715663 /nfs/dbraw/zinc/71/56/63/367715663.db2.gz ZAFRKULQLJKGQB-WDEREUQCSA-N 0 3 240.416 4.009 20 0 BIADHN C/C=C\CN[C@H](C)c1ccc2ccccc2c1 ZINC000384730987 398103715 /nfs/dbraw/zinc/10/37/15/398103715.db2.gz BDCANUHRBFITEG-DHCBQETCSA-N 0 3 225.335 4.067 20 0 BIADHN C/C=C/CN[C@H](C)c1ccc2ccccc2c1 ZINC000384730988 398103686 /nfs/dbraw/zinc/10/36/86/398103686.db2.gz BDCANUHRBFITEG-ITDFMYJTSA-N 0 3 225.335 4.067 20 0 BIADHN C/C=C/CN[C@@H](C)c1ccc2ccccc2c1 ZINC000384730989 398103443 /nfs/dbraw/zinc/10/34/43/398103443.db2.gz BDCANUHRBFITEG-OOPCZODUSA-N 0 3 225.335 4.067 20 0 BIADHN C/C=C\CN[C@@H](C)c1ccc2ccccc2c1 ZINC000384730990 398103619 /nfs/dbraw/zinc/10/36/19/398103619.db2.gz BDCANUHRBFITEG-SCOBNMCVSA-N 0 3 225.335 4.067 20 0 BIADHN CCC[C@H](CC)NCc1ccsc1Cl ZINC000388753781 352554375 /nfs/dbraw/zinc/55/43/75/352554375.db2.gz QBWZOGSXKOWUSJ-JTQLQIEISA-N 0 3 231.792 4.070 20 0 BIADHN CCC[C@@H](CC)NCc1ccsc1Cl ZINC000388753782 352554407 /nfs/dbraw/zinc/55/44/07/352554407.db2.gz QBWZOGSXKOWUSJ-SNVBAGLBSA-N 0 3 231.792 4.070 20 0 BIADHN C/C=C\CN[C@H](CC)c1ccc(Cl)s1 ZINC000389301031 541401506 /nfs/dbraw/zinc/40/15/06/541401506.db2.gz MAELNFLOBVKRJT-AZVKUDOFSA-N 0 3 229.776 4.018 20 0 BIADHN C/C=C/CN[C@H](CC)c1ccc(Cl)s1 ZINC000389301039 541401539 /nfs/dbraw/zinc/40/15/39/541401539.db2.gz MAELNFLOBVKRJT-HYYFJVDXSA-N 0 3 229.776 4.018 20 0 BIADHN C/C=C\CN[C@@H](CC)c1ccc(Cl)s1 ZINC000389301042 539015882 /nfs/dbraw/zinc/01/58/82/539015882.db2.gz MAELNFLOBVKRJT-LVCFMKKZSA-N 0 3 229.776 4.018 20 0 BIADHN C/C=C/CN[C@@H](CC)c1ccc(Cl)s1 ZINC000389301046 541424981 /nfs/dbraw/zinc/42/49/81/541424981.db2.gz MAELNFLOBVKRJT-SGRBOOSSSA-N 0 3 229.776 4.018 20 0 BIADHN CC1(C)CCC[C@H]1NCc1sccc1Cl ZINC000389405193 356490393 /nfs/dbraw/zinc/49/03/93/356490393.db2.gz KQSAXOXVAMWBAJ-LLVKDONJSA-N 0 3 243.803 4.070 20 0 BIADHN CC1(C)CCC[C@@H]1NCc1sccc1Cl ZINC000389405196 356490790 /nfs/dbraw/zinc/49/07/90/356490790.db2.gz KQSAXOXVAMWBAJ-NSHDSACASA-N 0 3 243.803 4.070 20 0 BIADHN C[C@@H](N[C@@H]1CCC1(C)C)c1csc(Cl)c1 ZINC000389573064 356993710 /nfs/dbraw/zinc/99/37/10/356993710.db2.gz COSZREIURWUJKN-PSASIEDQSA-N 0 3 243.803 4.241 20 0 BIADHN C[C@@H](N[C@H]1CCC1(C)C)c1csc(Cl)c1 ZINC000389573074 356993667 /nfs/dbraw/zinc/99/36/67/356993667.db2.gz COSZREIURWUJKN-SCZZXKLOSA-N 0 3 243.803 4.241 20 0 BIADHN C[C@H](N[C@@H]1CCC1(C)C)c1csc(Cl)c1 ZINC000389573080 356993733 /nfs/dbraw/zinc/99/37/33/356993733.db2.gz COSZREIURWUJKN-WCBMZHEXSA-N 0 3 243.803 4.241 20 0 BIADHN C[C@H](N[C@H]1CCC1(C)C)c1csc(Cl)c1 ZINC000389573082 356993590 /nfs/dbraw/zinc/99/35/90/356993590.db2.gz COSZREIURWUJKN-WPRPVWTQSA-N 0 3 243.803 4.241 20 0 BIADHN CC1(C)CCC[C@@H]1NCc1ccsc1Cl ZINC000389700495 357016620 /nfs/dbraw/zinc/01/66/20/357016620.db2.gz JRJGFIKMWKEUFE-JTQLQIEISA-N 0 3 243.803 4.070 20 0 BIADHN CC1(C)CCC[C@H]1NCc1ccsc1Cl ZINC000389700496 357016527 /nfs/dbraw/zinc/01/65/27/357016527.db2.gz JRJGFIKMWKEUFE-SNVBAGLBSA-N 0 3 243.803 4.070 20 0 BIADHN CC[C@H]1CCC[C@H]1NCc1ccsc1Cl ZINC000389834499 357049981 /nfs/dbraw/zinc/04/99/81/357049981.db2.gz CNHOBHRIEJTEKY-GXSJLCMTSA-N 0 3 243.803 4.070 20 0 BIADHN CC[C@@H]1CCC[C@@H]1NCc1ccsc1Cl ZINC000389834500 357049945 /nfs/dbraw/zinc/04/99/45/357049945.db2.gz CNHOBHRIEJTEKY-KOLCDFICSA-N 0 3 243.803 4.070 20 0 BIADHN CC[C@@H]1CCC[C@H]1NCc1ccsc1Cl ZINC000389834502 357049789 /nfs/dbraw/zinc/04/97/89/357049789.db2.gz CNHOBHRIEJTEKY-MWLCHTKSSA-N 0 3 243.803 4.070 20 0 BIADHN CC[C@H]1CCC[C@@H]1NCc1ccsc1Cl ZINC000389834503 357049908 /nfs/dbraw/zinc/04/99/08/357049908.db2.gz CNHOBHRIEJTEKY-ONGXEEELSA-N 0 3 243.803 4.070 20 0 BIADHN CC[C@@H](NC/C=C\Cl)c1ccc(Cl)cc1 ZINC000389894991 711095861 /nfs/dbraw/zinc/09/58/61/711095861.db2.gz YEYLQGVQMSCYJQ-CPWLGJMPSA-N 0 3 244.165 4.133 20 0 BIADHN CC[C@H](NC/C=C/Cl)c1ccc(Cl)cc1 ZINC000389894993 711096308 /nfs/dbraw/zinc/09/63/08/711096308.db2.gz YEYLQGVQMSCYJQ-DGDCUBRUSA-N 0 3 244.165 4.133 20 0 BIADHN CC[C@H](NC/C=C\Cl)c1ccc(Cl)cc1 ZINC000389894994 711096111 /nfs/dbraw/zinc/09/61/11/711096111.db2.gz YEYLQGVQMSCYJQ-KJPDOOANSA-N 0 3 244.165 4.133 20 0 BIADHN CC[C@@H](NC/C=C/Cl)c1ccc(Cl)cc1 ZINC000389894996 711095917 /nfs/dbraw/zinc/09/59/17/711095917.db2.gz YEYLQGVQMSCYJQ-STWLFGJUSA-N 0 3 244.165 4.133 20 0 BIADHN C[C@H](N[C@@H]1C=CCCCCC1)c1ccsc1 ZINC000390428485 397888894 /nfs/dbraw/zinc/88/88/94/397888894.db2.gz NQQIVOKXQWUQGN-GXTWGEPZSA-N 0 3 235.396 4.288 20 0 BIADHN C[C@H](N[C@H]1C=CCCCCC1)c1ccsc1 ZINC000390428488 398291846 /nfs/dbraw/zinc/29/18/46/398291846.db2.gz NQQIVOKXQWUQGN-JSGCOSHPSA-N 0 3 235.396 4.288 20 0 BIADHN C[C@@H](N[C@H]1C=CCCCCC1)c1ccsc1 ZINC000390428489 397888867 /nfs/dbraw/zinc/88/88/67/397888867.db2.gz NQQIVOKXQWUQGN-OCCSQVGLSA-N 0 3 235.396 4.288 20 0 BIADHN C[C@@H](N[C@@H]1C=CCCCCC1)c1ccsc1 ZINC000390428491 397888914 /nfs/dbraw/zinc/88/89/14/397888914.db2.gz NQQIVOKXQWUQGN-TZMCWYRMSA-N 0 3 235.396 4.288 20 0 BIADHN CSc1ccccc1[C@H](C)NCC=C(C)C ZINC000390466342 259390119 /nfs/dbraw/zinc/39/01/19/259390119.db2.gz HVVHSFXDDXRITR-LBPRGKRZSA-N 0 3 235.396 4.025 20 0 BIADHN C/C=C\CN[C@H](C)c1ccc(C(C)C)cc1 ZINC000390513652 371211687 /nfs/dbraw/zinc/21/16/87/371211687.db2.gz CKJCUQPFDYZSDA-CFHLNLSMSA-N 0 3 217.356 4.037 20 0 BIADHN C/C=C/CN[C@@H](C)c1ccc(C(C)C)cc1 ZINC000390513653 371212358 /nfs/dbraw/zinc/21/23/58/371212358.db2.gz CKJCUQPFDYZSDA-GFUIURDCSA-N 0 3 217.356 4.037 20 0 BIADHN C/C=C\CN[C@@H](C)c1ccc(C(C)C)cc1 ZINC000390513654 371212020 /nfs/dbraw/zinc/21/20/20/371212020.db2.gz CKJCUQPFDYZSDA-SZZPACECSA-N 0 3 217.356 4.037 20 0 BIADHN C/C=C/CN[C@H](C)c1ccc(C(C)C)cc1 ZINC000390513655 371210447 /nfs/dbraw/zinc/21/04/47/371210447.db2.gz CKJCUQPFDYZSDA-URWSZGRFSA-N 0 3 217.356 4.037 20 0 BIADHN C/C=C/CN[C@@H](C)c1ccc(SCC)cc1 ZINC000390669114 539027139 /nfs/dbraw/zinc/02/71/39/539027139.db2.gz UYXFXHPXSWGFTG-FUEXJSSKSA-N 0 3 235.396 4.025 20 0 BIADHN C/C=C/CN[C@H](C)c1ccc(SCC)cc1 ZINC000390669116 539026919 /nfs/dbraw/zinc/02/69/19/539026919.db2.gz UYXFXHPXSWGFTG-FVOPLDGLSA-N 0 3 235.396 4.025 20 0 BIADHN C/C=C\CN[C@@H](C)c1ccc(SCC)cc1 ZINC000390669118 539027107 /nfs/dbraw/zinc/02/71/07/539027107.db2.gz UYXFXHPXSWGFTG-RNZFLTOJSA-N 0 3 235.396 4.025 20 0 BIADHN C/C=C\CN[C@H](C)c1ccc(SCC)cc1 ZINC000390669121 539026971 /nfs/dbraw/zinc/02/69/71/539026971.db2.gz UYXFXHPXSWGFTG-TXNVCOODSA-N 0 3 235.396 4.025 20 0 BIADHN CC[C@@H](NCCC(C)(C)CC)c1nccs1 ZINC000390746976 259399301 /nfs/dbraw/zinc/39/93/01/259399301.db2.gz ADGNEEBWFLLGBV-LLVKDONJSA-N 0 3 240.416 4.010 20 0 BIADHN CC[C@H](NCCC(C)(C)CC)c1nccs1 ZINC000390746978 259399706 /nfs/dbraw/zinc/39/97/06/259399706.db2.gz ADGNEEBWFLLGBV-NSHDSACASA-N 0 3 240.416 4.010 20 0 BIADHN Cc1ccc([C@@H](C)NCC2(CC(C)C)CC2)o1 ZINC000391960451 353816523 /nfs/dbraw/zinc/81/65/23/353816523.db2.gz YXLLXAPCADBIRG-CYBMUJFWSA-N 0 3 235.371 4.065 20 0 BIADHN Cc1ccc([C@H](C)NCC2(CC(C)C)CC2)o1 ZINC000391960452 357136627 /nfs/dbraw/zinc/13/66/27/357136627.db2.gz YXLLXAPCADBIRG-ZDUSSCGKSA-N 0 3 235.371 4.065 20 0 BIADHN Cc1csc(CN[C@H](C)c2ccc(F)cc2)c1 ZINC000393329725 343830253 /nfs/dbraw/zinc/83/02/53/343830253.db2.gz ODPDZHRCCYLJGU-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1csc(CN[C@@H](C)c2ccc(F)cc2)c1 ZINC000393329726 343830154 /nfs/dbraw/zinc/83/01/54/343830154.db2.gz ODPDZHRCCYLJGU-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN CCC[C@@H](N[C@@H]1CCC[C@@H]1F)c1ccsc1 ZINC000393444540 357308930 /nfs/dbraw/zinc/30/89/30/357308930.db2.gz RCAAQRACOCNPMI-YNEHKIRRSA-N 0 3 241.375 4.070 20 0 BIADHN CCC[C@@H](N[C@H]1CCC[C@H]1F)c1ccsc1 ZINC000393568068 488091943 /nfs/dbraw/zinc/09/19/43/488091943.db2.gz RCAAQRACOCNPMI-UPJWGTAASA-N 0 3 241.375 4.070 20 0 BIADHN CCC1(CNCc2ccsc2Cl)CCC1 ZINC000393615440 259361540 /nfs/dbraw/zinc/36/15/40/259361540.db2.gz YNRNPSDAGJQSHL-UHFFFAOYSA-N 0 3 243.803 4.071 20 0 BIADHN C[C@H](N[C@H]1C[C@@H](C)[C@H]1C)c1ccccc1Cl ZINC000393758014 388441358 /nfs/dbraw/zinc/44/13/58/388441358.db2.gz YGYBLCZJVFEMEP-PUHVVEEASA-N 0 3 237.774 4.035 20 0 BIADHN C[C@H](N[C@H]1C[C@@H](C)[C@@H]1C)c1ccccc1Cl ZINC000393758015 388441188 /nfs/dbraw/zinc/44/11/88/388441188.db2.gz YGYBLCZJVFEMEP-ZHPDPMBESA-N 0 3 237.774 4.035 20 0 BIADHN C[C@H](NCCC1CCCCCC1)c1ccccn1 ZINC000394586620 582995423 /nfs/dbraw/zinc/99/54/23/582995423.db2.gz VFQWPAGLVQMKMM-AWEZNQCLSA-N 0 3 246.398 4.093 20 0 BIADHN C[C@@H](NCCC1CCCCCC1)c1ccccn1 ZINC000394586622 582995588 /nfs/dbraw/zinc/99/55/88/582995588.db2.gz VFQWPAGLVQMKMM-CQSZACIVSA-N 0 3 246.398 4.093 20 0 BIADHN C[C@H](NCCCC1CCCCC1)c1ccccn1 ZINC000395180114 386964741 /nfs/dbraw/zinc/96/47/41/386964741.db2.gz DSRLWZRNWMPAIS-AWEZNQCLSA-N 0 3 246.398 4.093 20 0 BIADHN C[C@@H](NCCCC1CCCCC1)c1ccccn1 ZINC000395180117 386963027 /nfs/dbraw/zinc/96/30/27/386963027.db2.gz DSRLWZRNWMPAIS-CQSZACIVSA-N 0 3 246.398 4.093 20 0 BIADHN Cc1ccoc1CNCCCC1CCCCC1 ZINC000395187505 386969008 /nfs/dbraw/zinc/96/90/08/386969008.db2.gz WFNTWZAVYGDIIM-UHFFFAOYSA-N 0 3 235.371 4.038 20 0 BIADHN Cc1ccc(CNCCCC2CCCCC2)o1 ZINC000395187817 410840101 /nfs/dbraw/zinc/84/01/01/410840101.db2.gz WPSIQWDVSFWSLY-UHFFFAOYSA-N 0 3 235.371 4.038 20 0 BIADHN C[C@H](CCC1CC1)NCc1ccc([C@H]2C[C@H]2C)o1 ZINC000398039151 322830655 /nfs/dbraw/zinc/83/06/55/322830655.db2.gz ORDPVSLJXVXRCK-JMSVASOKSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@H](CCC1CC1)NCc1ccc([C@@H]2C[C@H]2C)o1 ZINC000398039152 322830684 /nfs/dbraw/zinc/83/06/84/322830684.db2.gz ORDPVSLJXVXRCK-LALPHHSUSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@H](CCC1CC1)NCc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000398039154 322830651 /nfs/dbraw/zinc/83/06/51/322830651.db2.gz ORDPVSLJXVXRCK-YWPYICTPSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@H](CCC1CC1)NCc1ccc([C@H]2C[C@@H]2C)o1 ZINC000398039156 388515900 /nfs/dbraw/zinc/51/59/00/388515900.db2.gz ORDPVSLJXVXRCK-ZOWXZIJZSA-N 0 3 247.382 4.071 20 0 BIADHN C[C@H](c1ccco1)N(C)CCCC(C)(C)C ZINC000410334298 191028218 /nfs/dbraw/zinc/02/82/18/191028218.db2.gz DGEJOVNKLSZSIW-GFCCVEGCSA-N 0 3 223.360 4.099 20 0 BIADHN C[C@@H](c1ccco1)N(C)CCCC(C)(C)C ZINC000410334299 191028193 /nfs/dbraw/zinc/02/81/93/191028193.db2.gz DGEJOVNKLSZSIW-LBPRGKRZSA-N 0 3 223.360 4.099 20 0 BIADHN CCCN(CCC)[C@H](C)c1nc2ccccc2o1 ZINC000411170848 191166647 /nfs/dbraw/zinc/16/66/47/191166647.db2.gz YCDFPZQPUOAYCS-GFCCVEGCSA-N 0 3 246.354 4.011 20 0 BIADHN CCCN(CCC)[C@@H](C)c1nc2ccccc2o1 ZINC000411170856 191165517 /nfs/dbraw/zinc/16/55/17/191165517.db2.gz YCDFPZQPUOAYCS-LBPRGKRZSA-N 0 3 246.354 4.011 20 0 BIADHN CCCC[C@@H](C)[C@@H](C)N[C@@H](C)c1nccs1 ZINC000414222641 386074905 /nfs/dbraw/zinc/07/49/05/386074905.db2.gz NKWYZNJBPCTLJE-UTUOFQBUSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC[C@@H](C)[C@H](C)N[C@@H](C)c1nccs1 ZINC000414222642 386076052 /nfs/dbraw/zinc/07/60/52/386076052.db2.gz NKWYZNJBPCTLJE-WOPDTQHZSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](N[C@@H]1CCCC[C@H]1F)c1ccsc1 ZINC000414319183 386117407 /nfs/dbraw/zinc/11/74/07/386117407.db2.gz YTXCFVQNYUFEIE-FRRDWIJNSA-N 0 3 241.375 4.070 20 0 BIADHN CC[C@@H](N[C@@H]1CCCC[C@H]1F)c1ccsc1 ZINC000414319184 386118860 /nfs/dbraw/zinc/11/88/60/386118860.db2.gz YTXCFVQNYUFEIE-JHJVBQTASA-N 0 3 241.375 4.070 20 0 BIADHN Cc1occc1CN(Cc1cccs1)C(C)C ZINC000414366815 386159206 /nfs/dbraw/zinc/15/92/06/386159206.db2.gz CDZZHCBWCVYZFZ-UHFFFAOYSA-N 0 3 249.379 4.060 20 0 BIADHN CCSc1ccccc1[C@@H](C)N[C@@H]1CC12CC2 ZINC000424326179 385166972 /nfs/dbraw/zinc/16/69/72/385166972.db2.gz OLYXWARBNPJSTD-BXUZGUMPSA-N 0 3 247.407 4.002 20 0 BIADHN CCSc1ccccc1[C@H](C)N[C@H]1CC12CC2 ZINC000424326180 385167087 /nfs/dbraw/zinc/16/70/87/385167087.db2.gz OLYXWARBNPJSTD-FZMZJTMJSA-N 0 3 247.407 4.002 20 0 BIADHN CCSc1ccccc1[C@@H](C)N[C@H]1CC12CC2 ZINC000424326181 385167013 /nfs/dbraw/zinc/16/70/13/385167013.db2.gz OLYXWARBNPJSTD-RISCZKNCSA-N 0 3 247.407 4.002 20 0 BIADHN CCSc1ccccc1[C@H](C)N[C@@H]1CC12CC2 ZINC000424326182 384938086 /nfs/dbraw/zinc/93/80/86/384938086.db2.gz OLYXWARBNPJSTD-SMDDNHRTSA-N 0 3 247.407 4.002 20 0 BIADHN CCN(CCC1CC1)Cc1cc(Cl)cs1 ZINC000426154268 387542576 /nfs/dbraw/zinc/54/25/76/387542576.db2.gz QRBHMMKUBYYICL-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CN(Cc1ccsc1Cl)C1(C)CCCC1 ZINC000426519857 191096205 /nfs/dbraw/zinc/09/62/05/191096205.db2.gz AZAKDBFVFPJNQG-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN C[C@@H](CCN[C@@H](C)c1ccccn1)CC(C)(C)C ZINC000426992333 191051446 /nfs/dbraw/zinc/05/14/46/191051446.db2.gz UOYDKPQGEVFJSI-KBPBESRZSA-N 0 3 248.414 4.195 20 0 BIADHN C[C@H](CCN[C@@H](C)c1ccccn1)CC(C)(C)C ZINC000426992334 191051357 /nfs/dbraw/zinc/05/13/57/191051357.db2.gz UOYDKPQGEVFJSI-KGLIPLIRSA-N 0 3 248.414 4.195 20 0 BIADHN C[C@@H](CCN[C@H](C)c1ccccn1)CC(C)(C)C ZINC000426992335 191051119 /nfs/dbraw/zinc/05/11/19/191051119.db2.gz UOYDKPQGEVFJSI-UONOGXRCSA-N 0 3 248.414 4.195 20 0 BIADHN C[C@@H](NCC[C@@H](C)CC(C)(C)C)c1ccccn1 ZINC000426992336 191050929 /nfs/dbraw/zinc/05/09/29/191050929.db2.gz UOYDKPQGEVFJSI-ZIAGYGMSSA-N 0 3 248.414 4.195 20 0 BIADHN CC[C@@H](F)CN(C(C)C)[C@@H](C)c1ccccc1 ZINC000428830066 201044178 /nfs/dbraw/zinc/04/41/78/201044178.db2.gz ALXROYGEJMWENA-DZGCQCFKSA-N 0 3 237.362 4.206 20 0 BIADHN CC[C@H](F)CN(C(C)C)[C@H](C)c1ccccc1 ZINC000428830068 201044127 /nfs/dbraw/zinc/04/41/27/201044127.db2.gz ALXROYGEJMWENA-HIFRSBDPSA-N 0 3 237.362 4.206 20 0 BIADHN CC[C@@H](F)CN(C(C)C)[C@H](C)c1ccccc1 ZINC000428830069 201042677 /nfs/dbraw/zinc/04/26/77/201042677.db2.gz ALXROYGEJMWENA-UKRRQHHQSA-N 0 3 237.362 4.206 20 0 BIADHN CC[C@H](F)CN(C(C)C)[C@@H](C)c1ccccc1 ZINC000428830071 201043190 /nfs/dbraw/zinc/04/31/90/201043190.db2.gz ALXROYGEJMWENA-ZFWWWQNUSA-N 0 3 237.362 4.206 20 0 BIADHN CC[C@H]1CCN1Cc1ccc(SC(C)C)cc1 ZINC000429283097 201092180 /nfs/dbraw/zinc/09/21/80/201092180.db2.gz FQGWMXDXJZZRKT-AWEZNQCLSA-N 0 3 249.423 4.171 20 0 BIADHN CC[C@@H]1CCN1Cc1ccc(SC(C)C)cc1 ZINC000429283098 201091667 /nfs/dbraw/zinc/09/16/67/201091667.db2.gz FQGWMXDXJZZRKT-CQSZACIVSA-N 0 3 249.423 4.171 20 0 BIADHN Cc1ccoc1CN(C)[C@@H](C)c1cccc(C)c1 ZINC000429376580 201102913 /nfs/dbraw/zinc/10/29/13/201102913.db2.gz GECDEDZGUSNJIY-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccoc1CN(C)[C@H](C)c1cccc(C)c1 ZINC000429376582 201104110 /nfs/dbraw/zinc/10/41/10/201104110.db2.gz GECDEDZGUSNJIY-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(F)c(CN(C2CCC2)C2CCC2)c1 ZINC000430153405 201148491 /nfs/dbraw/zinc/14/84/91/201148491.db2.gz VMRYPDYXXGXGIB-UHFFFAOYSA-N 0 3 247.357 4.041 20 0 BIADHN CC[C@@H]1CCCCN1c1ccnc2ccccc21 ZINC000432142847 387763589 /nfs/dbraw/zinc/76/35/89/387763589.db2.gz JKSWFTCIPGIJJS-CYBMUJFWSA-N 0 3 240.350 4.004 20 0 BIADHN CC[C@H]1CCCCN1c1ccnc2ccccc21 ZINC000432142848 387762381 /nfs/dbraw/zinc/76/23/81/387762381.db2.gz JKSWFTCIPGIJJS-ZDUSSCGKSA-N 0 3 240.350 4.004 20 0 BIADHN CN(Cc1ccc(Cl)s1)CC1(C)CCC1 ZINC000432940671 387846514 /nfs/dbraw/zinc/84/65/14/387846514.db2.gz VTVKUTJAEWEAAM-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN Cc1ccc(CN2CC[C@H]2c2ccccc2)s1 ZINC000434983203 201248797 /nfs/dbraw/zinc/24/87/97/201248797.db2.gz POZFCGZMPSTHTN-HNNXBMFYSA-N 0 3 243.375 4.004 20 0 BIADHN Cc1ccc(CN2CC[C@@H]2c2ccccc2)s1 ZINC000434983204 201247043 /nfs/dbraw/zinc/24/70/43/201247043.db2.gz POZFCGZMPSTHTN-OAHLLOKOSA-N 0 3 243.375 4.004 20 0 BIADHN Cc1ccsc1CN1CC[C@H]1c1ccccc1 ZINC000434984472 201247239 /nfs/dbraw/zinc/24/72/39/201247239.db2.gz XVGNUWPETHDLHD-AWEZNQCLSA-N 0 3 243.375 4.004 20 0 BIADHN Cc1ccsc1CN1CC[C@@H]1c1ccccc1 ZINC000434984474 201248233 /nfs/dbraw/zinc/24/82/33/201248233.db2.gz XVGNUWPETHDLHD-CQSZACIVSA-N 0 3 243.375 4.004 20 0 BIADHN CC[C@@H](c1ccccc1)N1Cc2ccccc2C1 ZINC000436128368 201310253 /nfs/dbraw/zinc/31/02/53/201310253.db2.gz UFQYYSCSLIODPW-KRWDZBQOSA-N 0 3 237.346 4.154 20 0 BIADHN CC[C@H](c1ccccc1)N1Cc2ccccc2C1 ZINC000436128371 201309710 /nfs/dbraw/zinc/30/97/10/201309710.db2.gz UFQYYSCSLIODPW-QGZVFWFLSA-N 0 3 237.346 4.154 20 0 BIADHN Cc1cccc([C@H](C)N2Cc3ccccc3C2)c1 ZINC000436134415 201311126 /nfs/dbraw/zinc/31/11/26/201311126.db2.gz SPRVNJYKPAUXBN-AWEZNQCLSA-N 0 3 237.346 4.072 20 0 BIADHN Cc1cccc([C@@H](C)N2Cc3ccccc3C2)c1 ZINC000436134416 201309982 /nfs/dbraw/zinc/30/99/82/201309982.db2.gz SPRVNJYKPAUXBN-CQSZACIVSA-N 0 3 237.346 4.072 20 0 BIADHN CC1=CCCN([C@H](C)c2cccc(Cl)c2)C1 ZINC000436259614 201317418 /nfs/dbraw/zinc/31/74/18/201317418.db2.gz LGHNBOSNMFXAPN-GFCCVEGCSA-N 0 3 235.758 4.053 20 0 BIADHN CC1=CCCN([C@@H](C)c2cccc(Cl)c2)C1 ZINC000436259615 201316642 /nfs/dbraw/zinc/31/66/42/201316642.db2.gz LGHNBOSNMFXAPN-LBPRGKRZSA-N 0 3 235.758 4.053 20 0 BIADHN CC1=CCCN([C@H](C)c2ccccc2Cl)C1 ZINC000436260785 201317769 /nfs/dbraw/zinc/31/77/69/201317769.db2.gz IRVQHDDQKZRYOX-GFCCVEGCSA-N 0 3 235.758 4.053 20 0 BIADHN CC1=CCCN([C@@H](C)c2ccccc2Cl)C1 ZINC000436260786 201315559 /nfs/dbraw/zinc/31/55/59/201315559.db2.gz IRVQHDDQKZRYOX-LBPRGKRZSA-N 0 3 235.758 4.053 20 0 BIADHN CC1=CCCN(Cc2csc3ccccc23)C1 ZINC000436261105 201316758 /nfs/dbraw/zinc/31/67/58/201316758.db2.gz OCERBBJSVCRWEQ-UHFFFAOYSA-N 0 3 243.375 4.053 20 0 BIADHN CC1=CCCN(Cc2cc3ccccc3s2)C1 ZINC000436269002 201316242 /nfs/dbraw/zinc/31/62/42/201316242.db2.gz JHHLEPDIFSNNGJ-UHFFFAOYSA-N 0 3 243.375 4.053 20 0 BIADHN C[C@@H](NCCF)c1ccc(-c2ccccc2)s1 ZINC000436311184 201321117 /nfs/dbraw/zinc/32/11/17/201321117.db2.gz TZNLETQVBNPPGS-LLVKDONJSA-N 0 3 249.354 4.035 20 0 BIADHN C[C@H](NCCF)c1ccc(-c2ccccc2)s1 ZINC000436311185 201320583 /nfs/dbraw/zinc/32/05/83/201320583.db2.gz TZNLETQVBNPPGS-NSHDSACASA-N 0 3 249.354 4.035 20 0 BIADHN CSc1ccc([C@@H](C)N[C@H]2C=CCCC2)cc1 ZINC000439482925 388002979 /nfs/dbraw/zinc/00/29/79/388002979.db2.gz ZOMTUMGYDDMORO-OCCSQVGLSA-N 0 3 247.407 4.168 20 0 BIADHN CSc1ccc([C@@H](C)N[C@@H]2C=CCCC2)cc1 ZINC000439482926 388001777 /nfs/dbraw/zinc/00/17/77/388001777.db2.gz ZOMTUMGYDDMORO-TZMCWYRMSA-N 0 3 247.407 4.168 20 0 BIADHN CC[C@@H](F)CN[C@@H](C)c1ccc2ccccc2c1 ZINC000440595810 388059208 /nfs/dbraw/zinc/05/92/08/388059208.db2.gz IXWSCCPCAIVAEQ-BLLLJJGKSA-N 0 3 245.341 4.239 20 0 BIADHN CC[C@H](F)CN[C@@H](C)c1ccc2ccccc2c1 ZINC000440595811 388058907 /nfs/dbraw/zinc/05/89/07/388058907.db2.gz IXWSCCPCAIVAEQ-LRDDRELGSA-N 0 3 245.341 4.239 20 0 BIADHN CC[C@@H](F)CN[C@H](C)c1ccc2ccccc2c1 ZINC000440595812 388059858 /nfs/dbraw/zinc/05/98/58/388059858.db2.gz IXWSCCPCAIVAEQ-MLGOLLRUSA-N 0 3 245.341 4.239 20 0 BIADHN CC[C@H](F)CN[C@H](C)c1ccc2ccccc2c1 ZINC000440595813 388059336 /nfs/dbraw/zinc/05/93/36/388059336.db2.gz IXWSCCPCAIVAEQ-WBMJQRKESA-N 0 3 245.341 4.239 20 0 BIADHN CSc1ccccc1[C@H](C)N[C@@H]1C=CCCC1 ZINC000440649076 388062943 /nfs/dbraw/zinc/06/29/43/388062943.db2.gz RHPZXRAGTRIMJI-QWHCGFSZSA-N 0 3 247.407 4.168 20 0 BIADHN CSc1ccccc1[C@H](C)N[C@H]1C=CCCC1 ZINC000440649079 388063552 /nfs/dbraw/zinc/06/35/52/388063552.db2.gz RHPZXRAGTRIMJI-STQMWFEESA-N 0 3 247.407 4.168 20 0 BIADHN CC[C@H](F)CN(C)Cc1cccc2ccccc21 ZINC000440701332 388070603 /nfs/dbraw/zinc/07/06/03/388070603.db2.gz KVTXOKBEHOWYFT-HNNXBMFYSA-N 0 3 245.341 4.020 20 0 BIADHN CC[C@@H](F)CN(C)Cc1cccc2ccccc21 ZINC000440701333 388071791 /nfs/dbraw/zinc/07/17/91/388071791.db2.gz KVTXOKBEHOWYFT-OAHLLOKOSA-N 0 3 245.341 4.020 20 0 BIADHN CC[C@@H](F)CN(Cc1ccc(C)s1)C(C)C ZINC000440711058 387678434 /nfs/dbraw/zinc/67/84/34/387678434.db2.gz MVLSPESWMOEKOI-GFCCVEGCSA-N 0 3 243.391 4.015 20 0 BIADHN CC[C@H](F)CN(Cc1ccc(C)s1)C(C)C ZINC000440711062 388064641 /nfs/dbraw/zinc/06/46/41/388064641.db2.gz MVLSPESWMOEKOI-LBPRGKRZSA-N 0 3 243.391 4.015 20 0 BIADHN CC[C@H](F)CN[C@@H](c1ccccc1)C(C)(C)C ZINC000440775171 387693834 /nfs/dbraw/zinc/69/38/34/387693834.db2.gz MEEAAVUGTPRVDE-KBPBESRZSA-N 0 3 237.362 4.112 20 0 BIADHN CC[C@@H](F)CN[C@@H](c1ccccc1)C(C)(C)C ZINC000440775172 387694212 /nfs/dbraw/zinc/69/42/12/387694212.db2.gz MEEAAVUGTPRVDE-KGLIPLIRSA-N 0 3 237.362 4.112 20 0 BIADHN CC[C@H](F)CN[C@H](c1ccccc1)C(C)(C)C ZINC000440775173 387693296 /nfs/dbraw/zinc/69/32/96/387693296.db2.gz MEEAAVUGTPRVDE-UONOGXRCSA-N 0 3 237.362 4.112 20 0 BIADHN CC[C@@H](F)CN[C@H](c1ccccc1)C(C)(C)C ZINC000440775174 387693270 /nfs/dbraw/zinc/69/32/70/387693270.db2.gz MEEAAVUGTPRVDE-ZIAGYGMSSA-N 0 3 237.362 4.112 20 0 BIADHN CC[C@@H](F)CN[C@@H](C)c1cccc2ccccc21 ZINC000440804436 387705210 /nfs/dbraw/zinc/70/52/10/387705210.db2.gz XLKKGRNWYGPYKX-GXTWGEPZSA-N 0 3 245.341 4.239 20 0 BIADHN CC[C@H](F)CN[C@@H](C)c1cccc2ccccc21 ZINC000440804437 386168743 /nfs/dbraw/zinc/16/87/43/386168743.db2.gz XLKKGRNWYGPYKX-JSGCOSHPSA-N 0 3 245.341 4.239 20 0 BIADHN CC[C@H](F)CN[C@H](C)c1cccc2ccccc21 ZINC000440804438 386169547 /nfs/dbraw/zinc/16/95/47/386169547.db2.gz XLKKGRNWYGPYKX-OCCSQVGLSA-N 0 3 245.341 4.239 20 0 BIADHN CC[C@@H](F)CN[C@H](C)c1cccc2ccccc21 ZINC000440804439 386168169 /nfs/dbraw/zinc/16/81/69/386168169.db2.gz XLKKGRNWYGPYKX-TZMCWYRMSA-N 0 3 245.341 4.239 20 0 BIADHN CCC(C)(C)CCN(C)[C@H](C)c1ccco1 ZINC000441281022 387740770 /nfs/dbraw/zinc/74/07/70/387740770.db2.gz FQHGONBLVCLTHV-GFCCVEGCSA-N 0 3 223.360 4.099 20 0 BIADHN CCC(C)(C)CCN(C)[C@@H](C)c1ccco1 ZINC000441281023 387742468 /nfs/dbraw/zinc/74/24/68/387742468.db2.gz FQHGONBLVCLTHV-LBPRGKRZSA-N 0 3 223.360 4.099 20 0 BIADHN Clc1ccc(CN2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000441436912 387759256 /nfs/dbraw/zinc/75/92/56/387759256.db2.gz PMRNHKQRKGSVDT-DZGCQCFKSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1ccc(CN2CCC[C@H]3CCC[C@@H]32)cc1 ZINC000441436915 387760497 /nfs/dbraw/zinc/76/04/97/387760497.db2.gz PMRNHKQRKGSVDT-HIFRSBDPSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1ccc(CN2CCC[C@H]3CCC[C@H]32)cc1 ZINC000441436917 387761112 /nfs/dbraw/zinc/76/11/12/387761112.db2.gz PMRNHKQRKGSVDT-UKRRQHHQSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1ccc(CN2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000441436918 387759437 /nfs/dbraw/zinc/75/94/37/387759437.db2.gz PMRNHKQRKGSVDT-ZFWWWQNUSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1cccc(CN2CCC[C@@H]3CCC[C@H]32)c1 ZINC000441438189 387759574 /nfs/dbraw/zinc/75/95/74/387759574.db2.gz RITCTJNLSIPQOX-DZGCQCFKSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1cccc(CN2CCC[C@H]3CCC[C@@H]32)c1 ZINC000441438191 387759702 /nfs/dbraw/zinc/75/97/02/387759702.db2.gz RITCTJNLSIPQOX-HIFRSBDPSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1cccc(CN2CCC[C@H]3CCC[C@H]32)c1 ZINC000441438193 387760416 /nfs/dbraw/zinc/76/04/16/387760416.db2.gz RITCTJNLSIPQOX-UKRRQHHQSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1cccc(CN2CCC[C@@H]3CCC[C@@H]32)c1 ZINC000441438195 387760166 /nfs/dbraw/zinc/76/01/66/387760166.db2.gz RITCTJNLSIPQOX-ZFWWWQNUSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1ccccc1CN1CCC[C@H]2CCC[C@@H]21 ZINC000441443262 201553918 /nfs/dbraw/zinc/55/39/18/201553918.db2.gz FMCPLVRSZOEEFC-DOMZBBRYSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1ccccc1CN1CCC[C@H]2CCC[C@H]21 ZINC000441443264 387760667 /nfs/dbraw/zinc/76/06/67/387760667.db2.gz FMCPLVRSZOEEFC-IUODEOHRSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1ccccc1CN1CCC[C@@H]2CCC[C@H]21 ZINC000441443265 387760644 /nfs/dbraw/zinc/76/06/44/387760644.db2.gz FMCPLVRSZOEEFC-SWLSCSKDSA-N 0 3 249.785 4.105 20 0 BIADHN Clc1ccccc1CN1CCC[C@@H]2CCC[C@@H]21 ZINC000441443267 387759230 /nfs/dbraw/zinc/75/92/30/387759230.db2.gz FMCPLVRSZOEEFC-WFASDCNBSA-N 0 3 249.785 4.105 20 0 BIADHN C[C@@H](N[C@H]1C=CCCC1)c1cc2ccccc2o1 ZINC000442895298 193002052 /nfs/dbraw/zinc/00/20/52/193002052.db2.gz UFPNWSQUQNFBFI-OCCSQVGLSA-N 0 3 241.334 4.192 20 0 BIADHN C[C@@H](N[C@@H]1C=CCCC1)c1cc2ccccc2o1 ZINC000442895301 387008884 /nfs/dbraw/zinc/00/88/84/387008884.db2.gz UFPNWSQUQNFBFI-TZMCWYRMSA-N 0 3 241.334 4.192 20 0 BIADHN CN(Cc1ccc(-c2cccs2)cc1)C1CC1 ZINC000444589471 193051162 /nfs/dbraw/zinc/05/11/62/193051162.db2.gz JJULKIFKXMNYBY-UHFFFAOYSA-N 0 3 243.375 4.009 20 0 BIADHN CN(Cc1ccc(-c2ccsc2)cc1)C1CC1 ZINC000444593106 193052445 /nfs/dbraw/zinc/05/24/45/193052445.db2.gz QTRVWADTALXPKM-UHFFFAOYSA-N 0 3 243.375 4.009 20 0 BIADHN CCc1ccccc1CN(C)[C@H](C)c1ccco1 ZINC000445799501 387968686 /nfs/dbraw/zinc/96/86/86/387968686.db2.gz WUTNOJZGVDXTCE-CYBMUJFWSA-N 0 3 243.350 4.035 20 0 BIADHN CCc1ccccc1CN(C)[C@@H](C)c1ccco1 ZINC000445799502 387967448 /nfs/dbraw/zinc/96/74/48/387967448.db2.gz WUTNOJZGVDXTCE-ZDUSSCGKSA-N 0 3 243.350 4.035 20 0 BIADHN C[C@@H](N[C@@H](C)CC1CCCCC1)c1ccco1 ZINC000447578248 201724956 /nfs/dbraw/zinc/72/49/56/201724956.db2.gz KBKNYMVRVGFFPG-QWHCGFSZSA-N 0 3 235.371 4.289 20 0 BIADHN C[C@@H](CC1CCCCC1)N[C@@H](C)c1ccco1 ZINC000447578249 388079588 /nfs/dbraw/zinc/07/95/88/388079588.db2.gz KBKNYMVRVGFFPG-STQMWFEESA-N 0 3 235.371 4.289 20 0 BIADHN C[C@@H](NC1CC2(CCC2)C1)c1ccccc1Cl ZINC000448054707 384833228 /nfs/dbraw/zinc/83/32/28/384833228.db2.gz CMSBLPWYZAMFBY-LLVKDONJSA-N 0 3 249.785 4.323 20 0 BIADHN C[C@H](NC1CC2(CCC2)C1)c1ccccc1Cl ZINC000448054708 384835568 /nfs/dbraw/zinc/83/55/68/384835568.db2.gz CMSBLPWYZAMFBY-NSHDSACASA-N 0 3 249.785 4.323 20 0 BIADHN CCC1(N[C@H](C)c2cc3ccccc3o2)CC1 ZINC000448552545 201244023 /nfs/dbraw/zinc/24/40/23/201244023.db2.gz HQYKIKOKTHFFFB-LLVKDONJSA-N 0 3 229.323 4.026 20 0 BIADHN CCC1(N[C@@H](C)c2cc3ccccc3o2)CC1 ZINC000448552546 201242905 /nfs/dbraw/zinc/24/29/05/201242905.db2.gz HQYKIKOKTHFFFB-NSHDSACASA-N 0 3 229.323 4.026 20 0 BIADHN Cc1cc([C@@H](C)NCc2cccs2)ccc1F ZINC000449372435 388185518 /nfs/dbraw/zinc/18/55/18/388185518.db2.gz HWSDCHGGTDUAEW-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc([C@@H](C)NCc2ccsc2)ccc1F ZINC000449372682 388184877 /nfs/dbraw/zinc/18/48/77/388184877.db2.gz KQJWHSDWARNHIQ-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN CCC[C@H](NCC1=CCCCC1)c1ccccn1 ZINC000453260305 388027731 /nfs/dbraw/zinc/02/77/31/388027731.db2.gz XPMSTXBTQCYISC-HNNXBMFYSA-N 0 3 244.382 4.013 20 0 BIADHN CCC[C@@H](NCC1=CCCCC1)c1ccccn1 ZINC000453260306 202723508 /nfs/dbraw/zinc/72/35/08/202723508.db2.gz XPMSTXBTQCYISC-OAHLLOKOSA-N 0 3 244.382 4.013 20 0 BIADHN CCC[C@H](NCC1=CCCCC1)c1cccnc1 ZINC000453262477 388029013 /nfs/dbraw/zinc/02/90/13/388029013.db2.gz ZXUJKYMVZUAVNA-INIZCTEOSA-N 0 3 244.382 4.013 20 0 BIADHN CCC[C@@H](NCC1=CCCCC1)c1cccnc1 ZINC000453262478 388028086 /nfs/dbraw/zinc/02/80/86/388028086.db2.gz ZXUJKYMVZUAVNA-MRXNPFEDSA-N 0 3 244.382 4.013 20 0 BIADHN CCC[C@@H](N[C@H](C)c1nccs1)C(C)(C)C ZINC000453286830 388034202 /nfs/dbraw/zinc/03/42/02/388034202.db2.gz IMHUYZWUSSUQCK-GHMZBOCLSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](N[C@H](C)c1nccs1)C(C)(C)C ZINC000453286832 388034797 /nfs/dbraw/zinc/03/47/97/388034797.db2.gz IMHUYZWUSSUQCK-MNOVXSKESA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](N[C@@H](C)c1nccs1)C(C)(C)C ZINC000453286834 388034706 /nfs/dbraw/zinc/03/47/06/388034706.db2.gz IMHUYZWUSSUQCK-QWRGUYRKSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@@H](N[C@@H](C)c1nccs1)C(C)(C)C ZINC000453286837 388034451 /nfs/dbraw/zinc/03/44/51/388034451.db2.gz IMHUYZWUSSUQCK-WDEREUQCSA-N 0 3 240.416 4.009 20 0 BIADHN Cc1ccoc1CNCCCCC1CCCC1 ZINC000462744920 388271308 /nfs/dbraw/zinc/27/13/08/388271308.db2.gz JAZUQYWVTUUWGG-UHFFFAOYSA-N 0 3 235.371 4.038 20 0 BIADHN Cc1ccc(CNCCCCC2CCCC2)o1 ZINC000462754854 388270625 /nfs/dbraw/zinc/27/06/25/388270625.db2.gz ITKWDORBUGUZCU-UHFFFAOYSA-N 0 3 235.371 4.038 20 0 BIADHN CC(C)=CCN(C)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463040919 388276457 /nfs/dbraw/zinc/27/64/57/388276457.db2.gz XNLGLKQAXYWQCH-NEPJUHHUSA-N 0 3 249.320 4.006 20 0 BIADHN C[C@H](c1ccc(Cl)cc1)N1CCC(C)(C)C1 ZINC000464790146 388103148 /nfs/dbraw/zinc/10/31/48/388103148.db2.gz DJKHJZJOICENNB-LLVKDONJSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1ccc(Cl)cc1)N1CCC(C)(C)C1 ZINC000464790147 388102996 /nfs/dbraw/zinc/10/29/96/388102996.db2.gz DJKHJZJOICENNB-NSHDSACASA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1ccccc1Cl)N1CCC(C)(C)C1 ZINC000464796403 388104619 /nfs/dbraw/zinc/10/46/19/388104619.db2.gz UTQFGQFUXXNNBK-LLVKDONJSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1ccccc1Cl)N1CCC(C)(C)C1 ZINC000464796404 388104576 /nfs/dbraw/zinc/10/45/76/388104576.db2.gz UTQFGQFUXXNNBK-NSHDSACASA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1cccc(Cl)c1)N1CCC(C)(C)C1 ZINC000464797507 388104825 /nfs/dbraw/zinc/10/48/25/388104825.db2.gz ZCTHJEVTPKJMJL-LLVKDONJSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1cccc(Cl)c1)N1CCC(C)(C)C1 ZINC000464797508 388104605 /nfs/dbraw/zinc/10/46/05/388104605.db2.gz ZCTHJEVTPKJMJL-NSHDSACASA-N 0 3 237.774 4.133 20 0 BIADHN CCC[C@]1(C)CCCN([C@H](C)c2cccnc2)C1 ZINC000464844310 388106231 /nfs/dbraw/zinc/10/62/31/388106231.db2.gz GQLVZUGBVVHDRJ-GDBMZVCRSA-N 0 3 246.398 4.045 20 0 BIADHN CCC[C@]1(C)CCCN([C@@H](C)c2cccnc2)C1 ZINC000464844311 388105711 /nfs/dbraw/zinc/10/57/11/388105711.db2.gz GQLVZUGBVVHDRJ-GOEBONIOSA-N 0 3 246.398 4.045 20 0 BIADHN CCC[C@@]1(C)CCCN([C@@H](C)c2cccnc2)C1 ZINC000464844312 388106045 /nfs/dbraw/zinc/10/60/45/388106045.db2.gz GQLVZUGBVVHDRJ-HOCLYGCPSA-N 0 3 246.398 4.045 20 0 BIADHN CCC[C@@]1(C)CCCN([C@H](C)c2cccnc2)C1 ZINC000464844313 388106085 /nfs/dbraw/zinc/10/60/85/388106085.db2.gz GQLVZUGBVVHDRJ-ZBFHGGJFSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@H](c1ccc(F)c(Cl)c1)N1CCC[C@H]1C ZINC000464846218 388106091 /nfs/dbraw/zinc/10/60/91/388106091.db2.gz JDGSTLIXCZJZBY-NXEZZACHSA-N 0 3 241.737 4.024 20 0 BIADHN C[C@@H](c1ccc(F)c(Cl)c1)N1CCC[C@@H]1C ZINC000464846219 388105773 /nfs/dbraw/zinc/10/57/73/388105773.db2.gz JDGSTLIXCZJZBY-UWVGGRQHSA-N 0 3 241.737 4.024 20 0 BIADHN C[C@H](c1ccc(F)c(Cl)c1)N1CCC[C@@H]1C ZINC000464846220 388106264 /nfs/dbraw/zinc/10/62/64/388106264.db2.gz JDGSTLIXCZJZBY-VHSXEESVSA-N 0 3 241.737 4.024 20 0 BIADHN C[C@@H](c1ccc(F)c(Cl)c1)N1CCC[C@H]1C ZINC000464846221 388106131 /nfs/dbraw/zinc/10/61/31/388106131.db2.gz JDGSTLIXCZJZBY-ZJUUUORDSA-N 0 3 241.737 4.024 20 0 BIADHN C[C@@H]1CCN([C@H]2C=CCCC2)[C@H](c2ccco2)C1 ZINC000464862016 388106696 /nfs/dbraw/zinc/10/66/96/388106696.db2.gz WZGDVLPDLUVKPB-ILXRZTDVSA-N 0 3 245.366 4.161 20 0 BIADHN C[C@@H]1CCN([C@@H]2C=CCCC2)[C@H](c2ccco2)C1 ZINC000464862018 388106735 /nfs/dbraw/zinc/10/67/35/388106735.db2.gz WZGDVLPDLUVKPB-KFWWJZLASA-N 0 3 245.366 4.161 20 0 BIADHN C[C@@H]1CCN([C@H]2C=CCCC2)[C@@H](c2ccco2)C1 ZINC000464862021 388107175 /nfs/dbraw/zinc/10/71/75/388107175.db2.gz WZGDVLPDLUVKPB-QLFBSQMISA-N 0 3 245.366 4.161 20 0 BIADHN C[C@@H]1CCN([C@@H]2C=CCCC2)[C@@H](c2ccco2)C1 ZINC000464862023 388107257 /nfs/dbraw/zinc/10/72/57/388107257.db2.gz WZGDVLPDLUVKPB-RBSFLKMASA-N 0 3 245.366 4.161 20 0 BIADHN CC/C=C\CCN([C@H](C)c1ccco1)C1CC1 ZINC000466209844 398018120 /nfs/dbraw/zinc/01/81/20/398018120.db2.gz KFPMQZJYGHNTRL-DSYXLKISSA-N 0 3 233.355 4.161 20 0 BIADHN CC/C=C/CCN([C@@H](C)c1ccco1)C1CC1 ZINC000466209845 398018271 /nfs/dbraw/zinc/01/82/71/398018271.db2.gz KFPMQZJYGHNTRL-IHVVCDCBSA-N 0 3 233.355 4.161 20 0 BIADHN CC/C=C/CCN([C@H](C)c1ccco1)C1CC1 ZINC000466209846 398018101 /nfs/dbraw/zinc/01/81/01/398018101.db2.gz KFPMQZJYGHNTRL-MUBLQREKSA-N 0 3 233.355 4.161 20 0 BIADHN CC/C=C\CCN([C@@H](C)c1ccco1)C1CC1 ZINC000466209847 398018110 /nfs/dbraw/zinc/01/81/10/398018110.db2.gz KFPMQZJYGHNTRL-ZFDPJTLLSA-N 0 3 233.355 4.161 20 0 BIADHN CC/C=C\CC[N@@H+](CC)[C@@H](C)c1cccc([O-])c1 ZINC000466828692 528789794 /nfs/dbraw/zinc/78/97/94/528789794.db2.gz KLDDOYMIAKYFSE-AFNCTOJWSA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C\CC[N@H+](CC)[C@@H](C)c1cccc([O-])c1 ZINC000466828692 528789789 /nfs/dbraw/zinc/78/97/89/528789789.db2.gz KLDDOYMIAKYFSE-AFNCTOJWSA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C\CC[N@@H+](CC)[C@H](C)c1cccc([O-])c1 ZINC000466828693 528788822 /nfs/dbraw/zinc/78/88/22/528788822.db2.gz KLDDOYMIAKYFSE-LMVHVUTASA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C\CC[N@H+](CC)[C@H](C)c1cccc([O-])c1 ZINC000466828693 528788816 /nfs/dbraw/zinc/78/88/16/528788816.db2.gz KLDDOYMIAKYFSE-LMVHVUTASA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C/CC[N@@H+](CC)[C@H](C)c1cccc([O-])c1 ZINC000466828694 528769897 /nfs/dbraw/zinc/76/98/97/528769897.db2.gz KLDDOYMIAKYFSE-PSKZRQQASA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C/CC[N@H+](CC)[C@H](C)c1cccc([O-])c1 ZINC000466828694 528769895 /nfs/dbraw/zinc/76/98/95/528769895.db2.gz KLDDOYMIAKYFSE-PSKZRQQASA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C/CC[N@@H+](CC)[C@@H](C)c1cccc([O-])c1 ZINC000466828695 528770113 /nfs/dbraw/zinc/77/01/13/528770113.db2.gz KLDDOYMIAKYFSE-UZYOAWRESA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C/CC[N@H+](CC)[C@@H](C)c1cccc([O-])c1 ZINC000466828695 528770111 /nfs/dbraw/zinc/77/01/11/528770111.db2.gz KLDDOYMIAKYFSE-UZYOAWRESA-N 0 3 247.382 4.131 20 0 BIADHN CC/C=C\CCN(Cc1cccs1)C1CC1 ZINC000466833846 528789377 /nfs/dbraw/zinc/78/93/77/528789377.db2.gz HFPBHQPPFYGUAQ-ARJAWSKDSA-N 0 3 235.396 4.069 20 0 BIADHN CC/C=C/CCN(Cc1cccs1)C1CC1 ZINC000466833847 528770808 /nfs/dbraw/zinc/77/08/08/528770808.db2.gz HFPBHQPPFYGUAQ-ONEGZZNKSA-N 0 3 235.396 4.069 20 0 BIADHN CC/C=C/CCN1CCc2sccc2[C@@H]1C ZINC000466834273 528772876 /nfs/dbraw/zinc/77/28/76/528772876.db2.gz JHVIZNAONIBDGW-ITKZLYELSA-N 0 3 235.396 4.024 20 0 BIADHN CC/C=C\CCN1CCc2sccc2[C@H]1C ZINC000466834274 528790382 /nfs/dbraw/zinc/79/03/82/528790382.db2.gz JHVIZNAONIBDGW-QMAVJUDZSA-N 0 3 235.396 4.024 20 0 BIADHN CC/C=C\CCN1CCc2sccc2[C@@H]1C ZINC000466834275 528790405 /nfs/dbraw/zinc/79/04/05/528790405.db2.gz JHVIZNAONIBDGW-RXNFCKPNSA-N 0 3 235.396 4.024 20 0 BIADHN CC/C=C/CCN1CCc2sccc2[C@H]1C ZINC000466834276 528772111 /nfs/dbraw/zinc/77/21/11/528772111.db2.gz JHVIZNAONIBDGW-ZYOFXKKJSA-N 0 3 235.396 4.024 20 0 BIADHN C[C@H](N[C@@H]1C=CCCC1)c1cc2ccccc2o1 ZINC000467273862 533979257 /nfs/dbraw/zinc/97/92/57/533979257.db2.gz UFPNWSQUQNFBFI-GXTWGEPZSA-N 0 3 241.334 4.192 20 0 BIADHN C[C@H](N[C@H]1C=CCCC1)c1cc2ccccc2o1 ZINC000467273863 225008552 /nfs/dbraw/zinc/00/85/52/225008552.db2.gz UFPNWSQUQNFBFI-JSGCOSHPSA-N 0 3 241.334 4.192 20 0 BIADHN C[C@@H](NCCC1=CCCCCC1)c1ccco1 ZINC000467525672 533374320 /nfs/dbraw/zinc/37/43/20/533374320.db2.gz OJIFQAJDKFREDH-CYBMUJFWSA-N 0 3 233.355 4.211 20 0 BIADHN C[C@H](NCCC1=CCCCCC1)c1ccco1 ZINC000467525673 533840855 /nfs/dbraw/zinc/84/08/55/533840855.db2.gz OJIFQAJDKFREDH-ZDUSSCGKSA-N 0 3 233.355 4.211 20 0 BIADHN CCc1cccc(CN[C@@H](C)c2ccccc2)c1 ZINC000469756641 529169711 /nfs/dbraw/zinc/16/97/11/529169711.db2.gz HSMDTEGIMRUNQA-AWEZNQCLSA-N 0 3 239.362 4.100 20 0 BIADHN CCc1cccc(CN[C@H](C)c2ccccc2)c1 ZINC000469756642 529169213 /nfs/dbraw/zinc/16/92/13/529169213.db2.gz HSMDTEGIMRUNQA-CQSZACIVSA-N 0 3 239.362 4.100 20 0 BIADHN CCc1ccc([C@H](C)N[C@H](C)CCC2CC2)o1 ZINC000469808789 529722290 /nfs/dbraw/zinc/72/22/90/529722290.db2.gz RIHOSOYJKIWTRJ-NEPJUHHUSA-N 0 3 235.371 4.071 20 0 BIADHN CCc1ccc([C@@H](C)N[C@@H](C)CCC2CC2)o1 ZINC000469808790 529707144 /nfs/dbraw/zinc/70/71/44/529707144.db2.gz RIHOSOYJKIWTRJ-NWDGAFQWSA-N 0 3 235.371 4.071 20 0 BIADHN CCc1ccc([C@H](C)N[C@@H](C)CCC2CC2)o1 ZINC000469808791 529721740 /nfs/dbraw/zinc/72/17/40/529721740.db2.gz RIHOSOYJKIWTRJ-RYUDHWBXSA-N 0 3 235.371 4.071 20 0 BIADHN CCc1ccc([C@@H](C)N[C@H](C)CCC2CC2)o1 ZINC000469808792 529707649 /nfs/dbraw/zinc/70/76/49/529707649.db2.gz RIHOSOYJKIWTRJ-VXGBXAGGSA-N 0 3 235.371 4.071 20 0 BIADHN FC(F)c1cccc(CN2CCCCCC2)c1 ZINC000470724281 225058544 /nfs/dbraw/zinc/05/85/44/225058544.db2.gz SFVDKOKDIBNXAF-UHFFFAOYSA-N 0 3 239.309 4.000 20 0 BIADHN C[C@H](c1ccccc1F)N1CCCC2(CCC2)C1 ZINC000470864543 225061338 /nfs/dbraw/zinc/06/13/38/225061338.db2.gz BKTIFUACGIOQNA-CYBMUJFWSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@@H](c1ccccc1F)N1CCCC2(CCC2)C1 ZINC000470864549 534127711 /nfs/dbraw/zinc/12/77/11/534127711.db2.gz BKTIFUACGIOQNA-ZDUSSCGKSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@H](c1ccc(F)cc1)N1CCCC2(CCC2)C1 ZINC000470866029 225062256 /nfs/dbraw/zinc/06/22/56/225062256.db2.gz KOIJSEISAKBVMK-CYBMUJFWSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@@H](c1ccc(F)cc1)N1CCCC2(CCC2)C1 ZINC000470866030 534061462 /nfs/dbraw/zinc/06/14/62/534061462.db2.gz KOIJSEISAKBVMK-ZDUSSCGKSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@H](c1cccc(F)c1)N1CCCC2(CCC2)C1 ZINC000470868004 534128351 /nfs/dbraw/zinc/12/83/51/534128351.db2.gz WUPGJRUYUGMCPE-CYBMUJFWSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@@H](c1cccc(F)c1)N1CCCC2(CCC2)C1 ZINC000470868005 534089663 /nfs/dbraw/zinc/08/96/63/534089663.db2.gz WUPGJRUYUGMCPE-ZDUSSCGKSA-N 0 3 247.357 4.153 20 0 BIADHN CCN(Cc1ccsc1Cl)CC1CCC1 ZINC000475564683 528863594 /nfs/dbraw/zinc/86/35/94/528863594.db2.gz JSSKBTIIIFJNCB-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CCN(Cc1ccc(Cl)s1)CC1CCC1 ZINC000475576175 528785494 /nfs/dbraw/zinc/78/54/94/528785494.db2.gz VIFXYQUCLQXEMO-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CC[C@@H](c1ccccc1)N(C)Cc1cccs1 ZINC000477683993 529256310 /nfs/dbraw/zinc/25/63/10/529256310.db2.gz UKYOOIZQNVKEFS-HNNXBMFYSA-N 0 3 245.391 4.331 20 0 BIADHN CC[C@H](c1ccccc1)N(C)Cc1cccs1 ZINC000477683994 529180430 /nfs/dbraw/zinc/18/04/30/529180430.db2.gz UKYOOIZQNVKEFS-OAHLLOKOSA-N 0 3 245.391 4.331 20 0 BIADHN CC[C@H](NCC=C(C)C)c1cc(C)ccc1OC ZINC000479278878 529594358 /nfs/dbraw/zinc/59/43/58/529594358.db2.gz GVXVSPMYCJHAGR-HNNXBMFYSA-N 0 3 247.382 4.011 20 0 BIADHN CC[C@@H](NCC=C(C)C)c1cc(C)ccc1OC ZINC000479278880 529159518 /nfs/dbraw/zinc/15/95/18/529159518.db2.gz GVXVSPMYCJHAGR-OAHLLOKOSA-N 0 3 247.382 4.011 20 0 BIADHN CC(C)c1cccc(CNCc2ccsc2)c1 ZINC000479402820 528170866 /nfs/dbraw/zinc/17/08/66/528170866.db2.gz TYYVTONJDMBVDC-UHFFFAOYSA-N 0 3 245.391 4.161 20 0 BIADHN CC(C)c1cccc(CNCc2cccs2)c1 ZINC000479425785 528171008 /nfs/dbraw/zinc/17/10/08/528171008.db2.gz QRVRIXVHQUJKBV-UHFFFAOYSA-N 0 3 245.391 4.161 20 0 BIADHN CC(C)=CCNCc1ccc(-c2ccccc2)o1 ZINC000480305187 527443559 /nfs/dbraw/zinc/44/35/59/527443559.db2.gz MHHSGZNDSYAQRC-UHFFFAOYSA-N 0 3 241.334 4.002 20 0 BIADHN C[C@H](c1ccccc1Cl)N(C)CCC1CC1 ZINC000480525685 225202160 /nfs/dbraw/zinc/20/21/60/225202160.db2.gz JKJUPVGVWTVFHN-LLVKDONJSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1ccccc1Cl)N(C)CCC1CC1 ZINC000480525686 225202031 /nfs/dbraw/zinc/20/20/31/225202031.db2.gz JKJUPVGVWTVFHN-NSHDSACASA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](NCC(C)(C)C1=CCCCC1)c1ccco1 ZINC000480709030 225206737 /nfs/dbraw/zinc/20/67/37/225206737.db2.gz MPRLCBFHKCNBNG-CYBMUJFWSA-N 0 3 247.382 4.457 20 0 BIADHN C[C@H](NCC(C)(C)C1=CCCCC1)c1ccco1 ZINC000480709033 225206382 /nfs/dbraw/zinc/20/63/82/225206382.db2.gz MPRLCBFHKCNBNG-ZDUSSCGKSA-N 0 3 247.382 4.457 20 0 BIADHN C(=C/c1ccccc1)\CN1CC[C@H]1c1ccccc1 ZINC000482947807 527466515 /nfs/dbraw/zinc/46/65/15/527466515.db2.gz NZGTXVXQEOKMIK-HKMNZKMDSA-N 0 3 249.357 4.147 20 0 BIADHN C(=C\c1ccccc1)\CN1CC[C@@H]1c1ccccc1 ZINC000482947808 527470798 /nfs/dbraw/zinc/47/07/98/527470798.db2.gz NZGTXVXQEOKMIK-IEODJVTJSA-N 0 3 249.357 4.147 20 0 BIADHN C(=C/c1ccccc1)\CN1CC[C@@H]1c1ccccc1 ZINC000482947809 387105509 /nfs/dbraw/zinc/10/55/09/387105509.db2.gz NZGTXVXQEOKMIK-RUJXFNLJSA-N 0 3 249.357 4.147 20 0 BIADHN C(=C\c1ccccc1)\CN1CC[C@H]1c1ccccc1 ZINC000482947810 387106163 /nfs/dbraw/zinc/10/61/63/387106163.db2.gz NZGTXVXQEOKMIK-VOCYLRNQSA-N 0 3 249.357 4.147 20 0 BIADHN CCCN(CCC)Cc1ccsc1Cl ZINC000483142775 528060416 /nfs/dbraw/zinc/06/04/16/528060416.db2.gz NHMSEDQOVHYPJE-UHFFFAOYSA-N 0 3 231.792 4.024 20 0 BIADHN CN(Cc1ccsc1Cl)C1CCCCC1 ZINC000483146349 530013746 /nfs/dbraw/zinc/01/37/46/530013746.db2.gz HMRTXYUDEIFFJP-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN CCCN(Cc1ccsc1Cl)CC1CC1 ZINC000483163829 528149434 /nfs/dbraw/zinc/14/94/34/528149434.db2.gz ZXQLUTCOMIRUOL-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CC(C)[C@H]1CCCN1Cc1ccsc1Cl ZINC000483179374 527784567 /nfs/dbraw/zinc/78/45/67/527784567.db2.gz PFGIDYRHTVRUGR-LLVKDONJSA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)[C@@H]1CCCN1Cc1ccsc1Cl ZINC000483179375 528673929 /nfs/dbraw/zinc/67/39/29/528673929.db2.gz PFGIDYRHTVRUGR-NSHDSACASA-N 0 3 243.803 4.022 20 0 BIADHN Cc1ccc2c(c1)CN([C@@H](C)c1ccccc1)C2 ZINC000483305061 534424175 /nfs/dbraw/zinc/42/41/75/534424175.db2.gz BDMWRGBSXSQFNZ-AWEZNQCLSA-N 0 3 237.346 4.072 20 0 BIADHN Cc1ccc2c(c1)CN([C@H](C)c1ccccc1)C2 ZINC000483305062 534424115 /nfs/dbraw/zinc/42/41/15/534424115.db2.gz BDMWRGBSXSQFNZ-CQSZACIVSA-N 0 3 237.346 4.072 20 0 BIADHN C[C@H](c1ccccc1)N1CC[C@H]1c1ccccc1 ZINC000484928639 534133717 /nfs/dbraw/zinc/13/37/17/534133717.db2.gz VBMPULFDEXVHHN-PBHICJAKSA-N 0 3 237.346 4.195 20 0 BIADHN C[C@H](c1ccccc1)N1CC[C@@H]1c1ccccc1 ZINC000484928640 534131695 /nfs/dbraw/zinc/13/16/95/534131695.db2.gz VBMPULFDEXVHHN-RHSMWYFYSA-N 0 3 237.346 4.195 20 0 BIADHN C[C@@H](c1ccccc1)N1CC[C@@H]1c1ccccc1 ZINC000484928641 534109391 /nfs/dbraw/zinc/10/93/91/534109391.db2.gz VBMPULFDEXVHHN-WMLDXEAASA-N 0 3 237.346 4.195 20 0 BIADHN C[C@@H](c1ccccc1)N1CC[C@H]1c1ccccc1 ZINC000484928642 534110466 /nfs/dbraw/zinc/11/04/66/534110466.db2.gz VBMPULFDEXVHHN-YOEHRIQHSA-N 0 3 237.346 4.195 20 0 BIADHN Cc1ccccc1[C@H](C)N1Cc2ccccc2C1 ZINC000485688424 225257177 /nfs/dbraw/zinc/25/71/77/225257177.db2.gz YPHFOPZNGIELTQ-AWEZNQCLSA-N 0 3 237.346 4.072 20 0 BIADHN Cc1ccccc1[C@@H](C)N1Cc2ccccc2C1 ZINC000485688427 225256574 /nfs/dbraw/zinc/25/65/74/225256574.db2.gz YPHFOPZNGIELTQ-CQSZACIVSA-N 0 3 237.346 4.072 20 0 BIADHN c1cc(C2CCN([C@H]3C=CCCC3)CC2)cs1 ZINC000485999982 225260984 /nfs/dbraw/zinc/26/09/84/225260984.db2.gz CTTRMTOVIAFUSJ-HNNXBMFYSA-N 0 3 247.407 4.036 20 0 BIADHN c1cc(C2CCN([C@@H]3C=CCCC3)CC2)cs1 ZINC000485999991 225260600 /nfs/dbraw/zinc/26/06/00/225260600.db2.gz CTTRMTOVIAFUSJ-OAHLLOKOSA-N 0 3 247.407 4.036 20 0 BIADHN Cc1cccc([C@@H](C)N(C)Cc2cccs2)c1 ZINC000487815041 225325674 /nfs/dbraw/zinc/32/56/74/225325674.db2.gz DHCYWMMMVQUNNN-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1cccc([C@H](C)N(C)Cc2cccs2)c1 ZINC000487815042 225325847 /nfs/dbraw/zinc/32/58/47/225325847.db2.gz DHCYWMMMVQUNNN-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2cccc(C)c2)o1 ZINC000487859815 225327150 /nfs/dbraw/zinc/32/71/50/225327150.db2.gz MISZTSVVRQZDHM-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2cccc(C)c2)o1 ZINC000487859816 225326675 /nfs/dbraw/zinc/32/66/75/225326675.db2.gz MISZTSVVRQZDHM-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccccc1[C@@H](C)N(C)Cc1ccsc1 ZINC000488570965 388189132 /nfs/dbraw/zinc/18/91/32/388189132.db2.gz RXPWSKKDCGODBY-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccccc1[C@H](C)N(C)Cc1ccsc1 ZINC000488570967 388188945 /nfs/dbraw/zinc/18/89/45/388188945.db2.gz RXPWSKKDCGODBY-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN CCN(CC1CC1)[C@H](C)c1ccccc1Cl ZINC000489333341 388208312 /nfs/dbraw/zinc/20/83/12/388208312.db2.gz RFKPFLSZFPWYHG-LLVKDONJSA-N 0 3 237.774 4.133 20 0 BIADHN CCN(CC1CC1)[C@@H](C)c1ccccc1Cl ZINC000489333342 388208406 /nfs/dbraw/zinc/20/84/06/388208406.db2.gz RFKPFLSZFPWYHG-NSHDSACASA-N 0 3 237.774 4.133 20 0 BIADHN Cc1occc1CN(C)[C@H](C)c1ccc(C)cc1 ZINC000490412630 388238682 /nfs/dbraw/zinc/23/86/82/388238682.db2.gz JUMZERGUKQWLLG-CYBMUJFWSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1occc1CN(C)[C@@H](C)c1ccc(C)cc1 ZINC000490412631 388238777 /nfs/dbraw/zinc/23/87/77/388238777.db2.gz JUMZERGUKQWLLG-ZDUSSCGKSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1occc1CN(C)[C@H](C)c1cccc(C)c1 ZINC000490450117 388239361 /nfs/dbraw/zinc/23/93/61/388239361.db2.gz NQSCHIJXJZJLCF-CYBMUJFWSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1occc1CN(C)[C@@H](C)c1cccc(C)c1 ZINC000490450118 388239583 /nfs/dbraw/zinc/23/95/83/388239583.db2.gz NQSCHIJXJZJLCF-ZDUSSCGKSA-N 0 3 243.350 4.089 20 0 BIADHN CC(C)N(Cc1ccc(Cl)s1)C(C)C ZINC000492851443 528938787 /nfs/dbraw/zinc/93/87/87/528938787.db2.gz KKJAHUBUTBMVHS-UHFFFAOYSA-N 0 3 231.792 4.020 20 0 BIADHN CN(Cc1sccc1Cl)C1CCCCC1 ZINC000494423334 530032548 /nfs/dbraw/zinc/03/25/48/530032548.db2.gz DVLYRSGLEQZMHY-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN CCCN(CCC)Cc1sccc1Cl ZINC000494431321 528060572 /nfs/dbraw/zinc/06/05/72/528060572.db2.gz DOQZKMHPAQVFAJ-UHFFFAOYSA-N 0 3 231.792 4.024 20 0 BIADHN CCCN(Cc1sccc1Cl)CC1CC1 ZINC000494434693 528157425 /nfs/dbraw/zinc/15/74/25/528157425.db2.gz YUEDUAHYDUEGHY-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN C[C@H](CC1CCCCC1)N[C@H](C)c1ccco1 ZINC000494527578 533783708 /nfs/dbraw/zinc/78/37/08/533783708.db2.gz KBKNYMVRVGFFPG-CHWSQXEVSA-N 0 3 235.371 4.289 20 0 BIADHN C[C@H](CC1CCCCC1)N[C@@H](C)c1ccco1 ZINC000494527579 533784751 /nfs/dbraw/zinc/78/47/51/533784751.db2.gz KBKNYMVRVGFFPG-OLZOCXBDSA-N 0 3 235.371 4.289 20 0 BIADHN CN(Cc1cc(Cl)cs1)CC1CCCC1 ZINC000494946346 529978384 /nfs/dbraw/zinc/97/83/84/529978384.db2.gz IITMCKNZJRTPKC-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN C[C@@H](N(C)Cc1sccc1Cl)C1(C)CC1 ZINC000494952045 534285988 /nfs/dbraw/zinc/28/59/88/534285988.db2.gz HQKQNYHTWHXJDM-SECBINFHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H](N(C)Cc1sccc1Cl)C1(C)CC1 ZINC000494952046 226272432 /nfs/dbraw/zinc/27/24/32/226272432.db2.gz HQKQNYHTWHXJDM-VIFPVBQESA-N 0 3 243.803 4.022 20 0 BIADHN C[C@@H](N(C)Cc1cc(Cl)cs1)C1(C)CC1 ZINC000494961761 534284810 /nfs/dbraw/zinc/28/48/10/534284810.db2.gz VLGRLQIXPBHFCJ-SECBINFHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H](N(C)Cc1cc(Cl)cs1)C1(C)CC1 ZINC000494961762 226272823 /nfs/dbraw/zinc/27/28/23/226272823.db2.gz VLGRLQIXPBHFCJ-VIFPVBQESA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)CN(Cc1cc(Cl)cs1)C1CC1 ZINC000494980558 527945477 /nfs/dbraw/zinc/94/54/77/527945477.db2.gz ZROKQHVTFNGCKT-UHFFFAOYSA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)[C@H]1CCCN1Cc1cc(Cl)cs1 ZINC000494982508 527783902 /nfs/dbraw/zinc/78/39/02/527783902.db2.gz XVZIHAHYGDEFMV-GFCCVEGCSA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)[C@@H]1CCCN1Cc1cc(Cl)cs1 ZINC000494982510 528674467 /nfs/dbraw/zinc/67/44/67/528674467.db2.gz XVZIHAHYGDEFMV-LBPRGKRZSA-N 0 3 243.803 4.022 20 0 BIADHN CCC[C@@H](C)N(C)Cc1cc(Cl)cs1 ZINC000495059640 528886473 /nfs/dbraw/zinc/88/64/73/528886473.db2.gz NUCPGHYQEMKGFQ-SECBINFHSA-N 0 3 231.792 4.022 20 0 BIADHN CCC[C@H](C)N(C)Cc1cc(Cl)cs1 ZINC000495059641 528046758 /nfs/dbraw/zinc/04/67/58/528046758.db2.gz NUCPGHYQEMKGFQ-VIFPVBQESA-N 0 3 231.792 4.022 20 0 BIADHN CCCCN(CC)Cc1sccc1Cl ZINC000495074499 528394162 /nfs/dbraw/zinc/39/41/62/528394162.db2.gz MHTUWDXCQLDNED-UHFFFAOYSA-N 0 3 231.792 4.024 20 0 BIADHN CCCCN(CC)Cc1cc(Cl)cs1 ZINC000495075369 528394716 /nfs/dbraw/zinc/39/47/16/528394716.db2.gz QJQBZOFWDPTLHJ-UHFFFAOYSA-N 0 3 231.792 4.024 20 0 BIADHN C[C@H](c1ccccc1F)N(C)CCC(C)(C)C ZINC000496850060 226315757 /nfs/dbraw/zinc/31/57/57/226315757.db2.gz FLBFDODSLDCKAJ-GFCCVEGCSA-N 0 3 237.362 4.255 20 0 BIADHN C[C@@H](c1ccccc1F)N(C)CCC(C)(C)C ZINC000496850076 534127015 /nfs/dbraw/zinc/12/70/15/534127015.db2.gz FLBFDODSLDCKAJ-LBPRGKRZSA-N 0 3 237.362 4.255 20 0 BIADHN CC(C)(C)[C@@H](NC1CC1)c1cc2ccccc2o1 ZINC000497538131 385175228 /nfs/dbraw/zinc/17/52/28/385175228.db2.gz LKMMOGISOFJMPD-HNNXBMFYSA-N 0 3 243.350 4.272 20 0 BIADHN CC(C)(C)[C@H](NC1CC1)c1cc2ccccc2o1 ZINC000497538132 385177540 /nfs/dbraw/zinc/17/75/40/385177540.db2.gz LKMMOGISOFJMPD-OAHLLOKOSA-N 0 3 243.350 4.272 20 0 BIADHN C[C@@H](c1ccc(Cl)cc1)N1CCC(C)CC1 ZINC000497590382 259385663 /nfs/dbraw/zinc/38/56/63/259385663.db2.gz GCVMUNDGZPJTGG-LBPRGKRZSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1cccc(Cl)c1)N1CCC(C)CC1 ZINC000497591069 259385903 /nfs/dbraw/zinc/38/59/03/259385903.db2.gz TYDZCPUVWCCWRL-GFCCVEGCSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1cccc(Cl)c1)N1CCC(C)CC1 ZINC000497591070 259385892 /nfs/dbraw/zinc/38/58/92/259385892.db2.gz TYDZCPUVWCCWRL-LBPRGKRZSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1ccc(Cl)cc1)N1CCC[C@@H](C)C1 ZINC000497591115 259385923 /nfs/dbraw/zinc/38/59/23/259385923.db2.gz UPWGCOHBEOUFEL-NEPJUHHUSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1ccc(Cl)cc1)N1CCC[C@H](C)C1 ZINC000497591116 259385934 /nfs/dbraw/zinc/38/59/34/259385934.db2.gz UPWGCOHBEOUFEL-RYUDHWBXSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1ccc(Cl)cc1)N1CCC[C@@H](C)C1 ZINC000497591117 259385882 /nfs/dbraw/zinc/38/58/82/259385882.db2.gz UPWGCOHBEOUFEL-VXGBXAGGSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1cccc(Cl)c1)N1CCC[C@@H](C)C1 ZINC000497591275 259385908 /nfs/dbraw/zinc/38/59/08/259385908.db2.gz XRQGAUFVNGZJTI-NEPJUHHUSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1cccc(Cl)c1)N1CCC[C@H](C)C1 ZINC000497591276 259385828 /nfs/dbraw/zinc/38/58/28/259385828.db2.gz XRQGAUFVNGZJTI-RYUDHWBXSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H](c1cccc(Cl)c1)N1CCC[C@@H](C)C1 ZINC000497591277 259385866 /nfs/dbraw/zinc/38/58/66/259385866.db2.gz XRQGAUFVNGZJTI-VXGBXAGGSA-N 0 3 237.774 4.133 20 0 BIADHN CCCN(Cc1ccco1)Cc1cccc(C)c1 ZINC000497751773 259391308 /nfs/dbraw/zinc/39/13/08/259391308.db2.gz VNFBMYAVMYEFLR-UHFFFAOYSA-N 0 3 243.350 4.000 20 0 BIADHN CCCN(C)[C@H](c1ccccc1Cl)C(C)C ZINC000500253550 527863819 /nfs/dbraw/zinc/86/38/19/527863819.db2.gz PCHXEFNBRAOUJC-AWEZNQCLSA-N 0 3 239.790 4.379 20 0 BIADHN CCCN(C)[C@@H](c1ccccc1Cl)C(C)C ZINC000500253551 527863091 /nfs/dbraw/zinc/86/30/91/527863091.db2.gz PCHXEFNBRAOUJC-CQSZACIVSA-N 0 3 239.790 4.379 20 0 BIADHN CSc1ccc([C@H](C)N[C@@H]2C=CCCC2)cc1 ZINC000500267183 226325478 /nfs/dbraw/zinc/32/54/78/226325478.db2.gz ZOMTUMGYDDMORO-GXTWGEPZSA-N 0 3 247.407 4.168 20 0 BIADHN CSc1ccc([C@H](C)N[C@H]2C=CCCC2)cc1 ZINC000500267184 533004998 /nfs/dbraw/zinc/00/49/98/533004998.db2.gz ZOMTUMGYDDMORO-JSGCOSHPSA-N 0 3 247.407 4.168 20 0 BIADHN CCCCNCc1ccc(-c2ccc(C)cc2)o1 ZINC000500276768 528553578 /nfs/dbraw/zinc/55/35/78/528553578.db2.gz JTBYOBQLJKNWSJ-UHFFFAOYSA-N 0 3 243.350 4.145 20 0 BIADHN CCC[C@@H](C)N(C)Cc1ccc(Cl)s1 ZINC000500959532 528888905 /nfs/dbraw/zinc/88/89/05/528888905.db2.gz VTNNDBFIGMDHAN-SECBINFHSA-N 0 3 231.792 4.022 20 0 BIADHN CCC[C@H](C)N(C)Cc1ccc(Cl)s1 ZINC000500959538 528047781 /nfs/dbraw/zinc/04/77/81/528047781.db2.gz VTNNDBFIGMDHAN-VIFPVBQESA-N 0 3 231.792 4.022 20 0 BIADHN CSc1ccccc1[C@@H](C)N[C@@H]1C=CCCC1 ZINC000501506011 533058601 /nfs/dbraw/zinc/05/86/01/533058601.db2.gz RHPZXRAGTRIMJI-CHWSQXEVSA-N 0 3 247.407 4.168 20 0 BIADHN CSc1ccccc1[C@@H](C)N[C@H]1C=CCCC1 ZINC000501506019 533058041 /nfs/dbraw/zinc/05/80/41/533058041.db2.gz RHPZXRAGTRIMJI-OLZOCXBDSA-N 0 3 247.407 4.168 20 0 BIADHN Cc1cc([C@@H](C)NCC2(C3CC3)CCC2)oc1C ZINC000502370885 226329767 /nfs/dbraw/zinc/32/97/67/226329767.db2.gz GSKZMANAWYLPAG-GFCCVEGCSA-N 0 3 247.382 4.127 20 0 BIADHN Cc1cc([C@H](C)NCC2(C3CC3)CCC2)oc1C ZINC000502370886 226329705 /nfs/dbraw/zinc/32/97/05/226329705.db2.gz GSKZMANAWYLPAG-LBPRGKRZSA-N 0 3 247.382 4.127 20 0 BIADHN C[C@H](N[C@H]1CCC12CCC2)c1ccccc1Cl ZINC000502403744 226329636 /nfs/dbraw/zinc/32/96/36/226329636.db2.gz PBKYKEILBPSYJW-FZMZJTMJSA-N 0 3 249.785 4.323 20 0 BIADHN C[C@H](N[C@@H]1CCC12CCC2)c1ccccc1Cl ZINC000502403785 226329757 /nfs/dbraw/zinc/32/97/57/226329757.db2.gz PBKYKEILBPSYJW-SMDDNHRTSA-N 0 3 249.785 4.323 20 0 BIADHN Cc1cc([C@H](C)N[C@H](C)CCC2CC2)oc1C ZINC000502420115 226330014 /nfs/dbraw/zinc/33/00/14/226330014.db2.gz YMZFAFZRPOIFNN-NEPJUHHUSA-N 0 3 235.371 4.126 20 0 BIADHN Cc1cc([C@@H](C)N[C@@H](C)CCC2CC2)oc1C ZINC000502420116 226329978 /nfs/dbraw/zinc/32/99/78/226329978.db2.gz YMZFAFZRPOIFNN-NWDGAFQWSA-N 0 3 235.371 4.126 20 0 BIADHN Cc1cc([C@H](C)N[C@@H](C)CCC2CC2)oc1C ZINC000502420117 226330017 /nfs/dbraw/zinc/33/00/17/226330017.db2.gz YMZFAFZRPOIFNN-RYUDHWBXSA-N 0 3 235.371 4.126 20 0 BIADHN Cc1cc([C@@H](C)N[C@H](C)CCC2CC2)oc1C ZINC000502420478 226329992 /nfs/dbraw/zinc/32/99/92/226329992.db2.gz YMZFAFZRPOIFNN-VXGBXAGGSA-N 0 3 235.371 4.126 20 0 BIADHN Cc1cc([C@@H](C)N[C@H]2CCC23CCCC3)oc1C ZINC000502453265 226330179 /nfs/dbraw/zinc/33/01/79/226330179.db2.gz OOCKFMFUKGUZTF-DOMZBBRYSA-N 0 3 247.382 4.270 20 0 BIADHN Cc1cc([C@@H](C)N[C@@H]2CCC23CCCC3)oc1C ZINC000502453266 226330200 /nfs/dbraw/zinc/33/02/00/226330200.db2.gz OOCKFMFUKGUZTF-IUODEOHRSA-N 0 3 247.382 4.270 20 0 BIADHN Cc1cc([C@H](C)N[C@@H]2CCC23CCCC3)oc1C ZINC000502453267 226330073 /nfs/dbraw/zinc/33/00/73/226330073.db2.gz OOCKFMFUKGUZTF-SWLSCSKDSA-N 0 3 247.382 4.270 20 0 BIADHN Cc1cc([C@H](C)N[C@H]2CCC23CCCC3)oc1C ZINC000502453268 226330191 /nfs/dbraw/zinc/33/01/91/226330191.db2.gz OOCKFMFUKGUZTF-WFASDCNBSA-N 0 3 247.382 4.270 20 0 BIADHN C[C@@H](N[C@@H]1CCC12CCC2)c1ccccc1Cl ZINC000502454936 533518122 /nfs/dbraw/zinc/51/81/22/533518122.db2.gz PBKYKEILBPSYJW-BXUZGUMPSA-N 0 3 249.785 4.323 20 0 BIADHN C[C@@H](N[C@H]1CCC12CCC2)c1ccccc1Cl ZINC000502454937 533540481 /nfs/dbraw/zinc/54/04/81/533540481.db2.gz PBKYKEILBPSYJW-RISCZKNCSA-N 0 3 249.785 4.323 20 0 BIADHN CCCC1(CN[C@H](C)c2cc(C)c(C)o2)CC1 ZINC000502464292 528062689 /nfs/dbraw/zinc/06/26/89/528062689.db2.gz SHYZCCKTIYHQDX-GFCCVEGCSA-N 0 3 235.371 4.127 20 0 BIADHN CCCC1(CN[C@@H](C)c2cc(C)c(C)o2)CC1 ZINC000502464293 528062085 /nfs/dbraw/zinc/06/20/85/528062085.db2.gz SHYZCCKTIYHQDX-LBPRGKRZSA-N 0 3 235.371 4.127 20 0 BIADHN CC[C@@H](c1ccccc1)N(CC)Cc1ccco1 ZINC000503971000 529256760 /nfs/dbraw/zinc/25/67/60/529256760.db2.gz YKKHWJYUZWYAPR-INIZCTEOSA-N 0 3 243.350 4.253 20 0 BIADHN CC[C@H](c1ccccc1)N(CC)Cc1ccco1 ZINC000503971001 529181766 /nfs/dbraw/zinc/18/17/66/529181766.db2.gz YKKHWJYUZWYAPR-MRXNPFEDSA-N 0 3 243.350 4.253 20 0 BIADHN CCN(Cc1ccccc1)[C@H](C)c1cccs1 ZINC000503973778 528831302 /nfs/dbraw/zinc/83/13/02/528831302.db2.gz INTPLBYSASWQBA-CYBMUJFWSA-N 0 3 245.391 4.331 20 0 BIADHN CCN(Cc1ccccc1)[C@@H](C)c1cccs1 ZINC000503973779 528831220 /nfs/dbraw/zinc/83/12/20/528831220.db2.gz INTPLBYSASWQBA-ZDUSSCGKSA-N 0 3 245.391 4.331 20 0 BIADHN CCN(C)[C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000503992142 527864886 /nfs/dbraw/zinc/86/48/86/527864886.db2.gz INSJBZKEJMHSCG-MRVPVSSYSA-N 0 3 232.154 4.006 20 0 BIADHN CCN(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000503992148 527862531 /nfs/dbraw/zinc/86/25/31/527862531.db2.gz INSJBZKEJMHSCG-QMMMGPOBSA-N 0 3 232.154 4.006 20 0 BIADHN CC(C)(C)N(Cc1ccco1)Cc1ccccc1 ZINC000505432157 526283366 /nfs/dbraw/zinc/28/33/66/526283366.db2.gz FXCQXGJPYBMPDY-UHFFFAOYSA-N 0 3 243.350 4.080 20 0 BIADHN CCCN(Cc1ccsc1)Cc1ccccc1 ZINC000505558218 528149872 /nfs/dbraw/zinc/14/98/72/528149872.db2.gz BIIXHLBBHHSXGI-UHFFFAOYSA-N 0 3 245.391 4.160 20 0 BIADHN CCCN(Cc1cccs1)Cc1ccccc1 ZINC000505560211 528149784 /nfs/dbraw/zinc/14/97/84/528149784.db2.gz QJUXQXABKMLSCI-UHFFFAOYSA-N 0 3 245.391 4.160 20 0 BIADHN CCCN(Cc1ccc(C)o1)Cc1ccccc1 ZINC000505612953 528134925 /nfs/dbraw/zinc/13/49/25/528134925.db2.gz QHZBMGGCYGZPEB-UHFFFAOYSA-N 0 3 243.350 4.000 20 0 BIADHN CCCN(Cc1occc1C)Cc1ccccc1 ZINC000505630642 528156482 /nfs/dbraw/zinc/15/64/82/528156482.db2.gz DDNAKBIQHOQQHN-UHFFFAOYSA-N 0 3 243.350 4.000 20 0 BIADHN CCN(Cc1sccc1C)Cc1ccccc1 ZINC000505864886 528920534 /nfs/dbraw/zinc/92/05/34/528920534.db2.gz SCZBBKFDLYBWDY-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN CCN(Cc1ccc(C)s1)Cc1ccccc1 ZINC000505864943 528777224 /nfs/dbraw/zinc/77/72/24/528777224.db2.gz SVGPRCGLEHCPBE-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN CCc1ccc(CN(C)[C@H](C)c2ccccc2)o1 ZINC000506022636 529637424 /nfs/dbraw/zinc/63/74/24/529637424.db2.gz VWEHOGKDMUQELH-CYBMUJFWSA-N 0 3 243.350 4.035 20 0 BIADHN CCc1ccc(CN(C)[C@@H](C)c2ccccc2)o1 ZINC000506022637 529636038 /nfs/dbraw/zinc/63/60/38/529636038.db2.gz VWEHOGKDMUQELH-ZDUSSCGKSA-N 0 3 243.350 4.035 20 0 BIADHN CC[C@H](C)N(Cc1ccco1)Cc1ccccc1 ZINC000506124599 529695182 /nfs/dbraw/zinc/69/51/82/529695182.db2.gz HIPODECULOQVJS-AWEZNQCLSA-N 0 3 243.350 4.080 20 0 BIADHN CC[C@@H](C)N(Cc1ccco1)Cc1ccccc1 ZINC000506124600 529349203 /nfs/dbraw/zinc/34/92/03/529349203.db2.gz HIPODECULOQVJS-CQSZACIVSA-N 0 3 243.350 4.080 20 0 BIADHN CN(Cc1ccc(Cl)o1)C1CCCCCC1 ZINC000506140316 529985846 /nfs/dbraw/zinc/98/58/46/529985846.db2.gz ABOQPKRQPZOHDT-UHFFFAOYSA-N 0 3 241.762 4.088 20 0 BIADHN CCN(C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000506328417 527839886 /nfs/dbraw/zinc/83/98/86/527839886.db2.gz XZDRPIQPAPKELF-UHFFFAOYSA-N 0 3 249.354 4.006 20 0 BIADHN CCN(C)Cc1ccc(-c2ccccc2F)s1 ZINC000506339482 527839349 /nfs/dbraw/zinc/83/93/49/527839349.db2.gz GTCRUDVLQOYJQR-UHFFFAOYSA-N 0 3 249.354 4.006 20 0 BIADHN CCN(C)Cc1ccc(-c2ccc(F)cc2)s1 ZINC000506342167 527839414 /nfs/dbraw/zinc/83/94/14/527839414.db2.gz SFLLENIUWZJNSW-UHFFFAOYSA-N 0 3 249.354 4.006 20 0 BIADHN CCN(C)Cc1ccc(-c2ccccc2Cl)o1 ZINC000506356140 527839828 /nfs/dbraw/zinc/83/98/28/527839828.db2.gz LPTCHSLSBQTVJX-UHFFFAOYSA-N 0 3 249.741 4.052 20 0 BIADHN Cc1sccc1CN(C)[C@H](C)c1ccccc1 ZINC000507007358 226364794 /nfs/dbraw/zinc/36/47/94/226364794.db2.gz MVWXVHHLZGKKIT-GFCCVEGCSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1sccc1CN(C)[C@@H](C)c1ccccc1 ZINC000507007359 226364729 /nfs/dbraw/zinc/36/47/29/226364729.db2.gz MVWXVHHLZGKKIT-LBPRGKRZSA-N 0 3 245.391 4.250 20 0 BIADHN CN(Cc1ccc(-c2ccccc2)s1)C1CC1 ZINC000507119973 529982525 /nfs/dbraw/zinc/98/25/25/529982525.db2.gz ITYZFQFNZKKLOZ-UHFFFAOYSA-N 0 3 243.375 4.009 20 0 BIADHN CN(Cc1cc(-c2ccccc2)cs1)C1CC1 ZINC000507121121 529975395 /nfs/dbraw/zinc/97/53/95/529975395.db2.gz NNKDEPJONHDQMS-UHFFFAOYSA-N 0 3 243.375 4.009 20 0 BIADHN CCN(Cc1ccsc1)Cc1ccccc1C ZINC000507133305 528862919 /nfs/dbraw/zinc/86/29/19/528862919.db2.gz WDKYFWPWJCFVDJ-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN CC(C)[C@H]1CCCN1Cc1ccc(Cl)s1 ZINC000507186392 527785220 /nfs/dbraw/zinc/78/52/20/527785220.db2.gz DJVWFHFGDHQMKO-LLVKDONJSA-N 0 3 243.803 4.022 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2ccccc2C)o1 ZINC000507193574 226367218 /nfs/dbraw/zinc/36/72/18/226367218.db2.gz OPZNJUSILYMGOV-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2ccccc2C)o1 ZINC000507193577 226367078 /nfs/dbraw/zinc/36/70/78/226367078.db2.gz OPZNJUSILYMGOV-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2ccc(C)cc2)o1 ZINC000507193590 226367064 /nfs/dbraw/zinc/36/70/64/226367064.db2.gz ORKUHDDTBICMBO-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2ccc(C)cc2)o1 ZINC000507193591 226366994 /nfs/dbraw/zinc/36/69/94/226366994.db2.gz ORKUHDDTBICMBO-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1cccc(CN(C)[C@@H](C)c2ccco2)c1C ZINC000507203072 226367274 /nfs/dbraw/zinc/36/72/74/226367274.db2.gz LFFBDDKLHVTQMP-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1cccc(CN(C)[C@H](C)c2ccco2)c1C ZINC000507203073 534703680 /nfs/dbraw/zinc/70/36/80/534703680.db2.gz LFFBDDKLHVTQMP-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2ccco2)c(C)c1 ZINC000507207128 226367259 /nfs/dbraw/zinc/36/72/59/226367259.db2.gz BJFWIIARMDTQMH-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2ccco2)c(C)c1 ZINC000507207129 226367183 /nfs/dbraw/zinc/36/71/83/226367183.db2.gz BJFWIIARMDTQMH-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc([C@@H](C)N(C)Cc2ccsc2)cc1 ZINC000507209675 226367413 /nfs/dbraw/zinc/36/74/13/226367413.db2.gz IXJNEVSUJNHTPW-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccc([C@H](C)N(C)Cc2ccsc2)cc1 ZINC000507209678 226367464 /nfs/dbraw/zinc/36/74/64/226367464.db2.gz IXJNEVSUJNHTPW-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccoc1CN(C)[C@@H](C)c1ccccc1C ZINC000507210008 226367351 /nfs/dbraw/zinc/36/73/51/226367351.db2.gz JBXCJHYAWPQESL-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccoc1CN(C)[C@H](C)c1ccccc1C ZINC000507210010 226367478 /nfs/dbraw/zinc/36/74/78/226367478.db2.gz JBXCJHYAWPQESL-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccoc1CN(C)[C@@H](C)c1ccc(C)cc1 ZINC000507213165 226367628 /nfs/dbraw/zinc/36/76/28/226367628.db2.gz PSSQZYIJOSRYSY-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccoc1CN(C)[C@H](C)c1ccc(C)cc1 ZINC000507213166 226367577 /nfs/dbraw/zinc/36/75/77/226367577.db2.gz PSSQZYIJOSRYSY-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2ccco2)cc1C ZINC000507221887 226367407 /nfs/dbraw/zinc/36/74/07/226367407.db2.gz PEGQDPJDJPFTLD-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2ccco2)cc1C ZINC000507221888 226367634 /nfs/dbraw/zinc/36/76/34/226367634.db2.gz PEGQDPJDJPFTLD-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(C)c(CN(C)[C@@H](C)c2ccco2)c1 ZINC000507229554 533665886 /nfs/dbraw/zinc/66/58/86/533665886.db2.gz MTSBSGJOMFEAHC-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(C)c(CN(C)[C@H](C)c2ccco2)c1 ZINC000507229555 533666883 /nfs/dbraw/zinc/66/68/83/533666883.db2.gz MTSBSGJOMFEAHC-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN CCCN(Cc1ccco1)Cc1ccc(C)s1 ZINC000507231981 528148433 /nfs/dbraw/zinc/14/84/33/528148433.db2.gz MTTAQSFLKLFJHU-UHFFFAOYSA-N 0 3 249.379 4.062 20 0 BIADHN CC[C@@H](c1ccccc1)N(C)Cc1ccc(C)o1 ZINC000507232183 529256291 /nfs/dbraw/zinc/25/62/91/529256291.db2.gz RSADVZBAUSUTNL-INIZCTEOSA-N 0 3 243.350 4.171 20 0 BIADHN CC[C@@H](c1ccccc1)N(C)Cc1occc1C ZINC000507241575 529256088 /nfs/dbraw/zinc/25/60/88/529256088.db2.gz AIZGQQPHDHYMGB-HNNXBMFYSA-N 0 3 243.350 4.171 20 0 BIADHN CC[C@H](c1ccccc1)N(C)Cc1occc1C ZINC000507241576 529180660 /nfs/dbraw/zinc/18/06/60/529180660.db2.gz AIZGQQPHDHYMGB-OAHLLOKOSA-N 0 3 243.350 4.171 20 0 BIADHN Cc1cc(C)cc(CN(C)[C@@H](C)c2ccco2)c1 ZINC000507243296 226368008 /nfs/dbraw/zinc/36/80/08/226368008.db2.gz LGGAHLNTVAMNNO-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1cc(C)cc(CN(C)[C@H](C)c2ccco2)c1 ZINC000507243297 226368039 /nfs/dbraw/zinc/36/80/39/226368039.db2.gz LGGAHLNTVAMNNO-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN CCc1ccc(CN(C)[C@H](C)c2ccco2)cc1 ZINC000507243322 529637528 /nfs/dbraw/zinc/63/75/28/529637528.db2.gz LLXRBSGTXGLBGY-CYBMUJFWSA-N 0 3 243.350 4.035 20 0 BIADHN CCc1ccc(CN(C)[C@@H](C)c2ccco2)cc1 ZINC000507243323 529635954 /nfs/dbraw/zinc/63/59/54/529635954.db2.gz LLXRBSGTXGLBGY-ZDUSSCGKSA-N 0 3 243.350 4.035 20 0 BIADHN C[C@@H](NC1CCC1)c1cc2cc(Cl)ccc2o1 ZINC000507520391 533337436 /nfs/dbraw/zinc/33/74/36/533337436.db2.gz PZNCTIXIQVSVPV-SECBINFHSA-N 0 3 249.741 4.289 20 0 BIADHN C[C@H](NC1CCC1)c1cc2cc(Cl)ccc2o1 ZINC000507520392 533805722 /nfs/dbraw/zinc/80/57/22/533805722.db2.gz PZNCTIXIQVSVPV-VIFPVBQESA-N 0 3 249.741 4.289 20 0 BIADHN C[C@@H](c1cccnc1)N(C)CCC1CCCCC1 ZINC000507620031 226370427 /nfs/dbraw/zinc/37/04/27/226370427.db2.gz UCJYSFAIWALNJL-AWEZNQCLSA-N 0 3 246.398 4.045 20 0 BIADHN C[C@H](c1cccnc1)N(C)CCC1CCCCC1 ZINC000507620033 534148113 /nfs/dbraw/zinc/14/81/13/534148113.db2.gz UCJYSFAIWALNJL-CQSZACIVSA-N 0 3 246.398 4.045 20 0 BIADHN CCN(Cc1occc1C)[C@@H](C)c1ccccc1 ZINC000508616160 528919009 /nfs/dbraw/zinc/91/90/09/528919009.db2.gz TWNLCMGLNLRHHK-AWEZNQCLSA-N 0 3 243.350 4.171 20 0 BIADHN CCN(Cc1occc1C)[C@H](C)c1ccccc1 ZINC000508616163 528918740 /nfs/dbraw/zinc/91/87/40/528918740.db2.gz TWNLCMGLNLRHHK-CQSZACIVSA-N 0 3 243.350 4.171 20 0 BIADHN c1cc(C2CCC2)ccc1CN1CCC12CCC2 ZINC000508749309 226373785 /nfs/dbraw/zinc/37/37/85/226373785.db2.gz VHBHSDDBALYZSP-UHFFFAOYSA-N 0 3 241.378 4.083 20 0 BIADHN C[C@@H](F)CCN(C)[C@H](C)c1cccc(Cl)c1 ZINC000509310205 534275405 /nfs/dbraw/zinc/27/54/05/534275405.db2.gz KGTMOPACKJMDBR-GHMZBOCLSA-N 0 3 243.753 4.081 20 0 BIADHN C[C@@H](F)CCN(C)[C@@H](C)c1cccc(Cl)c1 ZINC000509310206 534275667 /nfs/dbraw/zinc/27/56/67/534275667.db2.gz KGTMOPACKJMDBR-MNOVXSKESA-N 0 3 243.753 4.081 20 0 BIADHN C[C@H](F)CCN(C)[C@@H](C)c1cccc(Cl)c1 ZINC000509310207 229268747 /nfs/dbraw/zinc/26/87/47/229268747.db2.gz KGTMOPACKJMDBR-QWRGUYRKSA-N 0 3 243.753 4.081 20 0 BIADHN C[C@H](c1cccc(Cl)c1)N(C)CC[C@H](C)F ZINC000509310208 534126842 /nfs/dbraw/zinc/12/68/42/534126842.db2.gz KGTMOPACKJMDBR-WDEREUQCSA-N 0 3 243.753 4.081 20 0 BIADHN C[C@H](c1ccccc1Cl)N(C)CCCCF ZINC000509312032 229270002 /nfs/dbraw/zinc/27/00/02/229270002.db2.gz VLDDIXBYVKMKGG-LLVKDONJSA-N 0 3 243.753 4.083 20 0 BIADHN C[C@@H](c1ccccc1Cl)N(C)CCCCF ZINC000509312033 229269680 /nfs/dbraw/zinc/26/96/80/229269680.db2.gz VLDDIXBYVKMKGG-NSHDSACASA-N 0 3 243.753 4.083 20 0 BIADHN C[C@@H](F)CCN(C)[C@H](C)c1ccccc1Cl ZINC000509312042 534275843 /nfs/dbraw/zinc/27/58/43/534275843.db2.gz VTOQWYUFDRCDTG-GHMZBOCLSA-N 0 3 243.753 4.081 20 0 BIADHN C[C@@H](F)CCN(C)[C@@H](C)c1ccccc1Cl ZINC000509312043 534275543 /nfs/dbraw/zinc/27/55/43/534275543.db2.gz VTOQWYUFDRCDTG-MNOVXSKESA-N 0 3 243.753 4.081 20 0 BIADHN C[C@H](F)CCN(C)[C@@H](C)c1ccccc1Cl ZINC000509312044 229270880 /nfs/dbraw/zinc/27/08/80/229270880.db2.gz VTOQWYUFDRCDTG-QWRGUYRKSA-N 0 3 243.753 4.081 20 0 BIADHN C[C@H](c1ccccc1Cl)N(C)CC[C@H](C)F ZINC000509312045 534137911 /nfs/dbraw/zinc/13/79/11/534137911.db2.gz VTOQWYUFDRCDTG-WDEREUQCSA-N 0 3 243.753 4.081 20 0 BIADHN C[C@@H](F)CCN(C)[C@@H](C)c1cc2ccccc2o1 ZINC000509854135 534275780 /nfs/dbraw/zinc/27/57/80/534275780.db2.gz VAFWPHNJZLQRCD-NEPJUHHUSA-N 0 3 249.329 4.174 20 0 BIADHN C[C@H](c1cc2ccccc2o1)N(C)CC[C@H](C)F ZINC000509854146 229286641 /nfs/dbraw/zinc/28/66/41/229286641.db2.gz VAFWPHNJZLQRCD-NWDGAFQWSA-N 0 3 249.329 4.174 20 0 BIADHN C[C@H](F)CCN(C)[C@@H](C)c1cc2ccccc2o1 ZINC000509854148 229286537 /nfs/dbraw/zinc/28/65/37/229286537.db2.gz VAFWPHNJZLQRCD-RYUDHWBXSA-N 0 3 249.329 4.174 20 0 BIADHN C[C@@H](F)CCN(C)[C@H](C)c1cc2ccccc2o1 ZINC000509854149 534275335 /nfs/dbraw/zinc/27/53/35/534275335.db2.gz VAFWPHNJZLQRCD-VXGBXAGGSA-N 0 3 249.329 4.174 20 0 BIADHN Cc1c2ccccc2oc1[C@@H](C)NCC[C@H](C)F ZINC000510810839 229306936 /nfs/dbraw/zinc/30/69/36/229306936.db2.gz LECSTEYNDGMLBP-CMPLNLGQSA-N 0 3 249.329 4.140 20 0 BIADHN Cc1c2ccccc2oc1[C@H](C)NCC[C@H](C)F ZINC000510810840 229306678 /nfs/dbraw/zinc/30/66/78/229306678.db2.gz LECSTEYNDGMLBP-JQWIXIFHSA-N 0 3 249.329 4.140 20 0 BIADHN Cc1c2ccccc2oc1[C@H](C)NCC[C@@H](C)F ZINC000510810841 229306767 /nfs/dbraw/zinc/30/67/67/229306767.db2.gz LECSTEYNDGMLBP-PWSUYJOCSA-N 0 3 249.329 4.140 20 0 BIADHN Cc1c2ccccc2oc1[C@@H](C)NCC[C@@H](C)F ZINC000510810843 229307409 /nfs/dbraw/zinc/30/74/09/229307409.db2.gz LECSTEYNDGMLBP-ZYHUDNBSSA-N 0 3 249.329 4.140 20 0 BIADHN C[C@@H]1CCCCCN1Cc1cccc(Cl)c1 ZINC000512149304 229334959 /nfs/dbraw/zinc/33/49/59/229334959.db2.gz TWDYWFMJAGVDQG-GFCCVEGCSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@H]1CCCCCN1Cc1cccc(Cl)c1 ZINC000512149305 229335282 /nfs/dbraw/zinc/33/52/82/229335282.db2.gz TWDYWFMJAGVDQG-LBPRGKRZSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@@H]1CCCCCN1Cc1ccc(Cl)cc1 ZINC000512174392 229335166 /nfs/dbraw/zinc/33/51/66/229335166.db2.gz HTOQQXOPFNGSFP-GFCCVEGCSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@H]1CCCCCN1Cc1ccc(Cl)cc1 ZINC000512174393 229334732 /nfs/dbraw/zinc/33/47/32/229334732.db2.gz HTOQQXOPFNGSFP-LBPRGKRZSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@@H]1CCCCCN1Cc1ccccc1Cl ZINC000512183547 229335645 /nfs/dbraw/zinc/33/56/45/229335645.db2.gz MXYPJODIXOKLMY-GFCCVEGCSA-N 0 3 237.774 4.105 20 0 BIADHN C[C@H]1CCCCCN1Cc1ccccc1Cl ZINC000512183549 229335901 /nfs/dbraw/zinc/33/59/01/229335901.db2.gz MXYPJODIXOKLMY-LBPRGKRZSA-N 0 3 237.774 4.105 20 0 BIADHN c1ccc2c(c1)CN(CC1CC1)Cc1ccccc1-2 ZINC000513150300 229391996 /nfs/dbraw/zinc/39/19/96/229391996.db2.gz PCAPLTDGYPDLSE-UHFFFAOYSA-N 0 3 249.357 4.079 20 0 BIADHN Cc1ccnc([C@H](C)NCCCC2CCCC2)c1 ZINC000513685018 388440663 /nfs/dbraw/zinc/44/06/63/388440663.db2.gz WERGUFOSQVGRID-AWEZNQCLSA-N 0 3 246.398 4.011 20 0 BIADHN Cc1ccnc([C@@H](C)NCCCC2CCCC2)c1 ZINC000513685019 388440494 /nfs/dbraw/zinc/44/04/94/388440494.db2.gz WERGUFOSQVGRID-CQSZACIVSA-N 0 3 246.398 4.011 20 0 BIADHN Cc1ccnc([C@H](C)NCCC2CCCCC2)c1 ZINC000513698249 388441173 /nfs/dbraw/zinc/44/11/73/388441173.db2.gz YGHMMRLLJRGGLE-AWEZNQCLSA-N 0 3 246.398 4.011 20 0 BIADHN Cc1ccnc([C@@H](C)NCCC2CCCCC2)c1 ZINC000513698250 388441204 /nfs/dbraw/zinc/44/12/04/388441204.db2.gz YGHMMRLLJRGGLE-CQSZACIVSA-N 0 3 246.398 4.011 20 0 BIADHN CCN(Cc1ccc(Cl)s1)CC1(C)CC1 ZINC000514904874 387310753 /nfs/dbraw/zinc/31/07/53/387310753.db2.gz ZVFLLKRGYXMFHN-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CCCN(C)[C@@H](C)c1ccc(Cl)cc1Cl ZINC000515246612 387350824 /nfs/dbraw/zinc/35/08/24/387350824.db2.gz DKXHPILJYJEQPZ-VIFPVBQESA-N 0 3 246.181 4.396 20 0 BIADHN CC(C)=CCN(Cc1cccc(F)c1)C(C)C ZINC000516307611 387500073 /nfs/dbraw/zinc/50/00/73/387500073.db2.gz WXYCRKYUVDDSKY-UHFFFAOYSA-N 0 3 235.346 4.002 20 0 BIADHN C[C@@H](c1ccc(Cl)cc1)N1C2CCC1CC2 ZINC000516562010 388344653 /nfs/dbraw/zinc/34/46/53/388344653.db2.gz RVPFRHRVWGNAIB-FNBIGBAISA-N 0 3 235.758 4.028 20 0 BIADHN C[C@H](c1ccc(Cl)cc1)N1C2CCC1CC2 ZINC000516562013 388344640 /nfs/dbraw/zinc/34/46/40/388344640.db2.gz RVPFRHRVWGNAIB-GWMXKSKGSA-N 0 3 235.758 4.028 20 0 BIADHN CCN(CC=C(C)C)[C@@H](C)c1cccc(OC)c1 ZINC000516617783 256797328 /nfs/dbraw/zinc/79/73/28/256797328.db2.gz XUBLJOIUBDYAMV-AWEZNQCLSA-N 0 3 247.382 4.044 20 0 BIADHN CCN(CC=C(C)C)[C@H](C)c1cccc(OC)c1 ZINC000516617784 388396704 /nfs/dbraw/zinc/39/67/04/388396704.db2.gz XUBLJOIUBDYAMV-CQSZACIVSA-N 0 3 247.382 4.044 20 0 BIADHN CCC[C@@H](N[C@@H](C)c1cscn1)C(C)(C)C ZINC000516909214 388523581 /nfs/dbraw/zinc/52/35/81/388523581.db2.gz JSCSTYBUMBAQIN-CMPLNLGQSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](N[C@@H](C)c1cscn1)C(C)(C)C ZINC000516909215 388524008 /nfs/dbraw/zinc/52/40/08/388524008.db2.gz JSCSTYBUMBAQIN-JQWIXIFHSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](N[C@H](C)c1cscn1)C(C)(C)C ZINC000516909216 388523646 /nfs/dbraw/zinc/52/36/46/388523646.db2.gz JSCSTYBUMBAQIN-PWSUYJOCSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@@H](N[C@H](C)c1cscn1)C(C)(C)C ZINC000516909217 388523773 /nfs/dbraw/zinc/52/37/73/388523773.db2.gz JSCSTYBUMBAQIN-ZYHUDNBSSA-N 0 3 240.416 4.009 20 0 BIADHN Cc1cccc2c1[C@H](C)C[C@@H]2N[C@@H]1CCC[C@@H]1F ZINC000517250713 388546014 /nfs/dbraw/zinc/54/60/14/388546014.db2.gz MLZSSJCOJVVXAL-BEAPCOKYSA-N 0 3 247.357 4.024 20 0 BIADHN Cc1cccc2c1[C@H](C)C[C@H]2N[C@@H]1CCC[C@@H]1F ZINC000517250714 256821929 /nfs/dbraw/zinc/82/19/29/256821929.db2.gz MLZSSJCOJVVXAL-FAAHXZRKSA-N 0 3 247.357 4.024 20 0 BIADHN Cc1cccc2c1[C@@H](C)C[C@@H]2N[C@@H]1CCC[C@@H]1F ZINC000517250715 388546106 /nfs/dbraw/zinc/54/61/06/388546106.db2.gz MLZSSJCOJVVXAL-MHEUCROKSA-N 0 3 247.357 4.024 20 0 BIADHN Cc1cccc2c1[C@@H](C)C[C@H]2N[C@@H]1CCC[C@@H]1F ZINC000517250716 388545456 /nfs/dbraw/zinc/54/54/56/388545456.db2.gz MLZSSJCOJVVXAL-SPWCGHHHSA-N 0 3 247.357 4.024 20 0 BIADHN CCC1CCN([C@H](C)c2cccc(F)c2)CC1 ZINC000517607641 388555688 /nfs/dbraw/zinc/55/56/88/388555688.db2.gz YCVNVCJNOYIHLF-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN CCC1CCN([C@@H](C)c2cccc(F)c2)CC1 ZINC000517607645 388555513 /nfs/dbraw/zinc/55/55/13/388555513.db2.gz YCVNVCJNOYIHLF-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN CCN(CC=C(C)C)[C@H](C)c1ccc(F)cc1 ZINC000517622078 388555853 /nfs/dbraw/zinc/55/58/53/388555853.db2.gz RRAOWHIPOCCXHA-CYBMUJFWSA-N 0 3 235.346 4.175 20 0 BIADHN CCN(CC=C(C)C)[C@@H](C)c1ccc(F)cc1 ZINC000517622079 388555836 /nfs/dbraw/zinc/55/58/36/388555836.db2.gz RRAOWHIPOCCXHA-ZDUSSCGKSA-N 0 3 235.346 4.175 20 0 BIADHN C[C@@H](c1cccc(Cl)c1)N1C2CCC1CC2 ZINC000518371744 384995520 /nfs/dbraw/zinc/99/55/20/384995520.db2.gz VYXUHMLEHIYKMT-FNBIGBAISA-N 0 3 235.758 4.028 20 0 BIADHN C[C@H](c1cccc(Cl)c1)N1C2CCC1CC2 ZINC000518371745 384994066 /nfs/dbraw/zinc/99/40/66/384994066.db2.gz VYXUHMLEHIYKMT-GWMXKSKGSA-N 0 3 235.758 4.028 20 0 BIADHN CCN(Cc1ccccc1Cl)[C@H](C)C(C)C ZINC000519274184 256646483 /nfs/dbraw/zinc/64/64/83/256646483.db2.gz ATIVXDSPBBXITA-GFCCVEGCSA-N 0 3 239.790 4.206 20 0 BIADHN CC(C)CCN(Cc1ccccc1F)C(C)C ZINC000519908571 386579708 /nfs/dbraw/zinc/57/97/08/386579708.db2.gz DWAWJEVGWYGNLL-UHFFFAOYSA-N 0 3 237.362 4.082 20 0 BIADHN CC(C)=CCN(Cc1ccc(F)cc1)C(C)C ZINC000519918349 491123500 /nfs/dbraw/zinc/12/35/00/491123500.db2.gz NJQFXYNKQFBHED-UHFFFAOYSA-N 0 3 235.346 4.002 20 0 BIADHN CCCCN(CC)Cc1ccccc1OC(C)C ZINC000519997418 385142356 /nfs/dbraw/zinc/14/23/56/385142356.db2.gz MTTRJKLLEFVDDR-UHFFFAOYSA-N 0 3 249.398 4.096 20 0 BIADHN CCC[C@H](C)N(C)Cc1ccccc1OC(C)C ZINC000520451611 386678652 /nfs/dbraw/zinc/67/86/52/386678652.db2.gz VSFKFQOBXDYSKN-AWEZNQCLSA-N 0 3 249.398 4.094 20 0 BIADHN CCC[C@@H](C)N(C)Cc1ccccc1OC(C)C ZINC000520451612 386677649 /nfs/dbraw/zinc/67/76/49/386677649.db2.gz VSFKFQOBXDYSKN-CQSZACIVSA-N 0 3 249.398 4.094 20 0 BIADHN C[C@H](C1CC1)N(Cc1ccccc1Cl)C1CC1 ZINC000520794036 388000074 /nfs/dbraw/zinc/00/00/74/388000074.db2.gz JBUUCFGNHJGFDR-LLVKDONJSA-N 0 3 249.785 4.103 20 0 BIADHN C[C@@H](C1CC1)N(Cc1ccccc1Cl)C1CC1 ZINC000520794039 387999939 /nfs/dbraw/zinc/99/99/39/387999939.db2.gz JBUUCFGNHJGFDR-NSHDSACASA-N 0 3 249.785 4.103 20 0 BIADHN CN(Cc1cccs1)[C@@H]1C=CCCCCC1 ZINC000520846576 384170463 /nfs/dbraw/zinc/17/04/63/384170463.db2.gz YMNONXVXBDVRSC-CYBMUJFWSA-N 0 3 235.396 4.069 20 0 BIADHN CN(Cc1cccs1)[C@H]1C=CCCCCC1 ZINC000520846577 384171909 /nfs/dbraw/zinc/17/19/09/384171909.db2.gz YMNONXVXBDVRSC-ZDUSSCGKSA-N 0 3 235.396 4.069 20 0 BIADHN CCCN(CC=C(C)C)Cc1ccc(F)cc1 ZINC000521196601 324178619 /nfs/dbraw/zinc/17/86/19/324178619.db2.gz ORHRYSFYVSMOQJ-UHFFFAOYSA-N 0 3 235.346 4.004 20 0 BIADHN CCCN(CC)Cc1ccc(Cl)cc1Cl ZINC000521814399 388628847 /nfs/dbraw/zinc/62/88/47/388628847.db2.gz ZGCIXPAFSVCEMK-UHFFFAOYSA-N 0 3 246.181 4.225 20 0 BIADHN CCN(CC=C(C)C)Cc1ccc(Cl)cc1 ZINC000521821732 388630807 /nfs/dbraw/zinc/63/08/07/388630807.db2.gz SILIKFYICTULCS-UHFFFAOYSA-N 0 3 237.774 4.128 20 0 BIADHN C[C@@H](N(C)c1ccnc2ccccc21)C(C)(C)C ZINC000522182790 388716294 /nfs/dbraw/zinc/71/62/94/388716294.db2.gz SNZHKPGAFBUHPW-GFCCVEGCSA-N 0 3 242.366 4.106 20 0 BIADHN C[C@H](N(C)c1ccnc2ccccc21)C(C)(C)C ZINC000522182791 388716258 /nfs/dbraw/zinc/71/62/58/388716258.db2.gz SNZHKPGAFBUHPW-LBPRGKRZSA-N 0 3 242.366 4.106 20 0 BIADHN CC(C)=CCN(Cc1ccc(F)cc1)CC1CC1 ZINC000522417610 388753656 /nfs/dbraw/zinc/75/36/56/388753656.db2.gz FKUDWZIRMKIZPE-UHFFFAOYSA-N 0 3 247.357 4.004 20 0 BIADHN Cc1cccc(CNC(C)(C)c2cccs2)c1 ZINC000522650392 388769184 /nfs/dbraw/zinc/76/91/84/388769184.db2.gz KPCMXBDAUNDHRV-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN CCN1CCCCC[C@H]1c1ccc(Cl)cc1 ZINC000522712273 259376116 /nfs/dbraw/zinc/37/61/16/259376116.db2.gz ISZLMUHKTAELIB-AWEZNQCLSA-N 0 3 237.774 4.277 20 0 BIADHN CCN1CCCCC[C@@H]1c1ccc(Cl)cc1 ZINC000522712274 259376148 /nfs/dbraw/zinc/37/61/48/259376148.db2.gz ISZLMUHKTAELIB-CQSZACIVSA-N 0 3 237.774 4.277 20 0 BIADHN Cc1ccc(CNC(C)(C)c2cccs2)cc1 ZINC000523976885 398116007 /nfs/dbraw/zinc/11/60/07/398116007.db2.gz GZCISMPBAVZAEO-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN CC(C)=CCN1CC[C@H](C)C[C@H]1c1ccco1 ZINC000524751770 388407086 /nfs/dbraw/zinc/40/70/86/388407086.db2.gz NFUNFPRDSJDCCM-KBPBESRZSA-N 0 3 233.355 4.019 20 0 BIADHN CC(C)=CCN1CC[C@@H](C)C[C@H]1c1ccco1 ZINC000524751772 388406649 /nfs/dbraw/zinc/40/66/49/388406649.db2.gz NFUNFPRDSJDCCM-KGLIPLIRSA-N 0 3 233.355 4.019 20 0 BIADHN CC(C)=CCN1CC[C@H](C)C[C@@H]1c1ccco1 ZINC000524751773 388407188 /nfs/dbraw/zinc/40/71/88/388407188.db2.gz NFUNFPRDSJDCCM-UONOGXRCSA-N 0 3 233.355 4.019 20 0 BIADHN CC(C)=CCN1CC[C@@H](C)C[C@@H]1c1ccco1 ZINC000524751774 388406937 /nfs/dbraw/zinc/40/69/37/388406937.db2.gz NFUNFPRDSJDCCM-ZIAGYGMSSA-N 0 3 233.355 4.019 20 0 BIADHN CC(C)=CCN1C[C@@H](C)C[C@H]1c1cccc(F)c1 ZINC000524755009 388407616 /nfs/dbraw/zinc/40/76/16/388407616.db2.gz OPYGMUVWFCSXDD-BBRMVZONSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)=CCN1C[C@H](C)C[C@H]1c1cccc(F)c1 ZINC000524755010 388407496 /nfs/dbraw/zinc/40/74/96/388407496.db2.gz OPYGMUVWFCSXDD-CJNGLKHVSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)=CCN1C[C@H](C)C[C@@H]1c1cccc(F)c1 ZINC000524755011 388408172 /nfs/dbraw/zinc/40/81/72/388408172.db2.gz OPYGMUVWFCSXDD-CZUORRHYSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)=CCN1C[C@@H](C)C[C@@H]1c1cccc(F)c1 ZINC000524755012 388408390 /nfs/dbraw/zinc/40/83/90/388408390.db2.gz OPYGMUVWFCSXDD-XJKSGUPXSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)=CCN1C[C@@H](C)C[C@H]1c1ccccc1F ZINC000525273222 388423933 /nfs/dbraw/zinc/42/39/33/388423933.db2.gz RMMYIMNNKCQGBV-BBRMVZONSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)=CCN1C[C@H](C)C[C@H]1c1ccccc1F ZINC000525273223 388423884 /nfs/dbraw/zinc/42/38/84/388423884.db2.gz RMMYIMNNKCQGBV-CJNGLKHVSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)=CCN1C[C@H](C)C[C@@H]1c1ccccc1F ZINC000525273224 388423614 /nfs/dbraw/zinc/42/36/14/388423614.db2.gz RMMYIMNNKCQGBV-CZUORRHYSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)=CCN1C[C@@H](C)C[C@@H]1c1ccccc1F ZINC000525273225 388423900 /nfs/dbraw/zinc/42/39/00/388423900.db2.gz RMMYIMNNKCQGBV-XJKSGUPXSA-N 0 3 247.357 4.175 20 0 BIADHN CC(C)CN(C)Cc1cc(Cl)ccc1Cl ZINC000525632780 259352345 /nfs/dbraw/zinc/35/23/45/259352345.db2.gz IIUQYAMMJBOHAF-UHFFFAOYSA-N 0 3 246.181 4.081 20 0 BIADHN CCN(Cc1cc(Cl)ccc1Cl)C(C)C ZINC000525633419 384457166 /nfs/dbraw/zinc/45/71/66/384457166.db2.gz OVOVQPAABRWMSI-UHFFFAOYSA-N 0 3 246.181 4.224 20 0 BIADHN C[C@@H](CN1C2CCC1CC2)c1cccc(Cl)c1 ZINC000525865336 386512636 /nfs/dbraw/zinc/51/26/36/386512636.db2.gz MDEYNZINMLUWEM-QGLTVNCISA-N 0 3 249.785 4.070 20 0 BIADHN C[C@H](CN1C2CCC1CC2)c1cccc(Cl)c1 ZINC000525865337 386510576 /nfs/dbraw/zinc/51/05/76/386510576.db2.gz MDEYNZINMLUWEM-VCANKDNSSA-N 0 3 249.785 4.070 20 0 BIADHN Cc1ccccc1[C@H](C(C)C)N(C)CC1(F)CC1 ZINC000525978558 388442172 /nfs/dbraw/zinc/44/21/72/388442172.db2.gz VXXVZHVFNUVRLP-HNNXBMFYSA-N 0 3 249.373 4.126 20 0 BIADHN Cc1ccccc1[C@@H](C(C)C)N(C)CC1(F)CC1 ZINC000525978559 388441537 /nfs/dbraw/zinc/44/15/37/388441537.db2.gz VXXVZHVFNUVRLP-OAHLLOKOSA-N 0 3 249.373 4.126 20 0 BIADHN FC1(CN2CCCCC[C@H]2c2ccccc2)CC1 ZINC000526970056 323309593 /nfs/dbraw/zinc/30/95/93/323309593.db2.gz FBHUYLQNYYFEKA-HNNXBMFYSA-N 0 3 247.357 4.106 20 0 BIADHN FC1(CN2CCCCC[C@@H]2c2ccccc2)CC1 ZINC000526970059 323309535 /nfs/dbraw/zinc/30/95/35/323309535.db2.gz FBHUYLQNYYFEKA-OAHLLOKOSA-N 0 3 247.357 4.106 20 0 BIADHN CCC(C)(C)N(C)Cc1sccc1Cl ZINC000526989643 386726827 /nfs/dbraw/zinc/72/68/27/386726827.db2.gz AQCOXULAHPBSOI-UHFFFAOYSA-N 0 3 231.792 4.022 20 0 BIADHN C[C@H](CN1CCC12CCC2)c1cccc(Cl)c1 ZINC000527116436 387483717 /nfs/dbraw/zinc/48/37/17/387483717.db2.gz IOIHCHFUBGIKLG-GFCCVEGCSA-N 0 3 249.785 4.072 20 0 BIADHN C[C@@H](CN1CCC12CCC2)c1cccc(Cl)c1 ZINC000527116437 387485139 /nfs/dbraw/zinc/48/51/39/387485139.db2.gz IOIHCHFUBGIKLG-LBPRGKRZSA-N 0 3 249.785 4.072 20 0 BIADHN CC[C@@H](CN(CC)CC1(F)CC1)c1ccccc1 ZINC000527233621 262834928 /nfs/dbraw/zinc/83/49/28/262834928.db2.gz MFOBUZKOGWSEIO-AWEZNQCLSA-N 0 3 249.373 4.004 20 0 BIADHN CC[C@H](CN(CC)CC1(F)CC1)c1ccccc1 ZINC000527233622 387543262 /nfs/dbraw/zinc/54/32/62/387543262.db2.gz MFOBUZKOGWSEIO-CQSZACIVSA-N 0 3 249.373 4.004 20 0 BIADHN CCN(Cc1sccc1Cl)CC1CCC1 ZINC000527249822 387549552 /nfs/dbraw/zinc/54/95/52/387549552.db2.gz IDWFJBYHBIJLTJ-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN Cc1cccc([C@@H](NCc2ccoc2)C(C)C)c1 ZINC000527806761 387730043 /nfs/dbraw/zinc/73/00/43/387730043.db2.gz APEDKCGTUPXCBO-INIZCTEOSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1cccc([C@H](NCc2ccoc2)C(C)C)c1 ZINC000527806763 387732397 /nfs/dbraw/zinc/73/23/97/387732397.db2.gz APEDKCGTUPXCBO-MRXNPFEDSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1cccc([C@@H](NCc2ccco2)C(C)C)c1 ZINC000527813625 323698421 /nfs/dbraw/zinc/69/84/21/323698421.db2.gz MOPXNOHUYUTAGR-INIZCTEOSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1cccc([C@H](NCc2ccco2)C(C)C)c1 ZINC000527813633 323698101 /nfs/dbraw/zinc/69/81/01/323698101.db2.gz MOPXNOHUYUTAGR-MRXNPFEDSA-N 0 3 243.350 4.075 20 0 BIADHN C/C(Cl)=C\CN1CCC[C@@H]1c1cccs1 ZINC000528334951 387892518 /nfs/dbraw/zinc/89/25/18/387892518.db2.gz BFDITLPTPFSVCP-CDCCAWJDSA-N 0 3 241.787 4.028 20 0 BIADHN C/C(Cl)=C\CN1CCC[C@H]1c1cccs1 ZINC000528334960 387892971 /nfs/dbraw/zinc/89/29/71/387892971.db2.gz BFDITLPTPFSVCP-RUYJGKKWSA-N 0 3 241.787 4.028 20 0 BIADHN C/C(Cl)=C/CN1CCC[C@@H]1c1cccs1 ZINC000528334963 387893207 /nfs/dbraw/zinc/89/32/07/387893207.db2.gz BFDITLPTPFSVCP-SDKXAQGSSA-N 0 3 241.787 4.028 20 0 BIADHN C/C(Cl)=C/CN1CCC[C@H]1c1cccs1 ZINC000528334967 387895483 /nfs/dbraw/zinc/89/54/83/387895483.db2.gz BFDITLPTPFSVCP-YAEJEKNGSA-N 0 3 241.787 4.028 20 0 BIADHN CC(C)=CCN[C@H](C)c1cc2cccc(F)c2o1 ZINC000530499914 322816521 /nfs/dbraw/zinc/81/65/21/322816521.db2.gz SPOHGTMWOHIYGG-LLVKDONJSA-N 0 3 247.313 4.189 20 0 BIADHN CC(C)=CCN[C@@H](C)c1cc2cccc(F)c2o1 ZINC000530499915 322816349 /nfs/dbraw/zinc/81/63/49/322816349.db2.gz SPOHGTMWOHIYGG-NSHDSACASA-N 0 3 247.313 4.189 20 0 BIADHN C[C@H](N[C@H](c1cccs1)C1CC1)c1ccoc1 ZINC000531688184 323111628 /nfs/dbraw/zinc/11/16/28/323111628.db2.gz XENHIJOEURSYDY-HZMBPMFUSA-N 0 3 247.363 4.143 20 0 BIADHN C[C@H](N[C@@H](c1cccs1)C1CC1)c1ccoc1 ZINC000531688185 323111588 /nfs/dbraw/zinc/11/15/88/323111588.db2.gz XENHIJOEURSYDY-IINYFYTJSA-N 0 3 247.363 4.143 20 0 BIADHN C[C@@H](N[C@@H](c1cccs1)C1CC1)c1ccoc1 ZINC000531688186 323111622 /nfs/dbraw/zinc/11/16/22/323111622.db2.gz XENHIJOEURSYDY-QMTHXVAHSA-N 0 3 247.363 4.143 20 0 BIADHN C[C@@H](N[C@H](c1cccs1)C1CC1)c1ccoc1 ZINC000531688187 323111602 /nfs/dbraw/zinc/11/16/02/323111602.db2.gz XENHIJOEURSYDY-YGRLFVJLSA-N 0 3 247.363 4.143 20 0 BIADHN CC[C@@H](NCC(C)(C)C)c1cc(F)ccc1F ZINC000532204463 323209116 /nfs/dbraw/zinc/20/91/16/323209116.db2.gz GNFLCWMJJROZCU-CYBMUJFWSA-N 0 3 241.325 4.052 20 0 BIADHN CC[C@H](NCC(C)(C)C)c1cc(F)ccc1F ZINC000532204465 323209026 /nfs/dbraw/zinc/20/90/26/323209026.db2.gz GNFLCWMJJROZCU-ZDUSSCGKSA-N 0 3 241.325 4.052 20 0 BIADHN CC[C@@H](CN[C@@H](C)c1ccco1)c1ccccc1 ZINC000532208975 323209846 /nfs/dbraw/zinc/20/98/46/323209846.db2.gz JEIGMZALLABOFH-KBPBESRZSA-N 0 3 243.350 4.124 20 0 BIADHN CC[C@@H](CN[C@H](C)c1ccco1)c1ccccc1 ZINC000532208976 323209931 /nfs/dbraw/zinc/20/99/31/323209931.db2.gz JEIGMZALLABOFH-KGLIPLIRSA-N 0 3 243.350 4.124 20 0 BIADHN CC[C@H](CN[C@@H](C)c1ccco1)c1ccccc1 ZINC000532208977 323209663 /nfs/dbraw/zinc/20/96/63/323209663.db2.gz JEIGMZALLABOFH-UONOGXRCSA-N 0 3 243.350 4.124 20 0 BIADHN CC[C@H](CN[C@H](C)c1ccco1)c1ccccc1 ZINC000532208978 323209850 /nfs/dbraw/zinc/20/98/50/323209850.db2.gz JEIGMZALLABOFH-ZIAGYGMSSA-N 0 3 243.350 4.124 20 0 BIADHN C[C@@H](c1ccc(F)cc1F)N(C)CC(C)(C)C ZINC000532548803 323276156 /nfs/dbraw/zinc/27/61/56/323276156.db2.gz ORDIGZYVWUUFGU-JTQLQIEISA-N 0 3 241.325 4.004 20 0 BIADHN C[C@H](c1ccc(F)cc1F)N(C)CC(C)(C)C ZINC000532548804 323276367 /nfs/dbraw/zinc/27/63/67/323276367.db2.gz ORDIGZYVWUUFGU-SNVBAGLBSA-N 0 3 241.325 4.004 20 0 BIADHN C[C@H](c1ccco1)N(CCC(C)(C)C)C1CC1 ZINC000532724119 323292244 /nfs/dbraw/zinc/29/22/44/323292244.db2.gz VOECNVOPTCKUAX-GFCCVEGCSA-N 0 3 235.371 4.241 20 0 BIADHN C[C@@H](c1ccco1)N(CCC(C)(C)C)C1CC1 ZINC000532724120 323292213 /nfs/dbraw/zinc/29/22/13/323292213.db2.gz VOECNVOPTCKUAX-LBPRGKRZSA-N 0 3 235.371 4.241 20 0 BIADHN CC[C@H](c1ccccc1)N(C)CCC(F)(F)F ZINC000533032077 387919897 /nfs/dbraw/zinc/91/98/97/387919897.db2.gz DQJCTOQNCVFFHU-GFCCVEGCSA-N 0 3 245.288 4.022 20 0 BIADHN CC[C@@H](c1ccccc1)N(C)CCC(F)(F)F ZINC000533032078 387920412 /nfs/dbraw/zinc/92/04/12/387920412.db2.gz DQJCTOQNCVFFHU-LBPRGKRZSA-N 0 3 245.288 4.022 20 0 BIADHN Cc1ccccc1[C@@H](C)N(C)Cc1cccs1 ZINC000533240994 388034210 /nfs/dbraw/zinc/03/42/10/388034210.db2.gz AXKVREGTMIBJPO-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccccc1[C@H](C)N(C)Cc1cccs1 ZINC000533240995 388033740 /nfs/dbraw/zinc/03/37/40/388033740.db2.gz AXKVREGTMIBJPO-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN CC(C)N(Cc1ccccc1Cl)C1CCC1 ZINC000533394534 384261347 /nfs/dbraw/zinc/26/13/47/384261347.db2.gz BFRDMVRRFNLRCH-UHFFFAOYSA-N 0 3 237.774 4.103 20 0 BIADHN Cc1ccc(CN(C)[C@H](C)c2ccccc2)s1 ZINC000533412647 342837387 /nfs/dbraw/zinc/83/73/87/342837387.db2.gz RLEOCSDNAILKJI-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1ccc(CN(C)[C@@H](C)c2ccccc2)s1 ZINC000533412657 342837351 /nfs/dbraw/zinc/83/73/51/342837351.db2.gz RLEOCSDNAILKJI-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN C[C@@H](c1cc(F)ccc1F)N(C)CC(C)(C)C ZINC000533416313 384283318 /nfs/dbraw/zinc/28/33/18/384283318.db2.gz VRRYDLDGOIVGOH-JTQLQIEISA-N 0 3 241.325 4.004 20 0 BIADHN C[C@H](c1cc(F)ccc1F)N(C)CC(C)(C)C ZINC000533416314 384284274 /nfs/dbraw/zinc/28/42/74/384284274.db2.gz VRRYDLDGOIVGOH-SNVBAGLBSA-N 0 3 241.325 4.004 20 0 BIADHN CCC[C@]1(C)CCCN([C@H](C)c2ccccn2)C1 ZINC000533448609 384328850 /nfs/dbraw/zinc/32/88/50/384328850.db2.gz NSNKWSFLRRKHOP-GDBMZVCRSA-N 0 3 246.398 4.045 20 0 BIADHN CCC[C@]1(C)CCCN([C@@H](C)c2ccccn2)C1 ZINC000533448610 384329543 /nfs/dbraw/zinc/32/95/43/384329543.db2.gz NSNKWSFLRRKHOP-GOEBONIOSA-N 0 3 246.398 4.045 20 0 BIADHN CCC[C@@]1(C)CCCN([C@@H](C)c2ccccn2)C1 ZINC000533448611 384328834 /nfs/dbraw/zinc/32/88/34/384328834.db2.gz NSNKWSFLRRKHOP-HOCLYGCPSA-N 0 3 246.398 4.045 20 0 BIADHN CCC[C@@]1(C)CCCN([C@H](C)c2ccccn2)C1 ZINC000533448612 384329843 /nfs/dbraw/zinc/32/98/43/384329843.db2.gz NSNKWSFLRRKHOP-ZBFHGGJFSA-N 0 3 246.398 4.045 20 0 BIADHN CC1=CCN([C@H](C)c2cccc(Cl)c2)CC1 ZINC000533764763 384187319 /nfs/dbraw/zinc/18/73/19/384187319.db2.gz PSALKSKDPHZBJA-GFCCVEGCSA-N 0 3 235.758 4.053 20 0 BIADHN CC1=CCN([C@@H](C)c2cccc(Cl)c2)CC1 ZINC000533764764 384186395 /nfs/dbraw/zinc/18/63/95/384186395.db2.gz PSALKSKDPHZBJA-LBPRGKRZSA-N 0 3 235.758 4.053 20 0 BIADHN CCN(Cc1ccsc1)Cc1ccc(C)cc1 ZINC000534336901 323117953 /nfs/dbraw/zinc/11/79/53/323117953.db2.gz BHYGRVWCFYECDS-UHFFFAOYSA-N 0 3 245.391 4.079 20 0 BIADHN CC1=CCN([C@H](C)c2ccccc2Cl)CC1 ZINC000534471896 323152829 /nfs/dbraw/zinc/15/28/29/323152829.db2.gz BYKFKHSQMRTIQI-GFCCVEGCSA-N 0 3 235.758 4.053 20 0 BIADHN CC1=CCN([C@@H](C)c2ccccc2Cl)CC1 ZINC000534471897 323152832 /nfs/dbraw/zinc/15/28/32/323152832.db2.gz BYKFKHSQMRTIQI-LBPRGKRZSA-N 0 3 235.758 4.053 20 0 BIADHN CC(C)(C)c1ccc(CN2C3CCC2CC3)s1 ZINC000535780254 323191161 /nfs/dbraw/zinc/19/11/61/323191161.db2.gz HTQRJCODCOTKJL-UHFFFAOYSA-N 0 3 249.423 4.172 20 0 BIADHN CCCN(Cc1ccco1)Cc1ccc(C)cc1 ZINC000535781932 323191217 /nfs/dbraw/zinc/19/12/17/323191217.db2.gz SBQRQWVUXOVFGJ-UHFFFAOYSA-N 0 3 243.350 4.000 20 0 BIADHN CCN(C)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000535782178 323191254 /nfs/dbraw/zinc/19/12/54/323191254.db2.gz XLQFZCFGTRSMRY-UHFFFAOYSA-N 0 3 249.741 4.052 20 0 BIADHN C[C@@H](N(C)Cc1ccc(Cl)s1)C1(C)CC1 ZINC000535825763 323192779 /nfs/dbraw/zinc/19/27/79/323192779.db2.gz QJBRWVQVTLTUNV-SECBINFHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H](N(C)Cc1ccc(Cl)s1)C1(C)CC1 ZINC000535825764 323192859 /nfs/dbraw/zinc/19/28/59/323192859.db2.gz QJBRWVQVTLTUNV-VIFPVBQESA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)CN(Cc1ccc(Cl)s1)C1CC1 ZINC000536634510 323199051 /nfs/dbraw/zinc/19/90/51/323199051.db2.gz KJPZQHQVHLVAGD-UHFFFAOYSA-N 0 3 243.803 4.022 20 0 BIADHN CCC(CC)N(Cc1ccc(Cl)o1)C1CC1 ZINC000536650077 323199698 /nfs/dbraw/zinc/19/96/98/323199698.db2.gz FMWKCHOMBCQOIK-UHFFFAOYSA-N 0 3 241.762 4.086 20 0 BIADHN CC(C)N(Cc1ccc([C@H]2C[C@H]2C)o1)C1CCC1 ZINC000536659228 323199799 /nfs/dbraw/zinc/19/97/99/323199799.db2.gz PFHFUZPPTSCXON-DOMZBBRYSA-N 0 3 247.382 4.166 20 0 BIADHN CC(C)N(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CCC1 ZINC000536659229 323199806 /nfs/dbraw/zinc/19/98/06/323199806.db2.gz PFHFUZPPTSCXON-IUODEOHRSA-N 0 3 247.382 4.166 20 0 BIADHN CC(C)N(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CCC1 ZINC000536659230 323199848 /nfs/dbraw/zinc/19/98/48/323199848.db2.gz PFHFUZPPTSCXON-SWLSCSKDSA-N 0 3 247.382 4.166 20 0 BIADHN CC(C)N(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CCC1 ZINC000536659231 323199796 /nfs/dbraw/zinc/19/97/96/323199796.db2.gz PFHFUZPPTSCXON-WFASDCNBSA-N 0 3 247.382 4.166 20 0 BIADHN CCc1c2cc(C)ccc2oc1[C@@H](C)NC1CC1 ZINC000537294296 324062746 /nfs/dbraw/zinc/06/27/46/324062746.db2.gz CAEVLXKAEOBCAJ-LLVKDONJSA-N 0 3 243.350 4.117 20 0 BIADHN CCc1c2cc(C)ccc2oc1[C@H](C)NC1CC1 ZINC000537294313 324062827 /nfs/dbraw/zinc/06/28/27/324062827.db2.gz CAEVLXKAEOBCAJ-NSHDSACASA-N 0 3 243.350 4.117 20 0 BIADHN CC(C)N(Cc1ccc(Cl)s1)C1CCC1 ZINC000537616304 324092835 /nfs/dbraw/zinc/09/28/35/324092835.db2.gz LEBUKNVHDUTHRD-UHFFFAOYSA-N 0 3 243.803 4.164 20 0 BIADHN CC1=CCN(Cc2cc3ccccc3s2)CC1 ZINC000537627588 360376475 /nfs/dbraw/zinc/37/64/75/360376475.db2.gz YVLUIDUEWUDGJA-UHFFFAOYSA-N 0 3 243.375 4.053 20 0 BIADHN C[C@H]1CCCN1Cc1c(Cl)oc2ccccc21 ZINC000537632021 324090280 /nfs/dbraw/zinc/09/02/80/324090280.db2.gz MBVDOFQKKCIOEB-JTQLQIEISA-N 0 3 249.741 4.071 20 0 BIADHN C[C@@H]1CCCN1Cc1c(Cl)oc2ccccc21 ZINC000537632022 324089769 /nfs/dbraw/zinc/08/97/69/324089769.db2.gz MBVDOFQKKCIOEB-SNVBAGLBSA-N 0 3 249.741 4.071 20 0 BIADHN CCN[C@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000538393266 324674960 /nfs/dbraw/zinc/67/49/60/324674960.db2.gz KSBNOZJRAWUHJF-LLVKDONJSA-N 0 3 239.318 4.257 20 0 BIADHN CCN[C@@H](C)c1cc2c(ccc3ccccc23)o1 ZINC000538393270 388686254 /nfs/dbraw/zinc/68/62/54/388686254.db2.gz KSBNOZJRAWUHJF-NSHDSACASA-N 0 3 239.318 4.257 20 0 BIADHN Cc1ccc(C)c([C@H](C)N(C)Cc2ccco2)c1 ZINC000538720103 388710634 /nfs/dbraw/zinc/71/06/34/388710634.db2.gz GVARYSVGLMPAQI-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc(C)c([C@@H](C)N(C)Cc2ccco2)c1 ZINC000538720104 388711168 /nfs/dbraw/zinc/71/11/68/388711168.db2.gz GVARYSVGLMPAQI-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN c1c2ccccc2sc1CN1CCC12CCC2 ZINC000538736620 388714873 /nfs/dbraw/zinc/71/48/73/388714873.db2.gz RTBPYNAFDCVAFY-UHFFFAOYSA-N 0 3 243.375 4.030 20 0 BIADHN C[C@@H](NCC(C)(C)C1CCCC1)c1ccco1 ZINC000539041323 388745104 /nfs/dbraw/zinc/74/51/04/388745104.db2.gz LTBBCCKFWSECGP-GFCCVEGCSA-N 0 3 235.371 4.147 20 0 BIADHN C[C@H](NCC(C)(C)C1CCCC1)c1ccco1 ZINC000539041324 324820677 /nfs/dbraw/zinc/82/06/77/324820677.db2.gz LTBBCCKFWSECGP-LBPRGKRZSA-N 0 3 235.371 4.147 20 0 BIADHN C[C@@H](NC1CCC1)c1ccc(-c2ccccc2)o1 ZINC000539071540 324823042 /nfs/dbraw/zinc/82/30/42/324823042.db2.gz WGDKLVDOOHNCGT-GFCCVEGCSA-N 0 3 241.334 4.150 20 0 BIADHN C[C@H](NC1CCC1)c1ccc(-c2ccccc2)o1 ZINC000539071542 324822831 /nfs/dbraw/zinc/82/28/31/324822831.db2.gz WGDKLVDOOHNCGT-LBPRGKRZSA-N 0 3 241.334 4.150 20 0 BIADHN CC(C)=CCN[C@@H](C)c1cccc(OC(C)C)c1 ZINC000539224460 324828905 /nfs/dbraw/zinc/82/89/05/324828905.db2.gz DWZAXXOSCQUVGT-AWEZNQCLSA-N 0 3 247.382 4.091 20 0 BIADHN CC(C)=CCN[C@H](C)c1cccc(OC(C)C)c1 ZINC000539224461 388750386 /nfs/dbraw/zinc/75/03/86/388750386.db2.gz DWZAXXOSCQUVGT-CQSZACIVSA-N 0 3 247.382 4.091 20 0 BIADHN CC(C)=CCN[C@@H](C)c1ccccc1OC(C)C ZINC000539226157 324829195 /nfs/dbraw/zinc/82/91/95/324829195.db2.gz RDNDPZHWRMLPQY-AWEZNQCLSA-N 0 3 247.382 4.091 20 0 BIADHN CC(C)=CCN[C@H](C)c1ccccc1OC(C)C ZINC000539226160 388751124 /nfs/dbraw/zinc/75/11/24/388751124.db2.gz RDNDPZHWRMLPQY-CQSZACIVSA-N 0 3 247.382 4.091 20 0 BIADHN CC(C)c1ccc([C@@H](NCCF)C(C)C)cc1 ZINC000539243378 324829794 /nfs/dbraw/zinc/82/97/94/324829794.db2.gz HKWQMVOAAKGXOO-HNNXBMFYSA-N 0 3 237.362 4.066 20 0 BIADHN CC(C)c1ccc([C@H](NCCF)C(C)C)cc1 ZINC000539243386 388750993 /nfs/dbraw/zinc/75/09/93/388750993.db2.gz HKWQMVOAAKGXOO-OAHLLOKOSA-N 0 3 237.362 4.066 20 0 BIADHN C[C@@H](NC1(C2CC2)CC1)c1cc2ccccc2o1 ZINC000539657357 388769484 /nfs/dbraw/zinc/76/94/84/388769484.db2.gz YVNZNFSLCYCVOV-LLVKDONJSA-N 0 3 241.334 4.026 20 0 BIADHN C[C@H](NC1(C2CC2)CC1)c1cc2ccccc2o1 ZINC000539657358 324850747 /nfs/dbraw/zinc/85/07/47/324850747.db2.gz YVNZNFSLCYCVOV-NSHDSACASA-N 0 3 241.334 4.026 20 0 BIADHN CC1=CCN(Cc2csc3ccccc23)CC1 ZINC000539825146 388781032 /nfs/dbraw/zinc/78/10/32/388781032.db2.gz MMRFNBJUTYICGU-UHFFFAOYSA-N 0 3 243.375 4.053 20 0 BIADHN CC(C)[C@@H](c1ccccc1)N(C)Cc1ccco1 ZINC000539827809 388782126 /nfs/dbraw/zinc/78/21/26/388782126.db2.gz DCYFFVFMSPFPKP-INIZCTEOSA-N 0 3 243.350 4.109 20 0 BIADHN CC(C)[C@H](c1ccccc1)N(C)Cc1ccco1 ZINC000539827810 388782386 /nfs/dbraw/zinc/78/23/86/388782386.db2.gz DCYFFVFMSPFPKP-MRXNPFEDSA-N 0 3 243.350 4.109 20 0 BIADHN CC(C)(C)c1ccc(CN2CCC23CCC3)s1 ZINC000539835152 388784152 /nfs/dbraw/zinc/78/41/52/388784152.db2.gz UODLEYMJFUTZOF-UHFFFAOYSA-N 0 3 249.423 4.174 20 0 BIADHN Clc1oc2ccccc2c1CN1CCCCC1 ZINC000539924359 388788771 /nfs/dbraw/zinc/78/87/71/388788771.db2.gz UWFANOMTVJJDCJ-UHFFFAOYSA-N 0 3 249.741 4.072 20 0 BIADHN CCc1ccc([C@@H](C)NCC2(C3CC3)CCC2)o1 ZINC000540146229 388796642 /nfs/dbraw/zinc/79/66/42/388796642.db2.gz BODXBFQMFFGVHW-GFCCVEGCSA-N 0 3 247.382 4.073 20 0 BIADHN CCc1ccc([C@H](C)NCC2(C3CC3)CCC2)o1 ZINC000540146232 324887835 /nfs/dbraw/zinc/88/78/35/324887835.db2.gz BODXBFQMFFGVHW-LBPRGKRZSA-N 0 3 247.382 4.073 20 0 BIADHN CCOc1ccccc1[C@H](CC)NCC=C(C)C ZINC000540351765 324897451 /nfs/dbraw/zinc/89/74/51/324897451.db2.gz MRUFYLVANQDMNM-HNNXBMFYSA-N 0 3 247.382 4.092 20 0 BIADHN CCOc1ccccc1[C@@H](CC)NCC=C(C)C ZINC000540351767 388804453 /nfs/dbraw/zinc/80/44/53/388804453.db2.gz MRUFYLVANQDMNM-OAHLLOKOSA-N 0 3 247.382 4.092 20 0 BIADHN C[C@@H](NC(C)(C)c1cccs1)c1ccccc1 ZINC000541642394 324101544 /nfs/dbraw/zinc/10/15/44/324101544.db2.gz DYYBPQXVXIUDIC-GFCCVEGCSA-N 0 3 245.391 4.334 20 0 BIADHN C[C@H](NC(C)(C)c1cccs1)c1ccccc1 ZINC000541642395 324101698 /nfs/dbraw/zinc/10/16/98/324101698.db2.gz DYYBPQXVXIUDIC-LBPRGKRZSA-N 0 3 245.391 4.334 20 0 BIADHN CCc1cccnc1[C@@H](C)NCCCC(C)(C)C ZINC000541882700 324988607 /nfs/dbraw/zinc/98/86/07/324988607.db2.gz YHYPVDCIEIFTKB-CYBMUJFWSA-N 0 3 248.414 4.121 20 0 BIADHN CCc1cccnc1[C@H](C)NCCCC(C)(C)C ZINC000541882701 324988329 /nfs/dbraw/zinc/98/83/29/324988329.db2.gz YHYPVDCIEIFTKB-ZDUSSCGKSA-N 0 3 248.414 4.121 20 0 BIADHN CCN(Cc1ccccn1)CC(CC)(CC)CC ZINC000542949322 325064769 /nfs/dbraw/zinc/06/47/69/325064769.db2.gz XAFWFVNLBLFROP-UHFFFAOYSA-N 0 3 248.414 4.120 20 0 BIADHN CC(C)N[C@H](c1ccc(F)cc1F)C(C)(C)C ZINC000545246996 325201485 /nfs/dbraw/zinc/20/14/85/325201485.db2.gz UHKNRGIXLNBXHZ-CYBMUJFWSA-N 0 3 241.325 4.050 20 0 BIADHN CC(C)N[C@@H](c1ccc(F)cc1F)C(C)(C)C ZINC000545246997 325201020 /nfs/dbraw/zinc/20/10/20/325201020.db2.gz UHKNRGIXLNBXHZ-ZDUSSCGKSA-N 0 3 241.325 4.050 20 0 BIADHN Cc1cccc(C)c1[C@@H](C)NCc1ccsc1 ZINC000545464346 325223535 /nfs/dbraw/zinc/22/35/35/325223535.db2.gz CBGYLKDGOBNMBB-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(C)c1[C@H](C)NCc1ccsc1 ZINC000545464352 325223563 /nfs/dbraw/zinc/22/35/63/325223563.db2.gz CBGYLKDGOBNMBB-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN CCCC[C@@H](CC)CN(C)CCC(F)(F)F ZINC000545519075 325226176 /nfs/dbraw/zinc/22/61/76/325226176.db2.gz SCOIBHFOABZKPK-LLVKDONJSA-N 0 3 239.325 4.087 20 0 BIADHN CCCC[C@H](CC)CN(C)CCC(F)(F)F ZINC000545519076 325226119 /nfs/dbraw/zinc/22/61/19/325226119.db2.gz SCOIBHFOABZKPK-NSHDSACASA-N 0 3 239.325 4.087 20 0 BIADHN CCN(CCC1CC1)[C@H](C)c1ccccc1F ZINC000545519940 325226435 /nfs/dbraw/zinc/22/64/35/325226435.db2.gz VPODHWYFOCCNNR-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN CCN(CCC1CC1)[C@@H](C)c1ccccc1F ZINC000545519941 325226076 /nfs/dbraw/zinc/22/60/76/325226076.db2.gz VPODHWYFOCCNNR-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN Cc1cccc(C)c1[C@H](C)NCc1ccccc1 ZINC000546177968 325270099 /nfs/dbraw/zinc/27/00/99/325270099.db2.gz CVQSVLZNEOVKTH-HNNXBMFYSA-N 0 3 239.362 4.154 20 0 BIADHN Cc1cccc(C)c1[C@@H](C)NCc1ccccc1 ZINC000546177969 325269798 /nfs/dbraw/zinc/26/97/98/325269798.db2.gz CVQSVLZNEOVKTH-OAHLLOKOSA-N 0 3 239.362 4.154 20 0 BIADHN C[C@@H](NCCC1=CCCCCC1)c1ccoc1 ZINC000546645354 325297849 /nfs/dbraw/zinc/29/78/49/325297849.db2.gz PTOJLJCPNCLVNL-CYBMUJFWSA-N 0 3 233.355 4.211 20 0 BIADHN C[C@H](NCCC1=CCCCCC1)c1ccoc1 ZINC000546645355 325297710 /nfs/dbraw/zinc/29/77/10/325297710.db2.gz PTOJLJCPNCLVNL-ZDUSSCGKSA-N 0 3 233.355 4.211 20 0 BIADHN CC[C@H](CC(F)(F)F)N[C@@H](C)c1ccccc1 ZINC000546874122 325315461 /nfs/dbraw/zinc/31/54/61/325315461.db2.gz JQIIIMGAYPVRDQ-CMPLNLGQSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@@H](CC(F)(F)F)N[C@@H](C)c1ccccc1 ZINC000546874123 325315658 /nfs/dbraw/zinc/31/56/58/325315658.db2.gz JQIIIMGAYPVRDQ-JQWIXIFHSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@@H](CC(F)(F)F)N[C@H](C)c1ccccc1 ZINC000546874124 325315706 /nfs/dbraw/zinc/31/57/06/325315706.db2.gz JQIIIMGAYPVRDQ-PWSUYJOCSA-N 0 3 245.288 4.068 20 0 BIADHN CC[C@H](CC(F)(F)F)N[C@H](C)c1ccccc1 ZINC000546874125 325315555 /nfs/dbraw/zinc/31/55/55/325315555.db2.gz JQIIIMGAYPVRDQ-ZYHUDNBSSA-N 0 3 245.288 4.068 20 0 BIADHN Cc1cccc(C)c1[C@@H](C)NCc1cccs1 ZINC000546877939 325315622 /nfs/dbraw/zinc/31/56/22/325315622.db2.gz USEGAVQKVAOYBC-CYBMUJFWSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(C)c1[C@H](C)NCc1cccs1 ZINC000546877940 325315744 /nfs/dbraw/zinc/31/57/44/325315744.db2.gz USEGAVQKVAOYBC-ZDUSSCGKSA-N 0 3 245.391 4.216 20 0 BIADHN Cc1cccc(C)c1[C@H](C)N[C@@H](C)c1ccoc1 ZINC000546934030 325319444 /nfs/dbraw/zinc/31/94/44/325319444.db2.gz JUDBUYQEPIEJJB-KBPBESRZSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cccc(C)c1[C@H](C)N[C@H](C)c1ccoc1 ZINC000546934031 325319312 /nfs/dbraw/zinc/31/93/12/325319312.db2.gz JUDBUYQEPIEJJB-KGLIPLIRSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cccc(C)c1[C@@H](C)N[C@@H](C)c1ccoc1 ZINC000546934032 325318895 /nfs/dbraw/zinc/31/88/95/325318895.db2.gz JUDBUYQEPIEJJB-UONOGXRCSA-N 0 3 243.350 4.308 20 0 BIADHN Cc1cccc(C)c1[C@@H](C)N[C@H](C)c1ccoc1 ZINC000546934033 325319027 /nfs/dbraw/zinc/31/90/27/325319027.db2.gz JUDBUYQEPIEJJB-ZIAGYGMSSA-N 0 3 243.350 4.308 20 0 BIADHN CC(C)Sc1ccc(CN2[C@H](C)C[C@@H]2C)cc1 ZINC000548753255 388557574 /nfs/dbraw/zinc/55/75/74/388557574.db2.gz NBRMUTCUWOMEOL-BETUJISGSA-N 0 3 249.423 4.170 20 0 BIADHN CC(C)Sc1ccc(CN2[C@H](C)C[C@H]2C)cc1 ZINC000548753256 325478213 /nfs/dbraw/zinc/47/82/13/325478213.db2.gz NBRMUTCUWOMEOL-CHWSQXEVSA-N 0 3 249.423 4.170 20 0 BIADHN CC(C)Sc1ccc(CN2[C@@H](C)C[C@@H]2C)cc1 ZINC000548753257 325478242 /nfs/dbraw/zinc/47/82/42/325478242.db2.gz NBRMUTCUWOMEOL-STQMWFEESA-N 0 3 249.423 4.170 20 0 BIADHN CC(C)N(Cc1sccc1Cl)C1CCC1 ZINC000549063394 388571421 /nfs/dbraw/zinc/57/14/21/388571421.db2.gz CQXIFKZZYARTOO-UHFFFAOYSA-N 0 3 243.803 4.164 20 0 BIADHN Cc1ccc([C@H](C)N(C)Cc2ccco2)c(C)c1 ZINC000549200462 388574298 /nfs/dbraw/zinc/57/42/98/388574298.db2.gz DBQAGKQSLDPGMA-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc([C@@H](C)N(C)Cc2ccco2)c(C)c1 ZINC000549200463 388575055 /nfs/dbraw/zinc/57/50/55/388575055.db2.gz DBQAGKQSLDPGMA-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN C[C@H](c1cccc(F)c1)N(C)Cc1ccccc1 ZINC000549202950 388574159 /nfs/dbraw/zinc/57/41/59/388574159.db2.gz VZWQFWTYADZBIZ-CYBMUJFWSA-N 0 3 243.325 4.019 20 0 BIADHN C[C@@H](c1cccc(F)c1)N(C)Cc1ccccc1 ZINC000549202951 388574774 /nfs/dbraw/zinc/57/47/74/388574774.db2.gz VZWQFWTYADZBIZ-ZDUSSCGKSA-N 0 3 243.325 4.019 20 0 BIADHN CCC[C@@H](C)N(C)Cc1sccc1Cl ZINC000549349997 388577596 /nfs/dbraw/zinc/57/75/96/388577596.db2.gz IQOZBXAXTRVMMP-SECBINFHSA-N 0 3 231.792 4.022 20 0 BIADHN CCC[C@H](C)N(C)Cc1sccc1Cl ZINC000549350012 388577894 /nfs/dbraw/zinc/57/78/94/388577894.db2.gz IQOZBXAXTRVMMP-VIFPVBQESA-N 0 3 231.792 4.022 20 0 BIADHN CC(C)N(Cc1sccc1Cl)CC1CC1 ZINC000549350025 388577986 /nfs/dbraw/zinc/57/79/86/388577986.db2.gz JWTSVZQQBSIVIP-UHFFFAOYSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H](c1ccccc1F)N1CCC(C)(C)CC1 ZINC000550147633 388600592 /nfs/dbraw/zinc/60/05/92/388600592.db2.gz DBFMGHROUGZIRT-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN C[C@@H](c1ccccc1F)N1CCC(C)(C)CC1 ZINC000550147634 325524523 /nfs/dbraw/zinc/52/45/23/325524523.db2.gz DBFMGHROUGZIRT-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN Cc1ccccc1C(C)(C)NCc1ccccc1 ZINC000550263798 325527521 /nfs/dbraw/zinc/52/75/21/325527521.db2.gz VUJXPMOIFJTNEC-UHFFFAOYSA-N 0 3 239.362 4.020 20 0 BIADHN C[C@H](c1ccccc1F)N(C)CC1(C)CCC1 ZINC000550680656 388613145 /nfs/dbraw/zinc/61/31/45/388613145.db2.gz NYULNMVJIMSQCV-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN C[C@@H](c1ccccc1F)N(C)CC1(C)CCC1 ZINC000550680657 388613745 /nfs/dbraw/zinc/61/37/45/388613745.db2.gz NYULNMVJIMSQCV-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN C[C@H](N[C@@H]1CCC[C@@H]1F)c1cccc(C2CC2)c1 ZINC000550931122 325543611 /nfs/dbraw/zinc/54/36/11/325543611.db2.gz MXVJCNMJOKXVDI-KNXALSJPSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@@H](N[C@@H]1CCC[C@@H]1F)c1cccc(C2CC2)c1 ZINC000550931123 388616983 /nfs/dbraw/zinc/61/69/83/388616983.db2.gz MXVJCNMJOKXVDI-XFBWCDHKSA-N 0 3 247.357 4.105 20 0 BIADHN Cc1ccc([C@H](C)NC2CC(C(C)(C)C)C2)o1 ZINC000551241590 388624988 /nfs/dbraw/zinc/62/49/88/388624988.db2.gz OBOFCFOZIFKDGY-HIFPTAJRSA-N 0 3 235.371 4.063 20 0 BIADHN Cc1ccc([C@@H](C)NC2CC(C(C)(C)C)C2)o1 ZINC000551241599 388624928 /nfs/dbraw/zinc/62/49/28/388624928.db2.gz OBOFCFOZIFKDGY-PNESKVBLSA-N 0 3 235.371 4.063 20 0 BIADHN Cc1ccc2cc([C@H](C)NCC[C@@H](C)F)oc2c1 ZINC000551262812 325551855 /nfs/dbraw/zinc/55/18/55/325551855.db2.gz IDHDRAUHCPBDDO-NEPJUHHUSA-N 0 3 249.329 4.140 20 0 BIADHN Cc1ccc2cc([C@@H](C)NCC[C@H](C)F)oc2c1 ZINC000551262813 388624838 /nfs/dbraw/zinc/62/48/38/388624838.db2.gz IDHDRAUHCPBDDO-NWDGAFQWSA-N 0 3 249.329 4.140 20 0 BIADHN Cc1ccc2cc([C@H](C)NCC[C@H](C)F)oc2c1 ZINC000551262814 388625091 /nfs/dbraw/zinc/62/50/91/388625091.db2.gz IDHDRAUHCPBDDO-RYUDHWBXSA-N 0 3 249.329 4.140 20 0 BIADHN Cc1ccc2cc([C@@H](C)NCC[C@@H](C)F)oc2c1 ZINC000551262815 325551844 /nfs/dbraw/zinc/55/18/44/325551844.db2.gz IDHDRAUHCPBDDO-VXGBXAGGSA-N 0 3 249.329 4.140 20 0 BIADHN F[C@H]1CCC[C@H]1N[C@H](CC1CC1)c1ccccc1 ZINC000551309886 388626008 /nfs/dbraw/zinc/62/60/08/388626008.db2.gz YHOOZQZQDYBBRG-ARFHVFGLSA-N 0 3 247.357 4.008 20 0 BIADHN F[C@@H]1CCC[C@@H]1N[C@H](CC1CC1)c1ccccc1 ZINC000551309887 388625993 /nfs/dbraw/zinc/62/59/93/388625993.db2.gz YHOOZQZQDYBBRG-OWCLPIDISA-N 0 3 247.357 4.008 20 0 BIADHN F[C@@H]1CCC[C@@H]1N[C@@H](CC1CC1)c1ccccc1 ZINC000551309889 388626218 /nfs/dbraw/zinc/62/62/18/388626218.db2.gz YHOOZQZQDYBBRG-PMPSAXMXSA-N 0 3 247.357 4.008 20 0 BIADHN F[C@H]1CCC[C@H]1N[C@@H](CC1CC1)c1ccccc1 ZINC000551309890 388626454 /nfs/dbraw/zinc/62/64/54/388626454.db2.gz YHOOZQZQDYBBRG-XHSDSOJGSA-N 0 3 247.357 4.008 20 0 BIADHN CCN(Cc1sccc1Cl)C1CCCC1 ZINC000551709702 388637924 /nfs/dbraw/zinc/63/79/24/388637924.db2.gz FPQFUAPWNLWMLK-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN CC(C)(C)CN1CC[C@@H]1c1ccc(Cl)cc1 ZINC000552343870 388695577 /nfs/dbraw/zinc/69/55/77/388695577.db2.gz QDLVBUPBBLMEEZ-CYBMUJFWSA-N 0 3 237.774 4.133 20 0 BIADHN CC(C)(C)CN1CC[C@H]1c1ccc(Cl)cc1 ZINC000552343871 388695322 /nfs/dbraw/zinc/69/53/22/388695322.db2.gz QDLVBUPBBLMEEZ-ZDUSSCGKSA-N 0 3 237.774 4.133 20 0 BIADHN CC(C)CN(Cc1ccccc1Cl)C(C)C ZINC000552828296 388737361 /nfs/dbraw/zinc/73/73/61/388737361.db2.gz PTNOKOAYDFNBBI-UHFFFAOYSA-N 0 3 239.790 4.206 20 0 BIADHN C[C@@H](N[C@H]1CC[C@H]1C1CC1)c1ccccc1Cl ZINC000554089920 388799553 /nfs/dbraw/zinc/79/95/53/388799553.db2.gz JHICXSCQORMRQJ-DGFSRKRXSA-N 0 3 249.785 4.179 20 0 BIADHN C[C@@H](N[C@@H]1CC[C@H]1C1CC1)c1ccccc1Cl ZINC000554089924 325705774 /nfs/dbraw/zinc/70/57/74/325705774.db2.gz JHICXSCQORMRQJ-RIEGTJTDSA-N 0 3 249.785 4.179 20 0 BIADHN C[C@@H](N[C@@H]1CC[C@@H]1C1CC1)c1ccccc1Cl ZINC000554089925 388798872 /nfs/dbraw/zinc/79/88/72/388798872.db2.gz JHICXSCQORMRQJ-WDBKCZKBSA-N 0 3 249.785 4.179 20 0 BIADHN C[C@@H](N[C@H]1CC[C@@H]1C1CC1)c1ccccc1Cl ZINC000554089927 388799814 /nfs/dbraw/zinc/79/98/14/388799814.db2.gz JHICXSCQORMRQJ-YVLXSGLVSA-N 0 3 249.785 4.179 20 0 BIADHN CCCN(CCC)[C@H](C)c1ccc(F)cc1F ZINC000554185379 388803237 /nfs/dbraw/zinc/80/32/37/388803237.db2.gz NHSGTYNZPCONOU-LLVKDONJSA-N 0 3 241.325 4.148 20 0 BIADHN CCCN(CCC)[C@@H](C)c1ccc(F)cc1F ZINC000554185380 388803312 /nfs/dbraw/zinc/80/33/12/388803312.db2.gz NHSGTYNZPCONOU-NSHDSACASA-N 0 3 241.325 4.148 20 0 BIADHN CC(C)Sc1ccc(CN2C[C@@H](C)[C@H]2C)cc1 ZINC000555634839 388856228 /nfs/dbraw/zinc/85/62/28/388856228.db2.gz IBFINXSXOZDBNS-CHWSQXEVSA-N 0 3 249.423 4.027 20 0 BIADHN CC(C)Sc1ccc(CN2C[C@@H](C)[C@@H]2C)cc1 ZINC000555634840 388856174 /nfs/dbraw/zinc/85/61/74/388856174.db2.gz IBFINXSXOZDBNS-OLZOCXBDSA-N 0 3 249.423 4.027 20 0 BIADHN CC(C)Sc1ccc(CN2C[C@H](C)[C@H]2C)cc1 ZINC000555634841 388857498 /nfs/dbraw/zinc/85/74/98/388857498.db2.gz IBFINXSXOZDBNS-QWHCGFSZSA-N 0 3 249.423 4.027 20 0 BIADHN CC(C)Sc1ccc(CN2C[C@H](C)[C@@H]2C)cc1 ZINC000555634842 388857406 /nfs/dbraw/zinc/85/74/06/388857406.db2.gz IBFINXSXOZDBNS-STQMWFEESA-N 0 3 249.423 4.027 20 0 BIADHN CC[C@@H](C)N(C)Cc1ccc(Cl)cc1Cl ZINC000556280820 388873764 /nfs/dbraw/zinc/87/37/64/388873764.db2.gz GTMGAAAMCVGJSB-SECBINFHSA-N 0 3 246.181 4.224 20 0 BIADHN CC[C@H](C)N(C)Cc1ccc(Cl)cc1Cl ZINC000556280830 388872886 /nfs/dbraw/zinc/87/28/86/388872886.db2.gz GTMGAAAMCVGJSB-VIFPVBQESA-N 0 3 246.181 4.224 20 0 BIADHN Cc1ccnc([C@H](C)NCCCCC(C)(C)C)c1 ZINC000556870586 322929733 /nfs/dbraw/zinc/92/97/33/322929733.db2.gz OZUHMHLQJUIGLU-AWEZNQCLSA-N 0 3 248.414 4.257 20 0 BIADHN Cc1ccnc([C@@H](C)NCCCCC(C)(C)C)c1 ZINC000556870592 384565672 /nfs/dbraw/zinc/56/56/72/384565672.db2.gz OZUHMHLQJUIGLU-CQSZACIVSA-N 0 3 248.414 4.257 20 0 BIADHN CCCC1(CN[C@@H](C)c2cc(C)ccn2)CCC1 ZINC000556887386 384597697 /nfs/dbraw/zinc/59/76/97/384597697.db2.gz WGUFICYDYBZPTR-AWEZNQCLSA-N 0 3 246.398 4.011 20 0 BIADHN CCCC1(CN[C@H](C)c2cc(C)ccn2)CCC1 ZINC000556887387 384598406 /nfs/dbraw/zinc/59/84/06/384598406.db2.gz WGUFICYDYBZPTR-CQSZACIVSA-N 0 3 246.398 4.011 20 0 BIADHN CC(C)C[C@H](C)N(C)Cc1ccc(Cl)s1 ZINC000557436431 384941655 /nfs/dbraw/zinc/94/16/55/384941655.db2.gz PRLXNQHJSCMTRX-JTQLQIEISA-N 0 3 245.819 4.268 20 0 BIADHN CC(C)C[C@@H](C)N(C)Cc1ccc(Cl)s1 ZINC000557436444 384942247 /nfs/dbraw/zinc/94/22/47/384942247.db2.gz PRLXNQHJSCMTRX-SNVBAGLBSA-N 0 3 245.819 4.268 20 0 BIADHN C[C@@H](N(C)Cc1ccccc1Cl)C(C)(C)C ZINC000557437822 384941986 /nfs/dbraw/zinc/94/19/86/384941986.db2.gz APVUXUVOAPLGDR-LLVKDONJSA-N 0 3 239.790 4.206 20 0 BIADHN C[C@H](N(C)Cc1ccccc1Cl)C(C)(C)C ZINC000557437823 384943434 /nfs/dbraw/zinc/94/34/34/384943434.db2.gz APVUXUVOAPLGDR-NSHDSACASA-N 0 3 239.790 4.206 20 0 BIADHN Clc1cccc(C2(N[C@H]3C=CCCC3)CC2)c1 ZINC000557536174 385011618 /nfs/dbraw/zinc/01/16/18/385011618.db2.gz SJOOXGISTWDZPL-AWEZNQCLSA-N 0 3 247.769 4.027 20 0 BIADHN Clc1cccc(C2(N[C@@H]3C=CCCC3)CC2)c1 ZINC000557536175 385010041 /nfs/dbraw/zinc/01/00/41/385010041.db2.gz SJOOXGISTWDZPL-CQSZACIVSA-N 0 3 247.769 4.027 20 0 BIADHN CCCN(CCC)[C@H](C)c1cc(F)ccc1F ZINC000558060987 322945686 /nfs/dbraw/zinc/94/56/86/322945686.db2.gz HAYYSTPCIUXSOF-LLVKDONJSA-N 0 3 241.325 4.148 20 0 BIADHN CCCN(CCC)[C@@H](C)c1cc(F)ccc1F ZINC000558060992 322945681 /nfs/dbraw/zinc/94/56/81/322945681.db2.gz HAYYSTPCIUXSOF-NSHDSACASA-N 0 3 241.325 4.148 20 0 BIADHN CCCN(CCC)[C@H](C)c1c(F)cccc1F ZINC000558061868 322945677 /nfs/dbraw/zinc/94/56/77/322945677.db2.gz ZBJAVQBRSVWQDV-LLVKDONJSA-N 0 3 241.325 4.148 20 0 BIADHN CCCN(CCC)[C@@H](C)c1c(F)cccc1F ZINC000558061869 322945641 /nfs/dbraw/zinc/94/56/41/322945641.db2.gz ZBJAVQBRSVWQDV-NSHDSACASA-N 0 3 241.325 4.148 20 0 BIADHN CC[C@@H](c1ccccc1OC)N(C)CC=C(C)C ZINC000558185369 491119593 /nfs/dbraw/zinc/11/95/93/491119593.db2.gz WWXWYWKOUWJBRE-HNNXBMFYSA-N 0 3 247.382 4.044 20 0 BIADHN CC[C@H](c1ccccc1OC)N(C)CC=C(C)C ZINC000558185373 491119654 /nfs/dbraw/zinc/11/96/54/491119654.db2.gz WWXWYWKOUWJBRE-OAHLLOKOSA-N 0 3 247.382 4.044 20 0 BIADHN CCC[C@@H](C)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000558598309 384194663 /nfs/dbraw/zinc/19/46/63/384194663.db2.gz CAPGIQAROOPIFC-BXUZGUMPSA-N 0 3 237.774 4.275 20 0 BIADHN CCC[C@H](C)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000558598310 384194987 /nfs/dbraw/zinc/19/49/87/384194987.db2.gz CAPGIQAROOPIFC-FZMZJTMJSA-N 0 3 237.774 4.275 20 0 BIADHN CCC[C@@H](C)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000558598311 384194255 /nfs/dbraw/zinc/19/42/55/384194255.db2.gz CAPGIQAROOPIFC-RISCZKNCSA-N 0 3 237.774 4.275 20 0 BIADHN CCC[C@H](C)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000558598312 384195408 /nfs/dbraw/zinc/19/54/08/384195408.db2.gz CAPGIQAROOPIFC-SMDDNHRTSA-N 0 3 237.774 4.275 20 0 BIADHN C[C@@H]1CC[C@@H](N(C)Cc2sccc2Cl)C1 ZINC000558830846 398216780 /nfs/dbraw/zinc/21/67/80/398216780.db2.gz GVEJSFBBBPXOHC-NXEZZACHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H]1CC[C@H](N(C)Cc2sccc2Cl)C1 ZINC000558830850 398216862 /nfs/dbraw/zinc/21/68/62/398216862.db2.gz GVEJSFBBBPXOHC-UWVGGRQHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H]1CC[C@@H](N(C)Cc2sccc2Cl)C1 ZINC000558830851 398216959 /nfs/dbraw/zinc/21/69/59/398216959.db2.gz GVEJSFBBBPXOHC-VHSXEESVSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@@H]1CC[C@H](N(C)Cc2sccc2Cl)C1 ZINC000558830852 398216874 /nfs/dbraw/zinc/21/68/74/398216874.db2.gz GVEJSFBBBPXOHC-ZJUUUORDSA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)CN(Cc1sccc1Cl)C1CC1 ZINC000558832971 398218965 /nfs/dbraw/zinc/21/89/65/398218965.db2.gz SOOGRMCYTCOTEE-UHFFFAOYSA-N 0 3 243.803 4.022 20 0 BIADHN CCN(CCC1CC1)Cc1sccc1Cl ZINC000558850877 645359804 /nfs/dbraw/zinc/35/98/04/645359804.db2.gz MBNMXGBOFCSCBO-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN Cc1cccc2c1[C@@H](C)C[C@@H]2N[C@H]1CCC[C@H]1F ZINC000559913746 344547073 /nfs/dbraw/zinc/54/70/73/344547073.db2.gz MLZSSJCOJVVXAL-ATGSNQNLSA-N 0 3 247.357 4.024 20 0 BIADHN Cc1cccc2c1[C@@H](C)C[C@H]2N[C@H]1CCC[C@H]1F ZINC000559913747 344547065 /nfs/dbraw/zinc/54/70/65/344547065.db2.gz MLZSSJCOJVVXAL-PMOUVXMZSA-N 0 3 247.357 4.024 20 0 BIADHN Cc1cccc2c1[C@H](C)C[C@H]2N[C@H]1CCC[C@H]1F ZINC000559913748 344547251 /nfs/dbraw/zinc/54/72/51/344547251.db2.gz MLZSSJCOJVVXAL-REBRKWNGSA-N 0 3 247.357 4.024 20 0 BIADHN Cc1cccc2c1[C@H](C)C[C@@H]2N[C@H]1CCC[C@H]1F ZINC000559913749 344547264 /nfs/dbraw/zinc/54/72/64/344547264.db2.gz MLZSSJCOJVVXAL-RZFFKMDDSA-N 0 3 247.357 4.024 20 0 BIADHN CC/C=C\CCN1CCC(CC(F)(F)F)CC1 ZINC000560170329 383951806 /nfs/dbraw/zinc/95/18/06/383951806.db2.gz UAXNYTFVWKFVOG-ARJAWSKDSA-N 0 3 249.320 4.007 20 0 BIADHN CC/C=C/CCN1CCC(CC(F)(F)F)CC1 ZINC000560170330 322983508 /nfs/dbraw/zinc/98/35/08/322983508.db2.gz UAXNYTFVWKFVOG-ONEGZZNKSA-N 0 3 249.320 4.007 20 0 BIADHN CCN(Cc1ccsc1Cl)C1CCCC1 ZINC000560276579 384031649 /nfs/dbraw/zinc/03/16/49/384031649.db2.gz NVUQTPHCPGLFPX-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN Cc1ccnc([C@H](C)NCC(C)(C)CC(C)C)c1 ZINC000560543896 344820849 /nfs/dbraw/zinc/82/08/49/344820849.db2.gz DDSSAWFANAJXMT-AWEZNQCLSA-N 0 3 248.414 4.113 20 0 BIADHN Cc1ccnc([C@@H](C)NCC(C)(C)CC(C)C)c1 ZINC000560543897 344820791 /nfs/dbraw/zinc/82/07/91/344820791.db2.gz DDSSAWFANAJXMT-CQSZACIVSA-N 0 3 248.414 4.113 20 0 BIADHN CC(C)C[C@@H](C)N(C)Cc1ccccc1Cl ZINC000561059704 384470119 /nfs/dbraw/zinc/47/01/19/384470119.db2.gz AITTWBGGLCKIAK-GFCCVEGCSA-N 0 3 239.790 4.206 20 0 BIADHN CC(C)C[C@H](C)N(C)Cc1ccccc1Cl ZINC000561059716 384469611 /nfs/dbraw/zinc/46/96/11/384469611.db2.gz AITTWBGGLCKIAK-LBPRGKRZSA-N 0 3 239.790 4.206 20 0 BIADHN CC(C)=CCN1CC(C)(C)[C@H]1c1cccs1 ZINC000561956648 323009393 /nfs/dbraw/zinc/00/93/93/323009393.db2.gz IOTSYIPHOGCHAH-CYBMUJFWSA-N 0 3 235.396 4.097 20 0 BIADHN CC(C)=CCN1CC(C)(C)[C@@H]1c1cccs1 ZINC000561956653 323009440 /nfs/dbraw/zinc/00/94/40/323009440.db2.gz IOTSYIPHOGCHAH-ZDUSSCGKSA-N 0 3 235.396 4.097 20 0 BIADHN CC(C)CCN1CC(C)(C)[C@H]1c1cccs1 ZINC000561962875 323009468 /nfs/dbraw/zinc/00/94/68/323009468.db2.gz HKFVOJPVCKIKKW-CYBMUJFWSA-N 0 3 237.412 4.177 20 0 BIADHN CC(C)CCN1CC(C)(C)[C@@H]1c1cccs1 ZINC000561962876 323009461 /nfs/dbraw/zinc/00/94/61/323009461.db2.gz HKFVOJPVCKIKKW-ZDUSSCGKSA-N 0 3 237.412 4.177 20 0 BIADHN CC(C)=CCC[C@H](C)N[C@H](C)c1ccc(C)o1 ZINC000563338197 323119205 /nfs/dbraw/zinc/11/92/05/323119205.db2.gz MVVYPGMJDLFHFD-GXTWGEPZSA-N 0 3 235.371 4.374 20 0 BIADHN CC(C)=CCC[C@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000563338198 323119113 /nfs/dbraw/zinc/11/91/13/323119113.db2.gz MVVYPGMJDLFHFD-JSGCOSHPSA-N 0 3 235.371 4.374 20 0 BIADHN CC(C)=CCC[C@@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000563338199 323119099 /nfs/dbraw/zinc/11/90/99/323119099.db2.gz MVVYPGMJDLFHFD-OCCSQVGLSA-N 0 3 235.371 4.374 20 0 BIADHN CC(C)=CCC[C@@H](C)N[C@H](C)c1ccc(C)o1 ZINC000563338200 323119168 /nfs/dbraw/zinc/11/91/68/323119168.db2.gz MVVYPGMJDLFHFD-TZMCWYRMSA-N 0 3 235.371 4.374 20 0 BIADHN CN(Cc1sccc1Cl)CC1CCCC1 ZINC000563818840 323179074 /nfs/dbraw/zinc/17/90/74/323179074.db2.gz FFDSQNSUAPMKCZ-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CC[C@@H](c1cccc(OC)c1)N(C)CC=C(C)C ZINC000564152983 363127432 /nfs/dbraw/zinc/12/74/32/363127432.db2.gz RFFUROAUBDODAW-INIZCTEOSA-N 0 3 247.382 4.044 20 0 BIADHN CC[C@H](c1cccc(OC)c1)N(C)CC=C(C)C ZINC000564152985 363127889 /nfs/dbraw/zinc/12/78/89/363127889.db2.gz RFFUROAUBDODAW-MRXNPFEDSA-N 0 3 247.382 4.044 20 0 BIADHN C[C@H]1CC[C@@H](N[C@@H]2CCC[C@@H]2F)c2ccccc21 ZINC000566024248 388984478 /nfs/dbraw/zinc/98/44/78/388984478.db2.gz NHFGWBPUMNCRKN-DANNLKNASA-N 0 3 247.357 4.105 20 0 BIADHN C[C@@H]1CC[C@@H](N[C@@H]2CCC[C@@H]2F)c2ccccc21 ZINC000566024249 388984121 /nfs/dbraw/zinc/98/41/21/388984121.db2.gz NHFGWBPUMNCRKN-MSQAHXEGSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@H]1CC[C@H](N[C@@H]2CCC[C@@H]2F)c2ccccc21 ZINC000566024250 388984643 /nfs/dbraw/zinc/98/46/43/388984643.db2.gz NHFGWBPUMNCRKN-VCOSZWKGSA-N 0 3 247.357 4.105 20 0 BIADHN CCC[C@H](C)[C@@H](CC)N[C@H](C)c1cscn1 ZINC000568276980 326340096 /nfs/dbraw/zinc/34/00/96/326340096.db2.gz RUMZYNDCAUEAGF-QJPTWQEYSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](C)[C@@H](CC)N[C@@H](C)c1cscn1 ZINC000568276981 326339979 /nfs/dbraw/zinc/33/99/79/326339979.db2.gz RUMZYNDCAUEAGF-SDDRHHMPSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](C)[C@H](CC)N[C@@H](C)c1cscn1 ZINC000568276982 326340136 /nfs/dbraw/zinc/34/01/36/326340136.db2.gz RUMZYNDCAUEAGF-SRVKXCTJSA-N 0 3 240.416 4.009 20 0 BIADHN CCC[C@H](C)[C@H](CC)N[C@H](C)c1cscn1 ZINC000568276983 326339969 /nfs/dbraw/zinc/33/99/69/326339969.db2.gz RUMZYNDCAUEAGF-TUAOUCFPSA-N 0 3 240.416 4.009 20 0 BIADHN C[C@@H]1CC[C@@H](N(C)Cc2ccc(Cl)s2)C1 ZINC000569617104 384134803 /nfs/dbraw/zinc/13/48/03/384134803.db2.gz RCLWVAFWHQWHKP-NXEZZACHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H]1CC[C@H](N(C)Cc2ccc(Cl)s2)C1 ZINC000569617105 384133107 /nfs/dbraw/zinc/13/31/07/384133107.db2.gz RCLWVAFWHQWHKP-UWVGGRQHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H]1CC[C@@H](N(C)Cc2ccc(Cl)s2)C1 ZINC000569617106 384132927 /nfs/dbraw/zinc/13/29/27/384132927.db2.gz RCLWVAFWHQWHKP-VHSXEESVSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@@H]1CC[C@H](N(C)Cc2ccc(Cl)s2)C1 ZINC000569617107 384133166 /nfs/dbraw/zinc/13/31/66/384133166.db2.gz RCLWVAFWHQWHKP-ZJUUUORDSA-N 0 3 243.803 4.022 20 0 BIADHN CC[C@H](C[C@@H](C)CC)N[C@H](C)c1cscn1 ZINC000569623862 322999635 /nfs/dbraw/zinc/99/96/35/322999635.db2.gz UWIFOTCTXPYXPI-QJPTWQEYSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](C[C@@H](C)CC)N[C@@H](C)c1cscn1 ZINC000569623866 384648440 /nfs/dbraw/zinc/64/84/40/384648440.db2.gz UWIFOTCTXPYXPI-SDDRHHMPSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](C)C[C@H](CC)N[C@@H](C)c1cscn1 ZINC000569623869 322999683 /nfs/dbraw/zinc/99/96/83/322999683.db2.gz UWIFOTCTXPYXPI-SRVKXCTJSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H](C)C[C@H](CC)N[C@H](C)c1cscn1 ZINC000569623871 384649146 /nfs/dbraw/zinc/64/91/46/384649146.db2.gz UWIFOTCTXPYXPI-TUAOUCFPSA-N 0 3 240.416 4.009 20 0 BIADHN C[C@@H]1CC[C@@H](N[C@H]2CCC[C@H]2F)c2ccccc21 ZINC000572384760 387368332 /nfs/dbraw/zinc/36/83/32/387368332.db2.gz NHFGWBPUMNCRKN-MPESAESLSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@H]1CC[C@H](N[C@H]2CCC[C@H]2F)c2ccccc21 ZINC000572384761 323616074 /nfs/dbraw/zinc/61/60/74/323616074.db2.gz NHFGWBPUMNCRKN-MWNCTCPHSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@H]1CC[C@@H](N[C@H]2CCC[C@H]2F)c2ccccc21 ZINC000572384762 323616186 /nfs/dbraw/zinc/61/61/86/323616186.db2.gz NHFGWBPUMNCRKN-SRMUXQRQSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@H](N[C@@H]1CC[C@@H]1C1CC1)c1ccccc1Cl ZINC000572547357 388824179 /nfs/dbraw/zinc/82/41/79/388824179.db2.gz JHICXSCQORMRQJ-PSOPSSQASA-N 0 3 249.785 4.179 20 0 BIADHN C[C@H](N[C@@H]1CC[C@H]1C1CC1)c1ccccc1Cl ZINC000572547358 388823913 /nfs/dbraw/zinc/82/39/13/388823913.db2.gz JHICXSCQORMRQJ-VZJVUDMVSA-N 0 3 249.785 4.179 20 0 BIADHN C[C@H](N[C@H]1CC[C@H]1C1CC1)c1ccccc1Cl ZINC000572547359 388824538 /nfs/dbraw/zinc/82/45/38/388824538.db2.gz JHICXSCQORMRQJ-XEGUGMAKSA-N 0 3 249.785 4.179 20 0 BIADHN C[C@H](N[C@H]1CC[C@@H]1C1CC1)c1ccccc1Cl ZINC000572547360 325730204 /nfs/dbraw/zinc/73/02/04/325730204.db2.gz JHICXSCQORMRQJ-ZBINZKHDSA-N 0 3 249.785 4.179 20 0 BIADHN CCC1CC(NCc2oc3ccccc3c2C)C1 ZINC000573227976 388434234 /nfs/dbraw/zinc/43/42/34/388434234.db2.gz KXJLVIPGPSWRGV-UHFFFAOYSA-N 0 3 243.350 4.019 20 0 BIADHN CC(C)(C)CN1CC(C)(C)[C@H]1c1cccs1 ZINC000573526472 364853856 /nfs/dbraw/zinc/85/38/56/364853856.db2.gz GPVHEIZFDYFBIU-GFCCVEGCSA-N 0 3 237.412 4.177 20 0 BIADHN CC(C)(C)CN1CC(C)(C)[C@@H]1c1cccs1 ZINC000573526473 364853921 /nfs/dbraw/zinc/85/39/21/364853921.db2.gz GPVHEIZFDYFBIU-LBPRGKRZSA-N 0 3 237.412 4.177 20 0 BIADHN CC(C)N(Cc1ccco1)[C@@H](C)c1ccccc1 ZINC000574540471 365086754 /nfs/dbraw/zinc/08/67/54/365086754.db2.gz VFNILEYRKWNMEZ-AWEZNQCLSA-N 0 3 243.350 4.251 20 0 BIADHN CC(C)N(Cc1ccco1)[C@H](C)c1ccccc1 ZINC000574540472 365086209 /nfs/dbraw/zinc/08/62/09/365086209.db2.gz VFNILEYRKWNMEZ-CQSZACIVSA-N 0 3 243.350 4.251 20 0 BIADHN CCCCN(CC)Cc1ccc(SC)s1 ZINC000574801721 365146182 /nfs/dbraw/zinc/14/61/82/365146182.db2.gz LIEYNYLJIANLDP-UHFFFAOYSA-N 0 3 243.441 4.092 20 0 BIADHN CCC[C@@H](N[C@H]1CCC[C@H]1F)c1ccccc1 ZINC000576485057 365609216 /nfs/dbraw/zinc/60/92/16/365609216.db2.gz IASYBTDESVXBJW-KFWWJZLASA-N 0 3 235.346 4.008 20 0 BIADHN CC1(C)CN([C@H]2C=CCCC2)[C@@H]1c1cccs1 ZINC000577374123 365938049 /nfs/dbraw/zinc/93/80/49/365938049.db2.gz AFNFHZJMRBCBRH-GXTWGEPZSA-N 0 3 247.407 4.240 20 0 BIADHN CC1(C)CN([C@H]2C=CCCC2)[C@H]1c1cccs1 ZINC000577374124 365938011 /nfs/dbraw/zinc/93/80/11/365938011.db2.gz AFNFHZJMRBCBRH-JSGCOSHPSA-N 0 3 247.407 4.240 20 0 BIADHN CC1(C)CN([C@@H]2C=CCCC2)[C@H]1c1cccs1 ZINC000577374125 365937849 /nfs/dbraw/zinc/93/78/49/365937849.db2.gz AFNFHZJMRBCBRH-OCCSQVGLSA-N 0 3 247.407 4.240 20 0 BIADHN CC1(C)CN([C@@H]2C=CCCC2)[C@@H]1c1cccs1 ZINC000577374126 365937798 /nfs/dbraw/zinc/93/77/98/365937798.db2.gz AFNFHZJMRBCBRH-TZMCWYRMSA-N 0 3 247.407 4.240 20 0 BIADHN CN(Cc1sccc1Cl)C1(C)CCCC1 ZINC000577772461 366058792 /nfs/dbraw/zinc/05/87/92/366058792.db2.gz VLYFLIYUXOSWIO-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN C[C@@H](N[C@H]1CCC[C@H]1F)c1cccc(C2CC2)c1 ZINC000577968403 366151530 /nfs/dbraw/zinc/15/15/30/366151530.db2.gz MXVJCNMJOKXVDI-LYRGGWFBSA-N 0 3 247.357 4.105 20 0 BIADHN C[C@H](N[C@H]1CCC[C@H]1F)c1cccc(C2CC2)c1 ZINC000577968404 366151658 /nfs/dbraw/zinc/15/16/58/366151658.db2.gz MXVJCNMJOKXVDI-XZJROXQQSA-N 0 3 247.357 4.105 20 0 BIADHN CC1=CCCN([C@H](C)c2ccc(Cl)cc2)C1 ZINC000578430918 366566634 /nfs/dbraw/zinc/56/66/34/366566634.db2.gz WVIYEWXTFAJCCO-GFCCVEGCSA-N 0 3 235.758 4.053 20 0 BIADHN CC1=CCCN([C@@H](C)c2ccc(Cl)cc2)C1 ZINC000578430919 366567050 /nfs/dbraw/zinc/56/70/50/366567050.db2.gz WVIYEWXTFAJCCO-LBPRGKRZSA-N 0 3 235.758 4.053 20 0 BIADHN CCC(CC)(CC)CN(C)CCC(F)(F)F ZINC000580367054 356435043 /nfs/dbraw/zinc/43/50/43/356435043.db2.gz SKYLBHLFFGHWMV-UHFFFAOYSA-N 0 3 239.325 4.087 20 0 BIADHN CCC[C@@H](N[C@@H]1CCC[C@@H]1F)c1ccccc1 ZINC000582501374 357322258 /nfs/dbraw/zinc/32/22/58/357322258.db2.gz IASYBTDESVXBJW-RRFJBIMHSA-N 0 3 235.346 4.008 20 0 BIADHN CC(C)[C@H]1CCCN1Cc1sccc1Cl ZINC000583211425 357545804 /nfs/dbraw/zinc/54/58/04/357545804.db2.gz IJYDSNPAQBRZCQ-LLVKDONJSA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)[C@@H]1CCCN1Cc1sccc1Cl ZINC000583211426 357545921 /nfs/dbraw/zinc/54/59/21/357545921.db2.gz IJYDSNPAQBRZCQ-NSHDSACASA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)N(Cc1ccsc1Cl)CC1CC1 ZINC000583238582 357670079 /nfs/dbraw/zinc/67/00/79/357670079.db2.gz XDEMEFMYNSABEZ-UHFFFAOYSA-N 0 3 243.803 4.022 20 0 BIADHN CCCC[C@H](C)[C@@H](C)N[C@H](C)c1cscn1 ZINC000583642182 355948114 /nfs/dbraw/zinc/94/81/14/355948114.db2.gz RHTXLADPYCUYLJ-QJPTWQEYSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC[C@H](C)[C@H](C)N[C@H](C)c1cscn1 ZINC000583642183 355947724 /nfs/dbraw/zinc/94/77/24/355947724.db2.gz RHTXLADPYCUYLJ-SDDRHHMPSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC[C@H](C)[C@H](C)N[C@@H](C)c1cscn1 ZINC000583642184 355948083 /nfs/dbraw/zinc/94/80/83/355948083.db2.gz RHTXLADPYCUYLJ-SRVKXCTJSA-N 0 3 240.416 4.009 20 0 BIADHN CCCC[C@H](C)[C@@H](C)N[C@@H](C)c1cscn1 ZINC000583642185 355948125 /nfs/dbraw/zinc/94/81/25/355948125.db2.gz RHTXLADPYCUYLJ-TUAOUCFPSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)=CCN[C@H](C)c1cccc(C2CC2)c1 ZINC000584067840 343312641 /nfs/dbraw/zinc/31/26/41/343312641.db2.gz KAOZQNIGNFEPAP-CYBMUJFWSA-N 0 3 229.367 4.181 20 0 BIADHN CC(C)=CCN[C@@H](C)c1cccc(C2CC2)c1 ZINC000584067841 343312538 /nfs/dbraw/zinc/31/25/38/343312538.db2.gz KAOZQNIGNFEPAP-ZDUSSCGKSA-N 0 3 229.367 4.181 20 0 BIADHN CC[C@@H](c1ccc(Cl)cc1)N1C2CCC1CC2 ZINC000588708122 344175514 /nfs/dbraw/zinc/17/55/14/344175514.db2.gz AUHNLYFQRYCQNL-NRXISQOPSA-N 0 3 249.785 4.418 20 0 BIADHN CC[C@H](c1ccc(Cl)cc1)N1C2CCC1CC2 ZINC000588708128 344175422 /nfs/dbraw/zinc/17/54/22/344175422.db2.gz AUHNLYFQRYCQNL-YMAMQOFZSA-N 0 3 249.785 4.418 20 0 BIADHN CC[C@@H](c1ccccc1)N(CC)Cc1ccoc1 ZINC000588709058 344175333 /nfs/dbraw/zinc/17/53/33/344175333.db2.gz RIGHPHMSMSZCHW-INIZCTEOSA-N 0 3 243.350 4.253 20 0 BIADHN CC[C@H](c1ccccc1)N(CC)Cc1ccoc1 ZINC000588709060 344175571 /nfs/dbraw/zinc/17/55/71/344175571.db2.gz RIGHPHMSMSZCHW-MRXNPFEDSA-N 0 3 243.350 4.253 20 0 BIADHN CSc1ccc(CN2CCC(C)(C)CC2)cc1 ZINC000588904581 344199123 /nfs/dbraw/zinc/19/91/23/344199123.db2.gz IIENZLIXWCOAOR-UHFFFAOYSA-N 0 3 249.423 4.031 20 0 BIADHN C[C@H](c1cccc(F)c1)N1CCC(C)(C)CC1 ZINC000588904597 344199163 /nfs/dbraw/zinc/19/91/63/344199163.db2.gz FQUITXVYEYNDAM-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN C[C@@H](c1cccc(F)c1)N1CCC(C)(C)CC1 ZINC000588904599 344199234 /nfs/dbraw/zinc/19/92/34/344199234.db2.gz FQUITXVYEYNDAM-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN CC(C)=CCN(C)Cc1ccc2ccccc2c1 ZINC000589251828 346678142 /nfs/dbraw/zinc/67/81/42/346678142.db2.gz NSWSJRJMRNZCCD-UHFFFAOYSA-N 0 3 239.362 4.238 20 0 BIADHN Fc1cccc([C@@H]2CCCN2[C@@H]2C=CCCC2)c1 ZINC000590400296 347087445 /nfs/dbraw/zinc/08/74/45/347087445.db2.gz AOJMVHQVJJBXFJ-CVEARBPZSA-N 0 3 245.341 4.071 20 0 BIADHN Fc1cccc([C@@H]2CCCN2[C@H]2C=CCCC2)c1 ZINC000590400305 347087463 /nfs/dbraw/zinc/08/74/63/347087463.db2.gz AOJMVHQVJJBXFJ-HOTGVXAUSA-N 0 3 245.341 4.071 20 0 BIADHN Fc1cccc([C@H]2CCCN2[C@@H]2C=CCCC2)c1 ZINC000590400309 347087084 /nfs/dbraw/zinc/08/70/84/347087084.db2.gz AOJMVHQVJJBXFJ-HZPDHXFCSA-N 0 3 245.341 4.071 20 0 BIADHN Fc1cccc([C@H]2CCCN2[C@H]2C=CCCC2)c1 ZINC000590400310 347087525 /nfs/dbraw/zinc/08/75/25/347087525.db2.gz AOJMVHQVJJBXFJ-JKSUJKDBSA-N 0 3 245.341 4.071 20 0 BIADHN CC[C@@H](C)[C@@H](C)N(Cc1ccccc1F)C1CC1 ZINC000591474410 347667145 /nfs/dbraw/zinc/66/71/45/347667145.db2.gz CLSXURAADLWZEY-CHWSQXEVSA-N 0 3 249.373 4.225 20 0 BIADHN CC[C@H](C)[C@@H](C)N(Cc1ccccc1F)C1CC1 ZINC000591474411 347667343 /nfs/dbraw/zinc/66/73/43/347667343.db2.gz CLSXURAADLWZEY-QWHCGFSZSA-N 0 3 249.373 4.225 20 0 BIADHN CC[C@H](C)[C@H](C)N(Cc1ccccc1F)C1CC1 ZINC000591474412 347667153 /nfs/dbraw/zinc/66/71/53/347667153.db2.gz CLSXURAADLWZEY-STQMWFEESA-N 0 3 249.373 4.225 20 0 BIADHN CCN(Cc1ccccc1Cl)[C@H]1C=CCCC1 ZINC000595563702 348282250 /nfs/dbraw/zinc/28/22/50/348282250.db2.gz GDNROHDYZYUTFX-AWEZNQCLSA-N 0 3 249.785 4.271 20 0 BIADHN CCN(Cc1ccccc1Cl)[C@@H]1C=CCCC1 ZINC000595563703 348281927 /nfs/dbraw/zinc/28/19/27/348281927.db2.gz GDNROHDYZYUTFX-CQSZACIVSA-N 0 3 249.785 4.271 20 0 BIADHN CC(C)N(Cc1ccccc1F)[C@H]1C=CCCC1 ZINC000595564144 348282206 /nfs/dbraw/zinc/28/22/06/348282206.db2.gz IJCPLXUSVZLVHI-HNNXBMFYSA-N 0 3 247.357 4.145 20 0 BIADHN CC(C)N(Cc1ccccc1F)[C@@H]1C=CCCC1 ZINC000595564145 348282017 /nfs/dbraw/zinc/28/20/17/348282017.db2.gz IJCPLXUSVZLVHI-OAHLLOKOSA-N 0 3 247.357 4.145 20 0 BIADHN CCCN(Cc1ccccc1F)[C@H]1C=CCCC1 ZINC000595564439 348281849 /nfs/dbraw/zinc/28/18/49/348281849.db2.gz WCFJPRDWQHSSBF-HNNXBMFYSA-N 0 3 247.357 4.146 20 0 BIADHN CCCN(Cc1ccccc1F)[C@@H]1C=CCCC1 ZINC000595564441 348281992 /nfs/dbraw/zinc/28/19/92/348281992.db2.gz WCFJPRDWQHSSBF-OAHLLOKOSA-N 0 3 247.357 4.146 20 0 BIADHN C1=C[C@H](N2CCC3(CCCCC3)CC2)CCC1 ZINC000595564741 348283237 /nfs/dbraw/zinc/28/32/37/348283237.db2.gz BMKXXTLDFXEMFH-HNNXBMFYSA-N 0 3 233.399 4.141 20 0 BIADHN C1=C[C@@H](N2CCC3(CCCCC3)CC2)CCC1 ZINC000595564742 348283141 /nfs/dbraw/zinc/28/31/41/348283141.db2.gz BMKXXTLDFXEMFH-OAHLLOKOSA-N 0 3 233.399 4.141 20 0 BIADHN CN(c1ccnc2ccccc21)C1CCCCC1 ZINC000599435097 349174844 /nfs/dbraw/zinc/17/48/44/349174844.db2.gz AAGGSNGWSPWCDG-UHFFFAOYSA-N 0 3 240.350 4.004 20 0 BIADHN C[C@H](c1ccccc1Cl)N(C)CC1CCC1 ZINC000600711146 344360657 /nfs/dbraw/zinc/36/06/57/344360657.db2.gz LVTVRDMNZRGXEN-LLVKDONJSA-N 0 3 237.774 4.133 20 0 BIADHN C[C@@H](c1ccccc1Cl)N(C)CC1CCC1 ZINC000600711157 344361708 /nfs/dbraw/zinc/36/17/08/344361708.db2.gz LVTVRDMNZRGXEN-NSHDSACASA-N 0 3 237.774 4.133 20 0 BIADHN C[C@H]1C[C@H]1c1ccc(CN(C)CCC(C)(C)C)o1 ZINC000603554816 349992141 /nfs/dbraw/zinc/99/21/41/349992141.db2.gz XUYOWVDUAMXSBK-GXTWGEPZSA-N 0 3 249.398 4.271 20 0 BIADHN C[C@H]1C[C@@H]1c1ccc(CN(C)CCC(C)(C)C)o1 ZINC000603554817 349992111 /nfs/dbraw/zinc/99/21/11/349992111.db2.gz XUYOWVDUAMXSBK-JSGCOSHPSA-N 0 3 249.398 4.271 20 0 BIADHN C[C@@H]1C[C@@H]1c1ccc(CN(C)CCC(C)(C)C)o1 ZINC000603554818 349991890 /nfs/dbraw/zinc/99/18/90/349991890.db2.gz XUYOWVDUAMXSBK-OCCSQVGLSA-N 0 3 249.398 4.271 20 0 BIADHN C[C@@H]1C[C@H]1c1ccc(CN(C)CCC(C)(C)C)o1 ZINC000603554819 349991847 /nfs/dbraw/zinc/99/18/47/349991847.db2.gz XUYOWVDUAMXSBK-TZMCWYRMSA-N 0 3 249.398 4.271 20 0 BIADHN C[C@H](CCC1CCCCC1)NCc1ccco1 ZINC000604417739 350127628 /nfs/dbraw/zinc/12/76/28/350127628.db2.gz UFTJLNDTGZECPV-CYBMUJFWSA-N 0 3 235.371 4.118 20 0 BIADHN C[C@@H](CCC1CCCCC1)NCc1ccco1 ZINC000604417740 350127748 /nfs/dbraw/zinc/12/77/48/350127748.db2.gz UFTJLNDTGZECPV-ZDUSSCGKSA-N 0 3 235.371 4.118 20 0 BIADHN Cc1ccccc1CNC(C)(C)c1cccs1 ZINC000604892917 350198029 /nfs/dbraw/zinc/19/80/29/350198029.db2.gz MDIMPSMPGWGXJY-UHFFFAOYSA-N 0 3 245.391 4.081 20 0 BIADHN CCCCCN(C)[C@H](C)c1ccccc1F ZINC000605150127 350260199 /nfs/dbraw/zinc/26/01/99/350260199.db2.gz WBYHEZZHXDICTJ-GFCCVEGCSA-N 0 3 223.335 4.009 20 0 BIADHN CCCCCN(C)[C@@H](C)c1ccccc1F ZINC000605150128 350260410 /nfs/dbraw/zinc/26/04/10/350260410.db2.gz WBYHEZZHXDICTJ-LBPRGKRZSA-N 0 3 223.335 4.009 20 0 BIADHN CC(C)=CCN1CCCCC[C@H]1c1ccco1 ZINC000605752193 347436533 /nfs/dbraw/zinc/43/65/33/347436533.db2.gz RLMDWPPLPMERMT-AWEZNQCLSA-N 0 3 233.355 4.163 20 0 BIADHN CC(C)=CCN1CCCCC[C@@H]1c1ccco1 ZINC000605752199 347436686 /nfs/dbraw/zinc/43/66/86/347436686.db2.gz RLMDWPPLPMERMT-CQSZACIVSA-N 0 3 233.355 4.163 20 0 BIADHN CC(C)=CCN1CCCCC[C@H]1c1ccc(C)o1 ZINC000606454371 350340309 /nfs/dbraw/zinc/34/03/09/350340309.db2.gz OJSBILVOESCYPK-HNNXBMFYSA-N 0 3 247.382 4.471 20 0 BIADHN CC(C)=CCN1CCCCC[C@@H]1c1ccc(C)o1 ZINC000606454372 350340337 /nfs/dbraw/zinc/34/03/37/350340337.db2.gz OJSBILVOESCYPK-OAHLLOKOSA-N 0 3 247.382 4.471 20 0 BIADHN CCCCCN[C@@H](CC)c1ccc(F)cc1F ZINC000606466594 350340884 /nfs/dbraw/zinc/34/08/84/350340884.db2.gz RZHNHXWCEUZKQG-AWEZNQCLSA-N 0 3 241.325 4.196 20 0 BIADHN CCCCCN[C@H](CC)c1ccc(F)cc1F ZINC000606466595 350340841 /nfs/dbraw/zinc/34/08/41/350340841.db2.gz RZHNHXWCEUZKQG-CQSZACIVSA-N 0 3 241.325 4.196 20 0 BIADHN CC[C@@H](NCC(C)(C)C)c1ccc(F)cc1F ZINC000606467303 350340911 /nfs/dbraw/zinc/34/09/11/350340911.db2.gz CIRDKELZPFBVFH-CYBMUJFWSA-N 0 3 241.325 4.052 20 0 BIADHN CC[C@H](NCC(C)(C)C)c1ccc(F)cc1F ZINC000606467304 350340978 /nfs/dbraw/zinc/34/09/78/350340978.db2.gz CIRDKELZPFBVFH-ZDUSSCGKSA-N 0 3 241.325 4.052 20 0 BIADHN Cc1ccc(CN[C@H](C)CCC2CCCC2)o1 ZINC000607167659 351028798 /nfs/dbraw/zinc/02/87/98/351028798.db2.gz CCYZZOFRFQPREG-GFCCVEGCSA-N 0 3 235.371 4.037 20 0 BIADHN Cc1ccc(CN[C@@H](C)CCC2CCCC2)o1 ZINC000607167660 351028848 /nfs/dbraw/zinc/02/88/48/351028848.db2.gz CCYZZOFRFQPREG-LBPRGKRZSA-N 0 3 235.371 4.037 20 0 BIADHN Cc1ccc(CN(CCC2CCCC2)C2CC2)o1 ZINC000607727037 342782443 /nfs/dbraw/zinc/78/24/43/342782443.db2.gz ZPMHXDZAZYCJHJ-UHFFFAOYSA-N 0 3 247.382 4.133 20 0 BIADHN CCCN(CC)Cc1cc(Cl)ccc1Cl ZINC000607727798 342782726 /nfs/dbraw/zinc/78/27/26/342782726.db2.gz IIGOWUZJGPWHFI-UHFFFAOYSA-N 0 3 246.181 4.225 20 0 BIADHN CC(C)=CCN(Cc1ccoc1)C1CCCCC1 ZINC000607742377 342787025 /nfs/dbraw/zinc/78/70/25/342787025.db2.gz KKUCVWDQNARRRS-UHFFFAOYSA-N 0 3 247.382 4.381 20 0 BIADHN CCN(CCC1CC1)Cc1ccc(Cl)s1 ZINC000608491404 355813705 /nfs/dbraw/zinc/81/37/05/355813705.db2.gz ZKJKFCAQAJWHIR-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CCC(C)(C)CCN(C)Cc1ccsc1 ZINC000608492022 355814787 /nfs/dbraw/zinc/81/47/87/355814787.db2.gz YRIVKJNKLJWUTO-UHFFFAOYSA-N 0 3 225.401 4.006 20 0 BIADHN CCN(Cc1ccoc1)[C@@H](C)c1cccc(C)c1 ZINC000608494673 355818232 /nfs/dbraw/zinc/81/82/32/355818232.db2.gz ISFKCRHVEAQHMZ-AWEZNQCLSA-N 0 3 243.350 4.171 20 0 BIADHN CCN(Cc1ccoc1)[C@H](C)c1cccc(C)c1 ZINC000608494679 355817944 /nfs/dbraw/zinc/81/79/44/355817944.db2.gz ISFKCRHVEAQHMZ-CQSZACIVSA-N 0 3 243.350 4.171 20 0 BIADHN CCN(CCC(C)(C)CC)CCC(F)(F)F ZINC000608494686 355818759 /nfs/dbraw/zinc/81/87/59/355818759.db2.gz JOIQBDRWQJLEOF-UHFFFAOYSA-N 0 3 239.325 4.087 20 0 BIADHN Clc1cccc(CN2C3CCCC2CCC3)c1 ZINC000608498833 355827150 /nfs/dbraw/zinc/82/71/50/355827150.db2.gz BGPSOTUZUBXPTD-UHFFFAOYSA-N 0 3 249.785 4.247 20 0 BIADHN Clc1ccc(CN2C3CCCC2CCC3)cc1 ZINC000608499107 355827902 /nfs/dbraw/zinc/82/79/02/355827902.db2.gz AENLSQZGWNWSAP-UHFFFAOYSA-N 0 3 249.785 4.247 20 0 BIADHN Clc1ccccc1CN1C2CCCC1CCC2 ZINC000608499694 355827754 /nfs/dbraw/zinc/82/77/54/355827754.db2.gz VRLCMLPTABMEOQ-UHFFFAOYSA-N 0 3 249.785 4.247 20 0 BIADHN CN(CCC1CCCCC1)Cc1ccsc1 ZINC000608559897 355857824 /nfs/dbraw/zinc/85/78/24/355857824.db2.gz RAMUKTFZAOPOJS-UHFFFAOYSA-N 0 3 237.412 4.150 20 0 BIADHN CC[C@@H]1CCCN([C@H](C)c2ccccc2F)C1 ZINC000613391164 363163241 /nfs/dbraw/zinc/16/32/41/363163241.db2.gz UOBKMHFFYUOJHK-CHWSQXEVSA-N 0 3 235.346 4.009 20 0 BIADHN CC[C@H]1CCCN([C@H](C)c2ccccc2F)C1 ZINC000613391165 363162756 /nfs/dbraw/zinc/16/27/56/363162756.db2.gz UOBKMHFFYUOJHK-OLZOCXBDSA-N 0 3 235.346 4.009 20 0 BIADHN CC[C@@H]1CCCN([C@@H](C)c2ccccc2F)C1 ZINC000613391166 363162960 /nfs/dbraw/zinc/16/29/60/363162960.db2.gz UOBKMHFFYUOJHK-QWHCGFSZSA-N 0 3 235.346 4.009 20 0 BIADHN CC[C@H]1CCCN([C@@H](C)c2ccccc2F)C1 ZINC000613391167 363163142 /nfs/dbraw/zinc/16/31/42/363163142.db2.gz UOBKMHFFYUOJHK-STQMWFEESA-N 0 3 235.346 4.009 20 0 BIADHN Cc1ccc(CN(CC2CCCCC2)C2CC2)o1 ZINC000613442929 363256714 /nfs/dbraw/zinc/25/67/14/363256714.db2.gz CMRQRFHSVUJCIL-UHFFFAOYSA-N 0 3 247.382 4.133 20 0 BIADHN CC(C)=CCN(C)Cc1cccc2ccccc21 ZINC000613448137 363271117 /nfs/dbraw/zinc/27/11/17/363271117.db2.gz VFIZGVIPAWYMPL-UHFFFAOYSA-N 0 3 239.362 4.238 20 0 BIADHN CCCCN(C)Cc1cc(Cl)cc(Cl)c1 ZINC000613462390 363369903 /nfs/dbraw/zinc/36/99/03/363369903.db2.gz PLMAJUJVKGBCPE-UHFFFAOYSA-N 0 3 246.181 4.225 20 0 BIADHN C[C@H](c1ccccc1F)N(C)CC1CCCC1 ZINC000613464737 363371867 /nfs/dbraw/zinc/37/18/67/363371867.db2.gz KSKWBXFTCHULKX-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN C[C@@H](c1ccccc1F)N(C)CC1CCCC1 ZINC000613464738 363371152 /nfs/dbraw/zinc/37/11/52/363371152.db2.gz KSKWBXFTCHULKX-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN CC(C)=CCN(Cc1ccc(Cl)cc1)C1CC1 ZINC000613464973 363373203 /nfs/dbraw/zinc/37/32/03/363373203.db2.gz VIPBREWYFZASIE-UHFFFAOYSA-N 0 3 249.785 4.271 20 0 BIADHN CC(C)CCN(C)[C@H](C)c1cc(F)ccc1F ZINC000613465852 363374610 /nfs/dbraw/zinc/37/46/10/363374610.db2.gz VMJGVTMFIBDIOO-LLVKDONJSA-N 0 3 241.325 4.004 20 0 BIADHN CC(C)CCN(C)[C@@H](C)c1cc(F)ccc1F ZINC000613465855 363374638 /nfs/dbraw/zinc/37/46/38/363374638.db2.gz VMJGVTMFIBDIOO-NSHDSACASA-N 0 3 241.325 4.004 20 0 BIADHN CC(C)=CCN1CCC[C@H]1c1cccc(Cl)c1 ZINC000613470158 363384246 /nfs/dbraw/zinc/38/42/46/363384246.db2.gz FHDLGOUZXHKNJM-HNNXBMFYSA-N 0 3 249.785 4.443 20 0 BIADHN CC(C)=CCN1CCC[C@@H]1c1cccc(Cl)c1 ZINC000613470160 363384604 /nfs/dbraw/zinc/38/46/04/363384604.db2.gz FHDLGOUZXHKNJM-OAHLLOKOSA-N 0 3 249.785 4.443 20 0 BIADHN CC(C)CCN(C)[C@H](C)c1ccccc1Cl ZINC000613484807 363455477 /nfs/dbraw/zinc/45/54/77/363455477.db2.gz NBLSSTUTJGPAEU-GFCCVEGCSA-N 0 3 239.790 4.379 20 0 BIADHN CC(C)CCN(C)[C@@H](C)c1ccccc1Cl ZINC000613484817 363455438 /nfs/dbraw/zinc/45/54/38/363455438.db2.gz NBLSSTUTJGPAEU-LBPRGKRZSA-N 0 3 239.790 4.379 20 0 BIADHN CC(C)=CCN(C)[C@H](C)c1cccc(Cl)c1 ZINC000613485396 363455717 /nfs/dbraw/zinc/45/57/17/363455717.db2.gz CUHHWLZELYDOQU-GFCCVEGCSA-N 0 3 237.774 4.299 20 0 BIADHN CC(C)=CCN(C)[C@@H](C)c1cccc(Cl)c1 ZINC000613485397 363455241 /nfs/dbraw/zinc/45/52/41/363455241.db2.gz CUHHWLZELYDOQU-LBPRGKRZSA-N 0 3 237.774 4.299 20 0 BIADHN CC(C)=CCN1CCC[C@H]1c1ccccc1Cl ZINC000613492596 363464974 /nfs/dbraw/zinc/46/49/74/363464974.db2.gz SYTICDKVZGICQU-HNNXBMFYSA-N 0 3 249.785 4.443 20 0 BIADHN CC(C)=CCN1CCC[C@@H]1c1ccccc1Cl ZINC000613492597 363465014 /nfs/dbraw/zinc/46/50/14/363465014.db2.gz SYTICDKVZGICQU-OAHLLOKOSA-N 0 3 249.785 4.443 20 0 BIADHN CCC1CCN(Cc2ccc(SC)cc2)CC1 ZINC000613503066 363466105 /nfs/dbraw/zinc/46/61/05/363466105.db2.gz GPJZUJGTQXKMLG-UHFFFAOYSA-N 0 3 249.423 4.031 20 0 BIADHN CCC1CCN([C@H](C)c2ccc(F)cc2)CC1 ZINC000613503080 363466034 /nfs/dbraw/zinc/46/60/34/363466034.db2.gz MAGDDGDYTIARBA-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN CCC1CCN([C@@H](C)c2ccc(F)cc2)CC1 ZINC000613503081 363465254 /nfs/dbraw/zinc/46/52/54/363465254.db2.gz MAGDDGDYTIARBA-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN CCC1CCN([C@H](C)c2ccccc2F)CC1 ZINC000613506167 363468010 /nfs/dbraw/zinc/46/80/10/363468010.db2.gz YNJSJJRPZQXURT-GFCCVEGCSA-N 0 3 235.346 4.009 20 0 BIADHN CCC1CCN([C@@H](C)c2ccccc2F)CC1 ZINC000613506168 363467682 /nfs/dbraw/zinc/46/76/82/363467682.db2.gz YNJSJJRPZQXURT-LBPRGKRZSA-N 0 3 235.346 4.009 20 0 BIADHN CCN(Cc1ccc(Cl)cc1Cl)C(C)C ZINC000613570209 363511202 /nfs/dbraw/zinc/51/12/02/363511202.db2.gz UPIOPINQNXLZMJ-UHFFFAOYSA-N 0 3 246.181 4.224 20 0 BIADHN CCCN([C@H](C)c1ccccc1Cl)C1CC1 ZINC000614330032 363787161 /nfs/dbraw/zinc/78/71/61/363787161.db2.gz DBWBKKYOSDCXFU-LLVKDONJSA-N 0 3 237.774 4.275 20 0 BIADHN CCCN([C@@H](C)c1ccccc1Cl)C1CC1 ZINC000614330033 363786623 /nfs/dbraw/zinc/78/66/23/363786623.db2.gz DBWBKKYOSDCXFU-NSHDSACASA-N 0 3 237.774 4.275 20 0 BIADHN CC(C)=CCN(C)[C@@H](C)c1ccc(C)cc1C ZINC000615464447 367965908 /nfs/dbraw/zinc/96/59/08/367965908.db2.gz YJPFFTNOHHDARN-HNNXBMFYSA-N 0 3 231.383 4.262 20 0 BIADHN CC(C)=CCN(C)[C@H](C)c1ccc(C)cc1C ZINC000615464451 367966887 /nfs/dbraw/zinc/96/68/87/367966887.db2.gz YJPFFTNOHHDARN-OAHLLOKOSA-N 0 3 231.383 4.262 20 0 BIADHN C[C@H](c1ccc(Cl)cc1)N1CCCCCC1 ZINC000618438365 369145490 /nfs/dbraw/zinc/14/54/90/369145490.db2.gz YKZLJGICORUIEU-GFCCVEGCSA-N 0 3 237.774 4.277 20 0 BIADHN CCCCC1CCC(NCc2ccco2)CC1 ZINC000620119745 369739227 /nfs/dbraw/zinc/73/92/27/369739227.db2.gz IVIHJHXWOHLXNY-UHFFFAOYSA-N 0 3 235.371 4.118 20 0 BIADHN CC(C)=CCN(C)[C@@H](C)c1cc(C)ccc1C ZINC000621281448 370213756 /nfs/dbraw/zinc/21/37/56/370213756.db2.gz OTEBQAAHYVSWAB-HNNXBMFYSA-N 0 3 231.383 4.262 20 0 BIADHN CC(C)=CCN(C)[C@H](C)c1cc(C)ccc1C ZINC000621281449 370213209 /nfs/dbraw/zinc/21/32/09/370213209.db2.gz OTEBQAAHYVSWAB-OAHLLOKOSA-N 0 3 231.383 4.262 20 0 BIADHN CCCN(CC=C(C)C)Cc1ccccc1F ZINC000621296958 370224804 /nfs/dbraw/zinc/22/48/04/370224804.db2.gz UPKLHDGQVRNMNK-UHFFFAOYSA-N 0 3 235.346 4.004 20 0 BIADHN CCC(F)(F)C(C)(C)CN[C@@H](C)c1ccco1 ZINC000623341531 356742203 /nfs/dbraw/zinc/74/22/03/356742203.db2.gz GZZCFRCOZGNKHU-JTQLQIEISA-N 0 3 245.313 4.002 20 0 BIADHN CCC(F)(F)C(C)(C)CN[C@H](C)c1ccco1 ZINC000623341532 356742267 /nfs/dbraw/zinc/74/22/67/356742267.db2.gz GZZCFRCOZGNKHU-SNVBAGLBSA-N 0 3 245.313 4.002 20 0 BIADHN CCC(F)(F)C(C)(C)CN[C@@H](C)c1ccoc1 ZINC000623452876 359402774 /nfs/dbraw/zinc/40/27/74/359402774.db2.gz SFDISRPSBMMYMX-JTQLQIEISA-N 0 3 245.313 4.002 20 0 BIADHN CCC(F)(F)C(C)(C)CN[C@H](C)c1ccoc1 ZINC000623452877 359404207 /nfs/dbraw/zinc/40/42/07/359404207.db2.gz SFDISRPSBMMYMX-SNVBAGLBSA-N 0 3 245.313 4.002 20 0 BIADHN CC[C@H](NCc1ccoc1)c1cc(C)ccc1C ZINC000623752079 371082267 /nfs/dbraw/zinc/08/22/67/371082267.db2.gz YNFJAXMYYRMMDD-INIZCTEOSA-N 0 3 243.350 4.137 20 0 BIADHN CC[C@@H](NCc1ccoc1)c1cc(C)ccc1C ZINC000623752080 371082528 /nfs/dbraw/zinc/08/25/28/371082528.db2.gz YNFJAXMYYRMMDD-MRXNPFEDSA-N 0 3 243.350 4.137 20 0 BIADHN CCC[C@@H](C)CCCN[C@@H](C)c1cscn1 ZINC000625535617 490262287 /nfs/dbraw/zinc/26/22/87/490262287.db2.gz TZRBTHQFMBYDON-NEPJUHHUSA-N 0 3 240.416 4.010 20 0 BIADHN CCC[C@H](C)CCCN[C@H](C)c1cscn1 ZINC000625535618 490262407 /nfs/dbraw/zinc/26/24/07/490262407.db2.gz TZRBTHQFMBYDON-NWDGAFQWSA-N 0 3 240.416 4.010 20 0 BIADHN CCC[C@H](C)CCCN[C@@H](C)c1cscn1 ZINC000625535619 490262356 /nfs/dbraw/zinc/26/23/56/490262356.db2.gz TZRBTHQFMBYDON-RYUDHWBXSA-N 0 3 240.416 4.010 20 0 BIADHN CCC[C@@H](C)CCCN[C@H](C)c1cscn1 ZINC000625535620 490262218 /nfs/dbraw/zinc/26/22/18/490262218.db2.gz TZRBTHQFMBYDON-VXGBXAGGSA-N 0 3 240.416 4.010 20 0 BIADHN Cc1ccc(CN[C@]23C[C@H]2CCCC3)c(Cl)c1 ZINC000630073173 388615497 /nfs/dbraw/zinc/61/54/97/388615497.db2.gz RTFHWCNEZYRKKC-UKRRQHHQSA-N 0 3 249.785 4.071 20 0 BIADHN Cc1ccc(CN[C@@]23C[C@@H]2CCCC3)c(Cl)c1 ZINC000630073175 388615402 /nfs/dbraw/zinc/61/54/02/388615402.db2.gz RTFHWCNEZYRKKC-ZFWWWQNUSA-N 0 3 249.785 4.071 20 0 BIADHN C[C@@H](c1ccccc1Cl)N1C2CCC1CC2 ZINC000635900208 346106010 /nfs/dbraw/zinc/10/60/10/346106010.db2.gz CQSSEIURIUJWOX-UNXYVOJBSA-N 0 3 235.758 4.028 20 0 BIADHN C[C@H](c1ccccc1Cl)N1C2CCC1CC2 ZINC000635900209 346105718 /nfs/dbraw/zinc/10/57/18/346105718.db2.gz CQSSEIURIUJWOX-VOMCLLRMSA-N 0 3 235.758 4.028 20 0 BIADHN CC(C)=CCN(C)[C@H](C)c1cc2ccccc2o1 ZINC000641903491 362801095 /nfs/dbraw/zinc/80/10/95/362801095.db2.gz VZXWEPPQIFTFPW-CYBMUJFWSA-N 0 3 243.350 4.392 20 0 BIADHN CC(C)=CCN(C)[C@@H](C)c1cc2ccccc2o1 ZINC000641903492 362800813 /nfs/dbraw/zinc/80/08/13/362800813.db2.gz VZXWEPPQIFTFPW-ZDUSSCGKSA-N 0 3 243.350 4.392 20 0 BIADHN CC(C)=CCN1CCC[C@H]1c1ccc(Cl)cc1 ZINC000641976675 362815804 /nfs/dbraw/zinc/81/58/04/362815804.db2.gz WDWVVHZWKHZYRL-HNNXBMFYSA-N 0 3 249.785 4.443 20 0 BIADHN CC(C)=CCN1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000641976676 362815877 /nfs/dbraw/zinc/81/58/77/362815877.db2.gz WDWVVHZWKHZYRL-OAHLLOKOSA-N 0 3 249.785 4.443 20 0 BIADHN CCCCN(Cc1ccccc1Cl)C1CC1 ZINC000642189412 362901735 /nfs/dbraw/zinc/90/17/35/362901735.db2.gz MKJQSAIZGALJJV-UHFFFAOYSA-N 0 3 237.774 4.105 20 0 BIADHN CC(C)CN(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000642252404 362994075 /nfs/dbraw/zinc/99/40/75/362994075.db2.gz OGZQINPZVCUFFF-DOMZBBRYSA-N 0 3 247.382 4.023 20 0 BIADHN CC(C)CN(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000642252405 362994449 /nfs/dbraw/zinc/99/44/49/362994449.db2.gz OGZQINPZVCUFFF-IUODEOHRSA-N 0 3 247.382 4.023 20 0 BIADHN CC(C)CN(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 ZINC000642252406 362994358 /nfs/dbraw/zinc/99/43/58/362994358.db2.gz OGZQINPZVCUFFF-SWLSCSKDSA-N 0 3 247.382 4.023 20 0 BIADHN CC(C)CN(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 ZINC000642252407 362994013 /nfs/dbraw/zinc/99/40/13/362994013.db2.gz OGZQINPZVCUFFF-WFASDCNBSA-N 0 3 247.382 4.023 20 0 BIADHN Cc1ccc([C@H](C)N(C)Cc2ccccc2)cc1 ZINC000642641930 388817295 /nfs/dbraw/zinc/81/72/95/388817295.db2.gz IUBLTQIGQHLTNX-HNNXBMFYSA-N 0 3 239.362 4.188 20 0 BIADHN C[C@H](c1ccc(F)cc1)N1CCC(C2CC2)CC1 ZINC000644718239 385135483 /nfs/dbraw/zinc/13/54/83/385135483.db2.gz GDIZDYPPDXQADM-GFCCVEGCSA-N 0 3 247.357 4.009 20 0 BIADHN C[C@@H](c1ccc(F)cc1)N1CCC(C2CC2)CC1 ZINC000644718246 385136061 /nfs/dbraw/zinc/13/60/61/385136061.db2.gz GDIZDYPPDXQADM-LBPRGKRZSA-N 0 3 247.357 4.009 20 0 BIADHN C[C@H](c1cccc(F)c1)N1CCC(C2CC2)CC1 ZINC000644720171 385139081 /nfs/dbraw/zinc/13/90/81/385139081.db2.gz VSANFYVFSDIEPU-GFCCVEGCSA-N 0 3 247.357 4.009 20 0 BIADHN C[C@@H](c1cccc(F)c1)N1CCC(C2CC2)CC1 ZINC000644720172 385137835 /nfs/dbraw/zinc/13/78/35/385137835.db2.gz VSANFYVFSDIEPU-LBPRGKRZSA-N 0 3 247.357 4.009 20 0 BIADHN C[C@H](c1ccccc1F)N1CCC(C2CC2)CC1 ZINC000644720202 385137639 /nfs/dbraw/zinc/13/76/39/385137639.db2.gz WLSVVRWCTXZHHV-GFCCVEGCSA-N 0 3 247.357 4.009 20 0 BIADHN C[C@@H](c1ccccc1F)N1CCC(C2CC2)CC1 ZINC000644720204 385138589 /nfs/dbraw/zinc/13/85/89/385138589.db2.gz WLSVVRWCTXZHHV-LBPRGKRZSA-N 0 3 247.357 4.009 20 0 BIADHN CN(Cc1ccsc1)[C@H]1C=CCCCCC1 ZINC000645076012 386704319 /nfs/dbraw/zinc/70/43/19/386704319.db2.gz JQXUGNYFDIUYAV-AWEZNQCLSA-N 0 3 235.396 4.069 20 0 BIADHN CN(Cc1ccsc1)[C@@H]1C=CCCCCC1 ZINC000645076013 386703245 /nfs/dbraw/zinc/70/32/45/386703245.db2.gz JQXUGNYFDIUYAV-CQSZACIVSA-N 0 3 235.396 4.069 20 0 BIADHN C[C@H](NCCC(C)(C)F)c1ccccc1Cl ZINC000656685660 411327979 /nfs/dbraw/zinc/32/79/79/411327979.db2.gz XDNBVXVBJZLHHO-JTQLQIEISA-N 0 3 243.753 4.129 20 0 BIADHN C[C@@H](NCCC(C)(C)F)c1ccccc1Cl ZINC000656685661 411328139 /nfs/dbraw/zinc/32/81/39/411328139.db2.gz XDNBVXVBJZLHHO-SNVBAGLBSA-N 0 3 243.753 4.129 20 0 BIADHN C[C@@H](NCCC(C)(C)F)c1csc(Cl)c1 ZINC000658191089 411286870 /nfs/dbraw/zinc/28/68/70/411286870.db2.gz JSNIYJIMXKKKCM-MRVPVSSYSA-N 0 3 249.782 4.190 20 0 BIADHN C[C@H](NCCC(C)(C)F)c1csc(Cl)c1 ZINC000658191090 411286913 /nfs/dbraw/zinc/28/69/13/411286913.db2.gz JSNIYJIMXKKKCM-QMMMGPOBSA-N 0 3 249.782 4.190 20 0 BIADHN CC[C@@H](NCCC(C)(C)F)c1ccccc1F ZINC000658191467 411287015 /nfs/dbraw/zinc/28/70/15/411287015.db2.gz UUQKUFKGRVODNA-CYBMUJFWSA-N 0 3 241.325 4.005 20 0 BIADHN CC[C@H](NCCC(C)(C)F)c1ccccc1F ZINC000658191468 411286595 /nfs/dbraw/zinc/28/65/95/411286595.db2.gz UUQKUFKGRVODNA-ZDUSSCGKSA-N 0 3 241.325 4.005 20 0 BIADHN C[C@@H](NCCC(C)(C)F)c1cc2ccccc2o1 ZINC000658192388 411287894 /nfs/dbraw/zinc/28/78/94/411287894.db2.gz IRGKLVXQFWDMSA-LLVKDONJSA-N 0 3 249.329 4.222 20 0 BIADHN C[C@H](NCCC(C)(C)F)c1cc2ccccc2o1 ZINC000658192389 411287360 /nfs/dbraw/zinc/28/73/60/411287360.db2.gz IRGKLVXQFWDMSA-NSHDSACASA-N 0 3 249.329 4.222 20 0 BIADHN CC[C@@H](CC(F)F)CN1C2CCCC1CCC2 ZINC000659956119 411398798 /nfs/dbraw/zinc/39/87/98/411398798.db2.gz HEGHBBIAMYKGMT-HIFPTAJRSA-N 0 3 245.357 4.075 20 0 BIADHN CC[C@H](CC(F)F)CN1C2CCCC1CCC2 ZINC000659956122 411398907 /nfs/dbraw/zinc/39/89/07/411398907.db2.gz HEGHBBIAMYKGMT-PNESKVBLSA-N 0 3 245.357 4.075 20 0 BIADHN CC(C)=CCCN1CCC(CC(F)(F)F)CC1 ZINC000660497405 411594572 /nfs/dbraw/zinc/59/45/72/411594572.db2.gz XFPVBEBXQFEHCH-UHFFFAOYSA-N 0 3 249.320 4.007 20 0 BIADHN CC(C)=CCCN1CC2(CCC2)[C@@H]1c1ccco1 ZINC000660738648 411620210 /nfs/dbraw/zinc/62/02/10/411620210.db2.gz RFXOXOCPMOERFI-HNNXBMFYSA-N 0 3 245.366 4.163 20 0 BIADHN CC(C)=CCCN1CC2(CCC2)[C@H]1c1ccco1 ZINC000660738651 411620324 /nfs/dbraw/zinc/62/03/24/411620324.db2.gz RFXOXOCPMOERFI-OAHLLOKOSA-N 0 3 245.366 4.163 20 0 BIADHN c1coc([C@@H]2N(C3CCCC3)CC23CCCC3)c1 ZINC000661438901 411776632 /nfs/dbraw/zinc/77/66/32/411776632.db2.gz WBRXOLREGNYCQL-HNNXBMFYSA-N 0 3 245.366 4.139 20 0 BIADHN c1coc([C@H]2N(C3CCCC3)CC23CCCC3)c1 ZINC000661438902 411776339 /nfs/dbraw/zinc/77/63/39/411776339.db2.gz WBRXOLREGNYCQL-OAHLLOKOSA-N 0 3 245.366 4.139 20 0 BIADHN c1ccc(C(c2ccccc2)N2CC=CCC2)cc1 ZINC000669932792 487936298 /nfs/dbraw/zinc/93/62/98/487936298.db2.gz JPNYKSICUIFNPJ-UHFFFAOYSA-N 0 3 249.357 4.038 20 0 BIADHN CCc1cccc(CN[C@H](C)c2ccsc2)c1 ZINC000669939424 487943327 /nfs/dbraw/zinc/94/33/27/487943327.db2.gz AWFYKVGQAQYKSA-GFCCVEGCSA-N 0 3 245.391 4.161 20 0 BIADHN CCc1cccc(CN[C@@H](C)c2ccsc2)c1 ZINC000669939425 487943860 /nfs/dbraw/zinc/94/38/60/487943860.db2.gz AWFYKVGQAQYKSA-LBPRGKRZSA-N 0 3 245.391 4.161 20 0 BIADHN CC(C)N(Cc1sccc1Cl)C(C)C ZINC000670084948 488073580 /nfs/dbraw/zinc/07/35/80/488073580.db2.gz ZUYRTYZUDIZTHX-UHFFFAOYSA-N 0 3 231.792 4.020 20 0 BIADHN CN(Cc1cccs1)C(C)(C)c1ccccc1 ZINC000671245857 487889598 /nfs/dbraw/zinc/88/95/98/487889598.db2.gz QOATVQKQZVAGMW-UHFFFAOYSA-N 0 3 245.391 4.115 20 0 BIADHN CN(Cc1ccsc1)C(C)(C)c1ccccc1 ZINC000671309226 487625173 /nfs/dbraw/zinc/62/51/73/487625173.db2.gz MYARXGDUXXINRF-UHFFFAOYSA-N 0 3 245.391 4.115 20 0 BIADHN C[C@H](c1ccc(F)cc1)N1CCC2(CCC2)CC1 ZINC000671728756 487711356 /nfs/dbraw/zinc/71/13/56/487711356.db2.gz DOIDXCWHLQOLTD-CYBMUJFWSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@@H](c1ccc(F)cc1)N1CCC2(CCC2)CC1 ZINC000671728757 487711477 /nfs/dbraw/zinc/71/14/77/487711477.db2.gz DOIDXCWHLQOLTD-ZDUSSCGKSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@H](c1ccccc1F)N1CCC2(CCC2)CC1 ZINC000671728855 487711104 /nfs/dbraw/zinc/71/11/04/487711104.db2.gz MLHVKCKSVVYNQE-CYBMUJFWSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@@H](c1ccccc1F)N1CCC2(CCC2)CC1 ZINC000671728856 487711044 /nfs/dbraw/zinc/71/10/44/487711044.db2.gz MLHVKCKSVVYNQE-ZDUSSCGKSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@H](c1cccc(F)c1)N1CCC2(CCC2)CC1 ZINC000671729665 487712144 /nfs/dbraw/zinc/71/21/44/487712144.db2.gz UYDBBSKLESBQRO-CYBMUJFWSA-N 0 3 247.357 4.153 20 0 BIADHN C[C@@H](c1cccc(F)c1)N1CCC2(CCC2)CC1 ZINC000671729666 487711932 /nfs/dbraw/zinc/71/19/32/487711932.db2.gz UYDBBSKLESBQRO-ZDUSSCGKSA-N 0 3 247.357 4.153 20 0 BIADHN CC[C@H](NCc1ccoc1C)c1cccc(C)c1 ZINC000671743666 487718567 /nfs/dbraw/zinc/71/85/67/487718567.db2.gz JRHHPEXQCKTHHX-INIZCTEOSA-N 0 3 243.350 4.137 20 0 BIADHN CC[C@@H](NCc1ccoc1C)c1cccc(C)c1 ZINC000671743667 487718578 /nfs/dbraw/zinc/71/85/78/487718578.db2.gz JRHHPEXQCKTHHX-MRXNPFEDSA-N 0 3 243.350 4.137 20 0 BIADHN CC(C)(C)CCN1CC[C@H]1c1cccc(F)c1 ZINC000674013783 487995131 /nfs/dbraw/zinc/99/51/31/487995131.db2.gz RGHGNBUCDFVGIC-AWEZNQCLSA-N 0 3 235.346 4.009 20 0 BIADHN CC(C)(C)CCN1CC[C@@H]1c1cccc(F)c1 ZINC000674013784 487995118 /nfs/dbraw/zinc/99/51/18/487995118.db2.gz RGHGNBUCDFVGIC-CQSZACIVSA-N 0 3 235.346 4.009 20 0 BIADHN CN(CCC(C)(C)C)Cc1cc2ccccc2[nH]1 ZINC000674505556 487590040 /nfs/dbraw/zinc/59/00/40/487590040.db2.gz MWMLXVPLINQHJY-UHFFFAOYSA-N 0 3 244.382 4.036 20 0 BIADHN CN(CCC(C)(C)C)Cc1ccc(Cl)s1 ZINC000674877475 487641042 /nfs/dbraw/zinc/64/10/42/487641042.db2.gz ULPMCKMZNDRWLW-UHFFFAOYSA-N 0 3 245.819 4.270 20 0 BIADHN CCc1ccc([C@H](C)NCc2ccoc2C)s1 ZINC000675780315 487778788 /nfs/dbraw/zinc/77/87/88/487778788.db2.gz WOPHUFIAKUOCKG-JTQLQIEISA-N 0 3 249.379 4.063 20 0 BIADHN CCc1ccc([C@@H](C)NCc2ccoc2C)s1 ZINC000675780324 487778637 /nfs/dbraw/zinc/77/86/37/487778637.db2.gz WOPHUFIAKUOCKG-SNVBAGLBSA-N 0 3 249.379 4.063 20 0 BIADHN CCN(Cc1ccoc1)[C@@H](C)c1ccccc1C ZINC000675888206 487787456 /nfs/dbraw/zinc/78/74/56/487787456.db2.gz AJYQMFYWMXIFJT-AWEZNQCLSA-N 0 3 243.350 4.171 20 0 BIADHN CCN(Cc1ccoc1)[C@H](C)c1ccccc1C ZINC000675888214 487787164 /nfs/dbraw/zinc/78/71/64/487787164.db2.gz AJYQMFYWMXIFJT-CQSZACIVSA-N 0 3 243.350 4.171 20 0 BIADHN FC(F)(F)CCCCN1C2CCCC1CCC2 ZINC000676889473 487793773 /nfs/dbraw/zinc/79/37/73/487793773.db2.gz MKGZFOHFVZBIJL-UHFFFAOYSA-N 0 3 249.320 4.126 20 0 BIADHN c1ccc2cc(CN3[C@H]4C=CC[C@@H]3CC4)ccc2c1 ZINC000676908037 487945991 /nfs/dbraw/zinc/94/59/91/487945991.db2.gz CJYXECXQMOGHHO-ZWKOTPCHSA-N 0 3 249.357 4.133 20 0 BIADHN Cc1cccc([C@@H](C)N(C)Cc2ccsc2)c1 ZINC000677881964 488145629 /nfs/dbraw/zinc/14/56/29/488145629.db2.gz HKGAFYPXDZZYAM-CYBMUJFWSA-N 0 3 245.391 4.250 20 0 BIADHN Cc1cccc([C@H](C)N(C)Cc2ccsc2)c1 ZINC000677881965 488146103 /nfs/dbraw/zinc/14/61/03/488146103.db2.gz HKGAFYPXDZZYAM-ZDUSSCGKSA-N 0 3 245.391 4.250 20 0 BIADHN CC[C@@H](c1ccccc1)N(C)Cc1ccsc1 ZINC000677882596 488145860 /nfs/dbraw/zinc/14/58/60/488145860.db2.gz XFIAKRSVSIGOGW-HNNXBMFYSA-N 0 3 245.391 4.331 20 0 BIADHN CC[C@H](c1ccccc1)N(C)Cc1ccsc1 ZINC000677882597 488145642 /nfs/dbraw/zinc/14/56/42/488145642.db2.gz XFIAKRSVSIGOGW-OAHLLOKOSA-N 0 3 245.391 4.331 20 0 BIADHN CCCN(Cc1cscc1Cl)CC1CC1 ZINC000678118752 488198668 /nfs/dbraw/zinc/19/86/68/488198668.db2.gz XALKQPGTJRMUIB-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CN(Cc1cscc1Cl)C1CCCCC1 ZINC000678119928 488199733 /nfs/dbraw/zinc/19/97/33/488199733.db2.gz FXMDKEMOVYAHQU-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN CCCN(CCC)Cc1cscc1Cl ZINC000678120497 488199986 /nfs/dbraw/zinc/19/99/86/488199986.db2.gz JCBNPENGCOCNOS-UHFFFAOYSA-N 0 3 231.792 4.024 20 0 BIADHN CC(C)[C@H]1CCCN1Cc1cscc1Cl ZINC000678140224 488204787 /nfs/dbraw/zinc/20/47/87/488204787.db2.gz YIXWUGZXXPEFMX-GFCCVEGCSA-N 0 3 243.803 4.022 20 0 BIADHN CC(C)[C@@H]1CCCN1Cc1cscc1Cl ZINC000678140225 488205156 /nfs/dbraw/zinc/20/51/56/488205156.db2.gz YIXWUGZXXPEFMX-LBPRGKRZSA-N 0 3 243.803 4.022 20 0 BIADHN CCN(Cc1cscc1Cl)C1CCCC1 ZINC000678140615 488203972 /nfs/dbraw/zinc/20/39/72/488203972.db2.gz PRRKPXIJSIQKLA-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN CC(C)N(Cc1cscc1Cl)CC1CC1 ZINC000678156238 488209944 /nfs/dbraw/zinc/20/99/44/488209944.db2.gz BFGKYILBVMNBGN-UHFFFAOYSA-N 0 3 243.803 4.022 20 0 BIADHN CN(Cc1cscc1Cl)CC1CCCC1 ZINC000678220822 488220574 /nfs/dbraw/zinc/22/05/74/488220574.db2.gz RTVTVWZVOYLAMF-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN CCC(C)(C)N(C)Cc1cscc1Cl ZINC000678259159 488227181 /nfs/dbraw/zinc/22/71/81/488227181.db2.gz DQMXTTXLNWOACN-UHFFFAOYSA-N 0 3 231.792 4.022 20 0 BIADHN CC(C)N(Cc1cscc1Cl)C1CCC1 ZINC000678277203 488235280 /nfs/dbraw/zinc/23/52/80/488235280.db2.gz RXDBIKFQHKLJDY-UHFFFAOYSA-N 0 3 243.803 4.164 20 0 BIADHN Clc1ccc([C@@H]2CCN2C2CCCC2)cc1 ZINC000678280296 488236329 /nfs/dbraw/zinc/23/63/29/488236329.db2.gz YSCLKPVNGBDBHF-AWEZNQCLSA-N 0 3 235.758 4.029 20 0 BIADHN Clc1ccc([C@H]2CCN2C2CCCC2)cc1 ZINC000678280299 488236324 /nfs/dbraw/zinc/23/63/24/488236324.db2.gz YSCLKPVNGBDBHF-CQSZACIVSA-N 0 3 235.758 4.029 20 0 BIADHN CCC(CC)CN1CC[C@H]1c1cccc(F)c1 ZINC000678283143 488236979 /nfs/dbraw/zinc/23/69/79/488236979.db2.gz BGOJHMSQPQNOQE-HNNXBMFYSA-N 0 3 235.346 4.009 20 0 BIADHN CCC(CC)CN1CC[C@@H]1c1cccc(F)c1 ZINC000678283144 488237298 /nfs/dbraw/zinc/23/72/98/488237298.db2.gz BGOJHMSQPQNOQE-OAHLLOKOSA-N 0 3 235.346 4.009 20 0 BIADHN CCCC[C@H](CC)CCN[C@H](C)c1ccccn1 ZINC000678359202 488246492 /nfs/dbraw/zinc/24/64/92/488246492.db2.gz UHDGSZDSLPYOQL-CABCVRRESA-N 0 3 248.414 4.339 20 0 BIADHN CCCC[C@H](CC)CCN[C@@H](C)c1ccccn1 ZINC000678359203 488246682 /nfs/dbraw/zinc/24/66/82/488246682.db2.gz UHDGSZDSLPYOQL-GJZGRUSLSA-N 0 3 248.414 4.339 20 0 BIADHN CCCC[C@@H](CC)CCN[C@H](C)c1ccccn1 ZINC000678359204 488246603 /nfs/dbraw/zinc/24/66/03/488246603.db2.gz UHDGSZDSLPYOQL-HUUCEWRRSA-N 0 3 248.414 4.339 20 0 BIADHN CCCC[C@@H](CC)CCN[C@@H](C)c1ccccn1 ZINC000678359205 488246755 /nfs/dbraw/zinc/24/67/55/488246755.db2.gz UHDGSZDSLPYOQL-LSDHHAIUSA-N 0 3 248.414 4.339 20 0 BIADHN Clc1ccc(C2(N[C@H]3C=CCCC3)CC2)cc1 ZINC000678775073 488282081 /nfs/dbraw/zinc/28/20/81/488282081.db2.gz ZXEZXZAXPMPEOK-AWEZNQCLSA-N 0 3 247.769 4.027 20 0 BIADHN Clc1ccc(C2(N[C@@H]3C=CCCC3)CC2)cc1 ZINC000678775074 488282048 /nfs/dbraw/zinc/28/20/48/488282048.db2.gz ZXEZXZAXPMPEOK-CQSZACIVSA-N 0 3 247.769 4.027 20 0 BIADHN CCC[C@@H](C)CN1CC[C@H]1c1cccc(F)c1 ZINC000678836188 488290418 /nfs/dbraw/zinc/29/04/18/488290418.db2.gz WHGLZTLORDCRLM-DOMZBBRYSA-N 0 3 235.346 4.009 20 0 BIADHN CCC[C@@H](C)CN1CC[C@@H]1c1cccc(F)c1 ZINC000678836196 488290080 /nfs/dbraw/zinc/29/00/80/488290080.db2.gz WHGLZTLORDCRLM-IUODEOHRSA-N 0 3 235.346 4.009 20 0 BIADHN CCC[C@H](C)CN1CC[C@@H]1c1cccc(F)c1 ZINC000678836197 488289726 /nfs/dbraw/zinc/28/97/26/488289726.db2.gz WHGLZTLORDCRLM-SWLSCSKDSA-N 0 3 235.346 4.009 20 0 BIADHN CCC[C@H](C)CN1CC[C@H]1c1cccc(F)c1 ZINC000678836199 488290396 /nfs/dbraw/zinc/29/03/96/488290396.db2.gz WHGLZTLORDCRLM-WFASDCNBSA-N 0 3 235.346 4.009 20 0 BIADHN CC[C@@H](c1ccc(Cl)cc1)N1CC=CCC1 ZINC000679322714 487902361 /nfs/dbraw/zinc/90/23/61/487902361.db2.gz AODIAYMISXZTOQ-AWEZNQCLSA-N 0 3 235.758 4.053 20 0 BIADHN CC[C@H](c1ccc(Cl)cc1)N1CC=CCC1 ZINC000679322716 487901920 /nfs/dbraw/zinc/90/19/20/487901920.db2.gz AODIAYMISXZTOQ-CQSZACIVSA-N 0 3 235.758 4.053 20 0 BIADHN C/C=C/CN[C@@H](C)c1cc2cc(Cl)ccc2o1 ZINC000680423132 487591744 /nfs/dbraw/zinc/59/17/44/487591744.db2.gz AIBDUUMKIULFLP-FSIBCCDJSA-N 0 3 249.741 4.313 20 0 BIADHN C/C=C/CN[C@H](C)c1cc2cc(Cl)ccc2o1 ZINC000680423133 487591165 /nfs/dbraw/zinc/59/11/65/487591165.db2.gz AIBDUUMKIULFLP-HMDXOVGESA-N 0 3 249.741 4.313 20 0 BIADHN C/C=C\CN[C@H](C)c1cc2cc(Cl)ccc2o1 ZINC000680423134 487591730 /nfs/dbraw/zinc/59/17/30/487591730.db2.gz AIBDUUMKIULFLP-UMBAGQNISA-N 0 3 249.741 4.313 20 0 BIADHN C/C=C\CN[C@@H](C)c1cc2cc(Cl)ccc2o1 ZINC000680423135 487591520 /nfs/dbraw/zinc/59/15/20/487591520.db2.gz AIBDUUMKIULFLP-XOULXFPDSA-N 0 3 249.741 4.313 20 0 BIADHN CC/C=C/CCN1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000681030799 487701401 /nfs/dbraw/zinc/70/14/01/487701401.db2.gz UYDHFFULCVPAJK-GKUNOOHESA-N 0 3 249.320 4.006 20 0 BIADHN CC/C=C\CCN1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000681030810 487701588 /nfs/dbraw/zinc/70/15/88/487701588.db2.gz UYDHFFULCVPAJK-KBIXYVOKSA-N 0 3 249.320 4.006 20 0 BIADHN CC/C=C/CCN1C[C@H](C(F)(F)F)CC[C@@H]1C ZINC000681030812 487701388 /nfs/dbraw/zinc/70/13/88/487701388.db2.gz UYDHFFULCVPAJK-RUULKOMLSA-N 0 3 249.320 4.006 20 0 BIADHN CC/C=C\CCN1C[C@H](C(F)(F)F)CC[C@H]1C ZINC000681030817 487701093 /nfs/dbraw/zinc/70/10/93/487701093.db2.gz UYDHFFULCVPAJK-XLMCQVRKSA-N 0 3 249.320 4.006 20 0 BIADHN CCN(CCCC(C)(C)C)CCC(F)(F)F ZINC000682028201 487882505 /nfs/dbraw/zinc/88/25/05/487882505.db2.gz YCJADOMLNSTKSE-UHFFFAOYSA-N 0 3 239.325 4.087 20 0 BIADHN CC(C)CCCN1CC[C@H]1c1cccc(F)c1 ZINC000682155677 487997747 /nfs/dbraw/zinc/99/77/47/487997747.db2.gz BWSIHOSCVUHVJV-HNNXBMFYSA-N 0 3 235.346 4.009 20 0 BIADHN CC(C)CCCN1CC[C@@H]1c1cccc(F)c1 ZINC000682155678 487997722 /nfs/dbraw/zinc/99/77/22/487997722.db2.gz BWSIHOSCVUHVJV-OAHLLOKOSA-N 0 3 235.346 4.009 20 0 BIADHN c1ccc([C@H]2CCN2[C@H]2CCc3ccccc32)cc1 ZINC000683782075 488220382 /nfs/dbraw/zinc/22/03/82/488220382.db2.gz JTONJYCANQZJET-MSOLQXFVSA-N 0 3 249.357 4.121 20 0 BIADHN c1ccc([C@H]2CCN2[C@@H]2CCc3ccccc32)cc1 ZINC000683782076 488220259 /nfs/dbraw/zinc/22/02/59/488220259.db2.gz JTONJYCANQZJET-QZTJIDSGSA-N 0 3 249.357 4.121 20 0 BIADHN c1ccc([C@@H]2CCN2[C@H]2CCc3ccccc32)cc1 ZINC000683782077 487698596 /nfs/dbraw/zinc/69/85/96/487698596.db2.gz JTONJYCANQZJET-ROUUACIJSA-N 0 3 249.357 4.121 20 0 BIADHN c1ccc([C@@H]2CCN2[C@@H]2CCc3ccccc32)cc1 ZINC000683782087 487698052 /nfs/dbraw/zinc/69/80/52/487698052.db2.gz JTONJYCANQZJET-ZWKOTPCHSA-N 0 3 249.357 4.121 20 0 BIADHN CN(Cc1cscc1Cl)C1(C)CCCC1 ZINC000683847388 488231691 /nfs/dbraw/zinc/23/16/91/488231691.db2.gz HNTLATWWZZHHEU-UHFFFAOYSA-N 0 3 243.803 4.166 20 0 BIADHN CCN(Cc1cscc1Cl)CC1CCC1 ZINC000684428255 488311957 /nfs/dbraw/zinc/31/19/57/488311957.db2.gz DWUQFSLYULBFOW-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN FC1(F)CCN(CCCC2CCCCC2)CC1 ZINC000685429866 487522326 /nfs/dbraw/zinc/52/23/26/487522326.db2.gz FJHIGCMODIOSLM-UHFFFAOYSA-N 0 3 245.357 4.078 20 0 BIADHN CC1(C)CCN(Cc2ccc(Cl)s2)CC1 ZINC000726972398 636038056 /nfs/dbraw/zinc/03/80/56/636038056.db2.gz UZNSNPJOACXERE-UHFFFAOYSA-N 0 3 243.803 4.024 20 0 BIADHN Cl/C=C\CN1CCC[C@H](c2ccccc2)CC1 ZINC000727584910 583687035 /nfs/dbraw/zinc/68/70/35/583687035.db2.gz AJMKUCNZIRJHOM-ANOSYLROSA-N 0 3 249.785 4.009 20 0 BIADHN Cl/C=C/CN1CCC[C@@H](c2ccccc2)CC1 ZINC000727584911 583686840 /nfs/dbraw/zinc/68/68/40/583686840.db2.gz AJMKUCNZIRJHOM-HYJLXUOHSA-N 0 3 249.785 4.009 20 0 BIADHN Cl/C=C/CN1CCC[C@H](c2ccccc2)CC1 ZINC000727584912 583687048 /nfs/dbraw/zinc/68/70/48/583687048.db2.gz AJMKUCNZIRJHOM-RNOHYWCBSA-N 0 3 249.785 4.009 20 0 BIADHN Cl/C=C\CN1CCC[C@@H](c2ccccc2)CC1 ZINC000727584913 583687074 /nfs/dbraw/zinc/68/70/74/583687074.db2.gz AJMKUCNZIRJHOM-WSVPDTOYSA-N 0 3 249.785 4.009 20 0 BIADHN C[C@@H]1CCC[C@H](C)N1Cc1ccc(Cl)s1 ZINC000731212767 584923801 /nfs/dbraw/zinc/92/38/01/584923801.db2.gz FHPIIBZEDICXHX-AOOOYVTPSA-N 0 3 243.803 4.164 20 0 BIADHN C[C@@H]1CCC[C@@H](C)N1Cc1ccc(Cl)s1 ZINC000731212779 584923834 /nfs/dbraw/zinc/92/38/34/584923834.db2.gz FHPIIBZEDICXHX-NXEZZACHSA-N 0 3 243.803 4.164 20 0 BIADHN C[C@H]1CCC[C@H](C)N1Cc1ccc(Cl)s1 ZINC000731212782 584923673 /nfs/dbraw/zinc/92/36/73/584923673.db2.gz FHPIIBZEDICXHX-UWVGGRQHSA-N 0 3 243.803 4.164 20 0 BIADHN c1ccc2c(c1)nccc2N1CCCCCCC1 ZINC000731905551 584931095 /nfs/dbraw/zinc/93/10/95/584931095.db2.gz PEOBXYRXVITWPU-UHFFFAOYSA-N 0 3 240.350 4.005 20 0 BIADHN Cc1ccccc1[C@@H](NCc1ccoc1)C(C)C ZINC000732672450 584939683 /nfs/dbraw/zinc/93/96/83/584939683.db2.gz ITFXGPHIWSDYDT-INIZCTEOSA-N 0 3 243.350 4.075 20 0 BIADHN Cc1ccccc1[C@H](NCc1ccoc1)C(C)C ZINC000732672451 584939714 /nfs/dbraw/zinc/93/97/14/584939714.db2.gz ITFXGPHIWSDYDT-MRXNPFEDSA-N 0 3 243.350 4.075 20 0 BIADHN CC(C)[C@H](c1ccccc1)N(C)C/C=C\Cl ZINC000733029357 584942477 /nfs/dbraw/zinc/94/24/77/584942477.db2.gz DGLGEBMMQPLFCZ-JKEYDSJLSA-N 0 3 237.774 4.068 20 0 BIADHN CC(C)[C@@H](c1ccccc1)N(C)C/C=C\Cl ZINC000733029362 584942522 /nfs/dbraw/zinc/94/25/22/584942522.db2.gz DGLGEBMMQPLFCZ-YHAOYDPOSA-N 0 3 237.774 4.068 20 0 BIADHN C[C@@H]1CCCN(Cc2ccc(Cl)s2)[C@@H]1C ZINC000741791294 585119179 /nfs/dbraw/zinc/11/91/79/585119179.db2.gz UGABZIFQPRRCGU-NXEZZACHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H]1CCCN(Cc2ccc(Cl)s2)[C@H]1C ZINC000741791364 585118990 /nfs/dbraw/zinc/11/89/90/585118990.db2.gz UGABZIFQPRRCGU-UWVGGRQHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@@H]1[C@@H](C)CCCN1Cc1ccc(Cl)s1 ZINC000741791365 585119165 /nfs/dbraw/zinc/11/91/65/585119165.db2.gz UGABZIFQPRRCGU-VHSXEESVSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@@H]1CCCN(Cc2ccc(Cl)s2)[C@H]1C ZINC000741791366 585119207 /nfs/dbraw/zinc/11/92/07/585119207.db2.gz UGABZIFQPRRCGU-ZJUUUORDSA-N 0 3 243.803 4.022 20 0 BIADHN Cc1cccc([C@@H]2CCCN2C/C=C/Cl)c1C ZINC000741805557 585119707 /nfs/dbraw/zinc/11/97/07/585119707.db2.gz KIWBQELBIVBFEH-BOSPYUDASA-N 0 3 249.785 4.193 20 0 BIADHN Cc1cccc([C@H]2CCCN2C/C=C/Cl)c1C ZINC000741805560 585119627 /nfs/dbraw/zinc/11/96/27/585119627.db2.gz KIWBQELBIVBFEH-FUVBFXSKSA-N 0 3 249.785 4.193 20 0 BIADHN Cc1cccc([C@H]2CCCN2C/C=C\Cl)c1C ZINC000741805563 585119684 /nfs/dbraw/zinc/11/96/84/585119684.db2.gz KIWBQELBIVBFEH-HMZQOCAUSA-N 0 3 249.785 4.193 20 0 BIADHN Cc1cccc([C@@H]2CCCN2C/C=C\Cl)c1C ZINC000741805565 585119514 /nfs/dbraw/zinc/11/95/14/585119514.db2.gz KIWBQELBIVBFEH-ZHMISCPASA-N 0 3 249.785 4.193 20 0 BIADHN Cc1ccc([C@H]2CCCCN2C/C=C/Cl)cc1 ZINC000741806333 585119356 /nfs/dbraw/zinc/11/93/56/585119356.db2.gz NAAYKXWWWMNCBN-GSDOMDMQSA-N 0 3 249.785 4.275 20 0 BIADHN Cc1ccc([C@@H]2CCCCN2C/C=C\Cl)cc1 ZINC000741806336 585119583 /nfs/dbraw/zinc/11/95/83/585119583.db2.gz NAAYKXWWWMNCBN-HGZZYMOZSA-N 0 3 249.785 4.275 20 0 BIADHN Cc1ccc([C@H]2CCCCN2C/C=C\Cl)cc1 ZINC000741806338 585119630 /nfs/dbraw/zinc/11/96/30/585119630.db2.gz NAAYKXWWWMNCBN-OZVSCIAHSA-N 0 3 249.785 4.275 20 0 BIADHN Cc1ccc([C@@H]2CCCCN2C/C=C/Cl)cc1 ZINC000741806341 585119717 /nfs/dbraw/zinc/11/97/17/585119717.db2.gz NAAYKXWWWMNCBN-SHBKCBRUSA-N 0 3 249.785 4.275 20 0 BIADHN CC[C@](C)(NCc1occc1C)c1ccccc1 ZINC000742369889 585125073 /nfs/dbraw/zinc/12/50/73/585125073.db2.gz IEMHQFUJZRRLIS-INIZCTEOSA-N 0 3 243.350 4.003 20 0 BIADHN CC[C@@](C)(NCc1occc1C)c1ccccc1 ZINC000742369890 585125115 /nfs/dbraw/zinc/12/51/15/585125115.db2.gz IEMHQFUJZRRLIS-MRXNPFEDSA-N 0 3 243.350 4.003 20 0 BIADHN Cc1cc(CN[C@H](C)c2cccc(C)c2)c(C)o1 ZINC000743477441 585137568 /nfs/dbraw/zinc/13/75/68/585137568.db2.gz SCZJQONHPHOWSD-CYBMUJFWSA-N 0 3 243.350 4.056 20 0 BIADHN Cc1cc(CN[C@@H](C)c2cccc(C)c2)c(C)o1 ZINC000743477442 585137572 /nfs/dbraw/zinc/13/75/72/585137572.db2.gz SCZJQONHPHOWSD-ZDUSSCGKSA-N 0 3 243.350 4.056 20 0 BIADHN Clc1ccccc1CN1CCC2(CCCC2)C1 ZINC000743863344 585141467 /nfs/dbraw/zinc/14/14/67/585141467.db2.gz GMIDQXMWGIZFGX-UHFFFAOYSA-N 0 3 249.785 4.106 20 0 BIADHN Clc1cccc(CN2CCC3(CCCC3)C2)c1 ZINC000743864832 585141831 /nfs/dbraw/zinc/14/18/31/585141831.db2.gz VMPVFOJYGPTLOO-UHFFFAOYSA-N 0 3 249.785 4.106 20 0 BIADHN Clc1ccc(CN2CCC3(CCCC3)C2)cc1 ZINC000743864973 585141835 /nfs/dbraw/zinc/14/18/35/585141835.db2.gz YJSBDVHCLMYEPB-UHFFFAOYSA-N 0 3 249.785 4.106 20 0 BIADHN C[C@@H]1CC[C@@H](C)N(Cc2ccc(Cl)s2)C1 ZINC000743872930 585141517 /nfs/dbraw/zinc/14/15/17/585141517.db2.gz FKEUXJUJAHWNPT-NXEZZACHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H]1CC[C@H](C)N(Cc2ccc(Cl)s2)C1 ZINC000743872931 585141684 /nfs/dbraw/zinc/14/16/84/585141684.db2.gz FKEUXJUJAHWNPT-UWVGGRQHSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@@H]1CC[C@H](C)CN1Cc1ccc(Cl)s1 ZINC000743872932 585141523 /nfs/dbraw/zinc/14/15/23/585141523.db2.gz FKEUXJUJAHWNPT-VHSXEESVSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@@H]1CC[C@H](C)N(Cc2ccc(Cl)s2)C1 ZINC000743872933 585141795 /nfs/dbraw/zinc/14/17/95/585141795.db2.gz FKEUXJUJAHWNPT-ZJUUUORDSA-N 0 3 243.803 4.022 20 0 BIADHN C[C@H]1CCCN(Cc2ccc(Cl)s2)CC1 ZINC000745170922 585157405 /nfs/dbraw/zinc/15/74/05/585157405.db2.gz VFENSXGVTDLKSJ-JTQLQIEISA-N 0 3 243.803 4.024 20 0 BIADHN C[C@@H]1CCCN(Cc2ccc(Cl)s2)CC1 ZINC000745170923 585157288 /nfs/dbraw/zinc/15/72/88/585157288.db2.gz VFENSXGVTDLKSJ-SNVBAGLBSA-N 0 3 243.803 4.024 20 0 BIADHN CC[C@@H]1C[C@@H](C)CN1Cc1ccc(Cl)s1 ZINC000745948821 585161546 /nfs/dbraw/zinc/16/15/46/585161546.db2.gz XCNPMEHKNDXGNN-NXEZZACHSA-N 0 3 243.803 4.022 20 0 BIADHN CC[C@H]1C[C@H](C)CN1Cc1ccc(Cl)s1 ZINC000745948823 585161653 /nfs/dbraw/zinc/16/16/53/585161653.db2.gz XCNPMEHKNDXGNN-UWVGGRQHSA-N 0 3 243.803 4.022 20 0 BIADHN CC[C@@H]1C[C@H](C)CN1Cc1ccc(Cl)s1 ZINC000745948824 585161497 /nfs/dbraw/zinc/16/14/97/585161497.db2.gz XCNPMEHKNDXGNN-VHSXEESVSA-N 0 3 243.803 4.022 20 0 BIADHN CC[C@H]1C[C@@H](C)CN1Cc1ccc(Cl)s1 ZINC000745948825 585161892 /nfs/dbraw/zinc/16/18/92/585161892.db2.gz XCNPMEHKNDXGNN-ZJUUUORDSA-N 0 3 243.803 4.022 20 0 BIADHN CCCN(C/C=C\Cl)[C@H]1CCc2ccccc21 ZINC000746653814 585171717 /nfs/dbraw/zinc/17/17/17/585171717.db2.gz WIBJMAUMDNCYQR-ANOSYLROSA-N 0 3 249.785 4.138 20 0 BIADHN CCCN(C/C=C/Cl)[C@@H]1CCc2ccccc21 ZINC000746653841 585171549 /nfs/dbraw/zinc/17/15/49/585171549.db2.gz WIBJMAUMDNCYQR-HYJLXUOHSA-N 0 3 249.785 4.138 20 0 BIADHN CCCN(C/C=C/Cl)[C@H]1CCc2ccccc21 ZINC000746653844 585171489 /nfs/dbraw/zinc/17/14/89/585171489.db2.gz WIBJMAUMDNCYQR-RNOHYWCBSA-N 0 3 249.785 4.138 20 0 BIADHN CCCN(C/C=C\Cl)[C@@H]1CCc2ccccc21 ZINC000746653846 585171583 /nfs/dbraw/zinc/17/15/83/585171583.db2.gz WIBJMAUMDNCYQR-WSVPDTOYSA-N 0 3 249.785 4.138 20 0 BIADHN CC[C@H](c1ccccc1)N(CC)C/C=C/Cl ZINC000746660195 585171969 /nfs/dbraw/zinc/17/19/69/585171969.db2.gz VCIUHUFZWUHITC-BMGYJQCNSA-N 0 3 237.774 4.212 20 0 BIADHN CC[C@H](c1ccccc1)N(CC)C/C=C\Cl ZINC000746660196 585172106 /nfs/dbraw/zinc/17/21/06/585172106.db2.gz VCIUHUFZWUHITC-KOTGUFOOSA-N 0 3 237.774 4.212 20 0 BIADHN CC[C@@H](c1ccccc1)N(CC)C/C=C\Cl ZINC000746660198 585171919 /nfs/dbraw/zinc/17/19/19/585171919.db2.gz VCIUHUFZWUHITC-MSKHEQNASA-N 0 3 237.774 4.212 20 0 BIADHN CC[C@@H](c1ccccc1)N(CC)C/C=C/Cl ZINC000746660199 585171911 /nfs/dbraw/zinc/17/19/11/585171911.db2.gz VCIUHUFZWUHITC-ZHZWZMEUSA-N 0 3 237.774 4.212 20 0 BIADHN C[C@@H](NCc1ccc(CF)cc1)c1cccs1 ZINC000754582480 585286835 /nfs/dbraw/zinc/28/68/35/585286835.db2.gz YGBYJJMWDPCOOG-LLVKDONJSA-N 0 3 249.354 4.068 20 0 BIADHN C[C@H](NCc1ccc(CF)cc1)c1cccs1 ZINC000754582485 585286668 /nfs/dbraw/zinc/28/66/68/585286668.db2.gz YGBYJJMWDPCOOG-NSHDSACASA-N 0 3 249.354 4.068 20 0 BIADHN Cl/C=C(\Cl)CN1CCCC12CCCCC2 ZINC000759386892 585371875 /nfs/dbraw/zinc/37/18/75/585371875.db2.gz LTKYFNZXYWQVIP-LUAWRHEFSA-N 0 3 248.197 4.104 20 0 BIADHN Cl/C=C(/Cl)CN1CCCC12CCCCC2 ZINC000759386895 585371823 /nfs/dbraw/zinc/37/18/23/585371823.db2.gz LTKYFNZXYWQVIP-PKNBQFBNSA-N 0 3 248.197 4.104 20 0 BIADHN C[C@@H](N[C@H](C)c1cccc(Cl)c1)c1ccc[nH]1 ZINC000760243518 585387182 /nfs/dbraw/zinc/38/71/82/585387182.db2.gz OVDTWVXFSFSXJN-GHMZBOCLSA-N 0 3 248.757 4.080 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccc[nH]1)c1cccc(Cl)c1 ZINC000760243521 585387119 /nfs/dbraw/zinc/38/71/19/585387119.db2.gz OVDTWVXFSFSXJN-MNOVXSKESA-N 0 3 248.757 4.080 20 0 BIADHN C[C@H](N[C@@H](C)c1cccc(Cl)c1)c1ccc[nH]1 ZINC000760243522 585387304 /nfs/dbraw/zinc/38/73/04/585387304.db2.gz OVDTWVXFSFSXJN-QWRGUYRKSA-N 0 3 248.757 4.080 20 0 BIADHN C[C@@H](N[C@@H](C)c1cccc(Cl)c1)c1ccc[nH]1 ZINC000760243524 585387216 /nfs/dbraw/zinc/38/72/16/585387216.db2.gz OVDTWVXFSFSXJN-WDEREUQCSA-N 0 3 248.757 4.080 20 0 BIADHN C[C@@H](N[C@H](C)c1ccc(Cl)cc1)c1ccc[nH]1 ZINC000760243558 585387211 /nfs/dbraw/zinc/38/72/11/585387211.db2.gz PJGRYIDQYWXNGY-GHMZBOCLSA-N 0 3 248.757 4.080 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccc[nH]1)c1ccc(Cl)cc1 ZINC000760243560 585387324 /nfs/dbraw/zinc/38/73/24/585387324.db2.gz PJGRYIDQYWXNGY-MNOVXSKESA-N 0 3 248.757 4.080 20 0 BIADHN C[C@H](N[C@@H](C)c1ccc(Cl)cc1)c1ccc[nH]1 ZINC000760243562 585387101 /nfs/dbraw/zinc/38/71/01/585387101.db2.gz PJGRYIDQYWXNGY-QWRGUYRKSA-N 0 3 248.757 4.080 20 0 BIADHN C[C@@H](N[C@@H](C)c1ccc(Cl)cc1)c1ccc[nH]1 ZINC000760243563 585387144 /nfs/dbraw/zinc/38/71/44/585387144.db2.gz PJGRYIDQYWXNGY-WDEREUQCSA-N 0 3 248.757 4.080 20 0 BIADHN Cc1ccc(C)c([C@H](C)N[C@@H](C)c2ccc[nH]2)c1 ZINC000760251134 584907308 /nfs/dbraw/zinc/90/73/08/584907308.db2.gz UYICLBSMNNYSGU-KBPBESRZSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc(C)c([C@@H](C)N[C@@H](C)c2ccc[nH]2)c1 ZINC000760251135 584907331 /nfs/dbraw/zinc/90/73/31/584907331.db2.gz UYICLBSMNNYSGU-KGLIPLIRSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc(C)c([C@H](C)N[C@H](C)c2ccc[nH]2)c1 ZINC000760251136 584907322 /nfs/dbraw/zinc/90/73/22/584907322.db2.gz UYICLBSMNNYSGU-UONOGXRCSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc(C)c([C@@H](C)N[C@H](C)c2ccc[nH]2)c1 ZINC000760251137 584907315 /nfs/dbraw/zinc/90/73/15/584907315.db2.gz UYICLBSMNNYSGU-ZIAGYGMSSA-N 0 3 242.366 4.043 20 0 BIADHN CC(C)(C)N(C/C=C/Cl)Cc1ccccc1 ZINC000762053948 585425438 /nfs/dbraw/zinc/42/54/38/585425438.db2.gz VXFWREKBGKFZGI-JXMROGBWSA-N 0 3 237.774 4.040 20 0 BIADHN CC(C)(C)N(C/C=C\Cl)Cc1ccccc1 ZINC000762053957 585425442 /nfs/dbraw/zinc/42/54/42/585425442.db2.gz VXFWREKBGKFZGI-YFHOEESVSA-N 0 3 237.774 4.040 20 0 BIADHN c1cc(CN2CCCC[C@H]2c2ccccc2)co1 ZINC000762793170 585437299 /nfs/dbraw/zinc/43/72/99/585437299.db2.gz DHHCXPLVDLVMJY-INIZCTEOSA-N 0 3 241.334 4.007 20 0 BIADHN c1cc(CN2CCCC[C@@H]2c2ccccc2)co1 ZINC000762793172 585437328 /nfs/dbraw/zinc/43/73/28/585437328.db2.gz DHHCXPLVDLVMJY-MRXNPFEDSA-N 0 3 241.334 4.007 20 0 BIADHN Cc1cc(CN[C@H](C)c2ccc(C)s2)c(C)o1 ZINC000767350673 585516928 /nfs/dbraw/zinc/51/69/28/585516928.db2.gz NPHUOYYRXRHXLJ-LLVKDONJSA-N 0 3 249.379 4.117 20 0 BIADHN Cc1cc(CN[C@@H](C)c2ccc(C)s2)c(C)o1 ZINC000767350674 585516923 /nfs/dbraw/zinc/51/69/23/585516923.db2.gz NPHUOYYRXRHXLJ-NSHDSACASA-N 0 3 249.379 4.117 20 0 BIADHN CC(C)(C)N(Cc1ccoc1)Cc1ccccc1 ZINC000768137524 585532641 /nfs/dbraw/zinc/53/26/41/585532641.db2.gz GKIKCDARRGUDOD-UHFFFAOYSA-N 0 3 243.350 4.080 20 0 BIADHN CC[C@H](C)N(Cc1ccoc1)Cc1ccccc1 ZINC000768192821 585533775 /nfs/dbraw/zinc/53/37/75/585533775.db2.gz FWGALZUXYXZJTD-AWEZNQCLSA-N 0 3 243.350 4.080 20 0 BIADHN CC[C@@H](C)N(Cc1ccoc1)Cc1ccccc1 ZINC000768192824 585533789 /nfs/dbraw/zinc/53/37/89/585533789.db2.gz FWGALZUXYXZJTD-CQSZACIVSA-N 0 3 243.350 4.080 20 0 BIADHN CCCN(Cc1ccoc1)Cc1ccc(C)cc1 ZINC000768194114 585533731 /nfs/dbraw/zinc/53/37/31/585533731.db2.gz ZVUGUZSNYWLEMJ-UHFFFAOYSA-N 0 3 243.350 4.000 20 0 BIADHN Cc1cc(CN(C)[C@H](C)c2ccccc2)c(C)o1 ZINC000768197610 585533767 /nfs/dbraw/zinc/53/37/67/585533767.db2.gz KTEJWICEMLETKE-CYBMUJFWSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1cc(CN(C)[C@@H](C)c2ccccc2)c(C)o1 ZINC000768197613 585533855 /nfs/dbraw/zinc/53/38/55/585533855.db2.gz KTEJWICEMLETKE-ZDUSSCGKSA-N 0 3 243.350 4.089 20 0 BIADHN C[C@H](c1ccccc1)N(Cc1ccoc1)C1CC1 ZINC000768257198 585534968 /nfs/dbraw/zinc/53/49/68/585534968.db2.gz KISISCSJZGRDHN-CYBMUJFWSA-N 0 3 241.334 4.005 20 0 BIADHN C[C@@H](c1ccccc1)N(Cc1ccoc1)C1CC1 ZINC000768257199 585534798 /nfs/dbraw/zinc/53/47/98/585534798.db2.gz KISISCSJZGRDHN-ZDUSSCGKSA-N 0 3 241.334 4.005 20 0 BIADHN Cc1ccc([C@H](C)N(C)Cc2ccoc2)c(C)c1 ZINC000768267282 585535178 /nfs/dbraw/zinc/53/51/78/585535178.db2.gz AVYUHMXBKPEAIX-AWEZNQCLSA-N 0 3 243.350 4.089 20 0 BIADHN Cc1ccc([C@@H](C)N(C)Cc2ccoc2)c(C)c1 ZINC000768267283 585535090 /nfs/dbraw/zinc/53/50/90/585535090.db2.gz AVYUHMXBKPEAIX-CQSZACIVSA-N 0 3 243.350 4.089 20 0 BIADHN CC(C)[C@@H](c1ccccc1)N(C)Cc1ccoc1 ZINC000769405431 585555705 /nfs/dbraw/zinc/55/57/05/585555705.db2.gz YOTDQEWGDKBLSN-INIZCTEOSA-N 0 3 243.350 4.109 20 0 BIADHN CC(C)[C@H](c1ccccc1)N(C)Cc1ccoc1 ZINC000769405435 585555722 /nfs/dbraw/zinc/55/57/22/585555722.db2.gz YOTDQEWGDKBLSN-MRXNPFEDSA-N 0 3 243.350 4.109 20 0 BIADHN Cc1cc([C@@H](C)N[C@H](C)c2ccc[nH]2)c(C)s1 ZINC000773113159 585631521 /nfs/dbraw/zinc/63/15/21/585631521.db2.gz AKCVPQJBMWSEAA-GHMZBOCLSA-N 0 3 248.395 4.105 20 0 BIADHN Cc1cc([C@@H](C)N[C@@H](C)c2ccc[nH]2)c(C)s1 ZINC000773113162 585631354 /nfs/dbraw/zinc/63/13/54/585631354.db2.gz AKCVPQJBMWSEAA-MNOVXSKESA-N 0 3 248.395 4.105 20 0 BIADHN Cc1cc([C@H](C)N[C@@H](C)c2ccc[nH]2)c(C)s1 ZINC000773113164 585631605 /nfs/dbraw/zinc/63/16/05/585631605.db2.gz AKCVPQJBMWSEAA-QWRGUYRKSA-N 0 3 248.395 4.105 20 0 BIADHN Cc1cc([C@H](C)N[C@H](C)c2ccc[nH]2)c(C)s1 ZINC000773113165 585631551 /nfs/dbraw/zinc/63/15/51/585631551.db2.gz AKCVPQJBMWSEAA-WDEREUQCSA-N 0 3 248.395 4.105 20 0 BIADHN Cc1cc(C)cc([C@H](C)N[C@@H](C)c2ccc[nH]2)c1 ZINC000773115048 585631683 /nfs/dbraw/zinc/63/16/83/585631683.db2.gz DWYFIGPQLDMQRU-KBPBESRZSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1cc(C)cc([C@@H](C)N[C@@H](C)c2ccc[nH]2)c1 ZINC000773115050 585631665 /nfs/dbraw/zinc/63/16/65/585631665.db2.gz DWYFIGPQLDMQRU-KGLIPLIRSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1cc(C)cc([C@H](C)N[C@H](C)c2ccc[nH]2)c1 ZINC000773115052 585631902 /nfs/dbraw/zinc/63/19/02/585631902.db2.gz DWYFIGPQLDMQRU-UONOGXRCSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1cc(C)cc([C@@H](C)N[C@H](C)c2ccc[nH]2)c1 ZINC000773115055 585631771 /nfs/dbraw/zinc/63/17/71/585631771.db2.gz DWYFIGPQLDMQRU-ZIAGYGMSSA-N 0 3 242.366 4.043 20 0 BIADHN CCc1ccc([C@@H](C)N[C@H](C)c2ccc[nH]2)s1 ZINC000773115638 585631822 /nfs/dbraw/zinc/63/18/22/585631822.db2.gz GQBWJWQRDJNFGQ-GHMZBOCLSA-N 0 3 248.395 4.050 20 0 BIADHN CCc1ccc([C@H](C)N[C@H](C)c2ccc[nH]2)s1 ZINC000773115640 585631613 /nfs/dbraw/zinc/63/16/13/585631613.db2.gz GQBWJWQRDJNFGQ-MNOVXSKESA-N 0 3 248.395 4.050 20 0 BIADHN CCc1ccc([C@H](C)N[C@@H](C)c2ccc[nH]2)s1 ZINC000773115642 585631736 /nfs/dbraw/zinc/63/17/36/585631736.db2.gz GQBWJWQRDJNFGQ-QWRGUYRKSA-N 0 3 248.395 4.050 20 0 BIADHN CCc1ccc([C@@H](C)N[C@@H](C)c2ccc[nH]2)s1 ZINC000773115644 585631330 /nfs/dbraw/zinc/63/13/30/585631330.db2.gz GQBWJWQRDJNFGQ-WDEREUQCSA-N 0 3 248.395 4.050 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2ccc[nH]2)c(C)c1 ZINC000773117197 585631831 /nfs/dbraw/zinc/63/18/31/585631831.db2.gz KXCFNTHGORPTRN-KBPBESRZSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc[nH]2)c(C)c1 ZINC000773117198 585631611 /nfs/dbraw/zinc/63/16/11/585631611.db2.gz KXCFNTHGORPTRN-KGLIPLIRSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2ccc[nH]2)c(C)c1 ZINC000773117199 585631843 /nfs/dbraw/zinc/63/18/43/585631843.db2.gz KXCFNTHGORPTRN-UONOGXRCSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2ccc[nH]2)c(C)c1 ZINC000773117200 585631898 /nfs/dbraw/zinc/63/18/98/585631898.db2.gz KXCFNTHGORPTRN-ZIAGYGMSSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1cccc([C@H](C)N[C@@H](C)c2ccc[nH]2)c1C ZINC000773121165 585632111 /nfs/dbraw/zinc/63/21/11/585632111.db2.gz YBXWHYQRGOPJJD-KBPBESRZSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1cccc([C@@H](C)N[C@@H](C)c2ccc[nH]2)c1C ZINC000773121167 585631935 /nfs/dbraw/zinc/63/19/35/585631935.db2.gz YBXWHYQRGOPJJD-KGLIPLIRSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1cccc([C@H](C)N[C@H](C)c2ccc[nH]2)c1C ZINC000773121172 585632099 /nfs/dbraw/zinc/63/20/99/585632099.db2.gz YBXWHYQRGOPJJD-UONOGXRCSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1cccc([C@@H](C)N[C@H](C)c2ccc[nH]2)c1C ZINC000773121175 585632109 /nfs/dbraw/zinc/63/21/09/585632109.db2.gz YBXWHYQRGOPJJD-ZIAGYGMSSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc([C@H](C)N[C@@H](C)c2ccc[nH]2)cc1C ZINC000773121567 585632172 /nfs/dbraw/zinc/63/21/72/585632172.db2.gz RYFQLWDBNYVBTQ-KBPBESRZSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc[nH]2)cc1C ZINC000773121570 585631939 /nfs/dbraw/zinc/63/19/39/585631939.db2.gz RYFQLWDBNYVBTQ-KGLIPLIRSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc([C@H](C)N[C@H](C)c2ccc[nH]2)cc1C ZINC000773121571 585632072 /nfs/dbraw/zinc/63/20/72/585632072.db2.gz RYFQLWDBNYVBTQ-UONOGXRCSA-N 0 3 242.366 4.043 20 0 BIADHN Cc1ccc([C@@H](C)N[C@H](C)c2ccc[nH]2)cc1C ZINC000773121573 585632144 /nfs/dbraw/zinc/63/21/44/585632144.db2.gz RYFQLWDBNYVBTQ-ZIAGYGMSSA-N 0 3 242.366 4.043 20 0 BIADHN CC[C@@H](N[C@@H](C)c1ccc[nH]1)c1ccc(C)cc1 ZINC000773121631 585632176 /nfs/dbraw/zinc/63/21/76/585632176.db2.gz SKGMGJGQVSVLPO-DZGCQCFKSA-N 0 3 242.366 4.125 20 0 BIADHN CC[C@H](N[C@H](C)c1ccc[nH]1)c1ccc(C)cc1 ZINC000773121632 585632088 /nfs/dbraw/zinc/63/20/88/585632088.db2.gz SKGMGJGQVSVLPO-HIFRSBDPSA-N 0 3 242.366 4.125 20 0 BIADHN CC[C@@H](N[C@H](C)c1ccc[nH]1)c1ccc(C)cc1 ZINC000773121633 585632180 /nfs/dbraw/zinc/63/21/80/585632180.db2.gz SKGMGJGQVSVLPO-UKRRQHHQSA-N 0 3 242.366 4.125 20 0 BIADHN CC[C@H](N[C@@H](C)c1ccc[nH]1)c1ccc(C)cc1 ZINC000773121634 585632075 /nfs/dbraw/zinc/63/20/75/585632075.db2.gz SKGMGJGQVSVLPO-ZFWWWQNUSA-N 0 3 242.366 4.125 20 0 BIADHN CCC[C@H](N[C@@H](C)c1ccc[nH]1)c1ccccc1 ZINC000773125365 585631995 /nfs/dbraw/zinc/63/19/95/585631995.db2.gz ZPDPHWPYEFSPLS-BBRMVZONSA-N 0 3 242.366 4.207 20 0 BIADHN CCC[C@H](N[C@H](C)c1ccc[nH]1)c1ccccc1 ZINC000773125368 585631907 /nfs/dbraw/zinc/63/19/07/585631907.db2.gz ZPDPHWPYEFSPLS-CJNGLKHVSA-N 0 3 242.366 4.207 20 0 BIADHN CCC[C@@H](N[C@H](C)c1ccc[nH]1)c1ccccc1 ZINC000773125371 585632134 /nfs/dbraw/zinc/63/21/34/585632134.db2.gz ZPDPHWPYEFSPLS-CZUORRHYSA-N 0 3 242.366 4.207 20 0 BIADHN CCC[C@@H](N[C@@H](C)c1ccc[nH]1)c1ccccc1 ZINC000773125373 585631941 /nfs/dbraw/zinc/63/19/41/585631941.db2.gz ZPDPHWPYEFSPLS-XJKSGUPXSA-N 0 3 242.366 4.207 20 0 BIADHN C[C@H](NC/C=C/Cl)c1ccc2ccccc2c1 ZINC000774785416 585666098 /nfs/dbraw/zinc/66/60/98/585666098.db2.gz NXANCMQEBHIANR-KFRNIWOLSA-N 0 3 245.753 4.243 20 0 BIADHN C[C@@H](NC/C=C/Cl)c1ccc2ccccc2c1 ZINC000774785417 585666075 /nfs/dbraw/zinc/66/60/75/585666075.db2.gz NXANCMQEBHIANR-OXFRDRNISA-N 0 3 245.753 4.243 20 0 BIADHN C[C@H](NC/C=C\Cl)c1ccc2ccccc2c1 ZINC000774785418 585666145 /nfs/dbraw/zinc/66/61/45/585666145.db2.gz NXANCMQEBHIANR-REPPVQDKSA-N 0 3 245.753 4.243 20 0 BIADHN C[C@@H](NC/C=C\Cl)c1ccc2ccccc2c1 ZINC000774785419 585666077 /nfs/dbraw/zinc/66/60/77/585666077.db2.gz NXANCMQEBHIANR-TWLAMCEISA-N 0 3 245.753 4.243 20 0 BIADHN C[C@@H](NCc1ccc(CF)cc1)c1ccccc1 ZINC000777720000 585719474 /nfs/dbraw/zinc/71/94/74/585719474.db2.gz HOCKXIVTCUYXDK-CYBMUJFWSA-N 0 3 243.325 4.007 20 0 BIADHN C[C@H](NCc1ccc(CF)cc1)c1ccccc1 ZINC000777720002 585719360 /nfs/dbraw/zinc/71/93/60/585719360.db2.gz HOCKXIVTCUYXDK-ZDUSSCGKSA-N 0 3 243.325 4.007 20 0 BIADHN CC(C)c1ccccc1CNCc1ccsc1 ZINC000782539240 585819976 /nfs/dbraw/zinc/81/99/76/585819976.db2.gz IMTZMFAPLISWPB-UHFFFAOYSA-N 0 3 245.391 4.161 20 0 BIADHN CC(C)c1ccccc1CNCc1ccccc1 ZINC000782539255 585820015 /nfs/dbraw/zinc/82/00/15/585820015.db2.gz JGZRTQHGFLVDMT-UHFFFAOYSA-N 0 3 239.362 4.100 20 0 BIADHN CC(C)c1ccccc1CNCc1cccs1 ZINC000782539889 585819924 /nfs/dbraw/zinc/81/99/24/585819924.db2.gz PWAMWEDEUFCIIU-UHFFFAOYSA-N 0 3 245.391 4.161 20 0 BIADHN CCCCCCN1CCc2sccc2[C@H]1C ZINC000782997812 585826825 /nfs/dbraw/zinc/82/68/25/585826825.db2.gz DWXXXBDJQXIMQO-GFCCVEGCSA-N 0 3 237.412 4.248 20 0 BIADHN CCCCCCN1CCc2sccc2[C@@H]1C ZINC000782997813 585826728 /nfs/dbraw/zinc/82/67/28/585826728.db2.gz DWXXXBDJQXIMQO-LBPRGKRZSA-N 0 3 237.412 4.248 20 0 BIADHN CCC[C@@H](N[C@H](C)c1ccc[nH]1)c1ccsc1 ZINC000785568694 585875752 /nfs/dbraw/zinc/87/57/52/585875752.db2.gz YWYKJQBMAGVQJQ-BXUZGUMPSA-N 0 3 248.395 4.268 20 0 BIADHN CCC[C@H](N[C@@H](C)c1ccc[nH]1)c1ccsc1 ZINC000785568695 585875823 /nfs/dbraw/zinc/87/58/23/585875823.db2.gz YWYKJQBMAGVQJQ-FZMZJTMJSA-N 0 3 248.395 4.268 20 0 BIADHN CCC[C@H](N[C@H](C)c1ccc[nH]1)c1ccsc1 ZINC000785568698 585875174 /nfs/dbraw/zinc/87/51/74/585875174.db2.gz YWYKJQBMAGVQJQ-RISCZKNCSA-N 0 3 248.395 4.268 20 0 BIADHN CCC[C@@H](N[C@@H](C)c1ccc[nH]1)c1ccsc1 ZINC000785568701 585875345 /nfs/dbraw/zinc/87/53/45/585875345.db2.gz YWYKJQBMAGVQJQ-SMDDNHRTSA-N 0 3 248.395 4.268 20 0 BIADHN C[C@@H](NC1CC1)c1ccccc1SC(C)(C)C ZINC000788498182 585925952 /nfs/dbraw/zinc/92/59/52/585925952.db2.gz LOVVANSERXSLTR-LLVKDONJSA-N 0 3 249.423 4.390 20 0 BIADHN C[C@H](NC1CC1)c1ccccc1SC(C)(C)C ZINC000788498185 585925882 /nfs/dbraw/zinc/92/58/82/585925882.db2.gz LOVVANSERXSLTR-NSHDSACASA-N 0 3 249.423 4.390 20 0 BIADHN CC(C)N(C/C=C\Cl)[C@H](C)c1ccccc1 ZINC000794685351 586046540 /nfs/dbraw/zinc/04/65/40/586046540.db2.gz PBNSIYWFXDUCPS-PGJNLMOESA-N 0 3 237.774 4.211 20 0 BIADHN CC(C)N(C/C=C/Cl)[C@@H](C)c1ccccc1 ZINC000794685352 586046686 /nfs/dbraw/zinc/04/66/86/586046686.db2.gz PBNSIYWFXDUCPS-RSPDNQDQSA-N 0 3 237.774 4.211 20 0 BIADHN CC(C)N(C/C=C\Cl)[C@@H](C)c1ccccc1 ZINC000794685354 586046790 /nfs/dbraw/zinc/04/67/90/586046790.db2.gz PBNSIYWFXDUCPS-SZNGSJQDSA-N 0 3 237.774 4.211 20 0 BIADHN CC(C)N(C/C=C/Cl)[C@H](C)c1ccccc1 ZINC000794685357 586046600 /nfs/dbraw/zinc/04/66/00/586046600.db2.gz PBNSIYWFXDUCPS-UTSBKAFOSA-N 0 3 237.774 4.211 20 0 BIADHN CC(C)=CCN1CC=C(c2ccc(C)cc2)CC1 ZINC000795392271 586076728 /nfs/dbraw/zinc/07/67/28/586076728.db2.gz ZBOWFUOIOCYVER-UHFFFAOYSA-N 0 3 241.378 4.050 20 0 BIADHN CC[C@@H](N[C@@H](C)c1ccc[nH]1)c1cccc(C)c1 ZINC000796845351 586114600 /nfs/dbraw/zinc/11/46/00/586114600.db2.gz JRQBFZDQGLFHOW-DZGCQCFKSA-N 0 3 242.366 4.125 20 0 BIADHN CC[C@H](N[C@H](C)c1ccc[nH]1)c1cccc(C)c1 ZINC000796845357 586114722 /nfs/dbraw/zinc/11/47/22/586114722.db2.gz JRQBFZDQGLFHOW-HIFRSBDPSA-N 0 3 242.366 4.125 20 0 BIADHN CC[C@@H](N[C@H](C)c1ccc[nH]1)c1cccc(C)c1 ZINC000796845359 586114707 /nfs/dbraw/zinc/11/47/07/586114707.db2.gz JRQBFZDQGLFHOW-UKRRQHHQSA-N 0 3 242.366 4.125 20 0 BIADHN CC[C@H](N[C@@H](C)c1ccc[nH]1)c1cccc(C)c1 ZINC000796845361 586114681 /nfs/dbraw/zinc/11/46/81/586114681.db2.gz JRQBFZDQGLFHOW-ZFWWWQNUSA-N 0 3 242.366 4.125 20 0 BIADHN C[C@@H](NCc1ccc(CF)cc1)c1ccsc1 ZINC000801569850 586264776 /nfs/dbraw/zinc/26/47/76/586264776.db2.gz GCNBUOXXLBXKDN-LLVKDONJSA-N 0 3 249.354 4.068 20 0 BIADHN C[C@H](NCc1ccc(CF)cc1)c1ccsc1 ZINC000801569851 586264594 /nfs/dbraw/zinc/26/45/94/586264594.db2.gz GCNBUOXXLBXKDN-NSHDSACASA-N 0 3 249.354 4.068 20 0 BIADHN CCCC(C)(C)N(CCF)Cc1cccs1 ZINC000801997784 586285626 /nfs/dbraw/zinc/28/56/26/586285626.db2.gz SPCIUSMDSZFYFN-UHFFFAOYSA-N 0 3 243.391 4.098 20 0 BIADHN CC[C@@H](C)N(C/C=C\Cl)Cc1ccccc1 ZINC000807263882 586431329 /nfs/dbraw/zinc/43/13/29/586431329.db2.gz IIQQEJUUZJPYDS-PGJNLMOESA-N 0 3 237.774 4.040 20 0 BIADHN CC[C@H](C)N(C/C=C/Cl)Cc1ccccc1 ZINC000807263884 586431098 /nfs/dbraw/zinc/43/10/98/586431098.db2.gz IIQQEJUUZJPYDS-RSPDNQDQSA-N 0 3 237.774 4.040 20 0 BIADHN CC[C@H](C)N(C/C=C\Cl)Cc1ccccc1 ZINC000807263885 586431033 /nfs/dbraw/zinc/43/10/33/586431033.db2.gz IIQQEJUUZJPYDS-SZNGSJQDSA-N 0 3 237.774 4.040 20 0 BIADHN CC[C@@H](C)N(C/C=C/Cl)Cc1ccccc1 ZINC000807263886 586430979 /nfs/dbraw/zinc/43/09/79/586430979.db2.gz IIQQEJUUZJPYDS-UTSBKAFOSA-N 0 3 237.774 4.040 20 0 BIADHN FC1(F)CCN(CCC2CCCCCC2)CC1 ZINC000809658113 585323698 /nfs/dbraw/zinc/32/36/98/585323698.db2.gz DKQIPYHIUNDQOS-UHFFFAOYSA-N 0 3 245.357 4.078 20 0 BIADHN CC(C)N(Cc1ccoc1)[C@@H](C)c1ccccc1 ZINC000814169073 586614909 /nfs/dbraw/zinc/61/49/09/586614909.db2.gz DCFWZNCVOSXPFQ-AWEZNQCLSA-N 0 3 243.350 4.251 20 0 BIADHN CC(C)N(Cc1ccoc1)[C@H](C)c1ccccc1 ZINC000814169074 586614973 /nfs/dbraw/zinc/61/49/73/586614973.db2.gz DCFWZNCVOSXPFQ-CQSZACIVSA-N 0 3 243.350 4.251 20 0 BIADHN Cc1cc(F)ccc1[C@@H](C)NCc1cccs1 ZINC000815553836 586687546 /nfs/dbraw/zinc/68/75/46/586687546.db2.gz LFHWHZNCJMCYMA-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc(F)ccc1[C@H](C)NCc1cccs1 ZINC000815553837 586687977 /nfs/dbraw/zinc/68/79/77/586687977.db2.gz LFHWHZNCJMCYMA-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc(F)ccc1[C@@H](C)NCc1ccsc1 ZINC000815559544 586687739 /nfs/dbraw/zinc/68/77/39/586687739.db2.gz KDRMTZKLOKEJPM-LLVKDONJSA-N 0 3 249.354 4.046 20 0 BIADHN Cc1cc(F)ccc1[C@H](C)NCc1ccsc1 ZINC000815559545 586687799 /nfs/dbraw/zinc/68/77/99/586687799.db2.gz KDRMTZKLOKEJPM-NSHDSACASA-N 0 3 249.354 4.046 20 0 BIADHN CC[C@](C)(NCc1ccoc1C)c1ccccc1 ZINC000840895791 587928922 /nfs/dbraw/zinc/92/89/22/587928922.db2.gz WUXLRRKZFLPBRB-INIZCTEOSA-N 0 3 243.350 4.003 20 0 BIADHN CC[C@@](C)(NCc1ccoc1C)c1ccccc1 ZINC000840895792 587928734 /nfs/dbraw/zinc/92/87/34/587928734.db2.gz WUXLRRKZFLPBRB-MRXNPFEDSA-N 0 3 243.350 4.003 20 0 BIADHN CC[C@@H](N[C@@H]1C=CCC1)c1ccc(Cl)s1 ZINC000850507633 588554103 /nfs/dbraw/zinc/55/41/03/588554103.db2.gz GEYMXYUDWILVCZ-NXEZZACHSA-N 0 3 241.787 4.161 20 0 BIADHN CC[C@H](N[C@H]1C=CCC1)c1ccc(Cl)s1 ZINC000850507640 588554094 /nfs/dbraw/zinc/55/40/94/588554094.db2.gz GEYMXYUDWILVCZ-UWVGGRQHSA-N 0 3 241.787 4.161 20 0 BIADHN CC[C@@H](N[C@H]1C=CCC1)c1ccc(Cl)s1 ZINC000850507642 588553957 /nfs/dbraw/zinc/55/39/57/588553957.db2.gz GEYMXYUDWILVCZ-VHSXEESVSA-N 0 3 241.787 4.161 20 0 BIADHN CC[C@H](N[C@@H]1C=CCC1)c1ccc(Cl)s1 ZINC000850507646 588554082 /nfs/dbraw/zinc/55/40/82/588554082.db2.gz GEYMXYUDWILVCZ-ZJUUUORDSA-N 0 3 241.787 4.161 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@@H](C)c1ccns1 ZINC000858579726 588968672 /nfs/dbraw/zinc/96/86/72/588968672.db2.gz YLFXIKYHVHLZRD-NEPJUHHUSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@H](C)N[C@H](C)c1ccns1 ZINC000858579727 588968964 /nfs/dbraw/zinc/96/89/64/588968964.db2.gz YLFXIKYHVHLZRD-NWDGAFQWSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@H](C)N[C@@H](C)c1ccns1 ZINC000858579728 588968637 /nfs/dbraw/zinc/96/86/37/588968637.db2.gz YLFXIKYHVHLZRD-RYUDHWBXSA-N 0 3 240.416 4.009 20 0 BIADHN CC(C)CCC[C@@H](C)N[C@H](C)c1ccns1 ZINC000858579729 588968892 /nfs/dbraw/zinc/96/88/92/588968892.db2.gz YLFXIKYHVHLZRD-VXGBXAGGSA-N 0 3 240.416 4.009 20 0 BIADHN CC[C@H]1CCCN(Cc2ccc(Cl)s2)C1 ZINC000915057866 641796705 /nfs/dbraw/zinc/79/67/05/641796705.db2.gz FLQMLIKMJZOOAT-JTQLQIEISA-N 0 3 243.803 4.024 20 0 BIADHN CC[C@@H]1CCCN(Cc2ccc(Cl)s2)C1 ZINC000915057868 641796498 /nfs/dbraw/zinc/79/64/98/641796498.db2.gz FLQMLIKMJZOOAT-SNVBAGLBSA-N 0 3 243.803 4.024 20 0 BIADHN Cl/C=C/CN(Cc1ccccc1)CC1CCC1 ZINC000920211084 642447915 /nfs/dbraw/zinc/44/79/15/642447915.db2.gz ZMZVSFDNSMDWSN-BJMVGYQFSA-N 0 3 249.785 4.041 20 0 BIADHN Cl/C=C\CN(Cc1ccccc1)CC1CCC1 ZINC000920211086 642448944 /nfs/dbraw/zinc/44/89/44/642448944.db2.gz ZMZVSFDNSMDWSN-YHYXMXQVSA-N 0 3 249.785 4.041 20 0 BIADHN Cc1ccc([C@@H]2CCCN2C/C=C/Cl)cc1C ZINC000920780229 642544984 /nfs/dbraw/zinc/54/49/84/642544984.db2.gz OABLFWCIMCYDNB-LWUPOJRFSA-N 0 3 249.785 4.193 20 0 BIADHN Cc1ccc([C@H]2CCCN2C/C=C\Cl)cc1C ZINC000920780230 642544913 /nfs/dbraw/zinc/54/49/13/642544913.db2.gz OABLFWCIMCYDNB-UFRMUOTOSA-N 0 3 249.785 4.193 20 0 BIADHN Cc1ccc([C@@H]2CCCN2C/C=C\Cl)cc1C ZINC000920780231 642545793 /nfs/dbraw/zinc/54/57/93/642545793.db2.gz OABLFWCIMCYDNB-UVCVVPOWSA-N 0 3 249.785 4.193 20 0 BIADHN C[C@@H](NCc1ccccc1CF)c1ccsc1 ZINC000930344476 639715599 /nfs/dbraw/zinc/71/55/99/639715599.db2.gz ARVAGYRXOYYWJP-LLVKDONJSA-N 0 3 249.354 4.068 20 0 BIADHN C[C@H](NCc1ccccc1CF)c1ccsc1 ZINC000930344477 639717324 /nfs/dbraw/zinc/71/73/24/639717324.db2.gz ARVAGYRXOYYWJP-NSHDSACASA-N 0 3 249.354 4.068 20 0 BIADHN